Browse entries in the PDBbind-CN Database
HEADER 6H52_COMPLEX COMPND 6H52_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 77 SER MET PHE LEU PRO PRO PRO GLU CYS PRO VAL PHE GLU SEQRES 2 A 77 PRO SER TRP GLU GLU PHE ALA ASP PRO PHE ALA PHE ILE SEQRES 3 A 77 HIS LYS ILE ARG PRO ILE ALA GLU GLN THR GLY ILE CYS SEQRES 4 A 77 LYS VAL ARG PRO PRO PRO ASP TRP GLN PRO PRO PHE ALA SEQRES 5 A 77 CYS ASP VAL ASP LYS LEU HIS PHE THR PRO ARG ILE GLN SEQRES 6 A 77 ARG LEU ASN GLU LEU GLU ALA GLN THR ARG VAL LYS SEQRES 1 A 70 ARG ASP TYR THR LEU ARG THR PHE GLY GLU MET ALA ASP SEQRES 2 A 70 ALA PHE LYS SER ASP TYR PHE ASN MET PRO VAL HIS MET SEQRES 3 A 70 VAL PRO THR GLU LEU VAL GLU LYS GLU PHE TRP ARG LEU SEQRES 4 A 70 VAL SER THR ILE GLU GLU ASP VAL THR VAL GLU TYR GLY SEQRES 5 A 70 ALA ASP ILE ALA SER LYS GLU PHE GLY SER GLY PHE PRO SEQRES 6 A 70 VAL ARG ASP GLY LYS SEQRES 1 A 311 ILE LYS LEU SER PRO GLU GLU GLU GLU TYR LEU ASP SER SEQRES 2 A 311 GLY TRP ASN LEU ASN ASN MET PRO VAL MET GLU GLN SER SEQRES 3 A 311 VAL LEU ALA HIS ILE THR ALA ASP ILE CYS GLY MET LYS SEQRES 4 A 311 LEU PRO TRP LEU TYR VAL GLY MET CYS PHE SER SER PHE SEQRES 5 A 311 CYS TRP HIS ILE GLU ASP HIS TRP SER TYR SER ILE ASN SEQRES 6 A 311 TYR LEU HIS TRP GLY GLU PRO LYS THR TRP TYR GLY VAL SEQRES 7 A 311 PRO GLY TYR ALA ALA GLU GLN LEU GLU ASN VAL MET LYS SEQRES 8 A 311 LYS LEU ALA PRO GLU LEU PHE VAL SER GLN PRO ASP LEU SEQRES 9 A 311 LEU HIS GLN LEU VAL THR ILE MET ASN PRO ASN THR LEU SEQRES 10 A 311 MET THR HIS GLU VAL PRO VAL TYR ARG THR ASN GLN CYS SEQRES 11 A 311 ALA GLY GLU PHE VAL ILE THR PHE PRO ARG ALA TYR HIS SEQRES 12 A 311 SER GLY PHE ASN GLN GLY PHE ASN PHE ALA GLU ALA VAL SEQRES 13 A 311 ASN PHE CYS THR VAL ASP TRP LEU PRO LEU GLY ARG GLN SEQRES 14 A 311 CYS VAL GLU HIS TYR ARG LEU LEU HIS ARG TYR CYS VAL SEQRES 15 A 311 PHE SER HIS ASP GLU MET ILE CYS LYS MET ALA SER LYS SEQRES 16 A 311 ALA ASP VAL LEU ASP VAL VAL VAL ALA SER THR VAL GLN SEQRES 17 A 311 LYS ASP MET ALA ILE MET ILE GLU ASP GLU LYS ALA LEU SEQRES 18 A 311 ARG GLU THR VAL ARG LYS LEU GLY VAL ILE ASP SER GLU SEQRES 19 A 311 ARG MET ASP PHE GLU LEU LEU PRO ASP ASP GLU ARG GLN SEQRES 20 A 311 CYS VAL LYS CYS LYS THR THR CYS PHE MET SER ALA ILE SEQRES 21 A 311 SER CYS SER CYS LYS PRO GLY LEU LEU VAL CYS LEU HIS SEQRES 22 A 311 HIS VAL LYS GLU LEU CYS SER CYS PRO PRO TYR LYS TYR SEQRES 23 A 311 LYS LEU ARG TYR ARG TYR THR LEU ASP ASP LEU TYR PRO SEQRES 24 A 311 MET MET ASN ALA LEU LYS LEU ARG ALA GLU SER TYR HET ZN A 1 1 HET ZN A 2 1 HET MN A 3 1 HET MN A 4 1 HET FQN A 784 39 ATOM 1 CA SER A 24 106.953 71.372 -2.025 1.00 78.46 C ATOM 2 C SER A 24 106.613 72.640 -1.242 1.00 80.21 C ATOM 3 O SER A 24 107.392 73.037 -0.367 1.00 81.28 O ATOM 4 N MET A 25 105.453 73.279 -1.562 1.00 71.85 N ATOM 5 CA MET A 25 105.016 74.514 -0.898 1.00 68.78 C ATOM 6 C MET A 25 103.569 74.496 -0.414 1.00 63.45 C ATOM 7 O MET A 25 102.669 74.143 -1.168 1.00 62.29 O ATOM 8 CB MET A 25 105.231 75.741 -1.796 1.00 72.68 C ATOM 9 CG MET A 25 105.344 77.029 -0.982 1.00 77.03 C ATOM 10 SD MET A 25 105.246 78.549 -1.935 1.00 83.16 S ATOM 11 CE MET A 25 106.746 78.430 -2.889 1.00 81.56 C ATOM 12 H MET A 25 104.851 72.875 -2.308 1.00 0.00 H ATOM 13 N PHE A 26 103.358 74.951 0.821 1.00 55.57 N ATOM 14 CA PHE A 26 102.045 75.053 1.448 1.00 52.46 C ATOM 15 C PHE A 26 101.867 76.458 1.970 1.00 56.65 C ATOM 16 O PHE A 26 102.731 76.962 2.683 1.00 57.85 O ATOM 17 CB PHE A 26 101.845 74.007 2.558 1.00 51.66 C ATOM 18 CG PHE A 26 100.454 74.036 3.152 1.00 50.62 C ATOM 19 CD1 PHE A 26 99.354 73.597 2.418 1.00 51.04 C ATOM 20 CD2 PHE A 26 100.237 74.537 4.431 1.00 50.38 C ATOM 21 CE1 PHE A 26 98.065 73.669 2.950 1.00 50.76 C ATOM 22 CE2 PHE A 26 98.949 74.591 4.969 1.00 51.52 C ATOM 23 CZ PHE A 26 97.871 74.159 4.229 1.00 49.14 C ATOM 24 H PHE A 26 104.185 75.253 1.375 1.00 0.00 H ATOM 25 N LEU A 27 100.805 77.125 1.525 1.00 52.15 N ATOM 26 CA LEU A 27 100.489 78.483 1.948 1.00 53.44 C ATOM 27 C LEU A 27 99.351 78.361 2.955 1.00 55.88 C ATOM 28 O LEU A 27 98.220 78.067 2.555 1.00 54.86 O ATOM 29 CB LEU A 27 100.122 79.364 0.743 1.00 55.47 C ATOM 30 CG LEU A 27 101.304 79.676 -0.190 1.00 64.50 C ATOM 31 CD1 LEU A 27 101.178 78.923 -1.499 1.00 66.60 C ATOM 32 CD2 LEU A 27 101.426 81.161 -0.455 1.00 68.52 C ATOM 33 H LEU A 27 100.173 76.656 0.845 1.00 0.00 H ATOM 34 N PRO A 28 99.636 78.435 4.280 1.00 51.12 N ATOM 35 CA PRO A 28 98.556 78.242 5.253 1.00 48.65 C ATOM 36 C PRO A 28 97.372 79.192 5.040 1.00 52.22 C ATOM 37 O PRO A 28 97.561 80.382 4.775 1.00 52.73 O ATOM 38 CB PRO A 28 99.248 78.402 6.617 1.00 50.68 C ATOM 39 CG PRO A 28 100.729 78.095 6.335 1.00 55.73 C ATOM 40 CD PRO A 28 100.928 78.712 4.960 1.00 52.68 C ATOM 41 N PRO A 29 96.140 78.634 5.009 1.00 46.48 N ATOM 42 CA PRO A 29 94.943 79.485 4.861 1.00 45.49 C ATOM 43 C PRO A 29 94.851 80.508 6.020 1.00 47.71 C ATOM 44 O PRO A 29 95.466 80.259 7.054 1.00 45.13 O ATOM 45 CB PRO A 29 93.786 78.468 4.965 1.00 45.40 C ATOM 46 CG PRO A 29 94.418 77.125 4.604 1.00 48.89 C ATOM 47 CD PRO A 29 95.772 77.217 5.220 1.00 45.99 C ATOM 48 N PRO A 30 94.127 81.656 5.884 1.00 44.51 N ATOM 49 CA PRO A 30 94.007 82.589 7.023 1.00 44.84 C ATOM 50 C PRO A 30 93.346 81.940 8.248 1.00 48.40 C ATOM 51 O PRO A 30 92.576 80.985 8.118 1.00 46.97 O ATOM 52 CB PRO A 30 93.113 83.711 6.469 1.00 47.23 C ATOM 53 CG PRO A 30 92.354 83.072 5.334 1.00 50.89 C ATOM 54 CD PRO A 30 93.353 82.138 4.719 1.00 46.02 C ATOM 55 N GLU A 31 93.640 82.473 9.433 1.00 45.48 N ATOM 56 CA GLU A 31 93.097 81.980 10.697 1.00 44.29 C ATOM 57 C GLU A 31 91.594 82.209 10.830 1.00 49.57 C ATOM 58 O GLU A 31 91.099 83.268 10.449 1.00 49.90 O ATOM 59 CB GLU A 31 93.849 82.605 11.897 1.00 45.91 C ATOM 60 CG GLU A 31 95.294 82.133 12.017 1.00 53.24 C ATOM 61 CD GLU A 31 95.514 80.652 12.292 1.00 63.16 C ATOM 62 OE1 GLU A 31 94.857 80.108 13.207 1.00 54.93 O ATOM 63 OE2 GLU A 31 96.396 80.052 11.641 1.00 61.86 O ATOM 64 H GLU A 31 94.291 83.284 9.460 1.00 0.00 H ATOM 65 N CYS A 32 90.868 81.215 11.378 1.00 46.16 N ATOM 66 CA CYS A 32 89.434 81.337 11.626 1.00 46.45 C ATOM 67 C CYS A 32 89.229 82.246 12.887 1.00 50.10 C ATOM 68 O CYS A 32 90.207 82.459 13.625 1.00 48.86 O ATOM 69 CB CYS A 32 88.796 79.956 11.802 1.00 46.20 C ATOM 70 SG CYS A 32 89.081 79.200 13.429 1.00 49.63 S ATOM 71 H CYS A 32 91.347 80.328 11.634 1.00 0.00 H ATOM 72 N PRO A 33 87.995 82.766 13.163 1.00 46.67 N ATOM 73 CA PRO A 33 87.797 83.606 14.364 1.00 46.96 C ATOM 74 C PRO A 33 88.013 82.830 15.661 1.00 50.06 C ATOM 75 O PRO A 33 87.736 81.637 15.714 1.00 47.55 O ATOM 76 CB PRO A 33 86.333 84.071 14.247 1.00 48.71 C ATOM 77 CG PRO A 33 85.932 83.796 12.843 1.00 52.91 C ATOM 78 CD PRO A 33 86.730 82.617 12.415 1.00 47.56 C ATOM 79 N VAL A 34 88.560 83.506 16.687 1.00 47.92 N ATOM 80 CA VAL A 34 88.815 82.925 18.007 1.00 46.93 C ATOM 81 C VAL A 34 88.042 83.782 18.989 1.00 53.52 C ATOM 82 O VAL A 34 88.173 85.011 18.985 1.00 55.53 O ATOM 83 CB VAL A 34 90.325 82.839 18.366 1.00 50.34 C ATOM 84 CG1 VAL A 34 90.539 82.097 19.692 1.00 49.08 C ATOM 85 CG2 VAL A 34 91.126 82.181 17.242 1.00 49.18 C ATOM 86 H VAL A 34 88.818 84.502 16.534 1.00 0.00 H ATOM 87 N PHE A 35 87.178 83.146 19.770 1.00 49.69 N ATOM 88 CA PHE A 35 86.365 83.842 20.755 1.00 50.10 C ATOM 89 C PHE A 35 86.815 83.490 22.145 1.00 54.34 C ATOM 90 O PHE A 35 87.188 82.342 22.425 1.00 50.34 O ATOM 91 CB PHE A 35 84.865 83.562 20.576 1.00 51.22 C ATOM 92 CG PHE A 35 84.347 83.928 19.211 1.00 52.28 C ATOM 93 CD1 PHE A 35 83.979 85.236 18.917 1.00 57.77 C ATOM 94 CD2 PHE A 35 84.239 82.970 18.213 1.00 52.00 C ATOM 95 CE1 PHE A 35 83.498 85.576 17.645 1.00 59.33 C ATOM 96 CE2 PHE A 35 83.750 83.305 16.948 1.00 56.29 C ATOM 97 CZ PHE A 35 83.384 84.603 16.668 1.00 56.89 C ATOM 98 H PHE A 35 87.079 82.115 19.675 1.00 0.00 H ATOM 99 N GLU A 36 86.774 84.503 23.020 1.00 54.38 N ATOM 100 CA GLU A 36 87.164 84.384 24.414 1.00 55.19 C ATOM 101 C GLU A 36 86.026 84.934 25.287 1.00 61.09 C ATOM 102 O GLU A 36 86.123 86.046 25.810 1.00 62.85 O ATOM 103 CB GLU A 36 88.498 85.095 24.658 1.00 57.11 C ATOM 104 CG GLU A 36 89.697 84.380 24.052 1.00 65.79 C ATOM 105 CD GLU A 36 91.051 84.802 24.594 1.00 87.67 C ATOM 106 OE1 GLU A 36 91.089 85.519 25.620 1.00 83.78 O ATOM 107 OE2 GLU A 36 92.077 84.383 24.011 1.00 79.44 O ATOM 108 H GLU A 36 86.444 85.429 22.681 1.00 0.00 H ATOM 109 N PRO A 37 84.910 84.180 25.423 1.00 56.94 N ATOM 110 CA PRO A 37 83.790 84.693 26.222 1.00 57.95 C ATOM 111 C PRO A 37 84.096 84.850 27.710 1.00 62.87 C ATOM 112 O PRO A 37 84.902 84.113 28.278 1.00 59.86 O ATOM 113 CB PRO A 37 82.688 83.657 25.995 1.00 58.46 C ATOM 114 CG PRO A 37 83.406 82.406 25.634 1.00 60.84 C ATOM 115 CD PRO A 37 84.606 82.842 24.865 1.00 55.97 C ATOM 116 N SER A 38 83.412 85.807 28.336 1.00 63.53 N ATOM 117 CA SER A 38 83.481 86.056 29.773 1.00 65.90 C ATOM 118 C SER A 38 82.567 85.008 30.412 1.00 73.14 C ATOM 119 O SER A 38 81.835 84.335 29.683 1.00 71.28 O ATOM 120 CB SER A 38 82.963 87.459 30.084 1.00 69.27 C ATOM 121 OG SER A 38 81.608 87.607 29.696 1.00 72.57 O ATOM 122 HG SER A 38 81.526 87.450 28.722 1.00 0.00 H ATOM 123 H SER A 38 82.790 86.415 27.765 1.00 0.00 H ATOM 124 N TRP A 39 82.584 84.874 31.747 1.00 74.40 N ATOM 125 CA TRP A 39 81.709 83.920 32.426 1.00 76.09 C ATOM 126 C TRP A 39 80.232 84.116 32.086 1.00 77.01 C ATOM 127 O TRP A 39 79.559 83.130 31.798 1.00 75.95 O ATOM 128 CB TRP A 39 81.935 83.905 33.939 1.00 78.27 C ATOM 129 CG TRP A 39 82.801 82.766 34.376 1.00 79.91 C ATOM 130 CD1 TRP A 39 84.091 82.840 34.815 1.00 83.11 C ATOM 131 CD2 TRP A 39 82.471 81.367 34.331 1.00 79.42 C ATOM 132 NE1 TRP A 39 84.577 81.577 35.074 1.00 81.99 N ATOM 133 CE2 TRP A 39 83.605 80.654 34.787 1.00 82.86 C ATOM 134 CE3 TRP A 39 81.316 80.645 33.968 1.00 81.05 C ATOM 135 CZ2 TRP A 39 83.614 79.259 34.913 1.00 81.38 C ATOM 136 CZ3 TRP A 39 81.334 79.260 34.072 1.00 81.95 C ATOM 137 CH2 TRP A 39 82.468 78.583 34.551 1.00 81.91 C ATOM 138 HE1 TRP A 39 85.529 81.359 35.430 1.00 0.00 H ATOM 139 H TRP A 39 83.233 85.461 32.310 1.00 0.00 H ATOM 140 N GLU A 40 79.759 85.378 32.042 1.00 72.73 N ATOM 141 CA GLU A 40 78.371 85.716 31.710 1.00 73.41 C ATOM 142 C GLU A 40 78.007 85.312 30.271 1.00 74.63 C ATOM 143 O GLU A 40 76.922 84.765 30.047 1.00 73.75 O ATOM 144 CB GLU A 40 78.085 87.209 31.964 1.00 77.03 C ATOM 145 H GLU A 40 80.416 86.156 32.256 1.00 0.00 H ATOM 146 N GLU A 41 78.923 85.572 29.308 1.00 69.22 N ATOM 147 CA GLU A 41 78.753 85.227 27.895 1.00 67.36 C ATOM 148 C GLU A 41 78.753 83.705 27.738 1.00 68.57 C ATOM 149 O GLU A 41 77.921 83.167 27.000 1.00 68.39 O ATOM 150 CB GLU A 41 79.902 85.796 27.049 1.00 68.01 C ATOM 151 CG GLU A 41 79.922 87.297 26.838 1.00 81.41 C ATOM 152 CD GLU A 41 81.130 87.730 26.028 1.00105.98 C ATOM 153 OE1 GLU A 41 82.169 88.064 26.642 1.00 92.76 O ATOM 154 OE2 GLU A 41 81.062 87.670 24.779 1.00108.96 O ATOM 155 H GLU A 41 79.804 86.047 29.590 1.00 0.00 H ATOM 156 N PHE A 42 79.674 83.022 28.461 1.00 62.51 N ATOM 157 CA PHE A 42 79.882 81.567 28.427 1.00 60.03 C ATOM 158 C PHE A 42 78.735 80.774 29.029 1.00 69.03 C ATOM 159 O PHE A 42 78.382 79.736 28.477 1.00 69.46 O ATOM 160 CB PHE A 42 81.233 81.180 29.083 1.00 58.96 C ATOM 161 CG PHE A 42 81.734 79.769 28.841 1.00 55.58 C ATOM 162 CD1 PHE A 42 82.196 79.381 27.585 1.00 53.46 C ATOM 163 CD2 PHE A 42 81.819 78.857 29.887 1.00 54.97 C ATOM 164 CE1 PHE A 42 82.713 78.100 27.379 1.00 51.94 C ATOM 165 CE2 PHE A 42 82.321 77.573 29.674 1.00 54.88 C ATOM 166 CZ PHE A 42 82.758 77.201 28.421 1.00 51.11 C ATOM 167 H PHE A 42 80.286 83.575 29.094 1.00 0.00 H ATOM 168 N ALA A 43 78.145 81.271 30.128 1.00 69.22 N ATOM 169 CA ALA A 43 77.028 80.678 30.884 1.00 71.13 C ATOM 170 C ALA A 43 75.986 79.936 30.033 1.00 77.53 C ATOM 171 O ALA A 43 75.595 78.823 30.393 1.00 79.22 O ATOM 172 CB ALA A 43 76.353 81.739 31.734 1.00 74.00 C ATOM 173 H ALA A 43 78.517 82.174 30.485 1.00 0.00 H ATOM 174 N ASP A 44 75.570 80.526 28.896 1.00 72.92 N ATOM 175 CA ASP A 44 74.595 79.910 27.996 1.00 71.33 C ATOM 176 C ASP A 44 75.240 79.616 26.627 1.00 70.67 C ATOM 177 O ASP A 44 75.429 80.546 25.832 1.00 69.28 O ATOM 178 CB ASP A 44 73.344 80.805 27.865 1.00 74.68 C ATOM 179 CG ASP A 44 72.158 80.220 27.106 1.00 80.49 C ATOM 180 OD1 ASP A 44 72.326 79.165 26.441 1.00 76.98 O ATOM 181 OD2 ASP A 44 71.064 80.814 27.179 1.00 90.79 O ATOM 182 H ASP A 44 75.958 81.458 28.648 1.00 0.00 H ATOM 183 N PRO A 45 75.566 78.325 26.334 1.00 64.74 N ATOM 184 CA PRO A 45 76.193 77.996 25.042 1.00 61.79 C ATOM 185 C PRO A 45 75.363 78.400 23.820 1.00 64.15 C ATOM 186 O PRO A 45 75.922 78.953 22.879 1.00 61.64 O ATOM 187 CB PRO A 45 76.415 76.479 25.120 1.00 62.56 C ATOM 188 CG PRO A 45 75.499 76.004 26.182 1.00 68.75 C ATOM 189 CD PRO A 45 75.415 77.117 27.173 1.00 66.06 C ATOM 190 N PHE A 46 74.033 78.200 23.874 1.00 61.22 N ATOM 191 CA PHE A 46 73.107 78.527 22.785 1.00 61.96 C ATOM 192 C PHE A 46 72.972 80.040 22.546 1.00 63.62 C ATOM 193 O PHE A 46 73.004 80.460 21.389 1.00 61.67 O ATOM 194 CB PHE A 46 71.744 77.840 22.987 1.00 65.75 C ATOM 195 CG PHE A 46 71.834 76.331 22.849 1.00 67.51 C ATOM 196 CD1 PHE A 46 71.720 75.721 21.603 1.00 70.29 C ATOM 197 CD2 PHE A 46 72.046 75.523 23.964 1.00 69.91 C ATOM 198 CE1 PHE A 46 71.828 74.331 21.473 1.00 70.47 C ATOM 199 CE2 PHE A 46 72.169 74.136 23.829 1.00 72.16 C ATOM 200 CZ PHE A 46 72.062 73.549 22.585 1.00 69.33 C ATOM 201 H PHE A 46 73.637 77.788 24.743 1.00 0.00 H ATOM 202 N ALA A 47 72.892 80.856 23.620 1.00 60.98 N ATOM 203 CA ALA A 47 72.856 82.321 23.486 1.00 61.71 C ATOM 204 C ALA A 47 74.216 82.830 22.927 1.00 62.81 C ATOM 205 O ALA A 47 74.242 83.739 22.093 1.00 62.73 O ATOM 206 CB ALA A 47 72.544 82.981 24.829 1.00 63.98 C ATOM 207 H ALA A 47 72.855 80.436 24.571 1.00 0.00 H ATOM 208 N PHE A 48 75.325 82.198 23.339 1.00 58.12 N ATOM 209 CA PHE A 48 76.661 82.547 22.841 1.00 57.70 C ATOM 210 C PHE A 48 76.839 82.191 21.347 1.00 60.65 C ATOM 211 O PHE A 48 77.321 83.022 20.572 1.00 60.18 O ATOM 212 CB PHE A 48 77.772 81.941 23.718 1.00 59.28 C ATOM 213 CG PHE A 48 79.163 82.276 23.227 1.00 61.12 C ATOM 214 CD1 PHE A 48 79.697 83.545 23.415 1.00 66.24 C ATOM 215 CD2 PHE A 48 79.917 81.340 22.530 1.00 62.64 C ATOM 216 CE1 PHE A 48 80.962 83.866 22.920 1.00 66.88 C ATOM 217 CE2 PHE A 48 81.184 81.663 22.041 1.00 64.85 C ATOM 218 CZ PHE A 48 81.706 82.915 22.263 1.00 63.91 C ATOM 219 H PHE A 48 75.235 81.432 24.037 1.00 0.00 H ATOM 220 N ILE A 49 76.429 80.979 20.947 1.00 57.43 N ATOM 221 CA ILE A 49 76.503 80.495 19.559 1.00 56.84 C ATOM 222 C ILE A 49 75.685 81.414 18.621 1.00 62.40 C ATOM 223 O ILE A 49 76.145 81.718 17.517 1.00 61.80 O ATOM 224 CB ILE A 49 76.115 78.983 19.481 1.00 59.41 C ATOM 225 CG1 ILE A 49 77.230 78.106 20.119 1.00 58.72 C ATOM 226 CG2 ILE A 49 75.800 78.537 18.041 1.00 59.56 C ATOM 227 CD1 ILE A 49 76.791 76.729 20.680 1.00 66.45 C ATOM 228 H ILE A 49 76.033 80.339 21.664 1.00 0.00 H ATOM 229 N HIS A 50 74.506 81.893 19.094 1.00 60.27 N ATOM 230 CA HIS A 50 73.650 82.829 18.365 1.00 61.74 C ATOM 231 C HIS A 50 74.330 84.205 18.199 1.00 65.06 C ATOM 232 O HIS A 50 74.225 84.800 17.129 1.00 65.16 O ATOM 233 CB HIS A 50 72.277 82.973 19.047 1.00 64.81 C ATOM 234 CG HIS A 50 71.361 83.915 18.336 1.00 70.55 C ATOM 235 ND1 HIS A 50 70.780 83.580 17.118 1.00 72.72 N ATOM 236 CD2 HIS A 50 70.971 85.165 18.680 1.00 74.56 C ATOM 237 CE1 HIS A 50 70.037 84.625 16.777 1.00 74.11 C ATOM 238 NE2 HIS A 50 70.124 85.606 17.686 1.00 75.64 N ATOM 239 H HIS A 50 74.192 81.575 20.033 1.00 0.00 H ATOM 240 N LYS A 51 75.026 84.695 19.250 1.00 61.10 N ATOM 241 CA LYS A 51 75.751 85.975 19.244 1.00 61.66 C ATOM 242 C LYS A 51 76.907 85.988 18.214 1.00 65.95 C ATOM 243 O LYS A 51 77.036 86.953 17.453 1.00 66.68 O ATOM 244 CB LYS A 51 76.277 86.309 20.653 1.00 63.55 C ATOM 245 CG LYS A 51 76.740 87.756 20.820 1.00 75.39 C ATOM 246 CD LYS A 51 77.358 88.012 22.185 1.00 83.03 C ATOM 247 H LYS A 51 75.050 84.128 20.122 1.00 0.00 H ATOM 248 N ILE A 52 77.731 84.914 18.191 1.00 60.62 N ATOM 249 CA ILE A 52 78.902 84.775 17.306 1.00 58.87 C ATOM 250 C ILE A 52 78.542 84.371 15.870 1.00 63.06 C ATOM 251 O ILE A 52 79.367 84.543 14.965 1.00 62.69 O ATOM 252 CB ILE A 52 79.964 83.823 17.919 1.00 59.72 C ATOM 253 CG1 ILE A 52 79.464 82.355 17.979 1.00 59.09 C ATOM 254 CG2 ILE A 52 80.416 84.353 19.288 1.00 59.89 C ATOM 255 CD1 ILE A 52 80.497 81.284 18.348 1.00 61.69 C ATOM 256 H ILE A 52 77.523 84.132 18.844 1.00 0.00 H ATOM 257 N ARG A 53 77.327 83.833 15.670 1.00 59.96 N ATOM 258 CA ARG A 53 76.826 83.348 14.387 1.00 60.08 C ATOM 259 C ARG A 53 77.081 84.324 13.197 1.00 64.14 C ATOM 260 O ARG A 53 77.615 83.840 12.205 1.00 61.40 O ATOM 261 CB ARG A 53 75.339 82.940 14.479 1.00 62.72 C ATOM 262 CG ARG A 53 74.827 82.183 13.250 1.00 73.66 C ATOM 263 CD ARG A 53 73.393 81.733 13.402 1.00 87.74 C ATOM 264 NE ARG A 53 72.451 82.841 13.243 1.00102.49 N ATOM 265 CZ ARG A 53 71.779 83.101 12.126 1.00120.37 C ATOM 266 NH1 ARG A 53 71.927 82.327 11.057 1.00107.03 N ATOM 267 NH2 ARG A 53 70.941 84.128 12.074 1.00111.07 N ATOM 268 HE ARG A 53 72.297 83.467 14.059 1.00 0.00 H ATOM 269 HH12 ARG A 53 71.398 82.536 10.186 1.00 0.00 H ATOM 270 HH11 ARG A 53 72.572 81.512 11.091 1.00 0.00 H ATOM 271 HH22 ARG A 53 70.417 84.328 11.198 1.00 0.00 H ATOM 272 HH21 ARG A 53 70.808 84.733 12.909 1.00 0.00 H ATOM 273 H ARG A 53 76.695 83.756 16.492 1.00 0.00 H ATOM 274 N PRO A 54 76.771 85.656 13.240 1.00 62.78 N ATOM 275 CA PRO A 54 77.051 86.507 12.060 1.00 63.08 C ATOM 276 C PRO A 54 78.505 86.498 11.581 1.00 64.17 C ATOM 277 O PRO A 54 78.741 86.558 10.375 1.00 63.33 O ATOM 278 CB PRO A 54 76.589 87.904 12.504 1.00 66.94 C ATOM 279 CG PRO A 54 75.580 87.639 13.567 1.00 71.81 C ATOM 280 CD PRO A 54 76.100 86.441 14.301 1.00 65.58 C ATOM 281 N ILE A 55 79.467 86.375 12.514 1.00 59.98 N ATOM 282 CA ILE A 55 80.908 86.306 12.209 1.00 58.67 C ATOM 283 C ILE A 55 81.306 84.881 11.797 1.00 60.88 C ATOM 284 O ILE A 55 81.878 84.686 10.721 1.00 60.64 O ATOM 285 CB ILE A 55 81.784 86.815 13.408 1.00 61.36 C ATOM 286 CG1 ILE A 55 81.497 88.295 13.746 1.00 63.57 C ATOM 287 CG2 ILE A 55 83.292 86.583 13.152 1.00 59.99 C ATOM 288 CD1 ILE A 55 81.882 88.726 15.205 1.00 70.45 C ATOM 289 H ILE A 55 79.176 86.326 13.511 1.00 0.00 H ATOM 290 N ALA A 56 81.038 83.903 12.677 1.00 56.98 N ATOM 291 CA ALA A 56 81.425 82.499 12.521 1.00 55.78 C ATOM 292 C ALA A 56 80.815 81.769 11.302 1.00 61.08 C ATOM 293 O ALA A 56 81.465 80.886 10.742 1.00 60.03 O ATOM 294 CB ALA A 56 81.125 81.743 13.796 1.00 55.80 C ATOM 295 H ALA A 56 80.514 84.163 13.537 1.00 0.00 H ATOM 296 N GLU A 57 79.604 82.148 10.866 1.00 58.49 N ATOM 297 CA GLU A 57 79.002 81.512 9.696 1.00 57.71 C ATOM 298 C GLU A 57 79.698 81.922 8.380 1.00 59.54 C ATOM 299 O GLU A 57 79.540 81.237 7.365 1.00 58.41 O ATOM 300 CB GLU A 57 77.476 81.716 9.651 1.00 60.12 C ATOM 301 CG GLU A 57 76.987 83.053 9.112 1.00 72.59 C ATOM 302 CD GLU A 57 75.487 83.280 9.217 1.00 97.69 C ATOM 303 OE1 GLU A 57 74.731 82.290 9.361 1.00 85.19 O ATOM 304 OE2 GLU A 57 75.067 84.457 9.140 1.00 99.01 O ATOM 305 H GLU A 57 79.089 82.901 11.365 1.00 0.00 H ATOM 306 N GLN A 58 80.489 83.011 8.419 1.00 55.82 N ATOM 307 CA GLN A 58 81.258 83.513 7.272 1.00 55.73 C ATOM 308 C GLN A 58 82.577 82.739 7.091 1.00 54.42 C ATOM 309 O GLN A 58 83.229 82.876 6.059 1.00 54.41 O ATOM 310 CB GLN A 58 81.551 85.029 7.430 1.00 58.80 C ATOM 311 CG GLN A 58 80.322 85.939 7.310 1.00 77.45 C ATOM 312 CD GLN A 58 79.566 85.753 6.007 1.00100.57 C ATOM 313 OE1 GLN A 58 78.491 85.139 5.969 1.00 94.26 O ATOM 314 NE2 GLN A 58 80.126 86.244 4.906 1.00 94.59 N ATOM 315 HE22 GLN A 58 81.029 86.756 4.966 1.00 0.00 H ATOM 316 HE21 GLN A 58 79.661 86.116 3.985 1.00 0.00 H ATOM 317 H GLN A 58 80.560 83.530 9.318 1.00 0.00 H ATOM 318 N THR A 59 82.967 81.937 8.094 1.00 46.93 N ATOM 319 CA THR A 59 84.207 81.168 8.078 1.00 45.30 C ATOM 320 C THR A 59 83.983 79.658 8.194 1.00 48.31 C ATOM 321 O THR A 59 84.922 78.880 7.998 1.00 47.04 O ATOM 322 CB THR A 59 85.171 81.690 9.165 1.00 48.13 C ATOM 323 OG1 THR A 59 84.568 81.478 10.445 1.00 51.02 O ATOM 324 CG2 THR A 59 85.521 83.180 8.979 1.00 42.31 C ATOM 325 HG1 THR A 59 84.403 80.510 10.575 1.00 0.00 H ATOM 326 H THR A 59 82.351 81.859 8.929 1.00 0.00 H ATOM 327 N GLY A 60 82.762 79.267 8.552 1.00 45.51 N ATOM 328 CA GLY A 60 82.360 77.872 8.715 1.00 44.71 C ATOM 329 C GLY A 60 82.727 77.278 10.057 1.00 47.75 C ATOM 330 O GLY A 60 81.924 76.579 10.668 1.00 46.88 O ATOM 331 H GLY A 60 82.048 80.002 8.727 1.00 0.00 H ATOM 332 N ILE A 61 83.956 77.521 10.500 1.00 46.03 N ATOM 333 CA ILE A 61 84.466 77.051 11.795 1.00 45.89 C ATOM 334 C ILE A 61 84.899 78.249 12.625 1.00 48.40 C ATOM 335 O ILE A 61 85.247 79.311 12.082 1.00 47.57 O ATOM 336 CB ILE A 61 85.638 75.999 11.682 1.00 47.74 C ATOM 337 CG1 ILE A 61 86.912 76.611 11.054 1.00 48.52 C ATOM 338 CG2 ILE A 61 85.199 74.719 10.965 1.00 47.10 C ATOM 339 CD1 ILE A 61 88.224 75.776 11.162 1.00 51.94 C ATOM 340 H ILE A 61 84.594 78.076 9.895 1.00 0.00 H ATOM 341 N CYS A 62 84.916 78.059 13.935 1.00 44.45 N ATOM 342 CA CYS A 62 85.464 79.043 14.864 1.00 45.29 C ATOM 343 C CYS A 62 85.989 78.313 16.092 1.00 46.01 C ATOM 344 O CYS A 62 85.638 77.160 16.331 1.00 45.23 O ATOM 345 CB CYS A 62 84.444 80.119 15.225 1.00 47.98 C ATOM 346 SG CYS A 62 83.135 79.543 16.329 1.00 52.81 S ATOM 347 H CYS A 62 84.524 77.175 14.317 1.00 0.00 H ATOM 348 N LYS A 63 86.847 78.972 16.849 1.00 42.48 N ATOM 349 CA LYS A 63 87.436 78.424 18.054 1.00 41.83 C ATOM 350 C LYS A 63 86.904 79.208 19.260 1.00 49.16 C ATOM 351 O LYS A 63 86.716 80.426 19.181 1.00 50.49 O ATOM 352 CB LYS A 63 88.957 78.522 17.952 1.00 42.85 C ATOM 353 CG LYS A 63 89.726 77.682 18.964 1.00 54.05 C ATOM 354 CD LYS A 63 91.165 77.400 18.508 1.00 52.60 C ATOM 355 CE LYS A 63 92.020 78.645 18.425 1.00 42.97 C ATOM 356 NZ LYS A 63 93.416 78.323 18.073 1.00 52.31 N ATOM 357 HZ1 LYS A 63 93.819 77.695 18.798 1.00 0.00 H ATOM 358 HZ2 LYS A 63 93.438 77.847 17.149 1.00 0.00 H ATOM 359 HZ3 LYS A 63 93.972 79.201 18.025 1.00 0.00 H ATOM 360 H LYS A 63 87.114 79.936 16.565 1.00 0.00 H ATOM 361 N VAL A 64 86.607 78.489 20.348 1.00 44.84 N ATOM 362 CA VAL A 64 86.121 79.062 21.587 1.00 44.63 C ATOM 363 C VAL A 64 87.066 78.708 22.727 1.00 48.59 C ATOM 364 O VAL A 64 87.217 77.535 23.074 1.00 47.03 O ATOM 365 CB VAL A 64 84.636 78.729 21.937 1.00 47.47 C ATOM 366 CG1 VAL A 64 84.199 79.432 23.236 1.00 47.51 C ATOM 367 CG2 VAL A 64 83.694 79.089 20.789 1.00 47.17 C ATOM 368 H VAL A 64 86.732 77.458 20.302 1.00 0.00 H ATOM 369 N ARG A 65 87.696 79.728 23.307 1.00 47.76 N ATOM 370 CA ARG A 65 88.577 79.574 24.461 1.00 48.51 C ATOM 371 C ARG A 65 87.690 79.822 25.696 1.00 52.87 C ATOM 372 O ARG A 65 87.207 80.940 25.880 1.00 53.92 O ATOM 373 CB ARG A 65 89.745 80.572 24.415 1.00 50.09 C ATOM 374 CG ARG A 65 90.837 80.229 23.403 1.00 56.50 C ATOM 375 CD ARG A 65 92.115 81.012 23.683 1.00 56.28 C ATOM 376 NE ARG A 65 93.216 80.587 22.820 1.00 58.95 N ATOM 377 CZ ARG A 65 93.616 81.259 21.749 1.00 68.38 C ATOM 378 HE ARG A 65 93.715 79.706 23.060 1.00 0.00 H ATOM 379 H ARG A 65 87.553 80.682 22.918 1.00 0.00 H ATOM 380 N PRO A 66 87.387 78.788 26.505 1.00 48.20 N ATOM 381 CA PRO A 66 86.522 79.009 27.681 1.00 50.02 C ATOM 382 C PRO A 66 87.205 79.890 28.739 1.00 55.53 C ATOM 383 O PRO A 66 88.436 79.967 28.715 1.00 53.71 O ATOM 384 CB PRO A 66 86.299 77.578 28.222 1.00 51.12 C ATOM 385 CG PRO A 66 86.689 76.662 27.082 1.00 53.23 C ATOM 386 CD PRO A 66 87.821 77.379 26.436 1.00 47.95 C ATOM 387 N PRO A 67 86.445 80.526 29.681 1.00 55.10 N ATOM 388 CA PRO A 67 87.089 81.303 30.760 1.00 57.00 C ATOM 389 C PRO A 67 88.197 80.503 31.456 1.00 63.68 C ATOM 390 O PRO A 67 88.061 79.282 31.573 1.00 61.82 O ATOM 391 CB PRO A 67 85.931 81.607 31.707 1.00 59.82 C ATOM 392 CG PRO A 67 84.728 81.583 30.842 1.00 63.24 C ATOM 393 CD PRO A 67 84.975 80.514 29.843 1.00 56.67 C ATOM 394 N PRO A 68 89.328 81.153 31.843 1.00 64.79 N ATOM 395 CA PRO A 68 90.482 80.415 32.418 1.00 65.27 C ATOM 396 C PRO A 68 90.202 79.404 33.535 1.00 70.21 C ATOM 397 O PRO A 68 90.900 78.385 33.621 1.00 69.50 O ATOM 398 CB PRO A 68 91.405 81.535 32.929 1.00 68.33 C ATOM 399 CG PRO A 68 90.563 82.807 32.889 1.00 73.95 C ATOM 400 CD PRO A 68 89.635 82.595 31.739 1.00 68.32 C ATOM 401 N ASP A 69 89.195 79.680 34.368 1.00 67.81 N ATOM 402 CA ASP A 69 88.787 78.837 35.490 1.00 69.08 C ATOM 403 C ASP A 69 87.770 77.711 35.118 1.00 71.30 C ATOM 404 O ASP A 69 87.510 76.862 35.974 1.00 72.42 O ATOM 405 CB ASP A 69 88.285 79.679 36.692 1.00 73.85 C ATOM 406 CG ASP A 69 87.454 80.932 36.411 1.00 94.22 C ATOM 407 OD1 ASP A 69 87.280 81.289 35.214 1.00 94.58 O ATOM 408 OD2 ASP A 69 86.994 81.572 37.389 1.00103.42 O ATOM 409 H ASP A 69 88.663 80.559 34.206 1.00 0.00 H ATOM 410 N TRP A 70 87.233 77.664 33.861 1.00 64.29 N ATOM 411 CA TRP A 70 86.350 76.553 33.453 1.00 61.64 C ATOM 412 C TRP A 70 87.295 75.421 33.101 1.00 64.69 C ATOM 413 O TRP A 70 87.929 75.458 32.054 1.00 63.51 O ATOM 414 CB TRP A 70 85.442 76.910 32.260 1.00 58.73 C ATOM 415 CG TRP A 70 84.373 75.883 31.981 1.00 58.57 C ATOM 416 CD1 TRP A 70 83.136 75.811 32.557 1.00 62.37 C ATOM 417 CD2 TRP A 70 84.418 74.831 30.994 1.00 56.37 C ATOM 418 NE1 TRP A 70 82.423 74.759 32.022 1.00 60.73 N ATOM 419 CE2 TRP A 70 83.191 74.131 31.073 1.00 60.57 C ATOM 420 CE3 TRP A 70 85.394 74.382 30.088 1.00 55.73 C ATOM 421 CZ2 TRP A 70 82.917 73.002 30.284 1.00 58.67 C ATOM 422 CZ3 TRP A 70 85.114 73.276 29.294 1.00 55.83 C ATOM 423 CH2 TRP A 70 83.904 72.580 29.420 1.00 56.82 C ATOM 424 HE1 TRP A 70 81.457 74.485 32.294 1.00 0.00 H ATOM 425 H TRP A 70 87.450 78.422 33.183 1.00 0.00 H ATOM 426 N GLN A 71 87.505 74.488 34.032 1.00 61.99 N ATOM 427 CA GLN A 71 88.443 73.395 33.795 1.00 61.43 C ATOM 428 C GLN A 71 87.800 72.086 34.204 1.00 65.55 C ATOM 429 O GLN A 71 87.908 71.709 35.373 1.00 66.58 O ATOM 430 CB GLN A 71 89.775 73.648 34.539 1.00 63.98 C ATOM 431 CG GLN A 71 90.702 74.642 33.819 1.00 89.18 C ATOM 432 CD GLN A 71 91.621 75.416 34.741 1.00108.94 C ATOM 433 OE1 GLN A 71 92.846 75.416 34.571 1.00107.16 O ATOM 434 NE2 GLN A 71 91.054 76.138 35.704 1.00 95.30 N ATOM 435 HE22 GLN A 71 90.021 76.121 35.827 1.00 0.00 H ATOM 436 HE21 GLN A 71 91.643 76.719 36.334 1.00 0.00 H ATOM 437 H GLN A 71 86.995 74.540 34.937 1.00 0.00 H ATOM 438 N PRO A 72 87.049 71.413 33.284 1.00 61.54 N ATOM 439 CA PRO A 72 86.401 70.136 33.648 1.00 61.22 C ATOM 440 C PRO A 72 87.448 69.101 34.054 1.00 65.30 C ATOM 441 O PRO A 72 88.533 69.111 33.475 1.00 62.56 O ATOM 442 CB PRO A 72 85.672 69.724 32.364 1.00 61.49 C ATOM 443 CG PRO A 72 86.376 70.431 31.279 1.00 64.60 C ATOM 444 CD PRO A 72 86.817 71.735 31.862 1.00 61.12 C ATOM 445 N PRO A 73 87.188 68.247 35.063 1.00 65.69 N ATOM 446 CA PRO A 73 88.224 67.292 35.464 1.00 66.99 C ATOM 447 C PRO A 73 88.348 66.116 34.514 1.00 73.93 C ATOM 448 O PRO A 73 87.355 65.465 34.200 1.00 75.58 O ATOM 449 CB PRO A 73 87.805 66.878 36.872 1.00 70.50 C ATOM 450 CG PRO A 73 86.310 67.044 36.890 1.00 75.52 C ATOM 451 CD PRO A 73 85.955 68.093 35.868 1.00 69.52 C ATOM 452 N PHE A 74 89.566 65.876 34.018 1.00 71.52 N ATOM 453 CA PHE A 74 89.823 64.721 33.176 1.00 71.36 C ATOM 454 C PHE A 74 90.582 63.662 33.970 1.00 73.38 C ATOM 455 O PHE A 74 91.725 63.883 34.384 1.00 71.81 O ATOM 456 CB PHE A 74 90.538 65.049 31.849 1.00 72.85 C ATOM 457 CG PHE A 74 90.375 63.880 30.901 1.00 75.83 C ATOM 458 CD1 PHE A 74 91.222 62.778 30.976 1.00 80.62 C ATOM 459 CD2 PHE A 74 89.297 63.818 30.029 1.00 78.98 C ATOM 460 CE1 PHE A 74 91.011 61.657 30.174 1.00 82.32 C ATOM 461 CE2 PHE A 74 89.108 62.706 29.207 1.00 82.49 C ATOM 462 CZ PHE A 74 89.964 61.630 29.285 1.00 81.21 C ATOM 463 H PHE A 74 90.345 66.529 34.239 1.00 0.00 H ATOM 464 N ALA A 75 89.930 62.512 34.179 1.00 70.10 N ATOM 465 CA ALA A 75 90.518 61.386 34.900 1.00 70.90 C ATOM 466 C ALA A 75 90.115 60.078 34.240 1.00 75.00 C ATOM 467 O ALA A 75 88.928 59.867 33.941 1.00 74.14 O ATOM 468 CB ALA A 75 90.103 61.402 36.367 1.00 72.77 C ATOM 469 H ALA A 75 88.962 62.416 33.812 1.00 0.00 H ATOM 470 N CYS A 76 91.128 59.219 33.974 1.00 72.06 N ATOM 471 CA CYS A 76 90.952 57.897 33.360 1.00 72.19 C ATOM 472 C CYS A 76 92.145 56.971 33.607 1.00 69.60 C ATOM 473 O CYS A 76 93.288 57.436 33.722 1.00 67.44 O ATOM 474 CB CYS A 76 90.662 58.026 31.869 1.00 72.60 C ATOM 475 SG CYS A 76 92.099 58.512 30.881 1.00 76.49 S ATOM 476 H CYS A 76 92.094 59.515 34.221 1.00 0.00 H ATOM 477 N ASP A 77 91.864 55.649 33.660 1.00 62.82 N ATOM 478 CA ASP A 77 92.886 54.613 33.785 1.00 61.06 C ATOM 479 C ASP A 77 93.211 54.210 32.351 1.00 59.00 C ATOM 480 O ASP A 77 92.346 53.706 31.638 1.00 57.97 O ATOM 481 CB ASP A 77 92.406 53.401 34.621 1.00 63.91 C ATOM 482 CG ASP A 77 93.513 52.398 34.944 1.00 67.66 C ATOM 483 OD1 ASP A 77 94.283 52.046 34.035 1.00 68.19 O ATOM 484 OD2 ASP A 77 93.597 51.961 36.098 1.00 73.63 O ATOM 485 H ASP A 77 90.868 55.355 33.609 1.00 0.00 H ATOM 486 N VAL A 78 94.449 54.471 31.928 1.00 53.46 N ATOM 487 CA VAL A 78 94.931 54.206 30.566 1.00 52.41 C ATOM 488 C VAL A 78 95.012 52.717 30.207 1.00 55.76 C ATOM 489 O VAL A 78 95.084 52.380 29.020 1.00 53.74 O ATOM 490 CB VAL A 78 96.276 54.917 30.274 1.00 55.61 C ATOM 491 CG1 VAL A 78 96.079 56.418 30.208 1.00 54.35 C ATOM 492 CG2 VAL A 78 97.360 54.542 31.288 1.00 56.20 C ATOM 493 H VAL A 78 95.116 54.889 32.607 1.00 0.00 H ATOM 494 N ASP A 79 95.034 51.846 31.230 1.00 54.27 N ATOM 495 CA ASP A 79 95.125 50.388 31.083 1.00 55.55 C ATOM 496 C ASP A 79 93.761 49.691 30.925 1.00 60.99 C ATOM 497 O ASP A 79 93.688 48.599 30.357 1.00 62.14 O ATOM 498 CB ASP A 79 95.925 49.796 32.251 1.00 57.51 C ATOM 499 CG ASP A 79 97.354 50.309 32.298 1.00 63.17 C ATOM 500 OD1 ASP A 79 98.027 50.285 31.246 1.00 62.71 O ATOM 501 OD2 ASP A 79 97.792 50.750 33.383 1.00 71.02 O ATOM 502 H ASP A 79 94.983 52.232 32.194 1.00 0.00 H ATOM 503 N LYS A 80 92.693 50.322 31.430 1.00 56.70 N ATOM 504 CA LYS A 80 91.328 49.794 31.396 1.00 56.40 C ATOM 505 C LYS A 80 90.519 50.303 30.196 1.00 61.32 C ATOM 506 O LYS A 80 89.519 49.679 29.824 1.00 62.40 O ATOM 507 CB LYS A 80 90.619 50.051 32.722 1.00 56.83 C ATOM 508 CG LYS A 80 91.233 49.220 33.833 1.00 57.65 C ATOM 509 CD LYS A 80 90.639 49.522 35.174 1.00 57.95 C ATOM 510 CE LYS A 80 91.281 48.631 36.191 1.00 52.66 C ATOM 511 NZ LYS A 80 90.787 48.925 37.542 1.00 55.64 N ATOM 512 HZ1 LYS A 80 91.004 49.913 37.782 1.00 0.00 H ATOM 513 HZ2 LYS A 80 89.758 48.778 37.573 1.00 0.00 H ATOM 514 HZ3 LYS A 80 91.250 48.292 38.225 1.00 0.00 H ATOM 515 H LYS A 80 92.843 51.249 31.876 1.00 0.00 H ATOM 516 N LEU A 81 90.946 51.421 29.591 1.00 57.29 N ATOM 517 CA LEU A 81 90.286 51.958 28.398 1.00 57.17 C ATOM 518 C LEU A 81 90.867 51.255 27.174 1.00 58.52 C ATOM 519 O LEU A 81 92.065 51.358 26.920 1.00 57.70 O ATOM 520 CB LEU A 81 90.443 53.492 28.283 1.00 56.70 C ATOM 521 CG LEU A 81 89.753 54.334 29.384 1.00 63.86 C ATOM 522 CD1 LEU A 81 90.247 55.760 29.353 1.00 62.99 C ATOM 523 CD2 LEU A 81 88.220 54.306 29.250 1.00 67.38 C ATOM 524 H LEU A 81 91.770 51.922 29.980 1.00 0.00 H ATOM 525 N HIS A 82 90.021 50.477 26.470 1.00 55.04 N ATOM 526 CA HIS A 82 90.343 49.675 25.281 1.00 54.71 C ATOM 527 C HIS A 82 89.523 50.167 24.073 1.00 57.14 C ATOM 528 O HIS A 82 88.397 50.642 24.247 1.00 56.13 O ATOM 529 CB HIS A 82 89.958 48.189 25.517 1.00 57.49 C ATOM 530 CG HIS A 82 90.781 47.441 26.528 1.00 62.34 C ATOM 531 ND1 HIS A 82 91.643 46.420 26.147 1.00 65.22 N ATOM 532 CD2 HIS A 82 90.793 47.535 27.880 1.00 64.32 C ATOM 533 CE1 HIS A 82 92.168 45.954 27.269 1.00 65.79 C ATOM 534 NE2 HIS A 82 91.700 46.605 28.336 1.00 65.64 N ATOM 535 H HIS A 82 89.037 50.440 26.803 1.00 0.00 H ATOM 536 N PHE A 83 90.075 50.022 22.850 1.00 53.41 N ATOM 537 CA PHE A 83 89.389 50.327 21.592 1.00 52.56 C ATOM 538 C PHE A 83 90.072 49.631 20.432 1.00 56.79 C ATOM 539 O PHE A 83 91.253 49.282 20.511 1.00 55.28 O ATOM 540 CB PHE A 83 89.244 51.841 21.335 1.00 52.01 C ATOM 541 CG PHE A 83 90.536 52.588 21.120 1.00 52.69 C ATOM 542 CD1 PHE A 83 91.286 53.038 22.203 1.00 56.45 C ATOM 543 CD2 PHE A 83 91.007 52.840 19.837 1.00 54.10 C ATOM 544 CE1 PHE A 83 92.484 53.727 22.002 1.00 56.70 C ATOM 545 CE2 PHE A 83 92.208 53.518 19.639 1.00 56.61 C ATOM 546 CZ PHE A 83 92.927 53.973 20.723 1.00 54.37 C ATOM 547 H PHE A 83 91.052 49.670 22.797 1.00 0.00 H ATOM 548 N THR A 84 89.305 49.422 19.362 1.00 55.74 N ATOM 549 CA THR A 84 89.754 48.805 18.128 1.00 57.02 C ATOM 550 C THR A 84 90.168 49.963 17.218 1.00 59.60 C ATOM 551 O THR A 84 89.347 50.840 16.931 1.00 57.46 O ATOM 552 CB THR A 84 88.626 47.913 17.561 1.00 68.69 C ATOM 553 OG1 THR A 84 88.422 46.818 18.461 1.00 73.68 O ATOM 554 CG2 THR A 84 88.927 47.387 16.144 1.00 65.42 C ATOM 555 HG1 THR A 84 89.260 46.297 18.540 1.00 0.00 H ATOM 556 H THR A 84 88.311 49.724 19.416 1.00 0.00 H ATOM 557 N PRO A 85 91.447 50.031 16.817 1.00 57.40 N ATOM 558 CA PRO A 85 91.878 51.149 15.960 1.00 56.02 C ATOM 559 C PRO A 85 91.419 50.995 14.511 1.00 58.93 C ATOM 560 O PRO A 85 91.176 49.890 14.054 1.00 58.92 O ATOM 561 CB PRO A 85 93.400 51.068 16.048 1.00 58.31 C ATOM 562 CG PRO A 85 93.644 49.568 16.146 1.00 65.21 C ATOM 563 CD PRO A 85 92.559 49.092 17.082 1.00 60.80 C ATOM 564 N ARG A 86 91.340 52.109 13.788 1.00 55.24 N ATOM 565 CA ARG A 86 90.996 52.136 12.366 1.00 54.57 C ATOM 566 C ARG A 86 92.287 52.489 11.619 1.00 55.29 C ATOM 567 O ARG A 86 93.036 53.361 12.079 1.00 53.45 O ATOM 568 CB ARG A 86 89.872 53.156 12.100 1.00 55.40 C ATOM 569 CG ARG A 86 88.770 53.065 13.152 1.00 71.65 C ATOM 570 CD ARG A 86 87.396 53.478 12.686 1.00 87.75 C ATOM 571 NE ARG A 86 86.384 52.985 13.626 1.00101.89 N ATOM 572 CZ ARG A 86 85.085 53.256 13.553 1.00114.62 C ATOM 573 NH1 ARG A 86 84.245 52.753 14.450 1.00100.78 N ATOM 574 NH2 ARG A 86 84.616 54.042 12.591 1.00 99.27 N ATOM 575 HE ARG A 86 86.707 52.379 14.407 1.00 0.00 H ATOM 576 HH12 ARG A 86 83.229 52.968 14.389 1.00 0.00 H ATOM 577 HH11 ARG A 86 84.603 52.144 15.214 1.00 0.00 H ATOM 578 HH22 ARG A 86 83.598 54.250 12.539 1.00 0.00 H ATOM 579 HH21 ARG A 86 85.266 54.449 11.889 1.00 0.00 H ATOM 580 H ARG A 86 91.534 53.014 14.262 1.00 0.00 H ATOM 581 N ILE A 87 92.596 51.756 10.542 1.00 51.99 N ATOM 582 CA ILE A 87 93.812 51.959 9.744 1.00 52.29 C ATOM 583 C ILE A 87 93.532 52.991 8.649 1.00 54.33 C ATOM 584 O ILE A 87 92.508 52.922 7.973 1.00 53.66 O ATOM 585 CB ILE A 87 94.388 50.610 9.207 1.00 58.37 C ATOM 586 CG1 ILE A 87 94.918 49.732 10.360 1.00 61.04 C ATOM 587 CG2 ILE A 87 95.484 50.823 8.160 1.00 59.41 C ATOM 588 CD1 ILE A 87 95.155 48.212 9.997 1.00 68.78 C ATOM 589 H ILE A 87 91.939 51.002 10.255 1.00 0.00 H ATOM 590 N GLN A 88 94.442 53.940 8.484 1.00 50.66 N ATOM 591 CA GLN A 88 94.280 55.011 7.522 1.00 50.09 C ATOM 592 C GLN A 88 95.489 55.189 6.616 1.00 54.18 C ATOM 593 O GLN A 88 96.599 55.390 7.100 1.00 53.47 O ATOM 594 CB GLN A 88 93.995 56.307 8.295 1.00 50.02 C ATOM 595 CG GLN A 88 93.476 57.451 7.463 1.00 60.89 C ATOM 596 CD GLN A 88 93.032 58.580 8.361 1.00 69.33 C ATOM 597 OE1 GLN A 88 93.689 58.934 9.354 1.00 55.17 O ATOM 598 NE2 GLN A 88 91.907 59.176 8.014 1.00 65.20 N ATOM 599 HE22 GLN A 88 91.384 58.852 7.176 1.00 0.00 H ATOM 600 HE21 GLN A 88 91.543 59.970 8.579 1.00 0.00 H ATOM 601 H GLN A 88 95.304 53.915 9.066 1.00 0.00 H ATOM 602 N ARG A 89 95.245 55.162 5.298 1.00 52.75 N ATOM 603 CA ARG A 89 96.227 55.430 4.240 1.00 54.39 C ATOM 604 C ARG A 89 96.149 56.931 4.008 1.00 58.67 C ATOM 605 O ARG A 89 95.050 57.504 3.988 1.00 59.59 O ATOM 606 CB ARG A 89 95.862 54.689 2.948 1.00 57.20 C ATOM 607 CG ARG A 89 96.140 53.194 2.990 1.00 66.02 C ATOM 608 CD ARG A 89 95.387 52.429 1.902 1.00 75.89 C ATOM 609 NE ARG A 89 95.643 52.929 0.545 1.00 89.07 N ATOM 610 CZ ARG A 89 96.728 52.657 -0.179 1.00102.36 C ATOM 611 NH1 ARG A 89 96.859 53.155 -1.402 1.00 84.13 N ATOM 612 NH2 ARG A 89 97.694 51.896 0.319 1.00 94.74 N ATOM 613 HE ARG A 89 94.921 53.543 0.116 1.00 0.00 H ATOM 614 HH12 ARG A 89 97.708 52.940 -1.963 1.00 0.00 H ATOM 615 HH11 ARG A 89 96.113 53.761 -1.800 1.00 0.00 H ATOM 616 HH22 ARG A 89 98.538 51.688 -0.252 1.00 0.00 H ATOM 617 HH21 ARG A 89 97.607 51.508 1.280 1.00 0.00 H ATOM 618 H ARG A 89 94.276 54.931 4.999 1.00 0.00 H ATOM 619 N LEU A 90 97.290 57.579 3.896 1.00 54.95 N ATOM 620 CA LEU A 90 97.348 59.031 3.765 1.00 53.77 C ATOM 621 C LEU A 90 97.596 59.467 2.317 1.00 58.33 C ATOM 622 O LEU A 90 98.719 59.828 1.958 1.00 59.43 O ATOM 623 CB LEU A 90 98.424 59.562 4.733 1.00 53.66 C ATOM 624 CG LEU A 90 98.031 60.035 6.157 1.00 57.70 C ATOM 625 CD1 LEU A 90 96.560 59.732 6.562 1.00 57.52 C ATOM 626 CD2 LEU A 90 99.035 59.586 7.173 1.00 58.73 C ATOM 627 H LEU A 90 98.178 57.038 3.901 1.00 0.00 H ATOM 628 N ASN A 91 96.550 59.379 1.468 1.00 54.37 N ATOM 629 CA ASN A 91 96.667 59.721 0.053 1.00 55.09 C ATOM 630 C ASN A 91 95.630 60.714 -0.403 1.00 58.22 C ATOM 631 O ASN A 91 94.428 60.461 -0.299 1.00 57.74 O ATOM 632 CB ASN A 91 96.677 58.469 -0.841 1.00 56.11 C ATOM 633 CG ASN A 91 97.867 57.592 -0.579 1.00 71.22 C ATOM 634 OD1 ASN A 91 99.018 58.031 -0.640 1.00 65.63 O ATOM 635 ND2 ASN A 91 97.615 56.354 -0.208 1.00 64.89 N ATOM 636 HD22 ASN A 91 96.633 56.013 -0.167 1.00 0.00 H ATOM 637 HD21 ASN A 91 98.398 55.717 0.044 1.00 0.00 H ATOM 638 H ASN A 91 95.631 59.057 1.834 1.00 0.00 H ATOM 639 N GLU A 92 96.108 61.860 -0.906 1.00 54.71 N ATOM 640 CA GLU A 92 95.251 62.928 -1.410 1.00 54.15 C ATOM 641 C GLU A 92 94.369 62.410 -2.538 1.00 59.08 C ATOM 642 O GLU A 92 94.863 61.700 -3.421 1.00 59.67 O ATOM 643 CB GLU A 92 96.093 64.097 -1.930 1.00 55.53 C ATOM 644 CG GLU A 92 95.280 65.373 -1.977 1.00 65.14 C ATOM 645 CD GLU A 92 96.023 66.647 -2.303 1.00 80.66 C ATOM 646 OE1 GLU A 92 97.269 66.617 -2.428 1.00 80.96 O ATOM 647 OE2 GLU A 92 95.342 67.690 -2.415 1.00 64.99 O ATOM 648 H GLU A 92 97.139 61.995 -0.939 1.00 0.00 H ATOM 649 N LEU A 93 93.070 62.773 -2.503 1.00 55.73 N ATOM 650 CA LEU A 93 92.050 62.430 -3.510 1.00 57.52 C ATOM 651 C LEU A 93 91.672 60.932 -3.552 1.00 63.43 C ATOM 652 O LEU A 93 90.815 60.544 -4.340 1.00 63.29 O ATOM 653 CB LEU A 93 92.425 62.945 -4.917 1.00 58.82 C ATOM 654 CG LEU A 93 92.724 64.445 -5.029 1.00 63.19 C ATOM 655 CD1 LEU A 93 93.164 64.804 -6.452 1.00 64.23 C ATOM 656 CD2 LEU A 93 91.531 65.286 -4.576 1.00 63.62 C ATOM 657 H LEU A 93 92.761 63.346 -1.692 1.00 0.00 H ATOM 658 N GLU A 94 92.243 60.113 -2.651 1.00 61.52 N ATOM 659 CA GLU A 94 91.907 58.695 -2.559 1.00 62.47 C ATOM 660 C GLU A 94 90.606 58.580 -1.763 1.00 64.95 C ATOM 661 O GLU A 94 90.445 59.245 -0.733 1.00 62.44 O ATOM 662 CB GLU A 94 93.040 57.911 -1.876 1.00 64.43 C ATOM 663 CG GLU A 94 92.914 56.402 -1.988 1.00 75.03 C ATOM 664 CD GLU A 94 94.129 55.654 -1.476 1.00 92.98 C ATOM 665 OE1 GLU A 94 94.252 55.487 -0.241 1.00 79.28 O ATOM 666 OE2 GLU A 94 94.975 55.261 -2.310 1.00 92.43 O ATOM 667 H GLU A 94 92.950 60.504 -1.996 1.00 0.00 H ATOM 668 N ALA A 95 89.667 57.766 -2.267 1.00 62.85 N ATOM 669 CA ALA A 95 88.375 57.532 -1.634 1.00 62.53 C ATOM 670 C ALA A 95 88.556 56.844 -0.291 1.00 68.52 C ATOM 671 O ALA A 95 89.355 55.909 -0.161 1.00 70.11 O ATOM 672 CB ALA A 95 87.488 56.693 -2.537 1.00 64.39 C ATOM 673 H ALA A 95 89.872 57.274 -3.160 1.00 0.00 H ATOM 674 N GLN A 96 87.861 57.369 0.720 1.00 64.20 N ATOM 675 CA GLN A 96 87.827 56.850 2.081 1.00 63.80 C ATOM 676 C GLN A 96 86.347 56.740 2.481 1.00 70.44 C ATOM 677 O GLN A 96 85.507 57.478 1.956 1.00 68.63 O ATOM 678 CB GLN A 96 88.605 57.766 3.057 1.00 63.30 C ATOM 679 CG GLN A 96 90.127 57.661 2.941 1.00 66.23 C ATOM 680 CD GLN A 96 90.847 58.309 4.105 1.00 76.74 C ATOM 681 OE1 GLN A 96 90.772 57.868 5.259 1.00 71.15 O ATOM 682 NE2 GLN A 96 91.589 59.364 3.826 1.00 62.03 N ATOM 683 HE22 GLN A 96 91.640 59.721 2.850 1.00 0.00 H ATOM 684 HE21 GLN A 96 92.123 59.839 4.582 1.00 0.00 H ATOM 685 H GLN A 96 87.297 58.219 0.520 1.00 0.00 H ATOM 686 N THR A 97 86.027 55.803 3.377 1.00 70.59 N ATOM 687 CA THR A 97 84.663 55.587 3.849 1.00 72.60 C ATOM 688 C THR A 97 84.483 56.180 5.252 1.00 79.29 C ATOM 689 O THR A 97 85.394 56.078 6.083 1.00 77.65 O ATOM 690 CB THR A 97 84.341 54.067 3.828 1.00 83.71 C ATOM 691 OG1 THR A 97 84.604 53.535 2.529 1.00 86.13 O ATOM 692 CG2 THR A 97 82.905 53.760 4.199 1.00 83.43 C ATOM 693 HG1 THR A 97 84.397 52.567 2.522 1.00 0.00 H ATOM 694 H THR A 97 86.785 55.199 3.756 1.00 0.00 H ATOM 695 N ARG A 98 83.302 56.783 5.516 1.00 80.04 N ATOM 696 CA ARG A 98 82.908 57.273 6.851 1.00 81.47 C ATOM 697 C ARG A 98 82.344 56.008 7.528 1.00 91.39 C ATOM 698 O ARG A 98 81.350 55.451 7.036 1.00 93.13 O ATOM 699 CB ARG A 98 81.791 58.343 6.779 1.00 81.02 C ATOM 700 CG ARG A 98 81.988 59.476 5.784 1.00 91.22 C ATOM 701 CD ARG A 98 80.873 60.503 5.902 1.00100.47 C ATOM 702 H ARG A 98 82.631 56.909 4.731 1.00 0.00 H ATOM 703 N VAL A 99 83.001 55.508 8.590 1.00 90.41 N ATOM 704 CA VAL A 99 82.561 54.258 9.243 1.00 92.80 C ATOM 705 C VAL A 99 82.025 54.534 10.665 1.00 98.16 C ATOM 706 O VAL A 99 82.484 55.475 11.317 1.00 98.06 O ATOM 707 CB VAL A 99 83.677 53.151 9.178 1.00 97.61 C ATOM 708 CG1 VAL A 99 83.361 51.933 10.052 1.00 98.85 C ATOM 709 CG2 VAL A 99 83.927 52.708 7.735 1.00 98.01 C ATOM 710 H VAL A 99 83.834 56.011 8.958 1.00 0.00 H ATOM 711 N LYS A 100 81.040 53.724 11.123 1.00 95.91 N ATOM 712 CA LYS A 100 80.425 53.830 12.450 1.00119.51 C ATOM 713 C LYS A 100 81.092 52.879 13.463 1.00144.53 C ATOM 714 O LYS A 100 80.495 51.910 13.943 1.00109.18 O ATOM 715 CB LYS A 100 78.903 53.612 12.365 1.00123.04 C ATOM 716 H LYS A 100 80.696 52.975 10.489 1.00 0.00 H TER 717 LYS A 100 ATOM 718 N ARG A 375 92.008 43.874 15.737 1.00 83.98 N ATOM 719 CA ARG A 375 93.040 44.652 16.421 1.00 82.38 C ATOM 720 C ARG A 375 92.483 45.313 17.695 1.00 82.99 C ATOM 721 O ARG A 375 91.287 45.633 17.742 1.00 84.12 O ATOM 722 CB ARG A 375 93.629 45.721 15.480 1.00 80.63 C ATOM 723 CG ARG A 375 94.706 45.196 14.539 1.00 91.17 C ATOM 724 CD ARG A 375 95.376 46.319 13.759 1.00 99.02 C ATOM 725 NE ARG A 375 96.328 47.076 14.571 1.00103.61 N ATOM 726 HE ARG A 375 96.481 46.820 15.567 1.00 0.00 H ATOM 727 HN3 ARG A 375 91.222 44.501 15.471 1.00 0.00 H ATOM 728 HN2 ARG A 375 91.658 43.129 16.373 1.00 0.00 H ATOM 729 HN1 ARG A 375 92.412 43.440 14.882 1.00 0.00 H ATOM 730 N ASP A 376 93.340 45.506 18.724 1.00 73.30 N ATOM 731 CA ASP A 376 92.934 46.147 19.971 1.00 70.00 C ATOM 732 C ASP A 376 94.099 46.799 20.704 1.00 66.46 C ATOM 733 O ASP A 376 95.151 46.188 20.877 1.00 67.93 O ATOM 734 CB ASP A 376 92.180 45.176 20.899 1.00 74.49 C ATOM 735 CG ASP A 376 91.395 45.867 22.005 1.00 87.04 C ATOM 736 OD1 ASP A 376 90.281 46.375 21.717 1.00 87.64 O ATOM 737 OD2 ASP A 376 91.889 45.892 23.163 1.00 92.35 O ATOM 738 H ASP A 376 94.324 45.186 18.623 1.00 0.00 H ATOM 739 N TYR A 377 93.903 48.042 21.129 1.00 56.31 N ATOM 740 CA TYR A 377 94.883 48.809 21.900 1.00 53.98 C ATOM 741 C TYR A 377 94.233 49.265 23.191 1.00 53.47 C ATOM 742 O TYR A 377 93.038 49.545 23.195 1.00 50.89 O ATOM 743 CB TYR A 377 95.254 50.121 21.166 1.00 52.64 C ATOM 744 CG TYR A 377 96.247 50.028 20.035 1.00 54.50 C ATOM 745 CD1 TYR A 377 97.614 49.901 20.286 1.00 56.62 C ATOM 746 CD2 TYR A 377 95.844 50.213 18.717 1.00 55.17 C ATOM 747 CE1 TYR A 377 98.544 49.880 19.244 1.00 55.89 C ATOM 748 CE2 TYR A 377 96.761 50.181 17.667 1.00 56.81 C ATOM 749 CZ TYR A 377 98.110 50.013 17.933 1.00 63.81 C ATOM 750 OH TYR A 377 98.991 49.989 16.880 1.00 66.16 O ATOM 751 HH TYR A 377 98.936 50.845 16.386 1.00 0.00 H ATOM 752 H TYR A 377 92.997 48.499 20.900 1.00 0.00 H ATOM 753 N THR A 378 95.029 49.444 24.259 1.00 49.05 N ATOM 754 CA THR A 378 94.536 50.135 25.441 1.00 47.34 C ATOM 755 C THR A 378 94.917 51.600 25.124 1.00 50.92 C ATOM 756 O THR A 378 95.690 51.840 24.178 1.00 49.63 O ATOM 757 CB THR A 378 95.183 49.659 26.748 1.00 50.73 C ATOM 758 OG1 THR A 378 96.576 49.975 26.743 1.00 49.95 O ATOM 759 CG2 THR A 378 94.942 48.172 27.040 1.00 47.69 C ATOM 760 HG1 THR A 378 96.987 49.665 27.589 1.00 0.00 H ATOM 761 H THR A 378 96.005 49.086 24.241 1.00 0.00 H ATOM 762 N LEU A 379 94.410 52.574 25.891 1.00 47.57 N ATOM 763 CA LEU A 379 94.815 53.965 25.680 1.00 46.22 C ATOM 764 C LEU A 379 96.352 54.100 25.848 1.00 47.45 C ATOM 765 O LEU A 379 96.983 54.824 25.074 1.00 46.21 O ATOM 766 CB LEU A 379 94.037 54.902 26.618 1.00 46.41 C ATOM 767 CG LEU A 379 94.124 56.398 26.369 1.00 51.90 C ATOM 768 CD1 LEU A 379 93.737 56.763 24.898 1.00 51.77 C ATOM 769 CD2 LEU A 379 93.237 57.156 27.378 1.00 54.85 C ATOM 770 H LEU A 379 93.726 52.341 26.639 1.00 0.00 H ATOM 771 N ARG A 380 96.954 53.341 26.796 1.00 44.42 N ATOM 772 CA ARG A 380 98.403 53.317 27.009 1.00 44.52 C ATOM 773 C ARG A 380 99.195 52.796 25.795 1.00 47.60 C ATOM 774 O ARG A 380 100.139 53.460 25.352 1.00 45.46 O ATOM 775 CB ARG A 380 98.796 52.521 28.270 1.00 45.14 C ATOM 776 CG ARG A 380 100.299 52.649 28.554 1.00 43.09 C ATOM 777 CD ARG A 380 100.834 51.755 29.640 1.00 42.38 C ATOM 778 NE ARG A 380 100.203 51.984 30.936 1.00 52.12 N ATOM 779 CZ ARG A 380 100.600 52.874 31.842 1.00 63.66 C ATOM 780 NH1 ARG A 380 101.608 53.704 31.577 1.00 51.42 N ATOM 781 NH2 ARG A 380 99.984 52.953 33.013 1.00 49.32 N ATOM 782 HE ARG A 380 99.373 51.403 31.171 1.00 0.00 H ATOM 783 HH12 ARG A 380 101.912 54.397 32.290 1.00 0.00 H ATOM 784 HH11 ARG A 380 102.090 53.659 30.657 1.00 0.00 H ATOM 785 HH22 ARG A 380 100.297 53.650 33.719 1.00 0.00 H ATOM 786 HH21 ARG A 380 99.188 52.318 33.226 1.00 0.00 H ATOM 787 H ARG A 380 96.356 52.745 27.403 1.00 0.00 H ATOM 788 N THR A 381 98.851 51.592 25.296 1.00 45.74 N ATOM 789 CA THR A 381 99.580 50.972 24.182 1.00 46.21 C ATOM 790 C THR A 381 99.393 51.781 22.897 1.00 49.66 C ATOM 791 O THR A 381 100.324 51.837 22.094 1.00 49.99 O ATOM 792 CB THR A 381 99.257 49.476 24.027 1.00 54.08 C ATOM 793 OG1 THR A 381 97.897 49.314 23.635 1.00 56.59 O ATOM 794 CG2 THR A 381 99.564 48.665 25.284 1.00 51.45 C ATOM 795 HG1 THR A 381 97.696 48.350 23.537 1.00 0.00 H ATOM 796 H THR A 381 98.044 51.086 25.713 1.00 0.00 H ATOM 797 N PHE A 382 98.231 52.455 22.730 1.00 44.71 N ATOM 798 CA PHE A 382 98.022 53.321 21.568 1.00 43.57 C ATOM 799 C PHE A 382 98.954 54.533 21.675 1.00 48.10 C ATOM 800 O PHE A 382 99.544 54.931 20.676 1.00 48.82 O ATOM 801 CB PHE A 382 96.557 53.777 21.407 1.00 43.60 C ATOM 802 CG PHE A 382 96.338 54.618 20.158 1.00 43.35 C ATOM 803 CD1 PHE A 382 96.533 56.003 20.181 1.00 43.34 C ATOM 804 CD2 PHE A 382 95.980 54.022 18.952 1.00 45.08 C ATOM 805 CE1 PHE A 382 96.382 56.768 19.025 1.00 43.10 C ATOM 806 CE2 PHE A 382 95.778 54.797 17.807 1.00 46.71 C ATOM 807 CZ PHE A 382 95.986 56.164 17.847 1.00 43.62 C ATOM 808 H PHE A 382 97.475 52.356 23.438 1.00 0.00 H ATOM 809 N GLY A 383 99.042 55.107 22.869 1.00 45.21 N ATOM 810 CA GLY A 383 99.898 56.244 23.167 1.00 44.62 C ATOM 811 C GLY A 383 101.366 55.956 22.957 1.00 48.64 C ATOM 812 O GLY A 383 102.069 56.779 22.366 1.00 47.26 O ATOM 813 H GLY A 383 98.462 54.719 23.640 1.00 0.00 H ATOM 814 N GLU A 384 101.834 54.772 23.406 1.00 47.47 N ATOM 815 CA GLU A 384 103.231 54.355 23.226 1.00 48.97 C ATOM 816 C GLU A 384 103.545 54.244 21.733 1.00 52.77 C ATOM 817 O GLU A 384 104.563 54.761 21.282 1.00 52.90 O ATOM 818 CB GLU A 384 103.542 53.043 23.961 1.00 51.95 C ATOM 819 CG GLU A 384 103.559 53.181 25.477 1.00 63.39 C ATOM 820 CD GLU A 384 103.477 51.915 26.323 1.00 80.62 C ATOM 821 OE1 GLU A 384 103.183 50.828 25.774 1.00 70.94 O ATOM 822 OE2 GLU A 384 103.664 52.027 27.557 1.00 75.04 O ATOM 823 H GLU A 384 101.180 54.130 23.898 1.00 0.00 H ATOM 824 N MET A 385 102.625 53.635 20.965 1.00 48.76 N ATOM 825 CA MET A 385 102.724 53.471 19.523 1.00 47.50 C ATOM 826 C MET A 385 102.708 54.863 18.851 1.00 49.09 C ATOM 827 O MET A 385 103.539 55.118 17.982 1.00 48.52 O ATOM 828 CB MET A 385 101.573 52.563 19.028 1.00 49.36 C ATOM 829 CG MET A 385 101.469 52.399 17.498 1.00 52.44 C ATOM 830 SD MET A 385 100.779 53.810 16.561 1.00 54.63 S ATOM 831 CE MET A 385 99.218 54.020 17.333 1.00 50.12 C ATOM 832 H MET A 385 101.780 53.253 21.436 1.00 0.00 H ATOM 833 N ALA A 386 101.769 55.748 19.252 1.00 44.69 N ATOM 834 CA ALA A 386 101.611 57.099 18.668 1.00 42.77 C ATOM 835 C ALA A 386 102.883 57.967 18.850 1.00 48.93 C ATOM 836 O ALA A 386 103.329 58.609 17.896 1.00 48.96 O ATOM 837 CB ALA A 386 100.387 57.794 19.257 1.00 41.03 C ATOM 838 H ALA A 386 101.121 55.464 20.014 1.00 0.00 H ATOM 839 N ASP A 387 103.456 57.962 20.066 1.00 47.09 N ATOM 840 CA ASP A 387 104.671 58.701 20.444 1.00 47.38 C ATOM 841 C ASP A 387 105.901 58.172 19.742 1.00 51.74 C ATOM 842 O ASP A 387 106.652 58.964 19.181 1.00 51.70 O ATOM 843 CB ASP A 387 104.872 58.701 21.966 1.00 49.20 C ATOM 844 CG ASP A 387 103.881 59.558 22.732 1.00 58.63 C ATOM 845 OD1 ASP A 387 103.150 60.343 22.092 1.00 56.71 O ATOM 846 OD2 ASP A 387 103.881 59.490 23.982 1.00 69.66 O ATOM 847 H ASP A 387 103.001 57.386 20.803 1.00 0.00 H ATOM 848 N ALA A 388 106.095 56.837 19.740 1.00 49.19 N ATOM 849 CA ALA A 388 107.203 56.204 19.023 1.00 50.97 C ATOM 850 C ALA A 388 107.124 56.580 17.534 1.00 55.70 C ATOM 851 O ALA A 388 108.143 56.927 16.958 1.00 57.97 O ATOM 852 CB ALA A 388 107.161 54.690 19.186 1.00 52.69 C ATOM 853 H ALA A 388 105.432 56.235 20.268 1.00 0.00 H ATOM 854 N PHE A 389 105.922 56.575 16.934 1.00 49.35 N ATOM 855 CA PHE A 389 105.762 56.911 15.521 1.00 48.32 C ATOM 856 C PHE A 389 106.223 58.330 15.184 1.00 51.08 C ATOM 857 O PHE A 389 106.962 58.497 14.217 1.00 50.49 O ATOM 858 CB PHE A 389 104.314 56.665 15.020 1.00 48.00 C ATOM 859 CG PHE A 389 104.033 57.281 13.667 1.00 47.06 C ATOM 860 CD1 PHE A 389 103.604 58.604 13.559 1.00 45.63 C ATOM 861 CD2 PHE A 389 104.243 56.558 12.499 1.00 49.79 C ATOM 862 CE1 PHE A 389 103.375 59.184 12.305 1.00 45.72 C ATOM 863 CE2 PHE A 389 104.000 57.138 11.248 1.00 51.38 C ATOM 864 CZ PHE A 389 103.558 58.443 11.164 1.00 47.38 C ATOM 865 H PHE A 389 105.081 56.325 17.492 1.00 0.00 H ATOM 866 N LYS A 390 105.716 59.344 15.923 1.00 46.77 N ATOM 867 CA LYS A 390 106.032 60.753 15.691 1.00 45.69 C ATOM 868 C LYS A 390 107.516 61.031 15.920 1.00 52.40 C ATOM 869 O LYS A 390 108.168 61.670 15.073 1.00 53.41 O ATOM 870 CB LYS A 390 105.143 61.667 16.565 1.00 45.32 C ATOM 871 CG LYS A 390 105.369 63.158 16.296 1.00 44.39 C ATOM 872 CD LYS A 390 104.364 64.063 16.994 1.00 44.88 C ATOM 873 CE LYS A 390 104.830 65.477 16.821 1.00 49.26 C ATOM 874 NZ LYS A 390 103.880 66.458 17.371 1.00 46.72 N ATOM 875 HZ1 LYS A 390 102.965 66.361 16.887 1.00 0.00 H ATOM 876 HZ2 LYS A 390 103.755 66.285 18.389 1.00 0.00 H ATOM 877 HZ3 LYS A 390 104.251 67.418 17.225 1.00 0.00 H ATOM 878 H LYS A 390 105.065 59.108 16.699 1.00 0.00 H ATOM 879 N SER A 391 108.055 60.533 17.050 1.00 49.76 N ATOM 880 CA SER A 391 109.455 60.734 17.383 1.00 51.56 C ATOM 881 C SER A 391 110.396 60.071 16.365 1.00 55.74 C ATOM 882 O SER A 391 111.430 60.650 16.052 1.00 55.28 O ATOM 883 CB SER A 391 109.751 60.313 18.821 1.00 57.79 C ATOM 884 OG SER A 391 109.682 58.908 19.002 1.00 72.02 O ATOM 885 HG SER A 391 108.773 58.591 18.773 1.00 0.00 H ATOM 886 H SER A 391 107.453 59.990 17.701 1.00 0.00 H ATOM 887 N ASP A 392 110.017 58.898 15.811 1.00 53.15 N ATOM 888 CA ASP A 392 110.822 58.205 14.791 1.00 54.63 C ATOM 889 C ASP A 392 110.698 58.837 13.412 1.00 58.45 C ATOM 890 O ASP A 392 111.634 58.755 12.615 1.00 61.57 O ATOM 891 CB ASP A 392 110.466 56.714 14.720 1.00 57.52 C ATOM 892 CG ASP A 392 110.920 55.907 15.927 1.00 72.37 C ATOM 893 OD1 ASP A 392 111.600 56.489 16.823 1.00 72.51 O ATOM 894 OD2 ASP A 392 110.591 54.701 15.989 1.00 79.83 O ATOM 895 H ASP A 392 109.121 58.468 16.117 1.00 0.00 H ATOM 896 N TYR A 393 109.557 59.465 13.134 1.00 52.41 N ATOM 897 CA TYR A 393 109.280 60.137 11.857 1.00 50.94 C ATOM 898 C TYR A 393 110.168 61.371 11.703 1.00 54.01 C ATOM 899 O TYR A 393 110.699 61.632 10.621 1.00 54.44 O ATOM 900 CB TYR A 393 107.793 60.574 11.796 1.00 48.61 C ATOM 901 CG TYR A 393 107.341 60.929 10.402 1.00 48.63 C ATOM 902 CD1 TYR A 393 107.494 62.222 9.905 1.00 49.44 C ATOM 903 CD2 TYR A 393 106.827 59.958 9.549 1.00 49.49 C ATOM 904 CE1 TYR A 393 107.134 62.539 8.596 1.00 49.24 C ATOM 905 CE2 TYR A 393 106.456 60.264 8.244 1.00 50.15 C ATOM 906 CZ TYR A 393 106.608 61.555 7.772 1.00 54.31 C ATOM 907 OH TYR A 393 106.228 61.836 6.489 1.00 50.58 O ATOM 908 HH TYR A 393 106.396 62.793 6.298 1.00 0.00 H ATOM 909 H TYR A 393 108.817 59.481 13.865 1.00 0.00 H ATOM 910 N PHE A 394 110.305 62.139 12.789 1.00 49.64 N ATOM 911 CA PHE A 394 111.043 63.383 12.799 1.00 48.96 C ATOM 912 C PHE A 394 112.414 63.303 13.423 1.00 53.67 C ATOM 913 O PHE A 394 113.183 64.259 13.285 1.00 53.97 O ATOM 914 CB PHE A 394 110.200 64.476 13.483 1.00 49.12 C ATOM 915 CG PHE A 394 108.960 64.872 12.713 1.00 49.18 C ATOM 916 CD1 PHE A 394 109.054 65.669 11.570 1.00 51.22 C ATOM 917 CD2 PHE A 394 107.696 64.456 13.132 1.00 49.88 C ATOM 918 CE1 PHE A 394 107.910 66.017 10.843 1.00 50.70 C ATOM 919 CE2 PHE A 394 106.549 64.823 12.418 1.00 51.80 C ATOM 920 CZ PHE A 394 106.666 65.602 11.274 1.00 49.97 C ATOM 921 H PHE A 394 109.857 61.825 13.674 1.00 0.00 H ATOM 922 N ASN A 395 112.743 62.174 14.091 1.00 50.26 N ATOM 923 CA ASN A 395 113.984 61.996 14.831 1.00 52.44 C ATOM 924 C ASN A 395 114.158 63.133 15.864 1.00 58.08 C ATOM 925 O ASN A 395 115.246 63.691 16.039 1.00 56.93 O ATOM 926 CB ASN A 395 115.219 61.810 13.933 1.00 52.56 C ATOM 927 CG ASN A 395 116.403 61.365 14.735 1.00 60.30 C ATOM 928 OD1 ASN A 395 116.255 60.629 15.714 1.00 58.05 O ATOM 929 ND2 ASN A 395 117.579 61.887 14.420 1.00 53.33 N ATOM 930 HD22 ASN A 395 117.668 62.504 13.587 1.00 0.00 H ATOM 931 HD21 ASN A 395 118.413 61.680 15.005 1.00 0.00 H ATOM 932 H ASN A 395 112.067 61.384 14.075 1.00 0.00 H ATOM 933 N MET A 396 113.056 63.491 16.509 1.00 57.36 N ATOM 934 CA MET A 396 113.019 64.573 17.483 1.00 60.33 C ATOM 935 C MET A 396 112.173 64.171 18.663 1.00 63.08 C ATOM 936 O MET A 396 111.195 63.447 18.454 1.00 60.94 O ATOM 937 CB MET A 396 112.323 65.795 16.851 1.00 63.20 C ATOM 938 CG MET A 396 113.204 66.606 15.922 1.00 70.90 C ATOM 939 SD MET A 396 112.337 68.151 15.538 1.00 76.95 S ATOM 940 CE MET A 396 111.363 67.650 14.143 1.00 72.49 C ATOM 941 H MET A 396 112.176 62.974 16.310 1.00 0.00 H ATOM 942 N PRO A 397 112.395 64.744 19.872 1.00 61.73 N ATOM 943 CA PRO A 397 111.432 64.518 20.978 1.00 61.86 C ATOM 944 C PRO A 397 110.057 65.045 20.537 1.00 69.46 C ATOM 945 O PRO A 397 109.973 66.115 19.932 1.00 68.60 O ATOM 946 CB PRO A 397 112.015 65.339 22.138 1.00 63.51 C ATOM 947 CG PRO A 397 113.455 65.533 21.770 1.00 68.87 C ATOM 948 CD PRO A 397 113.467 65.669 20.286 1.00 63.68 C ATOM 949 N VAL A 398 109.002 64.253 20.772 1.00 70.61 N ATOM 950 CA VAL A 398 107.593 64.475 20.359 1.00 71.28 C ATOM 951 C VAL A 398 107.053 65.931 20.532 1.00 76.90 C ATOM 952 O VAL A 398 106.377 66.429 19.624 1.00 77.21 O ATOM 953 CB VAL A 398 106.658 63.460 21.042 1.00 76.11 C ATOM 954 CG1 VAL A 398 105.562 63.047 20.100 1.00 75.33 C ATOM 955 CG2 VAL A 398 107.420 62.218 21.513 1.00 77.77 C ATOM 956 H VAL A 398 109.192 63.381 21.306 1.00 0.00 H ATOM 957 N HIS A 399 107.364 66.606 21.657 1.00 73.40 N ATOM 958 CA HIS A 399 106.921 67.977 21.986 1.00 72.76 C ATOM 959 C HIS A 399 107.710 69.078 21.304 1.00 74.58 C ATOM 960 O HIS A 399 107.390 70.264 21.487 1.00 74.74 O ATOM 961 CB HIS A 399 107.077 68.216 23.497 1.00 75.92 C ATOM 962 CG HIS A 399 105.811 68.522 24.233 1.00 79.23 C ATOM 963 ND1 HIS A 399 105.738 68.388 25.609 1.00 81.75 N ATOM 964 CD2 HIS A 399 104.605 68.916 23.769 1.00 80.72 C ATOM 965 CE1 HIS A 399 104.512 68.722 25.942 1.00 80.63 C ATOM 966 NE2 HIS A 399 103.790 69.051 24.868 1.00 80.52 N ATOM 967 H HIS A 399 107.967 66.121 22.352 1.00 0.00 H ATOM 968 N MET A 400 108.820 68.722 20.635 1.00 68.23 N ATOM 969 CA MET A 400 109.660 69.719 19.998 1.00 65.65 C ATOM 970 C MET A 400 109.385 69.895 18.519 1.00 63.90 C ATOM 971 O MET A 400 109.954 70.797 17.904 1.00 64.90 O ATOM 972 CB MET A 400 111.121 69.429 20.251 1.00 69.48 C ATOM 973 CG MET A 400 111.527 69.771 21.637 1.00 73.50 C ATOM 974 SD MET A 400 113.262 69.438 21.826 1.00 78.83 S ATOM 975 CE MET A 400 113.917 70.755 20.878 1.00 75.96 C ATOM 976 H MET A 400 109.081 67.717 20.573 1.00 0.00 H ATOM 977 N VAL A 401 108.524 69.051 17.944 1.00 55.33 N ATOM 978 CA VAL A 401 108.172 69.171 16.526 1.00 53.62 C ATOM 979 C VAL A 401 107.254 70.409 16.307 1.00 52.95 C ATOM 980 O VAL A 401 106.128 70.422 16.809 1.00 51.85 O ATOM 981 CB VAL A 401 107.568 67.867 15.931 1.00 56.32 C ATOM 982 CG1 VAL A 401 107.461 67.959 14.410 1.00 55.90 C ATOM 983 CG2 VAL A 401 108.394 66.643 16.333 1.00 56.97 C ATOM 984 H VAL A 401 108.095 68.294 18.513 1.00 0.00 H ATOM 985 N PRO A 402 107.733 71.468 15.608 1.00 48.52 N ATOM 986 CA PRO A 402 106.855 72.642 15.350 1.00 47.82 C ATOM 987 C PRO A 402 105.561 72.266 14.624 1.00 52.19 C ATOM 988 O PRO A 402 105.586 71.394 13.752 1.00 52.08 O ATOM 989 CB PRO A 402 107.726 73.556 14.472 1.00 50.45 C ATOM 990 CG PRO A 402 109.171 73.084 14.730 1.00 55.36 C ATOM 991 CD PRO A 402 109.050 71.615 14.945 1.00 50.32 C ATOM 992 N THR A 403 104.425 72.896 14.996 1.00 49.06 N ATOM 993 CA THR A 403 103.121 72.588 14.382 1.00 47.78 C ATOM 994 C THR A 403 103.099 72.902 12.879 1.00 50.18 C ATOM 995 O THR A 403 102.469 72.177 12.117 1.00 48.70 O ATOM 996 CB THR A 403 101.935 73.251 15.136 1.00 54.99 C ATOM 997 OG1 THR A 403 102.070 74.666 15.077 1.00 53.91 O ATOM 998 CG2 THR A 403 101.798 72.771 16.591 1.00 54.78 C ATOM 999 HG1 THR A 403 102.066 74.958 14.131 1.00 0.00 H ATOM 1000 H THR A 403 104.472 73.622 15.740 1.00 0.00 H ATOM 1001 N GLU A 404 103.783 73.984 12.475 1.00 48.64 N ATOM 1002 CA GLU A 404 103.903 74.435 11.086 1.00 50.18 C ATOM 1003 C GLU A 404 104.658 73.411 10.240 1.00 54.39 C ATOM 1004 O GLU A 404 104.338 73.244 9.063 1.00 53.16 O ATOM 1005 CB GLU A 404 104.497 75.862 10.948 1.00 53.04 C ATOM 1006 CG GLU A 404 105.376 76.333 12.098 1.00 74.39 C ATOM 1007 CD GLU A 404 104.668 76.713 13.390 1.00 98.28 C ATOM 1008 OE1 GLU A 404 103.740 77.556 13.349 1.00105.81 O ATOM 1009 OE2 GLU A 404 105.053 76.167 14.450 1.00 81.46 O ATOM 1010 H GLU A 404 104.266 74.546 13.205 1.00 0.00 H ATOM 1011 N LEU A 405 105.607 72.682 10.870 1.00 51.39 N ATOM 1012 CA LEU A 405 106.359 71.605 10.237 1.00 51.03 C ATOM 1013 C LEU A 405 105.455 70.392 10.004 1.00 51.32 C ATOM 1014 O LEU A 405 105.448 69.868 8.891 1.00 50.98 O ATOM 1015 CB LEU A 405 107.614 71.205 11.043 1.00 51.74 C ATOM 1016 CG LEU A 405 108.482 70.088 10.402 1.00 57.20 C ATOM 1017 CD1 LEU A 405 109.120 70.548 9.086 1.00 57.28 C ATOM 1018 CD2 LEU A 405 109.528 69.568 11.373 1.00 60.32 C ATOM 1019 H LEU A 405 105.813 72.903 11.865 1.00 0.00 H ATOM 1020 N VAL A 406 104.709 69.943 11.046 1.00 45.86 N ATOM 1021 CA VAL A 406 103.767 68.807 10.933 1.00 44.36 C ATOM 1022 C VAL A 406 102.740 69.076 9.816 1.00 45.34 C ATOM 1023 O VAL A 406 102.503 68.187 8.997 1.00 43.94 O ATOM 1024 CB VAL A 406 103.084 68.430 12.279 1.00 46.27 C ATOM 1025 CG1 VAL A 406 102.063 67.310 12.106 1.00 44.75 C ATOM 1026 CG2 VAL A 406 104.114 68.047 13.332 1.00 46.57 C ATOM 1027 H VAL A 406 104.804 70.419 11.966 1.00 0.00 H ATOM 1028 N GLU A 407 102.193 70.317 9.750 1.00 41.96 N ATOM 1029 CA GLU A 407 101.230 70.744 8.708 1.00 41.16 C ATOM 1030 C GLU A 407 101.848 70.668 7.292 1.00 47.06 C ATOM 1031 O GLU A 407 101.244 70.056 6.411 1.00 45.37 O ATOM 1032 CB GLU A 407 100.704 72.161 9.025 1.00 41.94 C ATOM 1033 CG GLU A 407 99.727 72.724 8.007 1.00 44.52 C ATOM 1034 CD GLU A 407 99.169 74.092 8.356 1.00 52.15 C ATOM 1035 OE1 GLU A 407 99.976 75.024 8.561 1.00 49.78 O ATOM 1036 OE2 GLU A 407 97.927 74.237 8.432 1.00 46.89 O ATOM 1037 H GLU A 407 102.467 71.010 10.475 1.00 0.00 H ATOM 1038 N LYS A 408 103.054 71.276 7.083 1.00 46.27 N ATOM 1039 CA LYS A 408 103.769 71.262 5.791 1.00 48.33 C ATOM 1040 C LYS A 408 104.040 69.830 5.350 1.00 51.77 C ATOM 1041 O LYS A 408 103.842 69.487 4.194 1.00 51.32 O ATOM 1042 CB LYS A 408 105.116 72.020 5.890 1.00 53.79 C ATOM 1043 CG LYS A 408 105.080 73.405 5.271 1.00 75.21 C ATOM 1044 H LYS A 408 103.494 71.778 7.881 1.00 0.00 H ATOM 1045 N GLU A 409 104.482 69.005 6.296 1.00 48.54 N ATOM 1046 CA GLU A 409 104.808 67.604 6.109 1.00 48.39 C ATOM 1047 C GLU A 409 103.607 66.781 5.779 1.00 50.10 C ATOM 1048 O GLU A 409 103.696 65.897 4.928 1.00 50.27 O ATOM 1049 CB GLU A 409 105.545 67.047 7.347 1.00 49.95 C ATOM 1050 CG GLU A 409 106.125 65.658 7.156 1.00 58.06 C ATOM 1051 CD GLU A 409 106.857 65.391 5.853 1.00 66.20 C ATOM 1052 OE1 GLU A 409 107.384 66.346 5.235 1.00 62.67 O ATOM 1053 OE2 GLU A 409 106.907 64.209 5.453 1.00 51.63 O ATOM 1054 H GLU A 409 104.604 69.398 7.251 1.00 0.00 H ATOM 1055 N PHE A 410 102.467 67.066 6.452 1.00 45.78 N ATOM 1056 CA PHE A 410 101.227 66.370 6.185 1.00 42.83 C ATOM 1057 C PHE A 410 100.849 66.565 4.715 1.00 46.62 C ATOM 1058 O PHE A 410 100.623 65.584 4.013 1.00 46.48 O ATOM 1059 CB PHE A 410 100.111 66.837 7.139 1.00 42.83 C ATOM 1060 CG PHE A 410 98.792 66.174 6.826 1.00 42.52 C ATOM 1061 CD1 PHE A 410 98.528 64.873 7.262 1.00 42.68 C ATOM 1062 CD2 PHE A 410 97.845 66.814 6.021 1.00 43.14 C ATOM 1063 CE1 PHE A 410 97.329 64.237 6.929 1.00 42.47 C ATOM 1064 CE2 PHE A 410 96.641 66.170 5.687 1.00 45.17 C ATOM 1065 CZ PHE A 410 96.384 64.895 6.164 1.00 42.12 C ATOM 1066 H PHE A 410 102.483 67.807 7.182 1.00 0.00 H ATOM 1067 N TRP A 411 100.857 67.815 4.229 1.00 44.57 N ATOM 1068 CA TRP A 411 100.481 68.115 2.849 1.00 45.14 C ATOM 1069 C TRP A 411 101.485 67.586 1.832 1.00 51.17 C ATOM 1070 O TRP A 411 101.080 67.205 0.735 1.00 50.27 O ATOM 1071 CB TRP A 411 100.156 69.606 2.667 1.00 43.58 C ATOM 1072 CG TRP A 411 98.904 69.942 3.439 1.00 42.66 C ATOM 1073 CD1 TRP A 411 98.823 70.686 4.577 1.00 44.76 C ATOM 1074 CD2 TRP A 411 97.604 69.370 3.243 1.00 41.75 C ATOM 1075 NE1 TRP A 411 97.545 70.645 5.082 1.00 42.62 N ATOM 1076 CE2 TRP A 411 96.777 69.839 4.287 1.00 44.04 C ATOM 1077 CE3 TRP A 411 97.053 68.497 2.285 1.00 43.05 C ATOM 1078 CZ2 TRP A 411 95.421 69.490 4.385 1.00 42.51 C ATOM 1079 CZ3 TRP A 411 95.722 68.130 2.404 1.00 43.47 C ATOM 1080 CH2 TRP A 411 94.917 68.638 3.430 1.00 43.01 C ATOM 1081 HE1 TRP A 411 97.215 71.146 5.932 1.00 0.00 H ATOM 1082 H TRP A 411 101.140 68.596 4.855 1.00 0.00 H ATOM 1083 N ARG A 412 102.762 67.447 2.223 1.00 49.90 N ATOM 1084 CA ARG A 412 103.747 66.842 1.350 1.00 51.60 C ATOM 1085 C ARG A 412 103.503 65.313 1.258 1.00 56.96 C ATOM 1086 O ARG A 412 103.443 64.785 0.147 1.00 57.63 O ATOM 1087 CB ARG A 412 105.175 67.145 1.837 1.00 52.94 C ATOM 1088 CG ARG A 412 106.251 66.688 0.855 1.00 57.85 C ATOM 1089 CD ARG A 412 107.588 66.444 1.521 1.00 61.66 C ATOM 1090 NE ARG A 412 107.531 65.318 2.454 1.00 62.49 N ATOM 1091 CZ ARG A 412 107.840 64.066 2.141 1.00 71.32 C ATOM 1092 NH1 ARG A 412 108.234 63.759 0.911 1.00 58.24 N ATOM 1093 NH2 ARG A 412 107.752 63.108 3.053 1.00 54.67 N ATOM 1094 HE ARG A 412 107.227 65.512 3.430 1.00 0.00 H ATOM 1095 HH12 ARG A 412 108.475 62.776 0.672 1.00 0.00 H ATOM 1096 HH11 ARG A 412 108.302 64.502 0.186 1.00 0.00 H ATOM 1097 HH22 ARG A 412 107.995 62.128 2.803 1.00 0.00 H ATOM 1098 HH21 ARG A 412 107.440 63.336 4.018 1.00 0.00 H ATOM 1099 H ARG A 412 103.048 67.779 3.166 1.00 0.00 H ATOM 1100 N LEU A 413 103.348 64.612 2.402 1.00 53.85 N ATOM 1101 CA LEU A 413 103.210 63.152 2.367 1.00 54.68 C ATOM 1102 C LEU A 413 101.915 62.656 1.672 1.00 56.12 C ATOM 1103 O LEU A 413 101.962 61.608 1.019 1.00 57.80 O ATOM 1104 CB LEU A 413 103.411 62.489 3.754 1.00 54.58 C ATOM 1105 CG LEU A 413 102.352 62.700 4.828 1.00 59.09 C ATOM 1106 CD1 LEU A 413 101.285 61.628 4.758 1.00 59.89 C ATOM 1107 CD2 LEU A 413 102.969 62.663 6.210 1.00 60.33 C ATOM 1108 H LEU A 413 103.326 65.111 3.314 1.00 0.00 H ATOM 1109 N VAL A 414 100.801 63.405 1.764 1.00 50.00 N ATOM 1110 CA VAL A 414 99.536 63.010 1.124 1.00 49.33 C ATOM 1111 C VAL A 414 99.572 63.192 -0.412 1.00 56.09 C ATOM 1112 O VAL A 414 98.799 62.542 -1.121 1.00 54.99 O ATOM 1113 CB VAL A 414 98.265 63.655 1.747 1.00 51.15 C ATOM 1114 CG1 VAL A 414 98.180 63.396 3.253 1.00 49.76 C ATOM 1115 CG2 VAL A 414 98.165 65.149 1.427 1.00 50.30 C ATOM 1116 H VAL A 414 100.835 64.292 2.305 1.00 0.00 H ATOM 1117 N SER A 415 100.450 64.084 -0.912 1.00 56.05 N ATOM 1118 CA SER A 415 100.570 64.367 -2.335 1.00 58.60 C ATOM 1119 C SER A 415 101.637 63.505 -3.021 1.00 67.70 C ATOM 1120 O SER A 415 101.560 63.318 -4.231 1.00 68.47 O ATOM 1121 CB SER A 415 100.821 65.854 -2.567 1.00 61.61 C ATOM 1122 OG SER A 415 102.109 66.240 -2.116 1.00 71.78 O ATOM 1123 HG SER A 415 102.187 66.056 -1.146 1.00 0.00 H ATOM 1124 H SER A 415 101.070 64.594 -0.251 1.00 0.00 H ATOM 1125 N THR A 416 102.620 62.976 -2.257 1.00 67.44 N ATOM 1126 CA THR A 416 103.705 62.146 -2.802 1.00 69.97 C ATOM 1127 C THR A 416 103.239 60.687 -2.962 1.00 77.02 C ATOM 1128 O THR A 416 102.927 60.022 -1.971 1.00 75.89 O ATOM 1129 CB THR A 416 104.998 62.272 -1.950 1.00 76.74 C ATOM 1130 OG1 THR A 416 105.242 63.635 -1.593 1.00 71.61 O ATOM 1131 CG2 THR A 416 106.229 61.715 -2.662 1.00 78.92 C ATOM 1132 HG1 THR A 416 104.478 63.979 -1.066 1.00 0.00 H ATOM 1133 H THR A 416 102.608 63.165 -1.234 1.00 0.00 H ATOM 1134 N ILE A 417 103.194 60.197 -4.212 1.00 77.54 N ATOM 1135 CA ILE A 417 102.793 58.815 -4.538 1.00 79.11 C ATOM 1136 C ILE A 417 103.788 57.788 -3.955 1.00 84.21 C ATOM 1137 O ILE A 417 103.381 56.712 -3.506 1.00 84.00 O ATOM 1138 CB ILE A 417 102.535 58.614 -6.067 1.00 83.54 C ATOM 1139 CG1 ILE A 417 103.765 58.976 -6.935 1.00 85.44 C ATOM 1140 H ILE A 417 103.457 60.828 -4.995 1.00 0.00 H ATOM 1141 N GLU A 418 105.081 58.170 -3.920 1.00 81.32 N ATOM 1142 CA GLU A 418 106.214 57.401 -3.396 1.00 82.28 C ATOM 1143 C GLU A 418 106.092 57.126 -1.882 1.00 84.30 C ATOM 1144 O GLU A 418 106.633 56.127 -1.399 1.00 85.41 O ATOM 1145 CB GLU A 418 107.530 58.134 -3.707 1.00 84.79 C ATOM 1146 CG GLU A 418 107.784 58.342 -5.193 1.00 97.40 C ATOM 1147 H GLU A 418 105.298 59.111 -4.306 1.00 0.00 H ATOM 1148 N GLU A 419 105.398 58.014 -1.140 1.00 77.24 N ATOM 1149 CA GLU A 419 105.178 57.866 0.304 1.00 75.41 C ATOM 1150 C GLU A 419 104.012 56.912 0.562 1.00 77.22 C ATOM 1151 O GLU A 419 102.926 57.115 0.011 1.00 76.88 O ATOM 1152 CB GLU A 419 104.920 59.232 0.979 1.00 74.78 C ATOM 1153 CG GLU A 419 106.122 60.169 1.013 1.00 82.41 C ATOM 1154 CD GLU A 419 107.289 59.807 1.918 1.00 90.75 C ATOM 1155 OE1 GLU A 419 107.174 58.843 2.709 1.00 76.14 O ATOM 1156 OE2 GLU A 419 108.322 60.510 1.843 1.00 77.92 O ATOM 1157 H GLU A 419 104.998 58.847 -1.616 1.00 0.00 H ATOM 1158 N ASP A 420 104.255 55.850 1.350 1.00 72.57 N ATOM 1159 CA ASP A 420 103.261 54.827 1.714 1.00 71.47 C ATOM 1160 C ASP A 420 103.048 54.852 3.248 1.00 72.82 C ATOM 1161 O ASP A 420 103.259 53.845 3.937 1.00 74.60 O ATOM 1162 CB ASP A 420 103.727 53.440 1.231 1.00 75.11 C ATOM 1163 H ASP A 420 105.217 55.743 1.731 1.00 0.00 H ATOM 1164 N VAL A 421 102.672 56.028 3.775 1.00 64.56 N ATOM 1165 CA VAL A 421 102.498 56.266 5.211 1.00 62.02 C ATOM 1166 C VAL A 421 101.112 55.855 5.697 1.00 61.36 C ATOM 1167 O VAL A 421 100.103 56.392 5.223 1.00 59.99 O ATOM 1168 CB VAL A 421 102.854 57.733 5.605 1.00 64.66 C ATOM 1169 CG1 VAL A 421 102.570 58.007 7.086 1.00 63.43 C ATOM 1170 CG2 VAL A 421 104.308 58.061 5.261 1.00 65.50 C ATOM 1171 H VAL A 421 102.493 56.819 3.124 1.00 0.00 H ATOM 1172 N THR A 422 101.066 54.908 6.652 1.00 56.91 N ATOM 1173 CA THR A 422 99.822 54.428 7.264 1.00 55.29 C ATOM 1174 C THR A 422 99.785 54.774 8.748 1.00 55.64 C ATOM 1175 O THR A 422 100.765 54.548 9.463 1.00 56.09 O ATOM 1176 CB THR A 422 99.615 52.923 7.040 1.00 64.93 C ATOM 1177 OG1 THR A 422 100.714 52.206 7.602 1.00 64.49 O ATOM 1178 CG2 THR A 422 99.426 52.563 5.570 1.00 64.94 C ATOM 1179 HG1 THR A 422 100.767 52.393 8.573 1.00 0.00 H ATOM 1180 H THR A 422 101.963 54.493 6.975 1.00 0.00 H ATOM 1181 N VAL A 423 98.656 55.330 9.206 1.00 49.12 N ATOM 1182 CA VAL A 423 98.435 55.707 10.624 1.00 46.76 C ATOM 1183 C VAL A 423 97.172 55.007 11.156 1.00 50.80 C ATOM 1184 O VAL A 423 96.436 54.375 10.387 1.00 49.95 O ATOM 1185 CB VAL A 423 98.411 57.248 10.889 1.00 46.64 C ATOM 1186 CG1 VAL A 423 99.762 57.895 10.573 1.00 45.99 C ATOM 1187 CG2 VAL A 423 97.278 57.934 10.120 1.00 44.52 C ATOM 1188 H VAL A 423 97.888 55.508 8.527 1.00 0.00 H ATOM 1189 N GLU A 424 96.911 55.162 12.458 1.00 46.92 N ATOM 1190 CA GLU A 424 95.760 54.583 13.151 1.00 46.24 C ATOM 1191 C GLU A 424 95.073 55.639 14.001 1.00 48.87 C ATOM 1192 O GLU A 424 95.716 56.591 14.426 1.00 46.90 O ATOM 1193 CB GLU A 424 96.181 53.385 14.014 1.00 48.61 C ATOM 1194 CG GLU A 424 96.427 52.120 13.214 1.00 56.01 C ATOM 1195 CD GLU A 424 97.012 50.969 14.008 1.00 65.81 C ATOM 1196 OE1 GLU A 424 98.142 51.114 14.523 1.00 70.79 O ATOM 1197 OE2 GLU A 424 96.365 49.901 14.072 1.00 66.98 O ATOM 1198 H GLU A 424 97.574 55.735 13.018 1.00 0.00 H ATOM 1199 N TYR A 425 93.717 55.542 14.127 1.00 47.00 N ATOM 1200 CA TYR A 425 92.818 56.502 14.814 1.00 46.68 C ATOM 1201 C TYR A 425 91.681 55.750 15.560 1.00 51.57 C ATOM 1202 O TYR A 425 91.143 54.778 15.017 1.00 52.52 O ATOM 1203 CB TYR A 425 92.159 57.429 13.730 1.00 46.65 C ATOM 1204 CG TYR A 425 91.768 58.854 14.117 1.00 47.10 C ATOM 1205 CD1 TYR A 425 91.313 59.154 15.400 1.00 49.21 C ATOM 1206 CD2 TYR A 425 91.706 59.865 13.159 1.00 46.41 C ATOM 1207 CE1 TYR A 425 90.919 60.445 15.749 1.00 46.70 C ATOM 1208 CE2 TYR A 425 91.339 61.165 13.501 1.00 45.90 C ATOM 1209 CZ TYR A 425 90.924 61.447 14.795 1.00 51.61 C ATOM 1210 OH TYR A 425 90.533 62.722 15.145 1.00 47.59 O ATOM 1211 HH TYR A 425 89.762 62.994 14.587 1.00 0.00 H ATOM 1212 H TYR A 425 93.267 54.709 13.697 1.00 0.00 H ATOM 1213 N GLY A 426 91.298 56.231 16.753 1.00 47.13 N ATOM 1214 CA GLY A 426 90.162 55.688 17.484 1.00 46.87 C ATOM 1215 C GLY A 426 88.976 56.573 17.169 1.00 49.47 C ATOM 1216 O GLY A 426 89.098 57.789 17.244 1.00 47.97 O ATOM 1217 H GLY A 426 91.832 57.020 17.170 1.00 0.00 H ATOM 1218 N ALA A 427 87.845 56.004 16.762 1.00 48.80 N ATOM 1219 CA ALA A 427 86.622 56.782 16.510 1.00 49.05 C ATOM 1220 C ALA A 427 85.409 55.944 16.900 1.00 57.02 C ATOM 1221 O ALA A 427 85.191 54.892 16.298 1.00 58.75 O ATOM 1222 CB ALA A 427 86.534 57.209 15.048 1.00 49.10 C ATOM 1223 H ALA A 427 87.824 54.974 16.617 1.00 0.00 H ATOM 1224 N ASP A 428 84.656 56.373 17.937 1.00 54.64 N ATOM 1225 CA ASP A 428 83.458 55.676 18.403 1.00 57.02 C ATOM 1226 C ASP A 428 82.603 56.450 19.399 1.00 59.91 C ATOM 1227 O ASP A 428 83.084 57.359 20.060 1.00 56.01 O ATOM 1228 CB ASP A 428 83.795 54.289 18.994 1.00 62.07 C ATOM 1229 CG ASP A 428 83.156 53.144 18.219 1.00 85.31 C ATOM 1230 OD1 ASP A 428 81.912 52.972 18.321 1.00 86.91 O ATOM 1231 OD2 ASP A 428 83.894 52.427 17.500 1.00 96.30 O ATOM 1232 H ASP A 428 84.943 57.243 18.429 1.00 0.00 H ATOM 1233 N ILE A 429 81.333 56.031 19.543 1.00 60.22 N ATOM 1234 CA ILE A 429 80.383 56.586 20.510 1.00 61.74 C ATOM 1235 C ILE A 429 80.784 56.096 21.916 1.00 66.79 C ATOM 1236 O ILE A 429 81.408 55.036 22.024 1.00 66.96 O ATOM 1237 CB ILE A 429 78.961 56.144 20.059 1.00 67.12 C ATOM 1238 CG1 ILE A 429 78.269 57.272 19.268 1.00 67.13 C ATOM 1239 CG2 ILE A 429 78.069 55.580 21.189 1.00 70.20 C ATOM 1240 CD1 ILE A 429 77.323 56.777 18.186 1.00 77.58 C ATOM 1241 H ILE A 429 81.003 55.261 18.926 1.00 0.00 H ATOM 1242 N ALA A 430 80.453 56.859 22.980 1.00 64.86 N ATOM 1243 CA ALA A 430 80.746 56.440 24.358 1.00 67.03 C ATOM 1244 C ALA A 430 80.062 55.093 24.709 1.00 75.97 C ATOM 1245 O ALA A 430 78.915 54.858 24.314 1.00 75.42 O ATOM 1246 CB ALA A 430 80.317 57.521 25.341 1.00 67.70 C ATOM 1247 H ALA A 430 79.977 57.770 22.820 1.00 0.00 H ATOM 1248 N SER A 431 80.800 54.204 25.412 1.00 76.16 N ATOM 1249 CA SER A 431 80.371 52.865 25.858 1.00 78.53 C ATOM 1250 C SER A 431 81.066 52.507 27.189 1.00 84.65 C ATOM 1251 O SER A 431 81.912 53.271 27.655 1.00 83.05 O ATOM 1252 CB SER A 431 80.722 51.822 24.799 1.00 82.36 C ATOM 1253 OG SER A 431 82.126 51.744 24.604 1.00 90.12 O ATOM 1254 HG SER A 431 82.325 51.062 23.914 1.00 0.00 H ATOM 1255 H SER A 431 81.767 54.493 25.663 1.00 0.00 H ATOM 1256 N LYS A 432 80.734 51.341 27.784 1.00 84.46 N ATOM 1257 CA LYS A 432 81.334 50.869 29.045 1.00 85.88 C ATOM 1258 C LYS A 432 82.840 50.563 28.905 1.00 90.21 C ATOM 1259 O LYS A 432 83.583 50.664 29.889 1.00 90.10 O ATOM 1260 CB LYS A 432 80.582 49.641 29.584 1.00 90.93 C ATOM 1261 H LYS A 432 80.016 50.743 27.328 1.00 0.00 H ATOM 1262 N GLU A 433 83.280 50.194 27.681 1.00 86.19 N ATOM 1263 CA GLU A 433 84.680 49.884 27.347 1.00 85.51 C ATOM 1264 C GLU A 433 85.529 51.167 27.317 1.00 85.76 C ATOM 1265 O GLU A 433 86.701 51.142 27.712 1.00 84.96 O ATOM 1266 CB GLU A 433 84.773 49.163 25.980 1.00 87.12 C ATOM 1267 CG GLU A 433 84.080 47.810 25.919 1.00 99.09 C ATOM 1268 H GLU A 433 82.577 50.124 26.918 1.00 0.00 H ATOM 1269 N PHE A 434 84.924 52.282 26.821 1.00 79.14 N ATOM 1270 CA PHE A 434 85.529 53.611 26.655 1.00 75.73 C ATOM 1271 C PHE A 434 84.407 54.683 26.702 1.00 75.70 C ATOM 1272 O PHE A 434 83.637 54.812 25.746 1.00 74.68 O ATOM 1273 CB PHE A 434 86.291 53.658 25.314 1.00 76.29 C ATOM 1274 CG PHE A 434 87.429 54.641 25.246 1.00 76.47 C ATOM 1275 CD1 PHE A 434 87.190 56.012 25.289 1.00 77.93 C ATOM 1276 CD2 PHE A 434 88.739 54.202 25.101 1.00 78.81 C ATOM 1277 CE1 PHE A 434 88.246 56.923 25.223 1.00 77.68 C ATOM 1278 CE2 PHE A 434 89.794 55.116 25.018 1.00 80.45 C ATOM 1279 CZ PHE A 434 89.540 56.472 25.077 1.00 76.97 C ATOM 1280 H PHE A 434 83.931 52.183 26.529 1.00 0.00 H ATOM 1281 N GLY A 435 84.287 55.382 27.833 1.00 69.67 N ATOM 1282 CA GLY A 435 83.233 56.370 28.053 1.00 67.70 C ATOM 1283 C GLY A 435 83.608 57.823 27.822 1.00 66.56 C ATOM 1284 O GLY A 435 84.744 58.136 27.437 1.00 65.47 O ATOM 1285 H GLY A 435 84.976 55.215 28.594 1.00 0.00 H ATOM 1286 N SER A 436 82.634 58.723 28.079 1.00 59.26 N ATOM 1287 CA SER A 436 82.767 60.172 27.940 1.00 56.63 C ATOM 1288 C SER A 436 83.934 60.744 28.763 1.00 59.31 C ATOM 1289 O SER A 436 84.194 60.280 29.879 1.00 59.74 O ATOM 1290 CB SER A 436 81.473 60.856 28.365 1.00 58.32 C ATOM 1291 OG SER A 436 81.544 62.265 28.216 1.00 60.89 O ATOM 1292 HG SER A 436 81.715 62.487 27.266 1.00 0.00 H ATOM 1293 H SER A 436 81.716 58.356 28.402 1.00 0.00 H ATOM 1294 N GLY A 437 84.627 61.725 28.184 1.00 52.53 N ATOM 1295 CA GLY A 437 85.695 62.457 28.850 1.00 51.41 C ATOM 1296 C GLY A 437 85.140 63.458 29.848 1.00 53.97 C ATOM 1297 O GLY A 437 85.865 63.953 30.709 1.00 53.80 O ATOM 1298 H GLY A 437 84.392 61.981 27.204 1.00 0.00 H ATOM 1299 N PHE A 438 83.838 63.767 29.735 1.00 50.94 N ATOM 1300 CA PHE A 438 83.145 64.673 30.643 1.00 50.91 C ATOM 1301 C PHE A 438 82.448 63.904 31.762 1.00 58.17 C ATOM 1302 O PHE A 438 82.010 62.774 31.513 1.00 57.15 O ATOM 1303 CB PHE A 438 82.105 65.493 29.887 1.00 51.34 C ATOM 1304 CG PHE A 438 82.672 66.534 28.963 1.00 49.97 C ATOM 1305 CD1 PHE A 438 83.239 67.701 29.468 1.00 51.94 C ATOM 1306 CD2 PHE A 438 82.593 66.376 27.583 1.00 48.77 C ATOM 1307 CE1 PHE A 438 83.763 68.668 28.602 1.00 51.52 C ATOM 1308 CE2 PHE A 438 83.107 67.348 26.723 1.00 49.72 C ATOM 1309 CZ PHE A 438 83.652 68.500 27.234 1.00 47.84 C ATOM 1310 H PHE A 438 83.295 63.337 28.959 1.00 0.00 H ATOM 1311 N PRO A 439 82.266 64.512 32.976 1.00 59.26 N ATOM 1312 CA PRO A 439 81.547 63.790 34.047 1.00 62.50 C ATOM 1313 C PRO A 439 80.101 63.472 33.693 1.00 70.42 C ATOM 1314 O PRO A 439 79.424 64.280 33.049 1.00 68.58 O ATOM 1315 CB PRO A 439 81.634 64.721 35.272 1.00 65.10 C ATOM 1316 CG PRO A 439 82.101 66.028 34.762 1.00 67.72 C ATOM 1317 CD PRO A 439 82.744 65.839 33.428 1.00 60.61 C ATOM 1318 N VAL A 440 79.663 62.255 34.067 1.00 71.82 N ATOM 1319 CA VAL A 440 78.314 61.723 33.851 1.00 74.92 C ATOM 1320 C VAL A 440 77.772 61.144 35.166 1.00 84.61 C ATOM 1321 O VAL A 440 78.549 60.684 36.017 1.00 84.34 O ATOM 1322 CB VAL A 440 78.210 60.690 32.689 1.00 79.06 C ATOM 1323 CG1 VAL A 440 78.516 61.325 31.336 1.00 77.05 C ATOM 1324 CG2 VAL A 440 79.089 59.461 32.934 1.00 79.57 C ATOM 1325 H VAL A 440 80.343 61.636 34.553 1.00 0.00 H ATOM 1326 N ARG A 441 76.448 61.174 35.334 1.00 86.06 N ATOM 1327 CA ARG A 441 75.818 60.620 36.532 1.00 90.00 C ATOM 1328 C ARG A 441 75.795 59.086 36.451 1.00 99.08 C ATOM 1329 O ARG A 441 75.258 58.525 35.491 1.00 98.62 O ATOM 1330 CB ARG A 441 74.407 61.192 36.737 1.00 90.57 C ATOM 1331 CG ARG A 441 74.408 62.583 37.345 1.00 97.49 C ATOM 1332 CD ARG A 441 73.025 62.965 37.834 1.00101.31 C ATOM 1333 NE ARG A 441 73.016 64.275 38.488 1.00100.92 N ATOM 1334 CZ ARG A 441 72.777 65.424 37.865 1.00106.52 C ATOM 1335 NH1 ARG A 441 72.520 65.440 36.562 1.00 85.63 N ATOM 1336 NH2 ARG A 441 72.779 66.565 38.541 1.00 94.07 N ATOM 1337 HE ARG A 441 73.210 64.308 39.509 1.00 0.00 H ATOM 1338 HH12 ARG A 441 72.334 66.342 36.080 1.00 0.00 H ATOM 1339 HH11 ARG A 441 72.505 64.550 36.024 1.00 0.00 H ATOM 1340 HH22 ARG A 441 72.591 67.462 38.048 1.00 0.00 H ATOM 1341 HH21 ARG A 441 72.968 66.563 39.564 1.00 0.00 H ATOM 1342 H ARG A 441 75.851 61.601 34.597 1.00 0.00 H ATOM 1343 N ASP A 442 76.429 58.421 37.436 1.00 99.52 N ATOM 1344 CA ASP A 442 76.505 56.959 37.524 1.00101.89 C ATOM 1345 C ASP A 442 76.077 56.482 38.921 1.00109.27 C ATOM 1346 O ASP A 442 76.548 57.020 39.930 1.00109.33 O ATOM 1347 CB ASP A 442 77.927 56.464 37.177 1.00103.03 C ATOM 1348 CG ASP A 442 78.028 54.969 36.922 1.00117.63 C ATOM 1349 OD1 ASP A 442 78.037 54.195 37.908 1.00121.29 O ATOM 1350 OD2 ASP A 442 78.127 54.574 35.739 1.00122.10 O ATOM 1351 H ASP A 442 76.894 58.979 38.181 1.00 0.00 H ATOM 1352 N GLY A 443 75.185 55.488 38.952 1.00108.02 N ATOM 1353 CA GLY A 443 74.657 54.899 40.179 1.00110.65 C ATOM 1354 C GLY A 443 75.680 54.106 40.969 1.00115.63 C ATOM 1355 O GLY A 443 75.988 54.456 42.110 1.00115.76 O ATOM 1356 H GLY A 443 74.845 55.110 38.045 1.00 0.00 H ATOM 1357 N LYS A 444 76.352 53.156 40.307 1.00112.13 N ATOM 1358 HN3 LYS A 444 76.307 52.265 40.841 1.00 0.00 H ATOM 1359 HN2 LYS A 444 77.345 53.447 40.199 1.00 0.00 H ATOM 1360 HN1 LYS A 444 75.925 53.021 39.369 1.00 0.00 H TER 1361 LYS A 444 ATOM 1362 N ILE A 445 78.774 54.681 41.953 1.00102.52 N ATOM 1363 CA ILE A 445 79.917 55.535 41.647 1.00100.10 C ATOM 1364 C ILE A 445 79.713 56.949 42.198 1.00103.84 C ATOM 1365 O ILE A 445 79.052 57.773 41.557 1.00102.94 O ATOM 1366 CB ILE A 445 80.244 55.526 40.129 1.00100.93 C ATOM 1367 CG1 ILE A 445 81.652 56.088 39.854 1.00 99.54 C ATOM 1368 HN3 ILE A 445 77.917 55.085 41.525 1.00 0.00 H ATOM 1369 HN2 ILE A 445 78.653 54.622 42.984 1.00 0.00 H ATOM 1370 HN1 ILE A 445 78.941 53.730 41.567 1.00 0.00 H ATOM 1371 N LYS A 446 80.281 57.219 43.395 1.00100.91 N ATOM 1372 CA LYS A 446 80.232 58.523 44.062 1.00100.18 C ATOM 1373 C LYS A 446 81.177 59.504 43.332 1.00101.97 C ATOM 1374 O LYS A 446 82.372 59.224 43.186 1.00100.30 O ATOM 1375 CB LYS A 446 80.601 58.388 45.554 1.00103.67 C ATOM 1376 CG LYS A 446 80.389 59.655 46.370 1.00111.52 C ATOM 1377 CD LYS A 446 81.051 59.557 47.731 1.00122.22 C ATOM 1378 H LYS A 446 80.788 56.448 43.875 1.00 0.00 H ATOM 1379 N LEU A 447 80.623 60.633 42.849 1.00 97.92 N ATOM 1380 CA LEU A 447 81.376 61.673 42.137 1.00 95.59 C ATOM 1381 C LEU A 447 81.927 62.740 43.092 1.00 99.77 C ATOM 1382 O LEU A 447 81.285 63.071 44.095 1.00100.55 O ATOM 1383 CB LEU A 447 80.512 62.330 41.041 1.00 94.41 C ATOM 1384 CG LEU A 447 80.103 61.446 39.858 1.00 98.01 C ATOM 1385 CD1 LEU A 447 78.818 61.924 39.250 1.00 98.07 C ATOM 1386 CD2 LEU A 447 81.188 61.386 38.805 1.00 97.90 C ATOM 1387 H LEU A 447 79.602 60.776 42.989 1.00 0.00 H ATOM 1388 N SER A 448 83.121 63.271 42.771 1.00 95.29 N ATOM 1389 CA SER A 448 83.790 64.319 43.550 1.00 95.21 C ATOM 1390 C SER A 448 83.126 65.693 43.291 1.00 98.04 C ATOM 1391 O SER A 448 82.571 65.872 42.199 1.00 96.26 O ATOM 1392 CB SER A 448 85.268 64.380 43.177 1.00 97.13 C ATOM 1393 OG SER A 448 85.439 64.771 41.825 1.00104.14 O ATOM 1394 HG SER A 448 86.405 64.802 41.611 1.00 0.00 H ATOM 1395 H SER A 448 83.599 62.917 41.918 1.00 0.00 H ATOM 1396 N PRO A 449 83.197 66.688 44.228 1.00 94.86 N ATOM 1397 CA PRO A 449 82.589 68.009 43.947 1.00 94.07 C ATOM 1398 C PRO A 449 83.060 68.677 42.642 1.00 94.50 C ATOM 1399 O PRO A 449 82.265 69.377 42.012 1.00 93.06 O ATOM 1400 CB PRO A 449 82.941 68.839 45.187 1.00 97.19 C ATOM 1401 CG PRO A 449 83.163 67.842 46.255 1.00103.25 C ATOM 1402 CD PRO A 449 83.806 66.668 45.575 1.00 97.74 C ATOM 1403 N GLU A 450 84.326 68.419 42.212 1.00 89.25 N ATOM 1404 CA GLU A 450 84.901 68.934 40.960 1.00 86.68 C ATOM 1405 C GLU A 450 84.138 68.370 39.751 1.00 88.83 C ATOM 1406 O GLU A 450 83.947 69.073 38.762 1.00 88.10 O ATOM 1407 CB GLU A 450 86.400 68.608 40.853 1.00 87.06 C ATOM 1408 H GLU A 450 84.927 67.817 42.810 1.00 0.00 H ATOM 1409 N GLU A 451 83.691 67.107 39.841 1.00 83.90 N ATOM 1410 CA GLU A 451 82.909 66.455 38.789 1.00 81.54 C ATOM 1411 C GLU A 451 81.456 66.955 38.830 1.00 82.68 C ATOM 1412 O GLU A 451 80.853 67.120 37.768 1.00 81.02 O ATOM 1413 CB GLU A 451 82.956 64.922 38.934 1.00 83.43 C ATOM 1414 CG GLU A 451 84.311 64.308 38.620 1.00 94.11 C ATOM 1415 CD GLU A 451 84.405 62.818 38.884 1.00119.42 C ATOM 1416 OE1 GLU A 451 84.335 62.412 40.068 1.00115.90 O ATOM 1417 OE2 GLU A 451 84.523 62.051 37.901 1.00114.01 O ATOM 1418 H GLU A 451 83.911 66.565 40.701 1.00 0.00 H ATOM 1419 N GLU A 452 80.911 67.219 40.053 1.00 78.38 N ATOM 1420 CA GLU A 452 79.527 67.676 40.285 1.00 78.44 C ATOM 1421 C GLU A 452 79.206 69.016 39.617 1.00 78.79 C ATOM 1422 O GLU A 452 78.177 69.124 38.952 1.00 76.63 O ATOM 1423 CB GLU A 452 79.183 67.702 41.784 1.00 81.83 C ATOM 1424 H GLU A 452 81.519 67.088 40.887 1.00 0.00 H ATOM 1425 N GLU A 453 80.104 70.008 39.745 1.00 75.48 N ATOM 1426 CA GLU A 453 79.946 71.337 39.126 1.00 75.08 C ATOM 1427 C GLU A 453 79.929 71.324 37.581 1.00 75.46 C ATOM 1428 O GLU A 453 79.314 72.206 36.982 1.00 77.31 O ATOM 1429 CB GLU A 453 80.992 72.348 39.649 1.00 76.78 C ATOM 1430 CG GLU A 453 82.411 71.834 39.784 1.00 84.20 C ATOM 1431 CD GLU A 453 83.319 72.750 40.584 1.00115.48 C ATOM 1432 OE1 GLU A 453 83.742 73.798 40.043 1.00114.40 O ATOM 1433 OE2 GLU A 453 83.620 72.413 41.752 1.00114.16 O ATOM 1434 H GLU A 453 80.957 69.828 40.312 1.00 0.00 H ATOM 1435 N TYR A 454 80.575 70.330 36.948 1.00 66.81 N ATOM 1436 CA TYR A 454 80.630 70.202 35.490 1.00 63.90 C ATOM 1437 C TYR A 454 79.589 69.198 34.958 1.00 67.48 C ATOM 1438 O TYR A 454 79.499 68.978 33.747 1.00 64.65 O ATOM 1439 CB TYR A 454 82.065 69.859 35.021 1.00 62.78 C ATOM 1440 CG TYR A 454 83.066 70.968 35.293 1.00 63.60 C ATOM 1441 CD1 TYR A 454 83.753 71.031 36.500 1.00 66.12 C ATOM 1442 CD2 TYR A 454 83.282 71.987 34.365 1.00 62.72 C ATOM 1443 CE1 TYR A 454 84.613 72.085 36.790 1.00 67.82 C ATOM 1444 CE2 TYR A 454 84.147 73.047 34.643 1.00 63.03 C ATOM 1445 CZ TYR A 454 84.811 73.089 35.860 1.00 71.65 C ATOM 1446 OH TYR A 454 85.678 74.111 36.166 1.00 72.04 O ATOM 1447 HH TYR A 454 86.050 73.966 37.072 1.00 0.00 H ATOM 1448 H TYR A 454 81.062 69.614 37.524 1.00 0.00 H ATOM 1449 N LEU A 455 78.797 68.600 35.865 1.00 66.39 N ATOM 1450 CA LEU A 455 77.786 67.618 35.488 1.00 67.53 C ATOM 1451 C LEU A 455 76.647 68.236 34.712 1.00 69.89 C ATOM 1452 O LEU A 455 76.128 67.607 33.794 1.00 67.75 O ATOM 1453 CB LEU A 455 77.202 66.935 36.727 1.00 70.58 C ATOM 1454 CG LEU A 455 77.797 65.609 37.166 1.00 77.17 C ATOM 1455 CD1 LEU A 455 77.142 65.157 38.463 1.00 80.76 C ATOM 1456 CD2 LEU A 455 77.560 64.543 36.124 1.00 79.51 C ATOM 1457 H LEU A 455 78.909 68.846 36.869 1.00 0.00 H ATOM 1458 N ASP A 456 76.246 69.454 35.100 1.00 67.81 N ATOM 1459 CA ASP A 456 75.095 70.142 34.529 1.00 69.07 C ATOM 1460 C ASP A 456 75.460 71.235 33.547 1.00 70.02 C ATOM 1461 O ASP A 456 74.556 71.840 32.962 1.00 71.50 O ATOM 1462 CB ASP A 456 74.176 70.676 35.651 1.00 74.22 C ATOM 1463 CG ASP A 456 73.765 69.606 36.650 1.00 91.99 C ATOM 1464 OD1 ASP A 456 73.065 68.645 36.239 1.00 93.47 O ATOM 1465 OD2 ASP A 456 74.179 69.706 37.836 1.00100.55 O ATOM 1466 H ASP A 456 76.785 69.934 35.849 1.00 0.00 H ATOM 1467 N SER A 457 76.770 71.461 33.332 1.00 61.63 N ATOM 1468 CA SER A 457 77.298 72.447 32.394 1.00 58.76 C ATOM 1469 C SER A 457 76.693 72.284 30.997 1.00 60.38 C ATOM 1470 O SER A 457 76.602 71.171 30.484 1.00 57.25 O ATOM 1471 CB SER A 457 78.820 72.326 32.310 1.00 59.25 C ATOM 1472 OG SER A 457 79.365 73.190 31.329 1.00 61.53 O ATOM 1473 HG SER A 457 79.140 74.127 31.555 1.00 0.00 H ATOM 1474 H SER A 457 77.454 70.893 33.872 1.00 0.00 H ATOM 1475 N GLY A 458 76.304 73.401 30.391 1.00 59.56 N ATOM 1476 CA GLY A 458 75.801 73.419 29.020 1.00 59.11 C ATOM 1477 C GLY A 458 76.894 73.019 28.034 1.00 61.73 C ATOM 1478 O GLY A 458 76.595 72.473 26.968 1.00 61.18 O ATOM 1479 H GLY A 458 76.360 74.298 30.914 1.00 0.00 H ATOM 1480 N TRP A 459 78.188 73.233 28.426 1.00 55.56 N ATOM 1481 CA TRP A 459 79.387 72.902 27.645 1.00 51.92 C ATOM 1482 C TRP A 459 79.908 71.484 27.884 1.00 53.11 C ATOM 1483 O TRP A 459 80.876 71.083 27.244 1.00 50.39 O ATOM 1484 CB TRP A 459 80.489 73.938 27.855 1.00 49.67 C ATOM 1485 CG TRP A 459 80.085 75.304 27.409 1.00 50.52 C ATOM 1486 CD1 TRP A 459 79.432 76.247 28.146 1.00 54.59 C ATOM 1487 CD2 TRP A 459 80.285 75.875 26.110 1.00 49.66 C ATOM 1488 NE1 TRP A 459 79.210 77.369 27.384 1.00 54.02 N ATOM 1489 CE2 TRP A 459 79.741 77.176 26.135 1.00 53.67 C ATOM 1490 CE3 TRP A 459 80.881 75.412 24.921 1.00 50.33 C ATOM 1491 CZ2 TRP A 459 79.784 78.029 25.026 1.00 52.92 C ATOM 1492 CZ3 TRP A 459 80.934 76.263 23.821 1.00 51.72 C ATOM 1493 CH2 TRP A 459 80.367 77.545 23.873 1.00 53.44 C ATOM 1494 HE1 TRP A 459 78.718 78.227 27.704 1.00 0.00 H ATOM 1495 H TRP A 459 78.335 73.668 29.359 1.00 0.00 H ATOM 1496 N ASN A 460 79.264 70.720 28.783 1.00 49.96 N ATOM 1497 CA ASN A 460 79.560 69.299 28.987 1.00 49.66 C ATOM 1498 C ASN A 460 78.773 68.702 27.809 1.00 54.24 C ATOM 1499 O ASN A 460 77.546 68.843 27.764 1.00 54.62 O ATOM 1500 CB ASN A 460 78.998 68.808 30.347 1.00 49.31 C ATOM 1501 CG ASN A 460 79.071 67.313 30.596 1.00 59.88 C ATOM 1502 OD1 ASN A 460 78.894 66.478 29.705 1.00 56.09 O ATOM 1503 ND2 ASN A 460 79.261 66.936 31.840 1.00 51.37 N ATOM 1504 HD22 ASN A 460 79.409 67.649 32.583 1.00 0.00 H ATOM 1505 HD21 ASN A 460 79.263 65.925 32.082 1.00 0.00 H ATOM 1506 H ASN A 460 78.520 71.158 29.362 1.00 0.00 H ATOM 1507 N LEU A 461 79.474 68.107 26.832 1.00 50.36 N ATOM 1508 CA LEU A 461 78.883 67.652 25.569 1.00 50.06 C ATOM 1509 C LEU A 461 77.818 66.525 25.714 1.00 59.07 C ATOM 1510 O LEU A 461 77.052 66.299 24.769 1.00 58.47 O ATOM 1511 CB LEU A 461 79.964 67.314 24.521 1.00 48.02 C ATOM 1512 CG LEU A 461 80.896 68.510 24.119 1.00 50.01 C ATOM 1513 CD1 LEU A 461 81.725 68.195 22.865 1.00 47.22 C ATOM 1514 CD2 LEU A 461 80.104 69.809 23.901 1.00 49.68 C ATOM 1515 H LEU A 461 80.493 67.960 26.978 1.00 0.00 H ATOM 1516 N ASN A 462 77.687 65.919 26.902 1.00 59.65 N ATOM 1517 CA ASN A 462 76.605 64.959 27.182 1.00 62.17 C ATOM 1518 C ASN A 462 75.252 65.690 27.372 1.00 69.15 C ATOM 1519 O ASN A 462 74.210 65.117 27.069 1.00 70.68 O ATOM 1520 CB ASN A 462 76.911 64.143 28.431 1.00 62.76 C ATOM 1521 CG ASN A 462 78.160 63.328 28.300 1.00 72.20 C ATOM 1522 OD1 ASN A 462 78.180 62.306 27.622 1.00 67.26 O ATOM 1523 ND2 ASN A 462 79.232 63.772 28.930 1.00 60.93 N ATOM 1524 HD22 ASN A 462 79.179 64.643 29.496 1.00 0.00 H ATOM 1525 HD21 ASN A 462 80.129 63.251 28.860 1.00 0.00 H ATOM 1526 H ASN A 462 78.374 66.134 27.653 1.00 0.00 H ATOM 1527 N ASN A 463 75.275 66.948 27.863 1.00 67.30 N ATOM 1528 CA ASN A 463 74.082 67.769 28.118 1.00 69.62 C ATOM 1529 C ASN A 463 73.577 68.573 26.917 1.00 79.29 C ATOM 1530 O ASN A 463 72.357 68.689 26.748 1.00 78.36 O ATOM 1531 CB ASN A 463 74.308 68.708 29.305 1.00 66.53 C ATOM 1532 CG ASN A 463 74.783 68.024 30.563 1.00 76.87 C ATOM 1533 OD1 ASN A 463 74.491 66.854 30.825 1.00 63.81 O ATOM 1534 ND2 ASN A 463 75.563 68.732 31.350 1.00 70.89 N ATOM 1535 HD22 ASN A 463 75.793 69.716 31.105 1.00 0.00 H ATOM 1536 HD21 ASN A 463 75.950 68.308 32.217 1.00 0.00 H ATOM 1537 H ASN A 463 76.203 67.366 28.076 1.00 0.00 H ATOM 1538 N MET A 464 74.516 69.162 26.112 1.00 79.30 N ATOM 1539 CA MET A 464 74.253 69.983 24.914 1.00 80.70 C ATOM 1540 C MET A 464 73.035 69.472 24.097 1.00 86.07 C ATOM 1541 O MET A 464 72.094 70.262 23.926 1.00 86.43 O ATOM 1542 CB MET A 464 75.527 70.127 24.056 1.00 82.01 C ATOM 1543 CG MET A 464 75.411 71.109 22.899 1.00 86.15 C ATOM 1544 SD MET A 464 76.130 72.769 23.178 1.00 91.46 S ATOM 1545 CE MET A 464 77.643 72.382 23.918 1.00 86.94 C ATOM 1546 H MET A 464 75.513 69.016 26.371 1.00 0.00 H ATOM 1547 N PRO A 465 72.955 68.164 23.694 1.00 82.07 N ATOM 1548 CA PRO A 465 71.749 67.692 22.978 1.00 82.14 C ATOM 1549 C PRO A 465 70.414 67.805 23.721 1.00 87.56 C ATOM 1550 O PRO A 465 69.423 68.213 23.113 1.00 89.38 O ATOM 1551 CB PRO A 465 72.058 66.213 22.702 1.00 83.86 C ATOM 1552 CG PRO A 465 73.111 65.836 23.702 1.00 87.99 C ATOM 1553 CD PRO A 465 73.951 67.074 23.799 1.00 82.39 C ATOM 1554 N VAL A 466 70.369 67.423 25.020 1.00 81.88 N ATOM 1555 CA VAL A 466 69.128 67.369 25.801 1.00 81.46 C ATOM 1556 C VAL A 466 68.722 68.734 26.412 1.00 83.38 C ATOM 1557 O VAL A 466 67.785 68.773 27.204 1.00 84.09 O ATOM 1558 CB VAL A 466 69.132 66.217 26.848 1.00 85.28 C ATOM 1559 CG1 VAL A 466 69.383 64.875 26.169 1.00 84.46 C ATOM 1560 CG2 VAL A 466 70.144 66.451 27.969 1.00 84.51 C ATOM 1561 H VAL A 466 71.259 67.155 25.487 1.00 0.00 H ATOM 1562 N MET A 467 69.353 69.848 25.994 1.00 78.14 N ATOM 1563 CA MET A 467 68.961 71.182 26.487 1.00 79.07 C ATOM 1564 C MET A 467 67.700 71.697 25.742 1.00 85.64 C ATOM 1565 O MET A 467 67.431 71.235 24.630 1.00 83.37 O ATOM 1566 CB MET A 467 70.127 72.167 26.395 1.00 79.69 C ATOM 1567 CG MET A 467 71.258 71.825 27.356 1.00 82.56 C ATOM 1568 SD MET A 467 72.562 73.060 27.345 1.00 84.87 S ATOM 1569 CE MET A 467 71.884 74.270 28.477 1.00 83.55 C ATOM 1570 H MET A 467 70.132 69.766 25.310 1.00 0.00 H ATOM 1571 N GLU A 468 66.917 72.622 26.354 1.00 86.64 N ATOM 1572 CA GLU A 468 65.657 73.094 25.738 1.00 88.79 C ATOM 1573 C GLU A 468 65.834 74.045 24.517 1.00 92.36 C ATOM 1574 O GLU A 468 64.873 74.208 23.759 1.00 94.17 O ATOM 1575 CB GLU A 468 64.688 73.710 26.763 1.00 92.65 C ATOM 1576 CG GLU A 468 63.424 72.878 27.010 1.00106.21 C ATOM 1577 CD GLU A 468 62.497 72.522 25.850 1.00124.42 C ATOM 1578 OE1 GLU A 468 62.341 73.340 24.913 1.00112.39 O ATOM 1579 OE2 GLU A 468 61.881 71.432 25.909 1.00115.92 O ATOM 1580 H GLU A 468 67.209 73.007 27.275 1.00 0.00 H ATOM 1581 N GLN A 469 67.040 74.626 24.297 1.00 84.66 N ATOM 1582 CA GLN A 469 67.304 75.505 23.143 1.00 81.96 C ATOM 1583 C GLN A 469 67.717 74.686 21.891 1.00 79.40 C ATOM 1584 O GLN A 469 67.843 75.228 20.779 1.00 76.50 O ATOM 1585 CB GLN A 469 68.353 76.572 23.485 1.00 82.72 C ATOM 1586 CG GLN A 469 67.995 77.447 24.681 1.00 96.80 C ATOM 1587 CD GLN A 469 68.909 77.192 25.858 1.00112.79 C ATOM 1588 OE1 GLN A 469 68.990 76.079 26.404 1.00106.00 O ATOM 1589 NE2 GLN A 469 69.602 78.233 26.290 1.00103.77 N ATOM 1590 HE22 GLN A 469 69.513 79.152 25.811 1.00 0.00 H ATOM 1591 HE21 GLN A 469 70.236 78.132 27.108 1.00 0.00 H ATOM 1592 H GLN A 469 67.811 74.444 24.971 1.00 0.00 H ATOM 1593 N SER A 470 67.913 73.372 22.097 1.00 73.31 N ATOM 1594 CA SER A 470 68.243 72.380 21.082 1.00 71.32 C ATOM 1595 C SER A 470 66.926 71.767 20.518 1.00 79.72 C ATOM 1596 O SER A 470 65.895 71.783 21.215 1.00 80.78 O ATOM 1597 CB SER A 470 69.117 71.300 21.703 1.00 71.75 C ATOM 1598 OG SER A 470 68.822 70.022 21.174 1.00 81.56 O ATOM 1599 HG SER A 470 68.978 70.027 20.196 1.00 0.00 H ATOM 1600 H SER A 470 67.820 73.031 23.075 1.00 0.00 H ATOM 1601 N VAL A 471 66.955 71.238 19.270 1.00 76.17 N ATOM 1602 CA VAL A 471 65.739 70.669 18.670 1.00 78.37 C ATOM 1603 C VAL A 471 65.854 69.142 18.469 1.00 83.63 C ATOM 1604 O VAL A 471 64.820 68.469 18.461 1.00 85.69 O ATOM 1605 CB VAL A 471 65.231 71.405 17.390 1.00 82.64 C ATOM 1606 CG1 VAL A 471 64.816 72.840 17.700 1.00 83.59 C ATOM 1607 CG2 VAL A 471 66.249 71.374 16.266 1.00 80.30 C ATOM 1608 H VAL A 471 67.845 71.235 18.732 1.00 0.00 H ATOM 1609 N LEU A 472 67.091 68.598 18.361 1.00 78.84 N ATOM 1610 CA LEU A 472 67.363 67.154 18.233 1.00 78.89 C ATOM 1611 C LEU A 472 67.014 66.412 19.533 1.00 86.24 C ATOM 1612 O LEU A 472 66.901 65.180 19.532 1.00 85.52 O ATOM 1613 CB LEU A 472 68.842 66.907 17.898 1.00 76.69 C ATOM 1614 CG LEU A 472 69.196 66.729 16.436 1.00 80.22 C ATOM 1615 CD1 LEU A 472 70.688 66.494 16.282 1.00 78.98 C ATOM 1616 H LEU A 472 67.906 69.244 18.369 1.00 0.00 H ATOM 1617 N ALA A 473 66.861 67.182 20.641 1.00 85.45 N ATOM 1618 CA ALA A 473 66.515 66.751 21.996 1.00 87.14 C ATOM 1619 C ALA A 473 65.264 65.914 21.985 1.00 93.21 C ATOM 1620 O ALA A 473 65.225 64.810 22.528 1.00 94.01 O ATOM 1621 CB ALA A 473 66.263 67.980 22.869 1.00 88.77 C ATOM 1622 H ALA A 473 67.008 68.203 20.511 1.00 0.00 H ATOM 1623 N HIS A 474 64.242 66.471 21.347 1.00 90.57 N ATOM 1624 CA HIS A 474 62.883 65.989 21.250 1.00 91.59 C ATOM 1625 C HIS A 474 62.710 64.736 20.405 1.00 94.28 C ATOM 1626 O HIS A 474 61.695 64.056 20.587 1.00 96.97 O ATOM 1627 CB HIS A 474 61.999 67.135 20.750 1.00 93.26 C ATOM 1628 CG HIS A 474 62.165 68.379 21.567 1.00 96.31 C ATOM 1629 ND1 HIS A 474 63.089 69.350 21.221 1.00 95.88 N ATOM 1630 CD2 HIS A 474 61.576 68.729 22.734 1.00 99.76 C ATOM 1631 CE1 HIS A 474 63.003 70.276 22.160 1.00 96.10 C ATOM 1632 NE2 HIS A 474 62.108 69.944 23.095 1.00 98.77 N ATOM 1633 H HIS A 474 64.444 67.365 20.856 1.00 0.00 H ATOM 1634 N ILE A 475 63.670 64.412 19.504 1.00 87.12 N ATOM 1635 CA ILE A 475 63.585 63.209 18.666 1.00 87.54 C ATOM 1636 C ILE A 475 63.541 61.943 19.545 1.00 95.50 C ATOM 1637 O ILE A 475 64.438 61.705 20.356 1.00 93.71 O ATOM 1638 CB ILE A 475 64.646 63.126 17.525 1.00 88.25 C ATOM 1639 CG1 ILE A 475 64.550 64.344 16.574 1.00 87.83 C ATOM 1640 CG2 ILE A 475 64.508 61.806 16.729 1.00 89.29 C ATOM 1641 CD1 ILE A 475 65.779 64.588 15.650 1.00 88.06 C ATOM 1642 H ILE A 475 64.495 65.037 19.403 1.00 0.00 H ATOM 1643 N THR A 476 62.443 61.178 19.403 1.00 96.95 N ATOM 1644 CA THR A 476 62.164 59.931 20.122 1.00 99.46 C ATOM 1645 C THR A 476 62.822 58.731 19.430 1.00105.16 C ATOM 1646 O THR A 476 63.197 57.768 20.099 1.00105.08 O ATOM 1647 CB THR A 476 60.642 59.765 20.355 1.00107.74 C ATOM 1648 OG1 THR A 476 60.376 58.471 20.895 1.00109.43 O ATOM 1649 CG2 THR A 476 59.819 59.970 19.093 1.00105.23 C ATOM 1650 HG1 THR A 476 60.689 57.779 20.260 1.00 0.00 H ATOM 1651 H THR A 476 61.727 61.501 18.721 1.00 0.00 H ATOM 1652 N ALA A 477 62.965 58.805 18.092 1.00102.83 N ATOM 1653 CA ALA A 477 63.582 57.782 17.248 1.00103.02 C ATOM 1654 C ALA A 477 65.044 57.482 17.631 1.00106.31 C ATOM 1655 O ALA A 477 65.742 58.337 18.197 1.00103.86 O ATOM 1656 CB ALA A 477 63.489 58.190 15.785 1.00103.12 C ATOM 1657 H ALA A 477 62.607 59.660 17.621 1.00 0.00 H ATOM 1658 N ASP A 478 65.481 56.241 17.348 1.00104.60 N ATOM 1659 CA ASP A 478 66.830 55.751 17.622 1.00103.54 C ATOM 1660 C ASP A 478 67.816 56.379 16.627 1.00105.69 C ATOM 1661 O ASP A 478 67.884 55.948 15.469 1.00105.63 O ATOM 1662 CB ASP A 478 66.860 54.210 17.552 1.00106.93 C ATOM 1663 H ASP A 478 64.810 55.583 16.902 1.00 0.00 H ATOM 1664 N ILE A 479 68.533 57.440 17.067 1.00100.05 N ATOM 1665 CA ILE A 479 69.513 58.170 16.245 1.00 97.63 C ATOM 1666 C ILE A 479 70.869 58.339 16.999 1.00100.93 C ATOM 1667 O ILE A 479 71.445 59.436 17.018 1.00 98.80 O ATOM 1668 CB ILE A 479 68.958 59.517 15.652 1.00 99.63 C ATOM 1669 CG1 ILE A 479 68.411 60.479 16.737 1.00 99.94 C ATOM 1670 CG2 ILE A 479 67.923 59.267 14.558 1.00101.16 C ATOM 1671 CD1 ILE A 479 68.422 61.956 16.349 1.00103.22 C ATOM 1672 H ILE A 479 68.382 57.759 18.045 1.00 0.00 H ATOM 1673 N CYS A 480 71.387 57.219 17.572 1.00 98.58 N ATOM 1674 CA CYS A 480 72.642 57.103 18.345 1.00 97.66 C ATOM 1675 C CYS A 480 73.811 57.960 17.818 1.00 96.82 C ATOM 1676 O CYS A 480 74.498 58.594 18.620 1.00 95.30 O ATOM 1677 CB CYS A 480 73.057 55.641 18.485 1.00 99.68 C ATOM 1678 SG CYS A 480 72.346 54.802 19.926 1.00106.30 S ATOM 1679 H CYS A 480 70.837 56.344 17.453 1.00 0.00 H ATOM 1680 N GLY A 481 74.009 57.979 16.498 1.00 90.81 N ATOM 1681 CA GLY A 481 75.075 58.740 15.849 1.00 88.13 C ATOM 1682 C GLY A 481 74.988 60.258 15.928 1.00 88.91 C ATOM 1683 O GLY A 481 76.024 60.935 15.857 1.00 88.10 O ATOM 1684 H GLY A 481 73.369 57.421 15.898 1.00 0.00 H ATOM 1685 N MET A 482 73.762 60.807 16.094 1.00 82.86 N ATOM 1686 CA MET A 482 73.488 62.250 16.086 1.00 80.45 C ATOM 1687 C MET A 482 73.130 62.905 17.428 1.00 82.30 C ATOM 1688 O MET A 482 73.018 64.137 17.494 1.00 81.92 O ATOM 1689 CB MET A 482 72.372 62.544 15.080 1.00 83.04 C ATOM 1690 CG MET A 482 72.862 62.645 13.669 1.00 84.80 C ATOM 1691 SD MET A 482 71.765 63.702 12.722 1.00 88.28 S ATOM 1692 CE MET A 482 72.344 65.323 13.211 1.00 83.07 C ATOM 1693 H MET A 482 72.958 60.163 16.237 1.00 0.00 H ATOM 1694 N LYS A 483 72.901 62.108 18.470 1.00 76.28 N ATOM 1695 CA LYS A 483 72.564 62.654 19.783 1.00 74.42 C ATOM 1696 C LYS A 483 73.667 62.329 20.797 1.00 70.80 C ATOM 1697 O LYS A 483 73.813 63.025 21.806 1.00 69.06 O ATOM 1698 CB LYS A 483 71.206 62.102 20.255 1.00 79.20 C ATOM 1699 H LYS A 483 72.963 61.077 18.347 1.00 0.00 H ATOM 1700 N LEU A 484 74.432 61.259 20.529 1.00 63.04 N ATOM 1701 CA LEU A 484 75.460 60.801 21.453 1.00 60.83 C ATOM 1702 C LEU A 484 76.838 61.299 21.089 1.00 59.46 C ATOM 1703 O LEU A 484 77.180 61.358 19.902 1.00 57.30 O ATOM 1704 CB LEU A 484 75.438 59.265 21.634 1.00 61.47 C ATOM 1705 CG LEU A 484 74.108 58.642 22.142 1.00 66.65 C ATOM 1706 CD1 LEU A 484 74.203 57.133 22.204 1.00 67.70 C ATOM 1707 CD2 LEU A 484 73.711 59.172 23.519 1.00 65.72 C ATOM 1708 H LEU A 484 74.287 60.743 19.638 1.00 0.00 H ATOM 1709 N PRO A 485 77.643 61.705 22.094 1.00 55.33 N ATOM 1710 CA PRO A 485 79.001 62.160 21.781 1.00 53.03 C ATOM 1711 C PRO A 485 79.895 61.060 21.205 1.00 55.15 C ATOM 1712 O PRO A 485 79.751 59.874 21.522 1.00 53.19 O ATOM 1713 CB PRO A 485 79.526 62.703 23.112 1.00 54.41 C ATOM 1714 CG PRO A 485 78.334 62.801 24.011 1.00 61.08 C ATOM 1715 CD PRO A 485 77.399 61.731 23.551 1.00 57.81 C ATOM 1716 N TRP A 486 80.781 61.471 20.302 1.00 51.58 N ATOM 1717 CA TRP A 486 81.789 60.612 19.696 1.00 52.64 C ATOM 1718 C TRP A 486 83.133 60.941 20.346 1.00 50.13 C ATOM 1719 O TRP A 486 83.396 62.091 20.681 1.00 46.41 O ATOM 1720 CB TRP A 486 81.847 60.821 18.180 1.00 52.96 C ATOM 1721 CG TRP A 486 80.753 60.102 17.449 1.00 56.62 C ATOM 1722 CD1 TRP A 486 79.417 60.385 17.479 1.00 60.30 C ATOM 1723 CD2 TRP A 486 80.914 59.002 16.543 1.00 58.02 C ATOM 1724 NE1 TRP A 486 78.733 59.517 16.661 1.00 61.48 N ATOM 1725 CE2 TRP A 486 79.626 58.650 16.080 1.00 63.49 C ATOM 1726 CE3 TRP A 486 82.027 58.268 16.084 1.00 60.18 C ATOM 1727 CZ2 TRP A 486 79.411 57.572 15.206 1.00 64.30 C ATOM 1728 CZ3 TRP A 486 81.818 57.217 15.196 1.00 63.30 C ATOM 1729 CH2 TRP A 486 80.523 56.880 14.763 1.00 64.89 C ATOM 1730 HE1 TRP A 486 77.704 59.517 16.507 1.00 0.00 H ATOM 1731 H TRP A 486 80.752 62.469 20.010 1.00 0.00 H ATOM 1732 N LEU A 487 83.942 59.919 20.568 1.00 46.27 N ATOM 1733 CA LEU A 487 85.258 60.016 21.186 1.00 45.62 C ATOM 1734 C LEU A 487 86.289 59.718 20.117 1.00 47.29 C ATOM 1735 O LEU A 487 86.117 58.776 19.337 1.00 46.67 O ATOM 1736 CB LEU A 487 85.374 59.020 22.354 1.00 47.25 C ATOM 1737 CG LEU A 487 84.281 59.110 23.443 1.00 53.89 C ATOM 1738 CD1 LEU A 487 84.229 57.852 24.244 1.00 55.35 C ATOM 1739 CD2 LEU A 487 84.496 60.296 24.353 1.00 56.96 C ATOM 1740 H LEU A 487 83.614 58.975 20.280 1.00 0.00 H ATOM 1741 N TYR A 488 87.319 60.562 20.032 1.00 42.17 N ATOM 1742 CA TYR A 488 88.373 60.432 19.019 1.00 40.71 C ATOM 1743 C TYR A 488 89.735 60.376 19.652 1.00 44.62 C ATOM 1744 O TYR A 488 90.173 61.363 20.251 1.00 45.12 O ATOM 1745 CB TYR A 488 88.322 61.592 18.019 1.00 39.77 C ATOM 1746 CG TYR A 488 87.026 61.645 17.247 1.00 43.54 C ATOM 1747 CD1 TYR A 488 86.759 60.730 16.228 1.00 45.04 C ATOM 1748 CD2 TYR A 488 86.052 62.596 17.546 1.00 44.95 C ATOM 1749 CE1 TYR A 488 85.553 60.755 15.532 1.00 47.32 C ATOM 1750 CE2 TYR A 488 84.866 62.666 16.818 1.00 46.80 C ATOM 1751 CZ TYR A 488 84.617 61.737 15.819 1.00 54.28 C ATOM 1752 OH TYR A 488 83.439 61.784 15.131 1.00 54.55 O ATOM 1753 HH TYR A 488 83.421 61.057 14.459 1.00 0.00 H ATOM 1754 H TYR A 488 87.377 61.346 20.713 1.00 0.00 H ATOM 1755 N VAL A 489 90.419 59.245 19.491 1.00 41.29 N ATOM 1756 CA VAL A 489 91.797 59.087 19.975 1.00 41.37 C ATOM 1757 C VAL A 489 92.722 59.270 18.770 1.00 45.70 C ATOM 1758 O VAL A 489 92.751 58.422 17.886 1.00 46.61 O ATOM 1759 CB VAL A 489 92.040 57.758 20.733 1.00 44.50 C ATOM 1760 CG1 VAL A 489 93.506 57.646 21.173 1.00 43.77 C ATOM 1761 CG2 VAL A 489 91.119 57.661 21.943 1.00 44.12 C ATOM 1762 H VAL A 489 89.962 58.446 19.006 1.00 0.00 H ATOM 1763 N GLY A 490 93.441 60.386 18.736 1.00 41.73 N ATOM 1764 CA GLY A 490 94.303 60.710 17.607 1.00 40.34 C ATOM 1765 C GLY A 490 95.774 60.412 17.786 1.00 44.13 C ATOM 1766 O GLY A 490 96.242 60.126 18.892 1.00 44.01 O ATOM 1767 H GLY A 490 93.387 61.047 19.537 1.00 0.00 H ATOM 1768 N MET A 491 96.496 60.432 16.662 1.00 40.27 N ATOM 1769 CA MET A 491 97.956 60.302 16.592 1.00 39.89 C ATOM 1770 C MET A 491 98.447 61.238 15.483 1.00 43.85 C ATOM 1771 O MET A 491 97.618 61.751 14.723 1.00 41.80 O ATOM 1772 CB MET A 491 98.409 58.854 16.381 1.00 42.23 C ATOM 1773 CG MET A 491 98.212 58.348 14.980 1.00 44.56 C ATOM 1774 SD MET A 491 98.945 56.718 14.743 1.00 49.46 S ATOM 1775 CE MET A 491 100.596 57.158 14.432 1.00 46.10 C ATOM 1776 H MET A 491 95.982 60.549 15.765 1.00 0.00 H ATOM 1777 N CYS A 492 99.772 61.455 15.378 1.00 42.42 N ATOM 1778 CA CYS A 492 100.354 62.304 14.330 1.00 42.19 C ATOM 1779 C CYS A 492 99.893 61.862 12.949 1.00 45.24 C ATOM 1780 O CYS A 492 100.029 60.681 12.599 1.00 44.17 O ATOM 1781 CB CYS A 492 101.880 62.355 14.416 1.00 43.26 C ATOM 1782 SG CYS A 492 102.646 63.609 13.340 1.00 47.11 S ATOM 1783 H CYS A 492 100.408 61.004 16.066 1.00 0.00 H ATOM 1784 N PHE A 493 99.301 62.824 12.197 1.00 41.74 N ATOM 1785 CA PHE A 493 98.809 62.722 10.818 1.00 41.29 C ATOM 1786 C PHE A 493 97.465 61.990 10.644 1.00 44.96 C ATOM 1787 O PHE A 493 96.968 61.981 9.522 1.00 44.77 O ATOM 1788 CB PHE A 493 99.872 62.102 9.856 1.00 43.75 C ATOM 1789 CG PHE A 493 101.265 62.692 9.862 1.00 45.30 C ATOM 1790 CD1 PHE A 493 101.458 64.067 9.752 1.00 47.73 C ATOM 1791 CD2 PHE A 493 102.387 61.865 9.836 1.00 47.63 C ATOM 1792 CE1 PHE A 493 102.753 64.601 9.658 1.00 49.00 C ATOM 1793 CE2 PHE A 493 103.678 62.400 9.760 1.00 50.14 C ATOM 1794 CZ PHE A 493 103.852 63.761 9.674 1.00 48.29 C ATOM 1795 H PHE A 493 99.181 63.750 12.655 1.00 0.00 H ATOM 1796 N SER A 494 96.870 61.391 11.706 1.00 42.06 N ATOM 1797 CA SER A 494 95.550 60.733 11.588 1.00 40.12 C ATOM 1798 C SER A 494 94.550 61.836 11.235 1.00 43.36 C ATOM 1799 O SER A 494 94.677 62.959 11.731 1.00 41.97 O ATOM 1800 CB SER A 494 95.177 59.940 12.844 1.00 38.42 C ATOM 1801 OG SER A 494 94.833 60.784 13.930 1.00 43.20 O ATOM 1802 HG SER A 494 95.603 61.366 14.151 1.00 0.00 H ATOM 1803 H SER A 494 97.354 61.394 12.626 1.00 0.00 H ATOM 1804 N SER A 495 93.660 61.585 10.273 1.00 41.07 N ATOM 1805 CA SER A 495 92.903 62.722 9.792 1.00 41.68 C ATOM 1806 C SER A 495 91.435 62.506 9.522 1.00 43.45 C ATOM 1807 O SER A 495 90.940 61.394 9.447 1.00 42.46 O ATOM 1808 CB SER A 495 93.579 63.275 8.524 1.00 46.20 C ATOM 1809 OG SER A 495 93.669 62.268 7.542 1.00 55.21 O ATOM 1810 HG SER A 495 94.105 62.636 6.733 1.00 0.00 H ATOM 1811 H SER A 495 93.518 60.628 9.891 1.00 0.00 H ATOM 1812 N PHE A 496 90.732 63.612 9.417 1.00 41.32 N ATOM 1813 CA PHE A 496 89.312 63.605 9.079 1.00 40.24 C ATOM 1814 C PHE A 496 89.206 64.262 7.716 1.00 43.61 C ATOM 1815 O PHE A 496 89.735 65.356 7.505 1.00 41.62 O ATOM 1816 CB PHE A 496 88.410 64.242 10.179 1.00 40.01 C ATOM 1817 CG PHE A 496 88.806 65.584 10.777 1.00 39.55 C ATOM 1818 CD1 PHE A 496 89.888 65.685 11.652 1.00 42.00 C ATOM 1819 CD2 PHE A 496 88.034 66.721 10.547 1.00 39.57 C ATOM 1820 CE1 PHE A 496 90.225 66.914 12.250 1.00 42.30 C ATOM 1821 CE2 PHE A 496 88.372 67.949 11.134 1.00 41.98 C ATOM 1822 CZ PHE A 496 89.481 68.043 11.970 1.00 40.54 C ATOM 1823 H PHE A 496 91.204 64.524 9.581 1.00 0.00 H ATOM 1824 N CYS A 497 88.593 63.545 6.773 1.00 42.62 N ATOM 1825 CA CYS A 497 88.392 63.971 5.389 1.00 43.57 C ATOM 1826 C CYS A 497 87.381 65.084 5.295 1.00 42.45 C ATOM 1827 O CYS A 497 86.620 65.282 6.242 1.00 41.16 O ATOM 1828 CB CYS A 497 87.969 62.777 4.539 1.00 46.36 C ATOM 1829 SG CYS A 497 89.242 61.506 4.381 1.00 52.11 S ATOM 1830 H CYS A 497 88.229 62.609 7.044 1.00 0.00 H ATOM 1831 N TRP A 498 87.361 65.807 4.160 1.00 38.11 N ATOM 1832 CA TRP A 498 86.386 66.876 3.924 1.00 38.32 C ATOM 1833 C TRP A 498 84.952 66.333 3.993 1.00 42.67 C ATOM 1834 O TRP A 498 84.622 65.357 3.316 1.00 41.38 O ATOM 1835 CB TRP A 498 86.591 67.517 2.550 1.00 36.99 C ATOM 1836 CG TRP A 498 87.759 68.434 2.496 1.00 37.69 C ATOM 1837 CD1 TRP A 498 88.966 68.185 1.915 1.00 40.26 C ATOM 1838 CD2 TRP A 498 87.845 69.752 3.064 1.00 37.30 C ATOM 1839 NE1 TRP A 498 89.794 69.262 2.079 1.00 40.12 N ATOM 1840 CE2 TRP A 498 89.120 70.255 2.746 1.00 40.71 C ATOM 1841 CE3 TRP A 498 86.943 70.579 3.763 1.00 38.26 C ATOM 1842 CZ2 TRP A 498 89.537 71.537 3.130 1.00 39.98 C ATOM 1843 CZ3 TRP A 498 87.350 71.854 4.130 1.00 39.22 C ATOM 1844 CH2 TRP A 498 88.626 72.327 3.797 1.00 40.07 C ATOM 1845 HE1 TRP A 498 90.779 69.319 1.750 1.00 0.00 H ATOM 1846 H TRP A 498 88.064 65.599 3.422 1.00 0.00 H ATOM 1847 N HIS A 499 84.114 66.949 4.833 1.00 40.14 N ATOM 1848 CA HIS A 499 82.708 66.541 4.969 1.00 39.12 C ATOM 1849 C HIS A 499 81.888 67.640 5.621 1.00 41.40 C ATOM 1850 O HIS A 499 82.419 68.573 6.212 1.00 40.79 O ATOM 1851 CB HIS A 499 82.600 65.264 5.848 1.00 40.25 C ATOM 1852 CG HIS A 499 82.992 65.516 7.275 1.00 43.58 C ATOM 1853 ND1 HIS A 499 84.317 65.748 7.633 1.00 46.20 N ATOM 1854 CD2 HIS A 499 82.225 65.603 8.379 1.00 46.27 C ATOM 1855 CE1 HIS A 499 84.313 65.958 8.939 1.00 45.54 C ATOM 1856 NE2 HIS A 499 83.078 65.893 9.431 1.00 46.49 N ATOM 1857 H HIS A 499 84.467 67.741 5.408 1.00 0.00 H ATOM 1858 N ILE A 500 80.582 67.459 5.587 1.00 40.29 N ATOM 1859 CA ILE A 500 79.595 68.269 6.299 1.00 40.15 C ATOM 1860 C ILE A 500 78.821 67.305 7.177 1.00 42.50 C ATOM 1861 O ILE A 500 78.817 66.100 6.921 1.00 39.80 O ATOM 1862 CB ILE A 500 78.666 69.112 5.391 1.00 42.63 C ATOM 1863 CG1 ILE A 500 77.982 68.245 4.296 1.00 42.84 C ATOM 1864 CG2 ILE A 500 79.420 70.314 4.821 1.00 41.15 C ATOM 1865 CD1 ILE A 500 77.181 69.034 3.250 1.00 42.20 C ATOM 1866 H ILE A 500 80.225 66.675 5.005 1.00 0.00 H ATOM 1867 N GLU A 501 78.167 67.826 8.203 1.00 42.44 N ATOM 1868 CA GLU A 501 77.380 66.994 9.122 1.00 41.13 C ATOM 1869 C GLU A 501 76.079 66.552 8.523 1.00 47.03 C ATOM 1870 O GLU A 501 75.554 67.192 7.607 1.00 46.29 O ATOM 1871 CB GLU A 501 77.140 67.710 10.458 1.00 41.58 C ATOM 1872 CG GLU A 501 78.416 68.163 11.167 1.00 47.15 C ATOM 1873 CD GLU A 501 79.500 67.114 11.315 1.00 54.24 C ATOM 1874 OE1 GLU A 501 79.225 66.038 11.894 1.00 46.56 O ATOM 1875 OE2 GLU A 501 80.621 67.358 10.819 1.00 59.06 O ATOM 1876 H GLU A 501 78.212 68.853 8.363 1.00 0.00 H ATOM 1877 N ASP A 502 75.569 65.425 9.034 1.00 44.99 N ATOM 1878 CA ASP A 502 74.285 64.870 8.660 1.00 46.91 C ATOM 1879 C ASP A 502 73.212 65.894 8.965 1.00 46.44 C ATOM 1880 O ASP A 502 73.277 66.549 10.002 1.00 43.72 O ATOM 1881 CB ASP A 502 74.019 63.581 9.454 1.00 50.72 C ATOM 1882 CG ASP A 502 74.832 62.397 8.971 1.00 62.36 C ATOM 1883 OD1 ASP A 502 75.314 62.442 7.824 1.00 63.07 O ATOM 1884 OD2 ASP A 502 74.995 61.431 9.750 1.00 72.30 O ATOM 1885 H ASP A 502 76.131 64.915 9.745 1.00 0.00 H ATOM 1886 N HIS A 503 72.294 66.101 8.000 1.00 43.54 N ATOM 1887 CA HIS A 503 71.174 67.052 8.079 1.00 43.51 C ATOM 1888 C HIS A 503 71.639 68.499 8.211 1.00 45.98 C ATOM 1889 O HIS A 503 70.881 69.354 8.667 1.00 45.84 O ATOM 1890 CB HIS A 503 70.180 66.654 9.180 1.00 44.28 C ATOM 1891 CG HIS A 503 69.394 65.443 8.816 1.00 47.57 C ATOM 1892 ND1 HIS A 503 68.056 65.529 8.497 1.00 50.61 N ATOM 1893 CD2 HIS A 503 69.792 64.157 8.703 1.00 48.61 C ATOM 1894 CE1 HIS A 503 67.678 64.296 8.206 1.00 50.82 C ATOM 1895 NE2 HIS A 503 68.683 63.435 8.331 1.00 50.20 N ATOM 1896 H HIS A 503 72.385 65.542 7.127 1.00 0.00 H ATOM 1897 N TRP A 504 72.855 68.774 7.713 1.00 42.52 N ATOM 1898 CA TRP A 504 73.552 70.065 7.783 1.00 41.96 C ATOM 1899 C TRP A 504 73.561 70.603 9.232 1.00 45.43 C ATOM 1900 O TRP A 504 73.432 71.808 9.442 1.00 43.40 O ATOM 1901 CB TRP A 504 72.975 71.109 6.784 1.00 40.96 C ATOM 1902 CG TRP A 504 73.058 70.736 5.329 1.00 40.94 C ATOM 1903 CD1 TRP A 504 73.798 69.734 4.775 1.00 43.03 C ATOM 1904 CD2 TRP A 504 72.377 71.382 4.243 1.00 41.14 C ATOM 1905 NE1 TRP A 504 73.607 69.701 3.417 1.00 43.15 N ATOM 1906 CE2 TRP A 504 72.737 70.701 3.060 1.00 45.06 C ATOM 1907 CE3 TRP A 504 71.494 72.477 4.155 1.00 43.07 C ATOM 1908 CZ2 TRP A 504 72.232 71.062 1.795 1.00 44.54 C ATOM 1909 CZ3 TRP A 504 71.030 72.866 2.902 1.00 45.55 C ATOM 1910 CH2 TRP A 504 71.382 72.152 1.740 1.00 45.88 C ATOM 1911 HE1 TRP A 504 74.051 69.026 2.762 1.00 0.00 H ATOM 1912 H TRP A 504 73.352 67.998 7.231 1.00 0.00 H ATOM 1913 N SER A 505 73.730 69.709 10.233 1.00 42.88 N ATOM 1914 CA SER A 505 73.744 70.144 11.631 1.00 41.86 C ATOM 1915 C SER A 505 75.032 70.842 12.007 1.00 45.90 C ATOM 1916 O SER A 505 76.022 70.835 11.252 1.00 43.76 O ATOM 1917 CB SER A 505 73.471 68.977 12.579 1.00 44.61 C ATOM 1918 OG SER A 505 74.509 68.014 12.578 1.00 53.10 O ATOM 1919 HG SER A 505 74.614 67.645 11.666 1.00 0.00 H ATOM 1920 H SER A 505 73.851 68.701 10.007 1.00 0.00 H ATOM 1921 N TYR A 506 75.013 71.468 13.186 1.00 42.45 N ATOM 1922 CA TYR A 506 76.201 72.071 13.767 1.00 40.68 C ATOM 1923 C TYR A 506 76.985 70.929 14.397 1.00 42.61 C ATOM 1924 O TYR A 506 76.444 69.863 14.663 1.00 42.09 O ATOM 1925 CB TYR A 506 75.817 72.940 14.990 1.00 42.73 C ATOM 1926 CG TYR A 506 75.238 74.309 14.737 1.00 46.02 C ATOM 1927 CD1 TYR A 506 73.888 74.470 14.440 1.00 47.56 C ATOM 1928 CD2 TYR A 506 76.002 75.456 14.941 1.00 48.00 C ATOM 1929 CE1 TYR A 506 73.333 75.734 14.260 1.00 48.69 C ATOM 1930 CE2 TYR A 506 75.451 76.728 14.784 1.00 49.98 C ATOM 1931 CZ TYR A 506 74.116 76.862 14.442 1.00 55.89 C ATOM 1932 OH TYR A 506 73.575 78.116 14.277 1.00 59.64 O ATOM 1933 HH TYR A 506 73.660 78.625 15.122 1.00 0.00 H ATOM 1934 H TYR A 506 74.115 71.526 13.708 1.00 0.00 H ATOM 1935 N SER A 507 78.231 71.182 14.727 1.00 40.53 N ATOM 1936 CA SER A 507 78.981 70.278 15.583 1.00 39.96 C ATOM 1937 C SER A 507 79.833 71.094 16.507 1.00 42.77 C ATOM 1938 O SER A 507 80.186 72.222 16.190 1.00 42.40 O ATOM 1939 CB SER A 507 79.758 69.206 14.831 1.00 39.85 C ATOM 1940 OG SER A 507 80.949 69.676 14.238 1.00 44.83 O ATOM 1941 HG SER A 507 81.400 68.930 13.769 1.00 0.00 H ATOM 1942 H SER A 507 78.689 72.045 14.369 1.00 0.00 H ATOM 1943 N ILE A 508 80.099 70.545 17.670 1.00 40.32 N ATOM 1944 CA ILE A 508 80.942 71.122 18.702 1.00 39.90 C ATOM 1945 C ILE A 508 81.903 70.027 19.116 1.00 42.93 C ATOM 1946 O ILE A 508 81.487 68.897 19.399 1.00 41.80 O ATOM 1947 CB ILE A 508 80.132 71.763 19.871 1.00 43.66 C ATOM 1948 CG1 ILE A 508 81.083 72.398 20.926 1.00 44.03 C ATOM 1949 CG2 ILE A 508 79.120 70.794 20.480 1.00 42.98 C ATOM 1950 CD1 ILE A 508 80.412 73.289 21.924 1.00 48.27 C ATOM 1951 H ILE A 508 79.670 69.619 17.869 1.00 0.00 H ATOM 1952 N ASN A 509 83.222 70.330 19.063 1.00 39.44 N ATOM 1953 CA ASN A 509 84.340 69.423 19.390 1.00 38.75 C ATOM 1954 C ASN A 509 85.158 70.027 20.519 1.00 42.01 C ATOM 1955 O ASN A 509 85.560 71.190 20.455 1.00 41.51 O ATOM 1956 CB ASN A 509 85.268 69.178 18.140 1.00 34.60 C ATOM 1957 CG ASN A 509 86.484 68.232 18.310 1.00 41.24 C ATOM 1958 OD1 ASN A 509 87.467 68.521 19.032 1.00 26.55 O ATOM 1959 ND2 ASN A 509 86.540 67.158 17.488 1.00 26.45 N ATOM 1960 HD22 ASN A 509 85.724 66.918 16.889 1.00 0.00 H ATOM 1961 HD21 ASN A 509 87.399 66.572 17.455 1.00 0.00 H ATOM 1962 H ASN A 509 83.471 71.294 18.763 1.00 0.00 H ATOM 1963 N TYR A 510 85.430 69.225 21.531 1.00 38.83 N ATOM 1964 CA TYR A 510 86.287 69.610 22.646 1.00 38.57 C ATOM 1965 C TYR A 510 87.527 68.736 22.629 1.00 41.39 C ATOM 1966 O TYR A 510 87.400 67.517 22.578 1.00 40.84 O ATOM 1967 CB TYR A 510 85.559 69.449 23.997 1.00 39.10 C ATOM 1968 CG TYR A 510 86.363 69.959 25.180 1.00 38.78 C ATOM 1969 CD1 TYR A 510 86.662 71.316 25.312 1.00 41.03 C ATOM 1970 CD2 TYR A 510 86.810 69.089 26.175 1.00 37.93 C ATOM 1971 CE1 TYR A 510 87.331 71.805 26.427 1.00 41.38 C ATOM 1972 CE2 TYR A 510 87.496 69.569 27.299 1.00 39.65 C ATOM 1973 CZ TYR A 510 87.749 70.930 27.419 1.00 47.10 C ATOM 1974 OH TYR A 510 88.394 71.450 28.512 1.00 47.66 O ATOM 1975 HH TYR A 510 89.295 71.047 28.584 1.00 0.00 H ATOM 1976 H TYR A 510 85.013 68.272 21.533 1.00 0.00 H ATOM 1977 N LEU A 511 88.718 69.341 22.748 1.00 39.59 N ATOM 1978 CA LEU A 511 89.950 68.570 22.859 1.00 38.34 C ATOM 1979 C LEU A 511 90.253 68.478 24.348 1.00 41.77 C ATOM 1980 O LEU A 511 90.608 69.492 24.947 1.00 40.46 O ATOM 1981 CB LEU A 511 91.117 69.248 22.091 1.00 37.96 C ATOM 1982 CG LEU A 511 92.407 68.414 21.974 1.00 41.48 C ATOM 1983 CD1 LEU A 511 92.125 67.047 21.306 1.00 40.41 C ATOM 1984 CD2 LEU A 511 93.460 69.161 21.148 1.00 41.61 C ATOM 1985 H LEU A 511 88.763 70.380 22.761 1.00 0.00 H ATOM 1986 N HIS A 512 90.081 67.285 24.958 1.00 39.74 N ATOM 1987 CA HIS A 512 90.294 67.093 26.402 1.00 40.64 C ATOM 1988 C HIS A 512 91.768 67.239 26.799 1.00 48.08 C ATOM 1989 O HIS A 512 92.061 67.855 27.822 1.00 48.11 O ATOM 1990 CB HIS A 512 89.789 65.722 26.870 1.00 41.14 C ATOM 1991 CG HIS A 512 88.304 65.592 26.884 1.00 44.72 C ATOM 1992 ND1 HIS A 512 87.550 66.110 27.917 1.00 46.84 N ATOM 1993 CD2 HIS A 512 87.478 64.983 25.995 1.00 45.06 C ATOM 1994 CE1 HIS A 512 86.294 65.803 27.631 1.00 45.70 C ATOM 1995 NE2 HIS A 512 86.205 65.112 26.492 1.00 45.37 N ATOM 1996 H HIS A 512 89.786 66.469 24.384 1.00 0.00 H ATOM 1997 N TRP A 513 92.678 66.617 26.021 1.00 47.19 N ATOM 1998 CA TRP A 513 94.113 66.633 26.278 1.00 48.63 C ATOM 1999 C TRP A 513 94.924 66.206 25.063 1.00 46.08 C ATOM 2000 O TRP A 513 94.379 65.616 24.112 1.00 42.08 O ATOM 2001 CB TRP A 513 94.476 65.771 27.524 1.00 51.30 C ATOM 2002 CG TRP A 513 94.044 64.340 27.455 1.00 55.48 C ATOM 2003 CD1 TRP A 513 92.946 63.775 28.050 1.00 59.29 C ATOM 2004 CD2 TRP A 513 94.746 63.270 26.806 1.00 57.09 C ATOM 2005 NE1 TRP A 513 92.904 62.422 27.782 1.00 59.68 N ATOM 2006 CE2 TRP A 513 93.986 62.089 27.002 1.00 61.80 C ATOM 2007 CE3 TRP A 513 95.914 63.206 26.015 1.00 59.23 C ATOM 2008 CZ2 TRP A 513 94.351 60.863 26.429 1.00 62.27 C ATOM 2009 CZ3 TRP A 513 96.274 61.991 25.453 1.00 61.86 C ATOM 2010 CH2 TRP A 513 95.505 60.835 25.674 1.00 63.03 C ATOM 2011 HE1 TRP A 513 92.173 61.762 28.116 1.00 0.00 H ATOM 2012 H TRP A 513 92.336 66.095 25.189 1.00 0.00 H ATOM 2013 N GLY A 514 96.233 66.448 25.156 1.00 40.06 N ATOM 2014 CA GLY A 514 97.227 66.040 24.173 1.00 39.12 C ATOM 2015 C GLY A 514 97.619 67.108 23.187 1.00 42.56 C ATOM 2016 O GLY A 514 97.349 68.304 23.390 1.00 41.54 O ATOM 2017 H GLY A 514 96.568 66.967 25.993 1.00 0.00 H ATOM 2018 N GLU A 515 98.260 66.666 22.098 1.00 39.09 N ATOM 2019 CA GLU A 515 98.769 67.568 21.074 1.00 39.34 C ATOM 2020 C GLU A 515 97.645 68.181 20.237 1.00 41.85 C ATOM 2021 O GLU A 515 96.533 67.667 20.238 1.00 39.75 O ATOM 2022 CB GLU A 515 99.857 66.890 20.231 1.00 41.71 C ATOM 2023 CG GLU A 515 101.091 66.696 21.102 1.00 52.68 C ATOM 2024 CD GLU A 515 102.347 66.188 20.433 1.00 64.32 C ATOM 2025 OE1 GLU A 515 102.457 64.957 20.225 1.00 57.46 O ATOM 2026 OE2 GLU A 515 103.274 67.005 20.241 1.00 62.92 O ATOM 2027 H GLU A 515 98.399 65.642 21.979 1.00 0.00 H ATOM 2028 N PRO A 516 97.882 69.347 19.601 1.00 39.64 N ATOM 2029 CA PRO A 516 96.779 70.023 18.897 1.00 37.43 C ATOM 2030 C PRO A 516 96.159 69.281 17.709 1.00 40.63 C ATOM 2031 O PRO A 516 96.698 68.306 17.177 1.00 40.00 O ATOM 2032 CB PRO A 516 97.390 71.366 18.479 1.00 39.41 C ATOM 2033 CG PRO A 516 98.602 71.551 19.378 1.00 44.22 C ATOM 2034 CD PRO A 516 99.116 70.178 19.609 1.00 39.96 C ATOM 2035 N LYS A 517 94.943 69.700 17.374 1.00 37.13 N ATOM 2036 CA LYS A 517 94.199 69.201 16.216 1.00 36.44 C ATOM 2037 C LYS A 517 94.144 70.354 15.216 1.00 38.83 C ATOM 2038 O LYS A 517 93.684 71.435 15.565 1.00 38.87 O ATOM 2039 CB LYS A 517 92.788 68.780 16.631 1.00 36.74 C ATOM 2040 CG LYS A 517 92.017 68.050 15.522 1.00 38.32 C ATOM 2041 CD LYS A 517 90.553 67.704 15.955 1.00 43.21 C ATOM 2042 CE LYS A 517 90.459 66.738 17.123 1.00 39.80 C ATOM 2043 NZ LYS A 517 90.783 65.348 16.714 1.00 45.12 N ATOM 2044 HZ1 LYS A 517 90.115 65.040 15.979 1.00 0.00 H ATOM 2045 HZ2 LYS A 517 91.752 65.315 16.339 1.00 0.00 H ATOM 2046 HZ3 LYS A 517 90.708 64.719 17.539 1.00 0.00 H ATOM 2047 H LYS A 517 94.494 70.425 17.969 1.00 0.00 H ATOM 2048 N THR A 518 94.639 70.149 14.008 1.00 36.17 N ATOM 2049 CA THR A 518 94.600 71.196 12.971 1.00 36.19 C ATOM 2050 C THR A 518 93.309 71.062 12.180 1.00 40.21 C ATOM 2051 O THR A 518 92.990 69.973 11.724 1.00 40.32 O ATOM 2052 CB THR A 518 95.841 71.108 12.065 1.00 37.45 C ATOM 2053 OG1 THR A 518 96.978 71.372 12.882 1.00 38.52 O ATOM 2054 CG2 THR A 518 95.794 72.110 10.892 1.00 33.95 C ATOM 2055 HG1 THR A 518 96.897 72.277 13.276 1.00 0.00 H ATOM 2056 H THR A 518 95.066 69.228 13.784 1.00 0.00 H ATOM 2057 N TRP A 519 92.603 72.173 11.983 1.00 37.95 N ATOM 2058 CA TRP A 519 91.342 72.235 11.256 1.00 37.56 C ATOM 2059 C TRP A 519 91.408 73.137 10.037 1.00 41.24 C ATOM 2060 O TRP A 519 92.082 74.163 10.068 1.00 40.41 O ATOM 2061 CB TRP A 519 90.254 72.819 12.175 1.00 36.04 C ATOM 2062 CG TRP A 519 89.824 71.937 13.311 1.00 36.95 C ATOM 2063 CD1 TRP A 519 90.506 71.693 14.473 1.00 39.72 C ATOM 2064 CD2 TRP A 519 88.536 71.317 13.460 1.00 36.50 C ATOM 2065 NE1 TRP A 519 89.741 70.921 15.318 1.00 39.20 N ATOM 2066 CE2 TRP A 519 88.534 70.653 14.707 1.00 40.55 C ATOM 2067 CE3 TRP A 519 87.412 71.183 12.614 1.00 37.70 C ATOM 2068 CZ2 TRP A 519 87.449 69.886 15.139 1.00 40.12 C ATOM 2069 CZ3 TRP A 519 86.316 70.471 13.063 1.00 39.34 C ATOM 2070 CH2 TRP A 519 86.327 69.854 14.326 1.00 40.34 C ATOM 2071 HE1 TRP A 519 90.027 70.593 16.263 1.00 0.00 H ATOM 2072 H TRP A 519 92.978 73.060 12.376 1.00 0.00 H ATOM 2073 N TYR A 520 90.623 72.786 9.004 1.00 37.51 N ATOM 2074 CA TYR A 520 90.358 73.597 7.819 1.00 37.75 C ATOM 2075 C TYR A 520 88.842 73.643 7.692 1.00 42.02 C ATOM 2076 O TYR A 520 88.190 72.625 7.884 1.00 39.69 O ATOM 2077 CB TYR A 520 91.031 73.058 6.541 1.00 38.81 C ATOM 2078 CG TYR A 520 92.515 72.830 6.738 1.00 40.82 C ATOM 2079 CD1 TYR A 520 93.405 73.903 6.788 1.00 43.43 C ATOM 2080 CD2 TYR A 520 93.018 71.555 6.966 1.00 41.29 C ATOM 2081 CE1 TYR A 520 94.763 73.705 7.020 1.00 43.40 C ATOM 2082 CE2 TYR A 520 94.375 71.345 7.207 1.00 42.27 C ATOM 2083 CZ TYR A 520 95.245 72.424 7.227 1.00 46.40 C ATOM 2084 OH TYR A 520 96.591 72.217 7.409 1.00 43.49 O ATOM 2085 HH TYR A 520 97.062 73.088 7.397 1.00 0.00 H ATOM 2086 H TYR A 520 90.164 71.854 9.053 1.00 0.00 H ATOM 2087 N GLY A 521 88.300 74.839 7.474 1.00 40.44 N ATOM 2088 CA GLY A 521 86.866 75.069 7.380 1.00 39.65 C ATOM 2089 C GLY A 521 86.499 75.968 6.221 1.00 43.78 C ATOM 2090 O GLY A 521 87.273 76.850 5.811 1.00 41.76 O ATOM 2091 H GLY A 521 88.936 75.654 7.365 1.00 0.00 H ATOM 2092 N VAL A 522 85.305 75.719 5.680 1.00 41.01 N ATOM 2093 CA VAL A 522 84.749 76.436 4.532 1.00 40.64 C ATOM 2094 C VAL A 522 83.348 76.916 4.937 1.00 44.54 C ATOM 2095 O VAL A 522 82.562 76.118 5.427 1.00 42.98 O ATOM 2096 CB VAL A 522 84.734 75.537 3.256 1.00 42.97 C ATOM 2097 CG1 VAL A 522 83.992 76.203 2.089 1.00 43.13 C ATOM 2098 CG2 VAL A 522 86.146 75.123 2.847 1.00 41.53 C ATOM 2099 H VAL A 522 84.730 74.963 6.104 1.00 0.00 H ATOM 2100 N PRO A 523 83.001 78.214 4.757 1.00 43.52 N ATOM 2101 CA PRO A 523 81.641 78.657 5.139 1.00 43.12 C ATOM 2102 C PRO A 523 80.535 77.931 4.356 1.00 44.91 C ATOM 2103 O PRO A 523 80.755 77.461 3.233 1.00 42.47 O ATOM 2104 CB PRO A 523 81.668 80.150 4.838 1.00 45.92 C ATOM 2105 CG PRO A 523 82.779 80.311 3.791 1.00 50.24 C ATOM 2106 CD PRO A 523 83.807 79.327 4.206 1.00 44.58 C ATOM 2107 N GLY A 524 79.365 77.811 4.979 1.00 42.64 N ATOM 2108 CA GLY A 524 78.194 77.162 4.390 1.00 42.00 C ATOM 2109 C GLY A 524 77.805 77.700 3.022 1.00 46.91 C ATOM 2110 O GLY A 524 77.393 76.921 2.158 1.00 45.77 O ATOM 2111 H GLY A 524 79.278 78.201 5.939 1.00 0.00 H ATOM 2112 N TYR A 525 77.985 79.019 2.790 1.00 45.11 N ATOM 2113 CA TYR A 525 77.640 79.647 1.509 1.00 47.06 C ATOM 2114 C TYR A 525 78.491 79.145 0.334 1.00 51.49 C ATOM 2115 O TYR A 525 78.066 79.270 -0.816 1.00 53.18 O ATOM 2116 CB TYR A 525 77.649 81.201 1.590 1.00 49.33 C ATOM 2117 CG TYR A 525 79.022 81.848 1.643 1.00 50.44 C ATOM 2118 CD1 TYR A 525 79.772 82.039 0.483 1.00 52.36 C ATOM 2119 CD2 TYR A 525 79.522 82.371 2.831 1.00 50.54 C ATOM 2120 CE1 TYR A 525 81.026 82.651 0.524 1.00 52.39 C ATOM 2121 CE2 TYR A 525 80.748 83.031 2.874 1.00 50.90 C ATOM 2122 CZ TYR A 525 81.508 83.146 1.724 1.00 55.14 C ATOM 2123 OH TYR A 525 82.729 83.766 1.781 1.00 56.21 O ATOM 2124 HH TYR A 525 83.315 83.280 2.414 1.00 0.00 H ATOM 2125 H TYR A 525 78.383 79.611 3.547 1.00 0.00 H ATOM 2126 N ALA A 526 79.690 78.602 0.620 1.00 46.95 N ATOM 2127 CA ALA A 526 80.619 78.116 -0.412 1.00 45.46 C ATOM 2128 C ALA A 526 80.565 76.586 -0.602 1.00 47.74 C ATOM 2129 O ALA A 526 81.414 76.031 -1.298 1.00 48.44 O ATOM 2130 CB ALA A 526 82.043 78.573 -0.080 1.00 44.80 C ATOM 2131 H ALA A 526 79.972 78.523 1.618 1.00 0.00 H ATOM 2132 N ALA A 527 79.594 75.909 0.035 1.00 43.89 N ATOM 2133 CA ALA A 527 79.444 74.443 -0.028 1.00 43.15 C ATOM 2134 C ALA A 527 79.363 73.865 -1.454 1.00 48.23 C ATOM 2135 O ALA A 527 80.062 72.899 -1.762 1.00 45.64 O ATOM 2136 CB ALA A 527 78.234 74.006 0.779 1.00 43.33 C ATOM 2137 H ALA A 527 78.911 76.449 0.604 1.00 0.00 H ATOM 2138 N GLU A 528 78.529 74.460 -2.317 1.00 48.34 N ATOM 2139 CA GLU A 528 78.364 73.976 -3.689 1.00 50.49 C ATOM 2140 C GLU A 528 79.578 74.311 -4.554 1.00 55.20 C ATOM 2141 O GLU A 528 79.928 73.531 -5.441 1.00 54.40 O ATOM 2142 CB GLU A 528 77.040 74.446 -4.308 1.00 53.60 C ATOM 2143 CG GLU A 528 75.844 73.989 -3.485 1.00 69.56 C ATOM 2144 CD GLU A 528 74.480 73.951 -4.153 1.00 94.37 C ATOM 2145 OE1 GLU A 528 74.227 74.784 -5.054 1.00102.84 O ATOM 2146 OE2 GLU A 528 73.643 73.116 -3.731 1.00 72.92 O ATOM 2147 H GLU A 528 77.984 75.288 -2.004 1.00 0.00 H ATOM 2148 N GLN A 529 80.263 75.429 -4.241 1.00 52.20 N ATOM 2149 CA GLN A 529 81.503 75.823 -4.907 1.00 52.13 C ATOM 2150 C GLN A 529 82.569 74.737 -4.609 1.00 52.78 C ATOM 2151 O GLN A 529 83.226 74.269 -5.537 1.00 51.96 O ATOM 2152 CB GLN A 529 81.954 77.195 -4.383 1.00 54.07 C ATOM 2153 CG GLN A 529 82.920 77.927 -5.292 1.00 75.21 C ATOM 2154 CD GLN A 529 83.433 79.233 -4.724 1.00 93.23 C ATOM 2155 OE1 GLN A 529 82.961 79.758 -3.701 1.00 83.93 O ATOM 2156 NE2 GLN A 529 84.413 79.798 -5.406 1.00 89.91 N ATOM 2157 HE22 GLN A 529 84.788 79.335 -6.258 1.00 0.00 H ATOM 2158 HE21 GLN A 529 84.810 80.706 -5.090 1.00 0.00 H ATOM 2159 H GLN A 529 79.891 76.042 -3.488 1.00 0.00 H ATOM 2160 N LEU A 530 82.692 74.303 -3.323 1.00 47.22 N ATOM 2161 CA LEU A 530 83.644 73.255 -2.935 1.00 46.19 C ATOM 2162 C LEU A 530 83.317 71.934 -3.629 1.00 51.08 C ATOM 2163 O LEU A 530 84.226 71.266 -4.111 1.00 50.66 O ATOM 2164 CB LEU A 530 83.712 73.065 -1.414 1.00 45.12 C ATOM 2165 CG LEU A 530 84.604 71.903 -0.896 1.00 48.27 C ATOM 2166 CD1 LEU A 530 85.258 72.264 0.417 1.00 46.98 C ATOM 2167 CD2 LEU A 530 83.810 70.584 -0.765 1.00 47.89 C ATOM 2168 H LEU A 530 82.090 74.730 -2.590 1.00 0.00 H ATOM 2169 N GLU A 531 82.029 71.553 -3.659 1.00 48.48 N ATOM 2170 CA GLU A 531 81.578 70.304 -4.281 1.00 48.76 C ATOM 2171 C GLU A 531 81.897 70.241 -5.779 1.00 53.19 C ATOM 2172 O GLU A 531 82.302 69.187 -6.273 1.00 52.90 O ATOM 2173 CB GLU A 531 80.097 70.083 -4.021 1.00 49.85 C ATOM 2174 CG GLU A 531 79.822 69.691 -2.582 1.00 56.82 C ATOM 2175 CD GLU A 531 78.368 69.799 -2.161 1.00 61.26 C ATOM 2176 OE1 GLU A 531 77.536 70.260 -2.974 1.00 66.65 O ATOM 2177 OE2 GLU A 531 78.064 69.445 -1.002 1.00 51.79 O ATOM 2178 H GLU A 531 81.318 72.173 -3.220 1.00 0.00 H ATOM 2179 N ASN A 532 81.755 71.378 -6.478 1.00 50.41 N ATOM 2180 CA ASN A 532 82.071 71.515 -7.894 1.00 51.83 C ATOM 2181 C ASN A 532 83.566 71.320 -8.175 1.00 56.04 C ATOM 2182 O ASN A 532 83.919 70.698 -9.184 1.00 56.16 O ATOM 2183 CB ASN A 532 81.566 72.852 -8.429 1.00 54.37 C ATOM 2184 CG ASN A 532 80.058 72.911 -8.510 1.00 73.30 C ATOM 2185 OD1 ASN A 532 79.367 71.884 -8.584 1.00 69.86 O ATOM 2186 ND2 ASN A 532 79.511 74.110 -8.439 1.00 62.32 N ATOM 2187 HD22 ASN A 532 80.115 74.954 -8.378 1.00 0.00 H ATOM 2188 HD21 ASN A 532 78.476 74.210 -8.444 1.00 0.00 H ATOM 2189 H ASN A 532 81.396 72.216 -5.977 1.00 0.00 H ATOM 2190 N VAL A 533 84.436 71.812 -7.266 1.00 50.78 N ATOM 2191 CA VAL A 533 85.893 71.641 -7.365 1.00 50.36 C ATOM 2192 C VAL A 533 86.219 70.149 -7.179 1.00 55.30 C ATOM 2193 O VAL A 533 87.004 69.591 -7.947 1.00 53.68 O ATOM 2194 CB VAL A 533 86.648 72.542 -6.343 1.00 52.92 C ATOM 2195 CG1 VAL A 533 88.153 72.244 -6.316 1.00 52.45 C ATOM 2196 CG2 VAL A 533 86.391 74.016 -6.630 1.00 53.15 C ATOM 2197 H VAL A 533 84.055 72.339 -6.454 1.00 0.00 H ATOM 2198 N MET A 534 85.604 69.514 -6.168 1.00 55.43 N ATOM 2199 CA MET A 534 85.809 68.101 -5.850 1.00 58.47 C ATOM 2200 C MET A 534 85.319 67.158 -6.960 1.00 63.12 C ATOM 2201 O MET A 534 85.981 66.155 -7.216 1.00 62.59 O ATOM 2202 CB MET A 534 85.210 67.740 -4.483 1.00 61.73 C ATOM 2203 CG MET A 534 85.887 68.457 -3.323 1.00 67.82 C ATOM 2204 SD MET A 534 86.443 67.476 -1.879 1.00 74.82 S ATOM 2205 CE MET A 534 85.548 65.917 -2.131 1.00 72.01 C ATOM 2206 H MET A 534 84.944 70.058 -5.577 1.00 0.00 H ATOM 2207 N LYS A 535 84.197 67.497 -7.640 1.00 59.98 N ATOM 2208 CA LYS A 535 83.649 66.712 -8.754 1.00 61.12 C ATOM 2209 C LYS A 535 84.643 66.636 -9.931 1.00 66.57 C ATOM 2210 O LYS A 535 84.803 65.570 -10.523 1.00 67.01 O ATOM 2211 CB LYS A 535 82.307 67.292 -9.227 1.00 63.38 C ATOM 2212 CG LYS A 535 81.154 66.306 -9.146 1.00 75.59 C ATOM 2213 H LYS A 535 83.695 68.363 -7.357 1.00 0.00 H ATOM 2214 N LYS A 536 85.305 67.757 -10.258 1.00 63.93 N ATOM 2215 CA LYS A 536 86.289 67.835 -11.341 1.00 66.18 C ATOM 2216 C LYS A 536 87.545 67.003 -11.054 1.00 71.67 C ATOM 2217 O LYS A 536 87.948 66.186 -11.880 1.00 72.05 O ATOM 2218 CB LYS A 536 86.690 69.295 -11.613 1.00 69.17 C ATOM 2219 CG LYS A 536 85.684 70.087 -12.418 1.00 85.32 C ATOM 2220 CD LYS A 536 86.253 71.446 -12.781 1.00 97.38 C ATOM 2221 H LYS A 536 85.108 68.620 -9.711 1.00 0.00 H ATOM 2222 N LEU A 537 88.135 67.202 -9.871 1.00 69.31 N ATOM 2223 CA LEU A 537 89.371 66.571 -9.419 1.00 70.03 C ATOM 2224 C LEU A 537 89.230 65.109 -8.979 1.00 76.37 C ATOM 2225 O LEU A 537 90.148 64.322 -9.212 1.00 77.70 O ATOM 2226 CB LEU A 537 89.986 67.426 -8.304 1.00 69.10 C ATOM 2227 CG LEU A 537 90.853 68.628 -8.753 1.00 74.76 C ATOM 2228 CD1 LEU A 537 90.046 69.730 -9.448 1.00 76.06 C ATOM 2229 CD2 LEU A 537 91.503 69.242 -7.595 1.00 75.66 C ATOM 2230 H LEU A 537 87.673 67.864 -9.216 1.00 0.00 H ATOM 2231 N ALA A 538 88.105 64.740 -8.349 1.00 72.87 N ATOM 2232 CA ALA A 538 87.865 63.375 -7.873 1.00 73.05 C ATOM 2233 C ALA A 538 86.419 62.929 -8.209 1.00 78.94 C ATOM 2234 O ALA A 538 85.549 62.946 -7.327 1.00 76.58 O ATOM 2235 CB ALA A 538 88.136 63.297 -6.376 1.00 72.30 C ATOM 2236 H ALA A 538 87.368 65.457 -8.191 1.00 0.00 H ATOM 2237 N PRO A 539 86.135 62.550 -9.491 1.00 79.07 N ATOM 2238 CA PRO A 539 84.750 62.179 -9.863 1.00 80.06 C ATOM 2239 C PRO A 539 84.220 60.897 -9.228 1.00 85.86 C ATOM 2240 O PRO A 539 83.014 60.797 -8.981 1.00 84.95 O ATOM 2241 CB PRO A 539 84.793 62.085 -11.397 1.00 83.08 C ATOM 2242 CG PRO A 539 86.104 62.688 -11.805 1.00 87.38 C ATOM 2243 CD PRO A 539 87.034 62.474 -10.660 1.00 81.78 C ATOM 2244 N GLU A 540 85.127 59.938 -8.943 1.00 84.75 N ATOM 2245 CA GLU A 540 84.839 58.634 -8.327 1.00 86.25 C ATOM 2246 C GLU A 540 84.073 58.728 -6.994 1.00 91.41 C ATOM 2247 O GLU A 540 83.264 57.852 -6.689 1.00 92.11 O ATOM 2248 CB GLU A 540 86.127 57.798 -8.172 1.00 89.56 C ATOM 2249 CG GLU A 540 87.283 58.508 -7.463 1.00104.93 C ATOM 2250 H GLU A 540 86.119 60.140 -9.181 1.00 0.00 H ATOM 2251 N LEU A 541 84.316 59.803 -6.226 1.00 87.53 N ATOM 2252 CA LEU A 541 83.695 60.095 -4.932 1.00 86.38 C ATOM 2253 C LEU A 541 82.222 60.488 -5.021 1.00 90.14 C ATOM 2254 O LEU A 541 81.519 60.431 -4.007 1.00 89.10 O ATOM 2255 CB LEU A 541 84.447 61.274 -4.303 1.00 85.18 C ATOM 2256 CG LEU A 541 85.502 60.959 -3.278 1.00 89.26 C ATOM 2257 CD1 LEU A 541 86.855 60.713 -3.938 1.00 89.85 C ATOM 2258 CD2 LEU A 541 85.605 62.093 -2.303 1.00 90.90 C ATOM 2259 H LEU A 541 85.009 60.491 -6.583 1.00 0.00 H ATOM 2260 N PHE A 542 81.776 60.951 -6.204 1.00 88.04 N ATOM 2261 CA PHE A 542 80.427 61.478 -6.417 1.00 88.45 C ATOM 2262 C PHE A 542 79.414 60.465 -6.976 1.00 97.59 C ATOM 2263 O PHE A 542 78.246 60.824 -7.160 1.00 98.02 O ATOM 2264 CB PHE A 542 80.493 62.751 -7.276 1.00 89.38 C ATOM 2265 CG PHE A 542 81.049 63.903 -6.473 1.00 88.84 C ATOM 2266 CD1 PHE A 542 82.422 64.050 -6.293 1.00 90.53 C ATOM 2267 CD2 PHE A 542 80.199 64.801 -5.836 1.00 89.66 C ATOM 2268 CE1 PHE A 542 82.931 65.070 -5.489 1.00 89.79 C ATOM 2269 CE2 PHE A 542 80.713 65.833 -5.045 1.00 90.82 C ATOM 2270 CZ PHE A 542 82.073 65.962 -4.881 1.00 88.15 C ATOM 2271 H PHE A 542 82.428 60.933 -7.014 1.00 0.00 H ATOM 2272 N VAL A 543 79.830 59.195 -7.164 1.00 97.34 N ATOM 2273 CA VAL A 543 78.949 58.114 -7.630 1.00 99.77 C ATOM 2274 C VAL A 543 77.885 57.771 -6.556 1.00106.03 C ATOM 2275 O VAL A 543 78.143 57.948 -5.359 1.00104.53 O ATOM 2276 CB VAL A 543 79.721 56.859 -8.142 1.00104.68 C ATOM 2277 CG1 VAL A 543 80.687 57.219 -9.273 1.00104.60 C ATOM 2278 CG2 VAL A 543 80.448 56.130 -7.009 1.00103.96 C ATOM 2279 H VAL A 543 80.826 58.969 -6.969 1.00 0.00 H ATOM 2280 N SER A 544 76.693 57.308 -6.991 1.00105.95 N ATOM 2281 CA SER A 544 75.580 56.931 -6.105 1.00106.89 C ATOM 2282 C SER A 544 75.985 55.760 -5.198 1.00112.10 C ATOM 2283 O SER A 544 76.544 54.771 -5.685 1.00112.21 O ATOM 2284 CB SER A 544 74.331 56.593 -6.917 1.00112.06 C ATOM 2285 H SER A 544 76.553 57.212 -8.017 1.00 0.00 H ATOM 2286 N GLN A 545 75.752 55.901 -3.878 1.00109.26 N ATOM 2287 CA GLN A 545 76.152 54.891 -2.896 1.00110.05 C ATOM 2288 C GLN A 545 74.975 54.054 -2.348 1.00117.18 C ATOM 2289 O GLN A 545 73.865 54.580 -2.191 1.00116.85 O ATOM 2290 CB GLN A 545 76.995 55.514 -1.767 1.00109.54 C ATOM 2291 CG GLN A 545 78.425 55.878 -2.217 1.00119.65 C ATOM 2292 CD GLN A 545 79.229 54.703 -2.749 1.00133.40 C ATOM 2293 OE1 GLN A 545 79.586 54.652 -3.929 1.00128.49 O ATOM 2294 NE2 GLN A 545 79.539 53.736 -1.901 1.00123.00 N ATOM 2295 HE22 GLN A 545 79.230 53.795 -0.910 1.00 0.00 H ATOM 2296 HE21 GLN A 545 80.092 52.917 -2.226 1.00 0.00 H ATOM 2297 H GLN A 545 75.270 56.760 -3.544 1.00 0.00 H ATOM 2298 N PRO A 546 75.211 52.736 -2.078 1.00116.21 N ATOM 2299 CA PRO A 546 74.109 51.853 -1.637 1.00117.88 C ATOM 2300 C PRO A 546 73.489 52.151 -0.272 1.00120.23 C ATOM 2301 O PRO A 546 72.324 51.809 -0.066 1.00121.38 O ATOM 2302 CB PRO A 546 74.743 50.457 -1.660 1.00121.20 C ATOM 2303 CG PRO A 546 76.205 50.703 -1.490 1.00124.30 C ATOM 2304 CD PRO A 546 76.466 51.970 -2.251 1.00118.26 C ATOM 2305 N ASP A 547 74.260 52.746 0.657 1.00113.80 N ATOM 2306 CA ASP A 547 73.796 53.079 2.007 1.00112.55 C ATOM 2307 C ASP A 547 74.488 54.337 2.552 1.00112.86 C ATOM 2308 O ASP A 547 75.372 54.890 1.891 1.00111.06 O ATOM 2309 CB ASP A 547 74.009 51.884 2.961 1.00115.28 C ATOM 2310 H ASP A 547 75.240 52.983 0.403 1.00 0.00 H ATOM 2311 N LEU A 548 74.070 54.789 3.758 1.00108.27 N ATOM 2312 CA LEU A 548 74.647 55.938 4.464 1.00105.97 C ATOM 2313 C LEU A 548 76.035 55.551 4.997 1.00108.40 C ATOM 2314 O LEU A 548 76.930 56.398 5.076 1.00106.51 O ATOM 2315 CB LEU A 548 73.733 56.380 5.615 1.00106.10 C ATOM 2316 H LEU A 548 73.284 54.286 4.216 1.00 0.00 H ATOM 2317 N LEU A 549 76.208 54.247 5.325 1.00105.29 N ATOM 2318 CA LEU A 549 77.457 53.633 5.794 1.00104.15 C ATOM 2319 C LEU A 549 78.543 53.732 4.709 1.00105.52 C ATOM 2320 O LEU A 549 79.711 53.956 5.031 1.00104.93 O ATOM 2321 CB LEU A 549 77.225 52.149 6.151 1.00105.93 C ATOM 2322 CG LEU A 549 76.347 51.866 7.367 1.00111.24 C ATOM 2323 H LEU A 549 75.380 53.624 5.236 1.00 0.00 H ATOM 2324 N HIS A 550 78.136 53.604 3.432 1.00100.01 N ATOM 2325 CA HIS A 550 78.994 53.617 2.249 1.00 98.80 C ATOM 2326 C HIS A 550 79.332 55.030 1.687 1.00 96.24 C ATOM 2327 O HIS A 550 79.709 55.134 0.517 1.00 95.71 O ATOM 2328 CB HIS A 550 78.372 52.724 1.157 1.00102.04 C ATOM 2329 CG HIS A 550 78.305 51.270 1.512 1.00107.79 C ATOM 2330 ND1 HIS A 550 77.514 50.815 2.559 1.00110.52 N ATOM 2331 CD2 HIS A 550 78.891 50.206 0.914 1.00111.33 C ATOM 2332 CE1 HIS A 550 77.668 49.500 2.579 1.00111.86 C ATOM 2333 NE2 HIS A 550 78.483 49.087 1.605 1.00112.74 N ATOM 2334 H HIS A 550 77.115 53.485 3.272 1.00 0.00 H ATOM 2335 N GLN A 551 79.258 56.095 2.517 1.00 87.47 N ATOM 2336 CA GLN A 551 79.595 57.464 2.096 1.00 83.75 C ATOM 2337 C GLN A 551 81.103 57.608 1.796 1.00 79.86 C ATOM 2338 O GLN A 551 81.933 57.166 2.599 1.00 79.23 O ATOM 2339 CB GLN A 551 79.193 58.469 3.175 1.00 84.49 C ATOM 2340 CG GLN A 551 77.752 58.935 3.115 1.00106.57 C ATOM 2341 CD GLN A 551 77.493 59.901 4.244 1.00132.30 C ATOM 2342 OE1 GLN A 551 77.324 59.510 5.409 1.00127.89 O ATOM 2343 NE2 GLN A 551 77.527 61.190 3.935 1.00126.55 N ATOM 2344 HE22 GLN A 551 77.671 61.485 2.948 1.00 0.00 H ATOM 2345 HE21 GLN A 551 77.410 61.907 4.680 1.00 0.00 H ATOM 2346 H GLN A 551 78.949 55.939 3.498 1.00 0.00 H ATOM 2347 N LEU A 552 81.446 58.215 0.640 1.00 70.28 N ATOM 2348 CA LEU A 552 82.835 58.403 0.214 1.00 67.08 C ATOM 2349 C LEU A 552 83.342 59.830 0.439 1.00 66.17 C ATOM 2350 O LEU A 552 82.723 60.807 0.006 1.00 66.04 O ATOM 2351 CB LEU A 552 83.074 57.943 -1.237 1.00 67.47 C ATOM 2352 CG LEU A 552 82.851 56.444 -1.550 1.00 71.88 C ATOM 2353 CD1 LEU A 552 83.037 56.176 -3.033 1.00 72.29 C ATOM 2354 CD2 LEU A 552 83.784 55.539 -0.728 1.00 71.34 C ATOM 2355 H LEU A 552 80.687 58.566 0.022 1.00 0.00 H ATOM 2356 N VAL A 553 84.473 59.931 1.136 1.00 58.63 N ATOM 2357 CA VAL A 553 85.132 61.190 1.519 1.00 55.91 C ATOM 2358 C VAL A 553 86.627 61.182 1.147 1.00 56.25 C ATOM 2359 O VAL A 553 87.196 60.109 0.937 1.00 56.27 O ATOM 2360 CB VAL A 553 84.894 61.530 3.021 1.00 57.96 C ATOM 2361 CG1 VAL A 553 83.458 62.001 3.265 1.00 57.14 C ATOM 2362 CG2 VAL A 553 85.250 60.350 3.932 1.00 58.08 C ATOM 2363 H VAL A 553 84.929 59.045 1.435 1.00 0.00 H ATOM 2364 N THR A 554 87.257 62.367 1.057 1.00 49.76 N ATOM 2365 CA THR A 554 88.676 62.446 0.713 1.00 49.21 C ATOM 2366 C THR A 554 89.467 63.586 1.390 1.00 50.52 C ATOM 2367 O THR A 554 88.882 64.569 1.858 1.00 46.92 O ATOM 2368 CB THR A 554 88.859 62.511 -0.818 1.00 56.47 C ATOM 2369 OG1 THR A 554 90.113 61.916 -1.127 1.00 56.67 O ATOM 2370 CG2 THR A 554 88.780 63.944 -1.386 1.00 50.64 C ATOM 2371 HG1 THR A 554 90.116 60.975 -0.818 1.00 0.00 H ATOM 2372 H THR A 554 86.725 63.243 1.235 1.00 0.00 H ATOM 2373 N ILE A 555 90.822 63.427 1.402 1.00 48.30 N ATOM 2374 CA ILE A 555 91.798 64.425 1.838 1.00 47.28 C ATOM 2375 C ILE A 555 92.020 65.297 0.581 1.00 50.99 C ATOM 2376 O ILE A 555 92.181 64.755 -0.516 1.00 52.00 O ATOM 2377 CB ILE A 555 93.139 63.750 2.298 1.00 50.74 C ATOM 2378 CG1 ILE A 555 92.981 62.955 3.623 1.00 49.75 C ATOM 2379 CG2 ILE A 555 94.296 64.771 2.414 1.00 51.19 C ATOM 2380 CD1 ILE A 555 94.023 61.808 3.819 1.00 47.04 C ATOM 2381 H ILE A 555 91.194 62.514 1.071 1.00 0.00 H ATOM 2382 N MET A 556 91.983 66.622 0.727 1.00 46.11 N ATOM 2383 CA MET A 556 92.253 67.556 -0.372 1.00 47.06 C ATOM 2384 C MET A 556 92.926 68.799 0.186 1.00 48.37 C ATOM 2385 O MET A 556 92.428 69.404 1.141 1.00 44.68 O ATOM 2386 CB MET A 556 91.008 67.925 -1.200 1.00 50.04 C ATOM 2387 CG MET A 556 91.366 68.735 -2.445 1.00 55.67 C ATOM 2388 SD MET A 556 89.977 69.514 -3.315 1.00 62.11 S ATOM 2389 CE MET A 556 89.591 68.264 -4.494 1.00 60.49 C ATOM 2390 H MET A 556 91.752 67.011 1.663 1.00 0.00 H ATOM 2391 N ASN A 557 94.055 69.176 -0.423 1.00 45.69 N ATOM 2392 CA ASN A 557 94.830 70.329 -0.004 1.00 45.65 C ATOM 2393 C ASN A 557 93.973 71.596 -0.019 1.00 48.79 C ATOM 2394 O ASN A 557 93.411 71.924 -1.064 1.00 48.07 O ATOM 2395 CB ASN A 557 96.065 70.492 -0.910 1.00 45.98 C ATOM 2396 CG ASN A 557 97.131 71.413 -0.376 1.00 51.79 C ATOM 2397 OD1 ASN A 557 96.873 72.542 0.035 1.00 45.74 O ATOM 2398 ND2 ASN A 557 98.368 70.982 -0.464 1.00 46.20 N ATOM 2399 HD22 ASN A 557 98.560 70.022 -0.815 1.00 0.00 H ATOM 2400 HD21 ASN A 557 99.155 71.600 -0.183 1.00 0.00 H ATOM 2401 H ASN A 557 94.393 68.618 -1.233 1.00 0.00 H ATOM 2402 N PRO A 558 93.891 72.342 1.102 1.00 44.96 N ATOM 2403 CA PRO A 558 93.131 73.608 1.075 1.00 44.54 C ATOM 2404 C PRO A 558 93.642 74.597 0.021 1.00 47.03 C ATOM 2405 O PRO A 558 92.825 75.344 -0.495 1.00 46.65 O ATOM 2406 CB PRO A 558 93.254 74.155 2.501 1.00 45.86 C ATOM 2407 CG PRO A 558 94.325 73.386 3.150 1.00 50.50 C ATOM 2408 CD PRO A 558 94.497 72.093 2.427 1.00 46.27 C ATOM 2409 N ASN A 559 94.949 74.552 -0.367 1.00 43.82 N ATOM 2410 CA ASN A 559 95.494 75.431 -1.431 1.00 44.84 C ATOM 2411 C ASN A 559 94.836 75.162 -2.791 1.00 48.13 C ATOM 2412 O ASN A 559 94.671 76.090 -3.576 1.00 48.24 O ATOM 2413 CB ASN A 559 97.041 75.352 -1.546 1.00 45.59 C ATOM 2414 CG ASN A 559 97.821 75.958 -0.394 1.00 52.54 C ATOM 2415 OD1 ASN A 559 99.030 75.783 -0.294 1.00 49.42 O ATOM 2416 ND2 ASN A 559 97.162 76.653 0.513 1.00 42.13 N ATOM 2417 HD22 ASN A 559 96.136 76.794 0.416 1.00 0.00 H ATOM 2418 HD21 ASN A 559 97.668 77.060 1.325 1.00 0.00 H ATOM 2419 H ASN A 559 95.587 73.877 0.100 1.00 0.00 H ATOM 2420 N THR A 560 94.422 73.913 -3.052 1.00 45.15 N ATOM 2421 CA THR A 560 93.702 73.543 -4.284 1.00 45.57 C ATOM 2422 C THR A 560 92.324 74.262 -4.292 1.00 49.30 C ATOM 2423 O THR A 560 91.905 74.794 -5.327 1.00 49.57 O ATOM 2424 CB THR A 560 93.555 72.013 -4.369 1.00 53.63 C ATOM 2425 OG1 THR A 560 94.850 71.427 -4.406 1.00 56.53 O ATOM 2426 CG2 THR A 560 92.768 71.559 -5.588 1.00 51.65 C ATOM 2427 HG1 THR A 560 94.764 70.442 -4.461 1.00 0.00 H ATOM 2428 H THR A 560 94.618 73.170 -2.351 1.00 0.00 H ATOM 2429 N LEU A 561 91.636 74.280 -3.138 1.00 45.57 N ATOM 2430 CA LEU A 561 90.348 74.965 -3.009 1.00 45.35 C ATOM 2431 C LEU A 561 90.522 76.477 -3.126 1.00 47.74 C ATOM 2432 O LEU A 561 89.763 77.142 -3.836 1.00 47.75 O ATOM 2433 CB LEU A 561 89.667 74.598 -1.686 1.00 45.01 C ATOM 2434 CG LEU A 561 89.216 73.135 -1.548 1.00 50.27 C ATOM 2435 CD1 LEU A 561 89.008 72.775 -0.089 1.00 48.66 C ATOM 2436 CD2 LEU A 561 87.957 72.830 -2.404 1.00 51.06 C ATOM 2437 H LEU A 561 92.031 73.791 -2.309 1.00 0.00 H ATOM 2438 N MET A 562 91.564 77.005 -2.475 1.00 44.63 N ATOM 2439 CA MET A 562 91.895 78.431 -2.502 1.00 45.81 C ATOM 2440 C MET A 562 92.201 78.950 -3.919 1.00 51.16 C ATOM 2441 O MET A 562 91.764 80.044 -4.268 1.00 52.13 O ATOM 2442 CB MET A 562 93.021 78.729 -1.530 1.00 47.60 C ATOM 2443 CG MET A 562 92.586 78.630 -0.080 1.00 49.24 C ATOM 2444 SD MET A 562 94.007 78.390 1.014 1.00 52.14 S ATOM 2445 CE MET A 562 94.770 79.991 0.933 1.00 49.67 C ATOM 2446 H MET A 562 92.172 76.369 -1.920 1.00 0.00 H ATOM 2447 N THR A 563 92.865 78.127 -4.743 1.00 48.40 N ATOM 2448 CA THR A 563 93.190 78.386 -6.152 1.00 50.06 C ATOM 2449 C THR A 563 91.889 78.511 -6.964 1.00 56.10 C ATOM 2450 O THR A 563 91.806 79.345 -7.867 1.00 55.45 O ATOM 2451 CB THR A 563 94.127 77.284 -6.653 1.00 53.55 C ATOM 2452 OG1 THR A 563 95.374 77.475 -5.987 1.00 57.54 O ATOM 2453 CG2 THR A 563 94.346 77.312 -8.157 1.00 55.10 C ATOM 2454 HG1 THR A 563 95.238 77.406 -5.009 1.00 0.00 H ATOM 2455 H THR A 563 93.180 77.218 -4.347 1.00 0.00 H ATOM 2456 N HIS A 564 90.862 77.720 -6.595 1.00 53.77 N ATOM 2457 CA HIS A 564 89.564 77.732 -7.262 1.00 54.68 C ATOM 2458 C HIS A 564 88.563 78.699 -6.613 1.00 58.31 C ATOM 2459 O HIS A 564 87.359 78.539 -6.780 1.00 57.17 O ATOM 2460 CB HIS A 564 89.010 76.313 -7.386 1.00 55.37 C ATOM 2461 CG HIS A 564 89.794 75.481 -8.348 1.00 60.15 C ATOM 2462 ND1 HIS A 564 90.800 74.634 -7.917 1.00 61.79 N ATOM 2463 CD2 HIS A 564 89.734 75.435 -9.698 1.00 63.63 C ATOM 2464 CE1 HIS A 564 91.306 74.086 -9.010 1.00 62.26 C ATOM 2465 NE2 HIS A 564 90.698 74.538 -10.107 1.00 63.94 N ATOM 2466 H HIS A 564 91.001 77.069 -5.796 1.00 0.00 H ATOM 2467 N GLU A 565 89.078 79.722 -5.892 1.00 56.71 N ATOM 2468 CA GLU A 565 88.321 80.809 -5.249 1.00 56.74 C ATOM 2469 C GLU A 565 87.338 80.335 -4.147 1.00 57.08 C ATOM 2470 O GLU A 565 86.393 81.060 -3.822 1.00 56.91 O ATOM 2471 CB GLU A 565 87.609 81.685 -6.311 1.00 59.82 C ATOM 2472 H GLU A 565 90.112 79.742 -5.781 1.00 0.00 H ATOM 2473 N VAL A 566 87.595 79.154 -3.535 1.00 50.63 N ATOM 2474 CA VAL A 566 86.796 78.653 -2.406 1.00 48.10 C ATOM 2475 C VAL A 566 87.419 79.243 -1.119 1.00 49.34 C ATOM 2476 O VAL A 566 88.590 78.973 -0.857 1.00 47.81 O ATOM 2477 CB VAL A 566 86.713 77.097 -2.345 1.00 50.98 C ATOM 2478 CG1 VAL A 566 85.939 76.631 -1.106 1.00 49.96 C ATOM 2479 CG2 VAL A 566 86.093 76.512 -3.620 1.00 51.14 C ATOM 2480 H VAL A 566 88.390 78.578 -3.878 1.00 0.00 H ATOM 2481 N PRO A 567 86.684 80.030 -0.291 1.00 46.50 N ATOM 2482 CA PRO A 567 87.301 80.553 0.949 1.00 46.04 C ATOM 2483 C PRO A 567 87.592 79.437 1.962 1.00 49.38 C ATOM 2484 O PRO A 567 86.719 78.625 2.242 1.00 50.02 O ATOM 2485 CB PRO A 567 86.263 81.560 1.478 1.00 47.80 C ATOM 2486 CG PRO A 567 84.979 81.153 0.863 1.00 51.68 C ATOM 2487 CD PRO A 567 85.278 80.465 -0.431 1.00 47.53 C ATOM 2488 N VAL A 568 88.828 79.367 2.468 1.00 44.86 N ATOM 2489 CA VAL A 568 89.254 78.351 3.429 1.00 43.66 C ATOM 2490 C VAL A 568 89.905 79.035 4.642 1.00 48.96 C ATOM 2491 O VAL A 568 90.680 79.970 4.485 1.00 50.23 O ATOM 2492 CB VAL A 568 90.203 77.273 2.817 1.00 46.65 C ATOM 2493 CG1 VAL A 568 90.471 76.140 3.817 1.00 45.49 C ATOM 2494 CG2 VAL A 568 89.669 76.710 1.502 1.00 46.24 C ATOM 2495 H VAL A 568 89.525 80.075 2.161 1.00 0.00 H ATOM 2496 N TYR A 569 89.603 78.537 5.845 1.00 45.29 N ATOM 2497 CA TYR A 569 90.142 79.029 7.105 1.00 43.75 C ATOM 2498 C TYR A 569 90.756 77.896 7.881 1.00 46.84 C ATOM 2499 O TYR A 569 90.339 76.752 7.735 1.00 45.69 O ATOM 2500 CB TYR A 569 89.046 79.733 7.926 1.00 44.27 C ATOM 2501 CG TYR A 569 88.510 80.945 7.198 1.00 46.90 C ATOM 2502 CD1 TYR A 569 89.162 82.178 7.278 1.00 49.34 C ATOM 2503 CD2 TYR A 569 87.418 80.837 6.335 1.00 47.79 C ATOM 2504 CE1 TYR A 569 88.707 83.284 6.560 1.00 50.38 C ATOM 2505 CE2 TYR A 569 86.977 81.927 5.588 1.00 50.25 C ATOM 2506 CZ TYR A 569 87.616 83.151 5.714 1.00 57.44 C ATOM 2507 OH TYR A 569 87.163 84.225 4.993 1.00 61.55 O ATOM 2508 HH TYR A 569 86.223 84.413 5.239 1.00 0.00 H ATOM 2509 H TYR A 569 88.935 77.741 5.884 1.00 0.00 H ATOM 2510 N ARG A 570 91.770 78.205 8.693 1.00 43.44 N ATOM 2511 CA ARG A 570 92.427 77.204 9.505 1.00 41.50 C ATOM 2512 C ARG A 570 92.412 77.580 10.982 1.00 45.26 C ATOM 2513 O ARG A 570 92.177 78.737 11.352 1.00 44.72 O ATOM 2514 CB ARG A 570 93.888 76.957 9.019 1.00 38.46 C ATOM 2515 CG ARG A 570 94.874 78.069 9.411 1.00 45.60 C ATOM 2516 CD ARG A 570 96.359 77.801 9.098 1.00 46.01 C ATOM 2517 NE ARG A 570 96.874 76.539 9.645 1.00 47.03 N ATOM 2518 CZ ARG A 570 97.063 76.272 10.937 1.00 54.18 C ATOM 2519 NH1 ARG A 570 96.772 77.178 11.862 1.00 41.34 N ATOM 2520 NH2 ARG A 570 97.528 75.092 11.314 1.00 46.71 N ATOM 2521 HE ARG A 570 97.112 75.789 8.965 1.00 0.00 H ATOM 2522 HH12 ARG A 570 96.923 76.961 12.868 1.00 0.00 H ATOM 2523 HH11 ARG A 570 96.393 78.105 11.581 1.00 0.00 H ATOM 2524 HH22 ARG A 570 97.674 74.889 12.324 1.00 0.00 H ATOM 2525 HH21 ARG A 570 97.748 74.368 10.601 1.00 0.00 H ATOM 2526 H ARG A 570 92.096 79.191 8.743 1.00 0.00 H ATOM 2527 N THR A 571 92.737 76.593 11.808 1.00 41.45 N ATOM 2528 CA THR A 571 93.015 76.744 13.225 1.00 41.66 C ATOM 2529 C THR A 571 93.757 75.538 13.757 1.00 45.29 C ATOM 2530 O THR A 571 93.578 74.423 13.260 1.00 44.27 O ATOM 2531 CB THR A 571 91.758 77.078 14.066 1.00 48.13 C ATOM 2532 OG1 THR A 571 92.169 77.907 15.149 1.00 49.18 O ATOM 2533 CG2 THR A 571 90.995 75.831 14.581 1.00 43.51 C ATOM 2534 HG1 THR A 571 92.576 78.736 14.792 1.00 0.00 H ATOM 2535 H THR A 571 92.797 75.635 11.408 1.00 0.00 H ATOM 2536 N ASN A 572 94.534 75.761 14.814 1.00 41.85 N ATOM 2537 CA ASN A 572 95.153 74.713 15.604 1.00 40.93 C ATOM 2538 C ASN A 572 94.353 74.750 16.915 1.00 43.02 C ATOM 2539 O ASN A 572 94.388 75.741 17.642 1.00 41.54 O ATOM 2540 CB ASN A 572 96.640 74.998 15.880 1.00 42.10 C ATOM 2541 CG ASN A 572 97.545 74.791 14.701 1.00 56.65 C ATOM 2542 OD1 ASN A 572 97.351 73.904 13.862 1.00 45.38 O ATOM 2543 ND2 ASN A 572 98.563 75.621 14.617 1.00 52.76 N ATOM 2544 HD22 ASN A 572 98.696 76.356 15.341 1.00 0.00 H ATOM 2545 HD21 ASN A 572 99.234 75.542 13.827 1.00 0.00 H ATOM 2546 H ASN A 572 94.709 76.748 15.091 1.00 0.00 H ATOM 2547 N GLN A 573 93.563 73.722 17.154 1.00 39.54 N ATOM 2548 CA GLN A 573 92.794 73.619 18.371 1.00 39.12 C ATOM 2549 C GLN A 573 93.686 72.948 19.412 1.00 44.37 C ATOM 2550 O GLN A 573 94.143 71.825 19.217 1.00 42.88 O ATOM 2551 CB GLN A 573 91.542 72.802 18.121 1.00 39.06 C ATOM 2552 CG GLN A 573 90.751 72.420 19.380 1.00 40.65 C ATOM 2553 CD GLN A 573 89.790 71.314 19.033 1.00 49.24 C ATOM 2554 OE1 GLN A 573 90.030 70.503 18.130 1.00 44.12 O ATOM 2555 NE2 GLN A 573 88.716 71.226 19.764 1.00 39.12 N ATOM 2556 HE22 GLN A 573 88.541 71.922 20.516 1.00 0.00 H ATOM 2557 HE21 GLN A 573 88.034 70.459 19.596 1.00 0.00 H ATOM 2558 H GLN A 573 93.492 72.964 16.446 1.00 0.00 H ATOM 2559 N CYS A 574 93.871 73.609 20.536 1.00 43.24 N ATOM 2560 CA CYS A 574 94.688 73.065 21.600 1.00 44.48 C ATOM 2561 C CYS A 574 93.819 72.502 22.699 1.00 43.92 C ATOM 2562 O CYS A 574 92.610 72.763 22.713 1.00 42.52 O ATOM 2563 CB CYS A 574 95.659 74.126 22.109 1.00 47.02 C ATOM 2564 SG CYS A 574 96.805 74.717 20.838 1.00 52.72 S ATOM 2565 H CYS A 574 93.422 74.539 20.661 1.00 0.00 H ATOM 2566 N ALA A 575 94.424 71.703 23.605 1.00 40.38 N ATOM 2567 CA ALA A 575 93.753 71.072 24.746 1.00 40.75 C ATOM 2568 C ALA A 575 92.986 72.138 25.575 1.00 44.90 C ATOM 2569 O ALA A 575 93.530 73.209 25.859 1.00 44.36 O ATOM 2570 CB ALA A 575 94.780 70.344 25.617 1.00 41.69 C ATOM 2571 H ALA A 575 95.441 71.522 23.484 1.00 0.00 H ATOM 2572 N GLY A 576 91.717 71.865 25.877 1.00 41.58 N ATOM 2573 CA GLY A 576 90.865 72.784 26.628 1.00 41.07 C ATOM 2574 C GLY A 576 90.117 73.762 25.733 1.00 46.11 C ATOM 2575 O GLY A 576 89.389 74.614 26.236 1.00 45.81 O ATOM 2576 H GLY A 576 91.316 70.958 25.564 1.00 0.00 H ATOM 2577 N GLU A 577 90.255 73.644 24.395 1.00 42.50 N ATOM 2578 CA GLU A 577 89.509 74.530 23.484 1.00 41.56 C ATOM 2579 C GLU A 577 88.427 73.784 22.736 1.00 42.10 C ATOM 2580 O GLU A 577 88.512 72.566 22.536 1.00 39.02 O ATOM 2581 CB GLU A 577 90.438 75.247 22.474 1.00 43.09 C ATOM 2582 CG GLU A 577 91.467 76.166 23.130 1.00 49.42 C ATOM 2583 CD GLU A 577 92.545 76.745 22.227 1.00 60.13 C ATOM 2584 OE1 GLU A 577 92.847 76.152 21.165 1.00 52.27 O ATOM 2585 OE2 GLU A 577 93.125 77.784 22.612 1.00 61.06 O ATOM 2586 H GLU A 577 90.893 72.922 24.004 1.00 0.00 H ATOM 2587 N PHE A 578 87.398 74.533 22.332 1.00 40.38 N ATOM 2588 CA PHE A 578 86.291 74.048 21.517 1.00 38.80 C ATOM 2589 C PHE A 578 86.430 74.575 20.116 1.00 42.86 C ATOM 2590 O PHE A 578 86.860 75.718 19.932 1.00 43.09 O ATOM 2591 CB PHE A 578 84.917 74.518 22.065 1.00 39.83 C ATOM 2592 CG PHE A 578 84.460 73.915 23.377 1.00 40.10 C ATOM 2593 CD1 PHE A 578 83.733 72.725 23.401 1.00 41.26 C ATOM 2594 CD2 PHE A 578 84.713 74.562 24.587 1.00 41.31 C ATOM 2595 CE1 PHE A 578 83.249 72.204 24.610 1.00 42.59 C ATOM 2596 CE2 PHE A 578 84.269 74.019 25.797 1.00 43.90 C ATOM 2597 CZ PHE A 578 83.545 72.842 25.804 1.00 41.96 C ATOM 2598 H PHE A 578 87.385 75.533 22.619 1.00 0.00 H ATOM 2599 N VAL A 579 85.998 73.757 19.127 1.00 38.02 N ATOM 2600 CA VAL A 579 85.819 74.138 17.736 1.00 36.65 C ATOM 2601 C VAL A 579 84.325 73.928 17.455 1.00 40.87 C ATOM 2602 O VAL A 579 83.776 72.900 17.804 1.00 40.30 O ATOM 2603 CB VAL A 579 86.727 73.378 16.704 1.00 38.26 C ATOM 2604 CG1 VAL A 579 86.215 73.570 15.259 1.00 36.94 C ATOM 2605 CG2 VAL A 579 88.182 73.839 16.828 1.00 37.42 C ATOM 2606 H VAL A 579 85.776 72.774 19.384 1.00 0.00 H ATOM 2607 N ILE A 580 83.676 74.917 16.860 1.00 38.94 N ATOM 2608 CA ILE A 580 82.282 74.826 16.478 1.00 39.57 C ATOM 2609 C ILE A 580 82.232 74.863 14.955 1.00 44.18 C ATOM 2610 O ILE A 580 82.877 75.709 14.352 1.00 43.49 O ATOM 2611 CB ILE A 580 81.440 75.967 17.122 1.00 43.04 C ATOM 2612 CG1 ILE A 580 81.495 75.875 18.689 1.00 44.22 C ATOM 2613 CG2 ILE A 580 79.977 75.962 16.568 1.00 41.12 C ATOM 2614 CD1 ILE A 580 80.780 76.999 19.480 1.00 50.59 C ATOM 2615 H ILE A 580 84.190 75.798 16.658 1.00 0.00 H ATOM 2616 N THR A 581 81.463 73.963 14.340 1.00 42.21 N ATOM 2617 CA THR A 581 81.246 73.979 12.888 1.00 41.25 C ATOM 2618 C THR A 581 79.805 74.403 12.656 1.00 45.77 C ATOM 2619 O THR A 581 78.905 73.948 13.361 1.00 44.66 O ATOM 2620 CB THR A 581 81.628 72.653 12.200 1.00 46.54 C ATOM 2621 OG1 THR A 581 80.693 71.659 12.576 1.00 47.41 O ATOM 2622 CG2 THR A 581 83.053 72.183 12.541 1.00 43.33 C ATOM 2623 HG1 THR A 581 79.786 71.936 12.292 1.00 0.00 H ATOM 2624 H THR A 581 81.001 73.225 14.909 1.00 0.00 H ATOM 2625 N PHE A 582 79.594 75.292 11.684 1.00 43.88 N ATOM 2626 CA PHE A 582 78.275 75.829 11.377 1.00 45.18 C ATOM 2627 C PHE A 582 77.534 75.007 10.306 1.00 47.12 C ATOM 2628 O PHE A 582 78.185 74.214 9.624 1.00 45.27 O ATOM 2629 CB PHE A 582 78.390 77.322 11.028 1.00 48.14 C ATOM 2630 CG PHE A 582 78.445 78.124 12.309 1.00 51.59 C ATOM 2631 CD1 PHE A 582 79.576 78.088 13.127 1.00 55.25 C ATOM 2632 CD2 PHE A 582 77.346 78.857 12.736 1.00 55.80 C ATOM 2633 CE1 PHE A 582 79.596 78.769 14.349 1.00 56.60 C ATOM 2634 CE2 PHE A 582 77.382 79.561 13.946 1.00 59.23 C ATOM 2635 CZ PHE A 582 78.501 79.497 14.748 1.00 56.58 C ATOM 2636 H PHE A 582 80.406 75.616 11.121 1.00 0.00 H ATOM 2637 N PRO A 583 76.183 75.096 10.210 1.00 42.78 N ATOM 2638 CA PRO A 583 75.462 74.312 9.185 1.00 42.79 C ATOM 2639 C PRO A 583 76.005 74.403 7.752 1.00 46.26 C ATOM 2640 O PRO A 583 76.245 75.498 7.226 1.00 45.22 O ATOM 2641 CB PRO A 583 74.029 74.844 9.277 1.00 45.47 C ATOM 2642 CG PRO A 583 73.900 75.314 10.718 1.00 49.55 C ATOM 2643 CD PRO A 583 75.242 75.928 11.001 1.00 44.78 C ATOM 2644 N ARG A 584 76.243 73.220 7.146 1.00 42.04 N ATOM 2645 CA ARG A 584 76.733 73.035 5.776 1.00 41.43 C ATOM 2646 C ARG A 584 78.174 73.562 5.555 1.00 43.26 C ATOM 2647 O ARG A 584 78.624 73.742 4.403 1.00 42.52 O ATOM 2648 CB ARG A 584 75.742 73.612 4.753 1.00 42.23 C ATOM 2649 CG ARG A 584 75.708 72.807 3.474 1.00 45.78 C ATOM 2650 CD ARG A 584 75.044 73.569 2.353 1.00 49.21 C ATOM 2651 NE ARG A 584 75.031 72.747 1.150 1.00 47.89 N ATOM 2652 CZ ARG A 584 74.401 73.067 0.031 1.00 58.62 C ATOM 2653 NH1 ARG A 584 73.744 74.215 -0.061 1.00 42.93 N ATOM 2654 NH2 ARG A 584 74.414 72.239 -1.002 1.00 49.36 N ATOM 2655 HE ARG A 584 75.552 71.847 1.172 1.00 0.00 H ATOM 2656 HH12 ARG A 584 73.250 74.462 -0.942 1.00 0.00 H ATOM 2657 HH11 ARG A 584 73.722 74.868 0.748 1.00 0.00 H ATOM 2658 HH22 ARG A 584 73.918 72.494 -1.879 1.00 0.00 H ATOM 2659 HH21 ARG A 584 74.921 71.333 -0.936 1.00 0.00 H ATOM 2660 H ARG A 584 76.062 72.360 7.702 1.00 0.00 H ATOM 2661 N ALA A 585 78.912 73.736 6.660 1.00 38.50 N ATOM 2662 CA ALA A 585 80.308 74.153 6.622 1.00 37.07 C ATOM 2663 C ALA A 585 81.233 72.946 6.447 1.00 40.85 C ATOM 2664 O ALA A 585 81.376 72.124 7.365 1.00 38.26 O ATOM 2665 CB ALA A 585 80.671 74.911 7.892 1.00 36.79 C ATOM 2666 H ALA A 585 78.469 73.566 7.585 1.00 0.00 H ATOM 2667 N TYR A 586 81.892 72.852 5.277 1.00 39.21 N ATOM 2668 CA TYR A 586 82.871 71.784 5.038 1.00 37.85 C ATOM 2669 C TYR A 586 84.071 71.923 5.957 1.00 42.02 C ATOM 2670 O TYR A 586 84.552 73.028 6.192 1.00 41.39 O ATOM 2671 CB TYR A 586 83.326 71.743 3.576 1.00 38.39 C ATOM 2672 CG TYR A 586 82.449 70.848 2.732 1.00 40.17 C ATOM 2673 CD1 TYR A 586 82.647 69.469 2.706 1.00 41.82 C ATOM 2674 CD2 TYR A 586 81.368 71.367 2.021 1.00 40.59 C ATOM 2675 CE1 TYR A 586 81.805 68.631 1.974 1.00 42.81 C ATOM 2676 CE2 TYR A 586 80.527 70.541 1.279 1.00 41.41 C ATOM 2677 CZ TYR A 586 80.755 69.174 1.253 1.00 46.51 C ATOM 2678 OH TYR A 586 79.946 68.348 0.518 1.00 47.00 O ATOM 2679 HH TYR A 586 79.986 68.612 -0.435 1.00 0.00 H ATOM 2680 H TYR A 586 81.704 73.549 4.528 1.00 0.00 H ATOM 2681 N HIS A 587 84.511 70.807 6.526 1.00 37.73 N ATOM 2682 CA HIS A 587 85.680 70.803 7.376 1.00 35.84 C ATOM 2683 C HIS A 587 86.468 69.524 7.207 1.00 38.76 C ATOM 2684 O HIS A 587 85.915 68.501 6.838 1.00 39.60 O ATOM 2685 CB HIS A 587 85.357 71.089 8.872 1.00 35.88 C ATOM 2686 CG HIS A 587 84.301 70.198 9.442 1.00 39.35 C ATOM 2687 ND1 HIS A 587 82.963 70.414 9.167 1.00 41.36 N ATOM 2688 CD2 HIS A 587 84.416 69.124 10.257 1.00 40.49 C ATOM 2689 CE1 HIS A 587 82.303 69.467 9.803 1.00 41.25 C ATOM 2690 NE2 HIS A 587 83.124 68.677 10.497 1.00 41.20 N ATOM 2691 H HIS A 587 84.003 69.916 6.356 1.00 0.00 H ATOM 2692 N SER A 588 87.776 69.611 7.454 1.00 34.93 N ATOM 2693 CA SER A 588 88.735 68.520 7.439 1.00 35.01 C ATOM 2694 C SER A 588 89.865 68.947 8.356 1.00 39.78 C ATOM 2695 O SER A 588 89.903 70.086 8.844 1.00 40.26 O ATOM 2696 CB SER A 588 89.266 68.237 6.024 1.00 36.91 C ATOM 2697 OG SER A 588 90.040 69.329 5.554 1.00 44.60 O ATOM 2698 HG SER A 588 90.373 69.129 4.643 1.00 0.00 H ATOM 2699 H SER A 588 88.147 70.556 7.680 1.00 0.00 H ATOM 2700 N GLY A 589 90.774 68.028 8.595 1.00 37.16 N ATOM 2701 CA GLY A 589 91.934 68.318 9.411 1.00 37.15 C ATOM 2702 C GLY A 589 92.694 67.085 9.789 1.00 39.78 C ATOM 2703 O GLY A 589 92.430 66.014 9.257 1.00 39.10 O ATOM 2704 H GLY A 589 90.658 67.077 8.191 1.00 0.00 H ATOM 2705 N PHE A 590 93.673 67.247 10.672 1.00 36.78 N ATOM 2706 CA PHE A 590 94.523 66.131 11.090 1.00 36.72 C ATOM 2707 C PHE A 590 95.051 66.428 12.487 1.00 41.10 C ATOM 2708 O PHE A 590 95.079 67.586 12.905 1.00 40.09 O ATOM 2709 CB PHE A 590 95.687 65.881 10.070 1.00 37.31 C ATOM 2710 CG PHE A 590 96.658 67.031 9.980 1.00 38.02 C ATOM 2711 CD1 PHE A 590 96.439 68.076 9.087 1.00 40.27 C ATOM 2712 CD2 PHE A 590 97.729 67.131 10.872 1.00 39.01 C ATOM 2713 CE1 PHE A 590 97.265 69.197 9.088 1.00 40.94 C ATOM 2714 CE2 PHE A 590 98.536 68.258 10.889 1.00 41.93 C ATOM 2715 CZ PHE A 590 98.304 69.281 9.993 1.00 40.82 C ATOM 2716 H PHE A 590 93.840 68.190 11.077 1.00 0.00 H ATOM 2717 N ASN A 591 95.509 65.389 13.187 1.00 39.39 N ATOM 2718 CA ASN A 591 96.078 65.554 14.509 1.00 39.17 C ATOM 2719 C ASN A 591 97.579 65.733 14.418 1.00 43.28 C ATOM 2720 O ASN A 591 98.237 65.126 13.555 1.00 42.72 O ATOM 2721 CB ASN A 591 95.685 64.378 15.405 1.00 40.05 C ATOM 2722 CG ASN A 591 94.188 64.277 15.575 1.00 47.39 C ATOM 2723 OD1 ASN A 591 93.544 65.145 16.174 1.00 40.45 O ATOM 2724 ND2 ASN A 591 93.593 63.237 15.029 1.00 36.63 N ATOM 2725 HD22 ASN A 591 94.156 62.519 14.530 1.00 0.00 H ATOM 2726 HD21 ASN A 591 92.560 63.134 15.097 1.00 0.00 H ATOM 2727 H ASN A 591 95.456 64.436 12.773 1.00 0.00 H ATOM 2728 N GLN A 592 98.119 66.587 15.306 1.00 40.45 N ATOM 2729 CA GLN A 592 99.552 66.893 15.433 1.00 40.77 C ATOM 2730 C GLN A 592 100.305 65.800 16.173 1.00 45.30 C ATOM 2731 O GLN A 592 101.513 65.679 16.013 1.00 47.91 O ATOM 2732 CB GLN A 592 99.763 68.218 16.186 1.00 40.83 C ATOM 2733 CG GLN A 592 99.264 69.433 15.436 1.00 45.44 C ATOM 2734 CD GLN A 592 100.275 69.934 14.456 1.00 56.36 C ATOM 2735 OE1 GLN A 592 101.487 69.784 14.654 1.00 54.12 O ATOM 2736 NE2 GLN A 592 99.792 70.574 13.401 1.00 43.66 N ATOM 2737 HE22 GLN A 592 98.764 70.674 13.279 1.00 0.00 H ATOM 2738 HE21 GLN A 592 100.441 70.976 12.695 1.00 0.00 H ATOM 2739 H GLN A 592 97.469 67.071 15.957 1.00 0.00 H ATOM 2740 N GLY A 593 99.594 65.035 16.982 1.00 39.15 N ATOM 2741 CA GLY A 593 100.160 63.963 17.795 1.00 39.17 C ATOM 2742 C GLY A 593 99.079 63.281 18.606 1.00 43.63 C ATOM 2743 O GLY A 593 97.891 63.454 18.311 1.00 41.73 O ATOM 2744 H GLY A 593 98.570 65.207 17.043 1.00 0.00 H ATOM 2745 N PHE A 594 99.488 62.483 19.623 1.00 40.44 N ATOM 2746 CA PHE A 594 98.601 61.755 20.516 1.00 39.52 C ATOM 2747 C PHE A 594 97.640 62.727 21.237 1.00 44.09 C ATOM 2748 O PHE A 594 98.073 63.698 21.852 1.00 42.76 O ATOM 2749 CB PHE A 594 99.424 60.903 21.502 1.00 41.88 C ATOM 2750 CG PHE A 594 98.675 60.073 22.532 1.00 42.76 C ATOM 2751 CD1 PHE A 594 97.526 59.353 22.176 1.00 44.91 C ATOM 2752 CD2 PHE A 594 99.180 59.915 23.819 1.00 44.56 C ATOM 2753 CE1 PHE A 594 96.861 58.550 23.117 1.00 46.23 C ATOM 2754 CE2 PHE A 594 98.512 59.115 24.767 1.00 47.86 C ATOM 2755 CZ PHE A 594 97.368 58.425 24.404 1.00 46.04 C ATOM 2756 H PHE A 594 100.512 62.384 19.776 1.00 0.00 H ATOM 2757 N ASN A 595 96.332 62.495 21.090 1.00 40.84 N ATOM 2758 CA ASN A 595 95.345 63.358 21.713 1.00 40.30 C ATOM 2759 C ASN A 595 93.997 62.648 21.906 1.00 43.94 C ATOM 2760 O ASN A 595 93.781 61.525 21.434 1.00 43.62 O ATOM 2761 CB ASN A 595 95.220 64.711 20.956 1.00 35.75 C ATOM 2762 CG ASN A 595 94.716 64.618 19.535 1.00 43.80 C ATOM 2763 OD1 ASN A 595 94.066 63.666 19.148 1.00 37.83 O ATOM 2764 ND2 ASN A 595 94.868 65.677 18.773 1.00 37.70 N ATOM 2765 HD22 ASN A 595 95.426 66.486 19.113 1.00 0.00 H ATOM 2766 HD21 ASN A 595 94.431 65.706 17.830 1.00 0.00 H ATOM 2767 H ASN A 595 96.017 61.684 20.521 1.00 0.00 H ATOM 2768 N PHE A 596 93.094 63.314 22.607 1.00 41.76 N ATOM 2769 CA PHE A 596 91.779 62.785 22.923 1.00 42.25 C ATOM 2770 C PHE A 596 90.746 63.884 22.822 1.00 43.10 C ATOM 2771 O PHE A 596 90.821 64.886 23.543 1.00 40.57 O ATOM 2772 CB PHE A 596 91.773 62.111 24.312 1.00 46.11 C ATOM 2773 CG PHE A 596 90.419 61.577 24.700 1.00 50.89 C ATOM 2774 CD1 PHE A 596 89.812 60.572 23.962 1.00 57.35 C ATOM 2775 CD2 PHE A 596 89.713 62.131 25.756 1.00 54.32 C ATOM 2776 CE1 PHE A 596 88.541 60.102 24.306 1.00 59.72 C ATOM 2777 CE2 PHE A 596 88.455 61.645 26.110 1.00 58.38 C ATOM 2778 CZ PHE A 596 87.889 60.618 25.401 1.00 57.75 C ATOM 2779 H PHE A 596 93.338 64.265 22.949 1.00 0.00 H ATOM 2780 N ALA A 597 89.771 63.675 21.931 1.00 39.71 N ATOM 2781 CA ALA A 597 88.704 64.629 21.645 1.00 39.13 C ATOM 2782 C ALA A 597 87.326 64.003 21.791 1.00 42.96 C ATOM 2783 O ALA A 597 87.171 62.791 21.714 1.00 42.12 O ATOM 2784 CB ALA A 597 88.863 65.193 20.233 1.00 38.44 C ATOM 2785 H ALA A 597 89.773 62.776 21.409 1.00 0.00 H ATOM 2786 N GLU A 598 86.322 64.861 22.011 1.00 39.91 N ATOM 2787 CA GLU A 598 84.929 64.486 22.178 1.00 39.34 C ATOM 2788 C GLU A 598 84.124 65.480 21.381 1.00 43.66 C ATOM 2789 O GLU A 598 84.395 66.688 21.440 1.00 43.84 O ATOM 2790 CB GLU A 598 84.541 64.505 23.655 1.00 41.12 C ATOM 2791 CG GLU A 598 83.170 63.902 23.917 1.00 49.32 C ATOM 2792 CD GLU A 598 82.942 63.431 25.336 1.00 59.04 C ATOM 2793 OE1 GLU A 598 83.888 63.500 26.154 1.00 53.79 O ATOM 2794 OE2 GLU A 598 81.817 62.964 25.623 1.00 60.51 O ATOM 2795 H GLU A 598 86.558 65.872 22.066 1.00 0.00 H ATOM 2796 N ALA A 599 83.188 64.969 20.579 1.00 39.63 N ATOM 2797 CA ALA A 599 82.379 65.794 19.698 1.00 38.92 C ATOM 2798 C ALA A 599 80.915 65.386 19.685 1.00 44.64 C ATOM 2799 O ALA A 599 80.580 64.208 19.879 1.00 45.38 O ATOM 2800 CB ALA A 599 82.945 65.748 18.278 1.00 37.92 C ATOM 2801 H ALA A 599 83.032 63.941 20.585 1.00 0.00 H ATOM 2802 N VAL A 600 80.037 66.353 19.373 1.00 40.17 N ATOM 2803 CA VAL A 600 78.607 66.054 19.270 1.00 40.06 C ATOM 2804 C VAL A 600 77.947 66.977 18.257 1.00 44.53 C ATOM 2805 O VAL A 600 78.391 68.110 18.061 1.00 42.94 O ATOM 2806 CB VAL A 600 77.896 66.038 20.679 1.00 44.06 C ATOM 2807 CG1 VAL A 600 77.670 67.445 21.237 1.00 43.28 C ATOM 2808 CG2 VAL A 600 76.599 65.229 20.661 1.00 44.54 C ATOM 2809 H VAL A 600 80.375 67.322 19.203 1.00 0.00 H ATOM 2810 N ASN A 601 76.906 66.472 17.596 1.00 44.41 N ATOM 2811 CA ASN A 601 76.084 67.251 16.684 1.00 45.34 C ATOM 2812 C ASN A 601 75.019 67.940 17.501 1.00 49.04 C ATOM 2813 O ASN A 601 74.620 67.427 18.540 1.00 46.25 O ATOM 2814 CB ASN A 601 75.378 66.347 15.675 1.00 46.15 C ATOM 2815 CG ASN A 601 76.319 65.806 14.660 1.00 55.89 C ATOM 2816 OD1 ASN A 601 76.504 64.602 14.577 1.00 52.66 O ATOM 2817 ND2 ASN A 601 77.031 66.690 13.964 1.00 50.96 N ATOM 2818 HD22 ASN A 601 76.840 67.707 14.065 1.00 0.00 H ATOM 2819 HD21 ASN A 601 77.778 66.363 13.319 1.00 0.00 H ATOM 2820 H ASN A 601 76.669 65.470 17.740 1.00 0.00 H ATOM 2821 N PHE A 602 74.565 69.103 17.034 1.00 48.24 N ATOM 2822 CA PHE A 602 73.462 69.819 17.661 1.00 49.32 C ATOM 2823 C PHE A 602 72.722 70.648 16.628 1.00 53.08 C ATOM 2824 O PHE A 602 73.278 71.003 15.582 1.00 51.68 O ATOM 2825 CB PHE A 602 73.885 70.627 18.919 1.00 50.58 C ATOM 2826 CG PHE A 602 74.764 71.819 18.650 1.00 49.98 C ATOM 2827 CD1 PHE A 602 76.135 71.667 18.480 1.00 50.41 C ATOM 2828 CD2 PHE A 602 74.223 73.097 18.570 1.00 51.39 C ATOM 2829 CE1 PHE A 602 76.951 72.775 18.243 1.00 50.62 C ATOM 2830 CE2 PHE A 602 75.034 74.204 18.338 1.00 53.21 C ATOM 2831 CZ PHE A 602 76.393 74.039 18.176 1.00 51.06 C ATOM 2832 H PHE A 602 75.015 69.514 16.191 1.00 0.00 H ATOM 2833 N CYS A 603 71.473 70.947 16.935 1.00 51.21 N ATOM 2834 CA CYS A 603 70.562 71.702 16.097 1.00 53.58 C ATOM 2835 C CYS A 603 69.856 72.785 16.893 1.00 58.23 C ATOM 2836 O CYS A 603 69.168 72.488 17.863 1.00 58.67 O ATOM 2837 CB CYS A 603 69.567 70.759 15.423 1.00 54.91 C ATOM 2838 SG CYS A 603 70.333 69.613 14.251 1.00 58.06 S ATOM 2839 H CYS A 603 71.114 70.614 17.852 1.00 0.00 H ATOM 2840 N THR A 604 70.041 74.040 16.484 1.00 55.14 N ATOM 2841 CA THR A 604 69.416 75.210 17.113 1.00 56.28 C ATOM 2842 C THR A 604 68.151 75.568 16.313 1.00 61.39 C ATOM 2843 O THR A 604 67.921 74.981 15.248 1.00 59.60 O ATOM 2844 CB THR A 604 70.405 76.400 17.135 1.00 57.40 C ATOM 2845 OG1 THR A 604 70.613 76.868 15.799 1.00 56.94 O ATOM 2846 CG2 THR A 604 71.731 76.055 17.770 1.00 53.82 C ATOM 2847 HG1 THR A 604 71.246 77.629 15.812 1.00 0.00 H ATOM 2848 H THR A 604 70.667 74.200 15.669 1.00 0.00 H ATOM 2849 N VAL A 605 67.350 76.541 16.816 1.00 60.42 N ATOM 2850 CA VAL A 605 66.139 77.060 16.153 1.00 62.83 C ATOM 2851 C VAL A 605 66.490 77.711 14.813 1.00 69.22 C ATOM 2852 O VAL A 605 65.714 77.614 13.876 1.00 71.52 O ATOM 2853 CB VAL A 605 65.270 77.994 17.054 1.00 68.30 C ATOM 2854 CG1 VAL A 605 64.607 77.210 18.168 1.00 68.39 C ATOM 2855 CG2 VAL A 605 66.067 79.179 17.614 1.00 68.14 C ATOM 2856 H VAL A 605 67.609 76.951 17.736 1.00 0.00 H ATOM 2857 N ASP A 606 67.676 78.335 14.726 1.00 66.45 N ATOM 2858 CA ASP A 606 68.241 78.961 13.532 1.00 66.73 C ATOM 2859 C ASP A 606 68.400 77.927 12.390 1.00 68.07 C ATOM 2860 O ASP A 606 68.215 78.274 11.219 1.00 69.14 O ATOM 2861 CB ASP A 606 69.635 79.556 13.857 1.00 68.35 C ATOM 2862 CG ASP A 606 69.668 80.704 14.861 1.00 90.20 C ATOM 2863 OD1 ASP A 606 68.626 81.397 15.019 1.00 94.69 O ATOM 2864 OD2 ASP A 606 70.756 80.954 15.447 1.00 95.26 O ATOM 2865 H ASP A 606 68.249 78.377 15.593 1.00 0.00 H ATOM 2866 N TRP A 607 68.776 76.670 12.751 1.00 58.79 N ATOM 2867 CA TRP A 607 69.024 75.561 11.830 1.00 53.95 C ATOM 2868 C TRP A 607 67.746 75.001 11.144 1.00 56.66 C ATOM 2869 O TRP A 607 67.868 74.506 10.025 1.00 54.54 O ATOM 2870 CB TRP A 607 69.825 74.442 12.555 1.00 49.13 C ATOM 2871 CG TRP A 607 69.781 73.101 11.870 1.00 47.52 C ATOM 2872 CD1 TRP A 607 70.643 72.640 10.915 1.00 48.66 C ATOM 2873 CD2 TRP A 607 68.761 72.100 12.009 1.00 46.95 C ATOM 2874 NE1 TRP A 607 70.240 71.402 10.475 1.00 47.38 N ATOM 2875 CE2 TRP A 607 69.088 71.045 11.128 1.00 49.56 C ATOM 2876 CE3 TRP A 607 67.609 71.981 12.812 1.00 49.15 C ATOM 2877 CZ2 TRP A 607 68.316 69.878 11.037 1.00 49.10 C ATOM 2878 CZ3 TRP A 607 66.833 70.836 12.709 1.00 50.86 C ATOM 2879 CH2 TRP A 607 67.191 69.797 11.834 1.00 50.70 C ATOM 2880 HE1 TRP A 607 70.731 70.827 9.760 1.00 0.00 H ATOM 2881 H TRP A 607 68.897 76.482 13.767 1.00 0.00 H ATOM 2882 N LEU A 608 66.555 75.025 11.817 1.00 54.59 N ATOM 2883 CA LEU A 608 65.289 74.429 11.333 1.00 53.96 C ATOM 2884 C LEU A 608 64.999 74.643 9.825 1.00 54.25 C ATOM 2885 O LEU A 608 64.774 73.633 9.148 1.00 49.67 O ATOM 2886 CB LEU A 608 64.058 74.834 12.179 1.00 54.71 C ATOM 2887 CG LEU A 608 63.809 74.057 13.484 1.00 59.62 C ATOM 2888 CD1 LEU A 608 62.625 74.626 14.230 1.00 60.67 C ATOM 2889 CD2 LEU A 608 63.535 72.604 13.215 1.00 57.47 C ATOM 2890 H LEU A 608 66.538 75.500 12.742 1.00 0.00 H ATOM 2891 N PRO A 609 65.045 75.891 9.262 1.00 52.06 N ATOM 2892 CA PRO A 609 64.826 76.047 7.803 1.00 51.92 C ATOM 2893 C PRO A 609 65.903 75.354 6.952 1.00 54.75 C ATOM 2894 O PRO A 609 65.572 74.812 5.907 1.00 54.68 O ATOM 2895 CB PRO A 609 64.863 77.572 7.589 1.00 55.23 C ATOM 2896 CG PRO A 609 64.665 78.164 8.938 1.00 59.63 C ATOM 2897 CD PRO A 609 65.282 77.206 9.898 1.00 54.28 C ATOM 2898 N LEU A 610 67.174 75.342 7.410 1.00 50.57 N ATOM 2899 CA LEU A 610 68.282 74.673 6.709 1.00 50.04 C ATOM 2900 C LEU A 610 68.106 73.157 6.756 1.00 50.94 C ATOM 2901 O LEU A 610 68.426 72.473 5.786 1.00 50.23 O ATOM 2902 CB LEU A 610 69.642 75.085 7.290 1.00 51.50 C ATOM 2903 CG LEU A 610 70.021 76.564 7.135 1.00 59.08 C ATOM 2904 CD1 LEU A 610 71.215 76.915 8.012 1.00 60.21 C ATOM 2905 CD2 LEU A 610 70.337 76.918 5.661 1.00 64.04 C ATOM 2906 H LEU A 610 67.380 75.831 8.304 1.00 0.00 H ATOM 2907 N GLY A 611 67.565 72.657 7.872 1.00 46.32 N ATOM 2908 CA GLY A 611 67.237 71.251 8.052 1.00 44.61 C ATOM 2909 C GLY A 611 66.229 70.781 7.027 1.00 48.64 C ATOM 2910 O GLY A 611 66.381 69.691 6.462 1.00 48.31 O ATOM 2911 H GLY A 611 67.367 73.311 8.656 1.00 0.00 H ATOM 2912 N ARG A 612 65.192 71.625 6.758 1.00 45.45 N ATOM 2913 CA ARG A 612 64.175 71.349 5.734 1.00 44.34 C ATOM 2914 C ARG A 612 64.802 71.400 4.309 1.00 46.74 C ATOM 2915 O ARG A 612 64.514 70.513 3.486 1.00 45.85 O ATOM 2916 CB ARG A 612 62.923 72.262 5.893 1.00 43.68 C ATOM 2917 CG ARG A 612 61.889 72.154 4.746 1.00 42.18 C ATOM 2918 CD ARG A 612 60.549 72.823 5.066 1.00 45.30 C ATOM 2919 NE ARG A 612 60.008 72.362 6.354 1.00 41.97 N ATOM 2920 CZ ARG A 612 59.425 71.184 6.553 1.00 45.15 C ATOM 2921 NH1 ARG A 612 59.214 70.359 5.536 1.00 42.83 N ATOM 2922 NH2 ARG A 612 59.024 70.835 7.762 1.00 37.28 N ATOM 2923 HE ARG A 612 60.087 73.004 7.168 1.00 0.00 H ATOM 2924 HH12 ARG A 612 58.757 69.439 5.699 1.00 0.00 H ATOM 2925 HH11 ARG A 612 59.505 70.632 4.576 1.00 0.00 H ATOM 2926 HH22 ARG A 612 58.568 69.912 7.913 1.00 0.00 H ATOM 2927 HH21 ARG A 612 59.164 71.483 8.563 1.00 0.00 H ATOM 2928 H ARG A 612 65.117 72.507 7.304 1.00 0.00 H ATOM 2929 N GLN A 613 65.651 72.405 4.044 1.00 44.65 N ATOM 2930 CA GLN A 613 66.360 72.576 2.768 1.00 45.49 C ATOM 2931 C GLN A 613 67.297 71.383 2.508 1.00 49.47 C ATOM 2932 O GLN A 613 67.442 70.956 1.357 1.00 49.03 O ATOM 2933 CB GLN A 613 67.168 73.878 2.778 1.00 48.72 C ATOM 2934 CG GLN A 613 66.325 75.149 2.722 1.00 61.10 C ATOM 2935 CD GLN A 613 67.171 76.383 2.921 1.00 71.25 C ATOM 2936 OE1 GLN A 613 68.216 76.563 2.288 1.00 69.81 O ATOM 2937 NE2 GLN A 613 66.734 77.267 3.803 1.00 59.18 N ATOM 2938 HE22 GLN A 613 65.850 77.090 4.322 1.00 0.00 H ATOM 2939 HE21 GLN A 613 67.274 78.139 3.977 1.00 0.00 H ATOM 2940 H GLN A 613 65.818 73.109 4.791 1.00 0.00 H ATOM 2941 N CYS A 614 67.922 70.843 3.592 1.00 45.69 N ATOM 2942 CA CYS A 614 68.810 69.683 3.529 1.00 44.95 C ATOM 2943 C CYS A 614 68.085 68.430 3.055 1.00 46.00 C ATOM 2944 O CYS A 614 68.582 67.739 2.181 1.00 45.68 O ATOM 2945 CB CYS A 614 69.507 69.425 4.861 1.00 44.97 C ATOM 2946 SG CYS A 614 70.708 68.076 4.770 1.00 49.35 S ATOM 2947 H CYS A 614 67.757 71.283 4.520 1.00 0.00 H ATOM 2948 N VAL A 615 66.934 68.135 3.648 1.00 42.52 N ATOM 2949 CA VAL A 615 66.131 66.962 3.324 1.00 42.08 C ATOM 2950 C VAL A 615 65.665 67.013 1.849 1.00 46.57 C ATOM 2951 O VAL A 615 65.686 65.993 1.162 1.00 45.78 O ATOM 2952 CB VAL A 615 65.002 66.784 4.372 1.00 44.83 C ATOM 2953 CG1 VAL A 615 63.939 65.765 3.919 1.00 42.96 C ATOM 2954 CG2 VAL A 615 65.615 66.386 5.715 1.00 45.07 C ATOM 2955 H VAL A 615 66.585 68.778 4.387 1.00 0.00 H ATOM 2956 N GLU A 616 65.327 68.212 1.366 1.00 45.16 N ATOM 2957 CA GLU A 616 64.971 68.480 -0.025 1.00 47.35 C ATOM 2958 C GLU A 616 66.214 68.218 -0.924 1.00 51.73 C ATOM 2959 O GLU A 616 66.090 67.626 -1.989 1.00 51.47 O ATOM 2960 CB GLU A 616 64.485 69.935 -0.130 1.00 49.99 C ATOM 2961 CG GLU A 616 64.258 70.466 -1.540 1.00 62.34 C ATOM 2962 CD GLU A 616 63.949 71.952 -1.603 1.00 96.34 C ATOM 2963 OE1 GLU A 616 63.856 72.598 -0.532 1.00 94.75 O ATOM 2964 OE2 GLU A 616 63.808 72.475 -2.732 1.00101.70 O ATOM 2965 H GLU A 616 65.317 69.013 2.029 1.00 0.00 H ATOM 2966 N HIS A 617 67.410 68.586 -0.444 1.00 49.29 N ATOM 2967 CA HIS A 617 68.671 68.364 -1.147 1.00 49.58 C ATOM 2968 C HIS A 617 69.028 66.866 -1.169 1.00 49.63 C ATOM 2969 O HIS A 617 69.476 66.366 -2.205 1.00 48.31 O ATOM 2970 CB HIS A 617 69.775 69.223 -0.523 1.00 51.96 C ATOM 2971 CG HIS A 617 71.063 69.167 -1.262 1.00 57.73 C ATOM 2972 ND1 HIS A 617 71.276 69.933 -2.391 1.00 61.42 N ATOM 2973 CD2 HIS A 617 72.181 68.451 -0.997 1.00 60.62 C ATOM 2974 CE1 HIS A 617 72.505 69.643 -2.786 1.00 62.56 C ATOM 2975 NE2 HIS A 617 73.089 68.762 -1.969 1.00 62.42 N ATOM 2976 H HIS A 617 67.442 69.057 0.483 1.00 0.00 H ATOM 2977 N TYR A 618 68.761 66.131 -0.060 1.00 44.75 N ATOM 2978 CA TYR A 618 68.996 64.677 -0.015 1.00 44.71 C ATOM 2979 C TYR A 618 68.111 63.944 -1.051 1.00 49.20 C ATOM 2980 O TYR A 618 68.562 62.979 -1.679 1.00 48.62 O ATOM 2981 CB TYR A 618 68.717 64.093 1.385 1.00 44.23 C ATOM 2982 CG TYR A 618 69.758 64.339 2.462 1.00 46.56 C ATOM 2983 CD1 TYR A 618 70.995 64.915 2.157 1.00 49.33 C ATOM 2984 CD2 TYR A 618 69.512 63.985 3.786 1.00 46.98 C ATOM 2985 CE1 TYR A 618 71.964 65.117 3.146 1.00 49.08 C ATOM 2986 CE2 TYR A 618 70.472 64.173 4.778 1.00 48.59 C ATOM 2987 CZ TYR A 618 71.698 64.732 4.453 1.00 52.42 C ATOM 2988 OH TYR A 618 72.603 64.951 5.454 1.00 53.47 O ATOM 2989 HH TYR A 618 73.424 65.351 5.073 1.00 0.00 H ATOM 2990 H TYR A 618 68.380 66.607 0.782 1.00 0.00 H ATOM 2991 N ARG A 619 66.853 64.403 -1.204 1.00 46.17 N ATOM 2992 CA ARG A 619 65.889 63.828 -2.147 1.00 47.37 C ATOM 2993 C ARG A 619 66.402 63.976 -3.581 1.00 53.72 C ATOM 2994 O ARG A 619 66.448 62.984 -4.300 1.00 53.78 O ATOM 2995 CB ARG A 619 64.473 64.406 -1.927 1.00 43.69 C ATOM 2996 CG ARG A 619 63.501 64.201 -3.088 1.00 52.48 C ATOM 2997 CD ARG A 619 62.051 64.420 -2.677 1.00 54.47 C ATOM 2998 NE ARG A 619 61.824 65.690 -1.969 1.00 54.26 N ATOM 2999 CZ ARG A 619 61.724 66.878 -2.562 1.00 68.24 C ATOM 3000 NH1 ARG A 619 61.837 66.983 -3.885 1.00 53.40 N ATOM 3001 NH2 ARG A 619 61.510 67.969 -1.838 1.00 53.98 N ATOM 3002 HE ARG A 619 61.736 65.657 -0.933 1.00 0.00 H ATOM 3003 HH12 ARG A 619 61.758 67.914 -4.341 1.00 0.00 H ATOM 3004 HH11 ARG A 619 62.004 66.134 -4.462 1.00 0.00 H ATOM 3005 HH22 ARG A 619 61.432 68.895 -2.304 1.00 0.00 H ATOM 3006 HH21 ARG A 619 61.420 67.898 -0.804 1.00 0.00 H ATOM 3007 H ARG A 619 66.550 65.209 -0.621 1.00 0.00 H ATOM 3008 N LEU A 620 66.864 65.181 -3.958 1.00 53.68 N ATOM 3009 CA LEU A 620 67.440 65.450 -5.288 1.00 57.08 C ATOM 3010 C LEU A 620 68.655 64.571 -5.594 1.00 60.82 C ATOM 3011 O LEU A 620 68.870 64.204 -6.749 1.00 63.18 O ATOM 3012 CB LEU A 620 67.798 66.946 -5.453 1.00 59.36 C ATOM 3013 CG LEU A 620 66.618 67.928 -5.224 1.00 65.20 C ATOM 3014 CD1 LEU A 620 67.091 69.367 -5.208 1.00 67.03 C ATOM 3015 CD2 LEU A 620 65.455 67.711 -6.236 1.00 67.63 C ATOM 3016 H LEU A 620 66.812 65.964 -3.276 1.00 0.00 H ATOM 3017 N LEU A 621 69.389 64.171 -4.556 1.00 55.39 N ATOM 3018 CA LEU A 621 70.592 63.348 -4.654 1.00 56.64 C ATOM 3019 C LEU A 621 70.368 61.857 -4.393 1.00 57.83 C ATOM 3020 O LEU A 621 71.315 61.085 -4.524 1.00 57.25 O ATOM 3021 CB LEU A 621 71.645 63.906 -3.667 1.00 57.97 C ATOM 3022 CG LEU A 621 72.855 64.654 -4.267 1.00 67.33 C ATOM 3023 CD1 LEU A 621 72.434 65.925 -5.023 1.00 68.94 C ATOM 3024 CD2 LEU A 621 73.841 65.012 -3.178 1.00 71.55 C ATOM 3025 H LEU A 621 69.083 64.466 -3.607 1.00 0.00 H ATOM 3026 N HIS A 622 69.145 61.454 -3.952 1.00 52.93 N ATOM 3027 CA HIS A 622 68.808 60.068 -3.587 1.00 51.62 C ATOM 3028 C HIS A 622 69.660 59.597 -2.377 1.00 56.13 C ATOM 3029 O HIS A 622 70.056 58.440 -2.280 1.00 56.55 O ATOM 3030 CB HIS A 622 68.880 59.088 -4.795 1.00 53.16 C ATOM 3031 CG HIS A 622 68.023 59.455 -5.976 1.00 56.14 C ATOM 3032 ND1 HIS A 622 67.965 58.639 -7.097 1.00 58.90 N ATOM 3033 CD2 HIS A 622 67.233 60.536 -6.187 1.00 57.00 C ATOM 3034 CE1 HIS A 622 67.140 59.239 -7.943 1.00 57.94 C ATOM 3035 NE2 HIS A 622 66.670 60.382 -7.442 1.00 57.51 N ATOM 3036 H HIS A 622 68.399 62.173 -3.867 1.00 0.00 H ATOM 3037 N ARG A 623 69.924 60.514 -1.451 1.00 53.41 N ATOM 3038 CA ARG A 623 70.700 60.223 -0.259 1.00 54.40 C ATOM 3039 C ARG A 623 69.776 59.850 0.911 1.00 56.92 C ATOM 3040 O ARG A 623 68.733 60.467 1.096 1.00 54.08 O ATOM 3041 CB ARG A 623 71.603 61.420 0.102 1.00 55.94 C ATOM 3042 H ARG A 623 69.560 61.479 -1.586 1.00 0.00 H ATOM 3043 N TYR A 624 70.160 58.841 1.693 1.00 55.36 N ATOM 3044 CA TYR A 624 69.397 58.422 2.866 1.00 55.39 C ATOM 3045 C TYR A 624 69.417 59.511 3.959 1.00 56.69 C ATOM 3046 O TYR A 624 70.375 60.272 4.064 1.00 57.07 O ATOM 3047 CB TYR A 624 69.946 57.097 3.422 1.00 58.60 C ATOM 3048 CG TYR A 624 69.702 55.931 2.493 1.00 63.73 C ATOM 3049 CD1 TYR A 624 68.523 55.192 2.563 1.00 65.34 C ATOM 3050 CD2 TYR A 624 70.636 55.579 1.523 1.00 67.03 C ATOM 3051 CE1 TYR A 624 68.290 54.118 1.704 1.00 68.07 C ATOM 3052 CE2 TYR A 624 70.397 54.532 0.634 1.00 69.06 C ATOM 3053 CZ TYR A 624 69.235 53.787 0.743 1.00 76.20 C ATOM 3054 OH TYR A 624 69.017 52.738 -0.121 1.00 78.87 O ATOM 3055 HH TYR A 624 69.743 52.073 -0.021 1.00 0.00 H ATOM 3056 H TYR A 624 71.037 58.333 1.459 1.00 0.00 H ATOM 3057 N CYS A 625 68.330 59.608 4.707 1.00 49.59 N ATOM 3058 CA CYS A 625 68.146 60.542 5.824 1.00 48.72 C ATOM 3059 C CYS A 625 68.532 59.792 7.082 1.00 50.68 C ATOM 3060 O CYS A 625 68.356 58.570 7.143 1.00 51.36 O ATOM 3061 CB CYS A 625 66.679 60.990 5.908 1.00 47.50 C ATOM 3062 SG CYS A 625 66.091 61.953 4.487 1.00 51.34 S ATOM 3063 H CYS A 625 67.540 58.969 4.485 1.00 0.00 H ATOM 3064 N VAL A 626 68.913 60.513 8.124 1.00 45.38 N ATOM 3065 CA VAL A 626 69.198 59.889 9.416 1.00 45.22 C ATOM 3066 C VAL A 626 67.853 59.786 10.176 1.00 46.66 C ATOM 3067 O VAL A 626 67.597 58.816 10.889 1.00 46.49 O ATOM 3068 CB VAL A 626 70.292 60.676 10.193 1.00 49.48 C ATOM 3069 CG1 VAL A 626 70.450 60.164 11.626 1.00 49.91 C ATOM 3070 CG2 VAL A 626 71.626 60.621 9.448 1.00 49.71 C ATOM 3071 H VAL A 626 69.012 61.543 8.022 1.00 0.00 H ATOM 3072 N PHE A 627 67.010 60.807 10.018 1.00 42.05 N ATOM 3073 CA PHE A 627 65.693 60.909 10.637 1.00 40.75 C ATOM 3074 C PHE A 627 64.785 61.665 9.696 1.00 42.62 C ATOM 3075 O PHE A 627 65.256 62.266 8.720 1.00 40.28 O ATOM 3076 CB PHE A 627 65.778 61.618 12.015 1.00 42.91 C ATOM 3077 CG PHE A 627 66.305 63.041 11.987 1.00 44.34 C ATOM 3078 CD1 PHE A 627 67.677 63.297 12.045 1.00 46.36 C ATOM 3079 CD2 PHE A 627 65.430 64.125 11.905 1.00 43.60 C ATOM 3080 CE1 PHE A 627 68.167 64.613 11.998 1.00 47.27 C ATOM 3081 CE2 PHE A 627 65.917 65.434 11.847 1.00 46.83 C ATOM 3082 CZ PHE A 627 67.287 65.673 11.918 1.00 45.87 C ATOM 3083 H PHE A 627 67.315 61.591 9.406 1.00 0.00 H ATOM 3084 N SER A 628 63.475 61.639 9.996 1.00 39.00 N ATOM 3085 CA SER A 628 62.480 62.399 9.258 1.00 38.06 C ATOM 3086 C SER A 628 62.392 63.769 9.945 1.00 40.65 C ATOM 3087 O SER A 628 62.170 63.846 11.151 1.00 39.76 O ATOM 3088 CB SER A 628 61.115 61.697 9.293 1.00 39.21 C ATOM 3089 OG SER A 628 60.069 62.547 8.845 1.00 42.25 O ATOM 3090 HG SER A 628 60.250 62.827 7.913 1.00 0.00 H ATOM 3091 H SER A 628 63.159 61.049 10.792 1.00 0.00 H ATOM 3092 N HIS A 629 62.615 64.831 9.178 1.00 38.38 N ATOM 3093 CA HIS A 629 62.514 66.213 9.643 1.00 37.94 C ATOM 3094 C HIS A 629 61.040 66.534 10.004 1.00 40.41 C ATOM 3095 O HIS A 629 60.783 67.198 11.012 1.00 41.37 O ATOM 3096 CB HIS A 629 63.077 67.187 8.573 1.00 38.14 C ATOM 3097 CG HIS A 629 63.059 68.627 8.989 1.00 41.33 C ATOM 3098 ND1 HIS A 629 64.179 69.233 9.531 1.00 43.22 N ATOM 3099 CD2 HIS A 629 62.048 69.530 8.955 1.00 41.87 C ATOM 3100 CE1 HIS A 629 63.821 70.477 9.807 1.00 42.35 C ATOM 3101 NE2 HIS A 629 62.551 70.705 9.488 1.00 42.07 N ATOM 3102 H HIS A 629 62.878 64.669 8.185 1.00 0.00 H ATOM 3103 N ASP A 630 60.078 66.059 9.193 1.00 36.62 N ATOM 3104 CA ASP A 630 58.643 66.287 9.446 1.00 35.09 C ATOM 3105 C ASP A 630 58.164 65.613 10.713 1.00 38.78 C ATOM 3106 O ASP A 630 57.425 66.217 11.494 1.00 38.07 O ATOM 3107 CB ASP A 630 57.781 65.900 8.237 1.00 35.41 C ATOM 3108 CG ASP A 630 58.039 66.776 7.024 1.00 46.71 C ATOM 3109 OD1 ASP A 630 58.602 67.907 7.202 1.00 46.52 O ATOM 3110 OD2 ASP A 630 57.699 66.339 5.892 1.00 48.26 O ATOM 3111 H ASP A 630 60.357 65.510 8.355 1.00 0.00 H ATOM 3112 N GLU A 631 58.633 64.386 10.944 1.00 34.90 N ATOM 3113 CA GLU A 631 58.336 63.644 12.160 1.00 34.85 C ATOM 3114 C GLU A 631 58.840 64.419 13.395 1.00 40.76 C ATOM 3115 O GLU A 631 58.139 64.473 14.393 1.00 41.90 O ATOM 3116 CB GLU A 631 58.986 62.251 12.097 1.00 34.94 C ATOM 3117 CG GLU A 631 58.691 61.398 13.315 1.00 41.58 C ATOM 3118 CD GLU A 631 59.262 59.998 13.300 1.00 49.35 C ATOM 3119 OE1 GLU A 631 59.698 59.529 12.225 1.00 46.13 O ATOM 3120 OE2 GLU A 631 59.268 59.365 14.377 1.00 53.74 O ATOM 3121 H GLU A 631 59.237 63.940 10.224 1.00 0.00 H ATOM 3122 N MET A 632 60.035 65.014 13.329 1.00 38.06 N ATOM 3123 CA MET A 632 60.598 65.793 14.443 1.00 39.12 C ATOM 3124 C MET A 632 59.713 67.028 14.739 1.00 41.51 C ATOM 3125 O MET A 632 59.386 67.283 15.897 1.00 39.65 O ATOM 3126 CB MET A 632 62.064 66.179 14.118 1.00 43.11 C ATOM 3127 CG MET A 632 62.656 67.279 15.019 1.00 49.59 C ATOM 3128 SD MET A 632 64.070 68.116 14.223 1.00 57.77 S ATOM 3129 CE MET A 632 63.216 69.080 12.986 1.00 53.55 C ATOM 3130 H MET A 632 60.590 64.923 12.454 1.00 0.00 H ATOM 3131 N ILE A 633 59.304 67.764 13.674 1.00 39.43 N ATOM 3132 CA ILE A 633 58.430 68.943 13.747 1.00 39.77 C ATOM 3133 C ILE A 633 57.085 68.576 14.413 1.00 42.61 C ATOM 3134 O ILE A 633 56.660 69.270 15.337 1.00 40.60 O ATOM 3135 CB ILE A 633 58.233 69.581 12.324 1.00 42.37 C ATOM 3136 CG1 ILE A 633 59.540 70.204 11.796 1.00 43.78 C ATOM 3137 CG2 ILE A 633 57.063 70.591 12.274 1.00 42.30 C ATOM 3138 CD1 ILE A 633 60.173 71.382 12.695 1.00 45.54 C ATOM 3139 H ILE A 633 59.635 67.470 12.733 1.00 0.00 H ATOM 3140 N CYS A 634 56.447 67.482 13.952 1.00 38.92 N ATOM 3141 CA CYS A 634 55.159 67.023 14.482 1.00 40.09 C ATOM 3142 C CYS A 634 55.263 66.536 15.937 1.00 43.54 C ATOM 3143 O CYS A 634 54.366 66.795 16.738 1.00 43.23 O ATOM 3144 CB CYS A 634 54.519 65.990 13.555 1.00 39.73 C ATOM 3145 SG CYS A 634 53.982 66.683 11.960 1.00 43.68 S ATOM 3146 H CYS A 634 56.889 66.938 13.184 1.00 0.00 H ATOM 3147 N LYS A 635 56.393 65.915 16.290 1.00 41.36 N ATOM 3148 CA LYS A 635 56.655 65.485 17.662 1.00 41.26 C ATOM 3149 C LYS A 635 56.732 66.730 18.580 1.00 45.87 C ATOM 3150 O LYS A 635 56.151 66.729 19.663 1.00 45.06 O ATOM 3151 CB LYS A 635 57.942 64.650 17.735 1.00 42.26 C ATOM 3152 CG LYS A 635 58.308 64.168 19.157 1.00 52.22 C ATOM 3153 CD LYS A 635 57.333 63.098 19.697 1.00 61.81 C ATOM 3154 CE LYS A 635 57.586 62.780 21.149 1.00 67.81 C ATOM 3155 H LYS A 635 57.112 65.731 15.562 1.00 0.00 H ATOM 3156 N MET A 636 57.424 67.788 18.128 1.00 43.76 N ATOM 3157 CA MET A 636 57.532 69.036 18.883 1.00 44.41 C ATOM 3158 C MET A 636 56.158 69.713 19.008 1.00 47.51 C ATOM 3159 O MET A 636 55.792 70.145 20.113 1.00 47.56 O ATOM 3160 CB MET A 636 58.570 69.956 18.251 1.00 47.25 C ATOM 3161 CG MET A 636 59.974 69.401 18.373 1.00 52.29 C ATOM 3162 SD MET A 636 61.202 70.490 17.641 1.00 58.28 S ATOM 3163 CE MET A 636 61.508 71.450 18.991 1.00 55.67 C ATOM 3164 H MET A 636 57.901 67.718 17.207 1.00 0.00 H ATOM 3165 N ALA A 637 55.360 69.711 17.911 1.00 41.25 N ATOM 3166 CA ALA A 637 54.006 70.273 17.919 1.00 41.91 C ATOM 3167 C ALA A 637 53.119 69.546 18.944 1.00 48.57 C ATOM 3168 O ALA A 637 52.371 70.200 19.663 1.00 47.83 O ATOM 3169 CB ALA A 637 53.380 70.220 16.524 1.00 41.01 C ATOM 3170 H ALA A 637 55.723 69.294 17.030 1.00 0.00 H ATOM 3171 N SER A 638 53.253 68.204 19.054 1.00 47.09 N ATOM 3172 CA SER A 638 52.486 67.400 20.020 1.00 47.92 C ATOM 3173 C SER A 638 52.916 67.672 21.483 1.00 52.66 C ATOM 3174 O SER A 638 52.209 67.278 22.403 1.00 53.85 O ATOM 3175 CB SER A 638 52.593 65.908 19.695 1.00 51.24 C ATOM 3176 OG SER A 638 53.825 65.373 20.155 1.00 59.97 O ATOM 3177 HG SER A 638 54.574 65.848 19.716 1.00 0.00 H ATOM 3178 H SER A 638 53.928 67.719 18.429 1.00 0.00 H ATOM 3179 N LYS A 639 54.067 68.335 21.690 1.00 48.82 N ATOM 3180 CA LYS A 639 54.580 68.690 23.014 1.00 49.47 C ATOM 3181 C LYS A 639 54.621 70.232 23.172 1.00 51.93 C ATOM 3182 O LYS A 639 55.417 70.740 23.967 1.00 50.95 O ATOM 3183 CB LYS A 639 56.009 68.104 23.203 1.00 53.00 C ATOM 3184 CG LYS A 639 56.139 66.573 23.100 1.00 65.25 C ATOM 3185 CD LYS A 639 55.690 65.829 24.359 1.00 75.99 C ATOM 3186 H LYS A 639 54.627 68.613 20.859 1.00 0.00 H ATOM 3187 N ALA A 640 53.791 70.976 22.387 1.00 47.61 N ATOM 3188 CA ALA A 640 53.776 72.448 22.403 1.00 48.92 C ATOM 3189 C ALA A 640 53.718 73.066 23.810 1.00 55.65 C ATOM 3190 O ALA A 640 54.480 73.993 24.083 1.00 54.36 O ATOM 3191 CB ALA A 640 52.654 72.990 21.532 1.00 48.91 C ATOM 3192 H ALA A 640 53.138 70.481 21.747 1.00 0.00 H ATOM 3193 N ASP A 641 52.880 72.499 24.713 1.00 55.23 N ATOM 3194 CA ASP A 641 52.709 72.956 26.104 1.00 57.98 C ATOM 3195 C ASP A 641 54.002 73.002 26.935 1.00 64.97 C ATOM 3196 O ASP A 641 54.113 73.862 27.801 1.00 67.29 O ATOM 3197 CB ASP A 641 51.633 72.127 26.841 1.00 60.47 C ATOM 3198 CG ASP A 641 51.814 70.611 26.874 1.00 74.67 C ATOM 3199 OD1 ASP A 641 52.665 70.089 26.112 1.00 73.52 O ATOM 3200 OD2 ASP A 641 51.059 69.940 27.615 1.00 84.38 O ATOM 3201 H ASP A 641 52.317 71.682 24.401 1.00 0.00 H ATOM 3202 N VAL A 642 54.988 72.127 26.648 1.00 61.48 N ATOM 3203 CA VAL A 642 56.248 72.072 27.408 1.00 62.33 C ATOM 3204 C VAL A 642 57.464 72.642 26.648 1.00 65.53 C ATOM 3205 O VAL A 642 58.573 72.586 27.185 1.00 67.17 O ATOM 3206 CB VAL A 642 56.553 70.646 27.970 1.00 66.40 C ATOM 3207 CG1 VAL A 642 55.559 70.257 29.062 1.00 67.51 C ATOM 3208 CG2 VAL A 642 56.594 69.587 26.867 1.00 64.28 C ATOM 3209 H VAL A 642 54.853 71.464 25.858 1.00 0.00 H ATOM 3210 N LEU A 643 57.280 73.195 25.429 1.00 59.43 N ATOM 3211 CA LEU A 643 58.413 73.734 24.666 1.00 58.10 C ATOM 3212 C LEU A 643 58.818 75.105 25.121 1.00 64.39 C ATOM 3213 O LEU A 643 57.981 75.870 25.594 1.00 64.64 O ATOM 3214 CB LEU A 643 58.122 73.827 23.152 1.00 56.01 C ATOM 3215 CG LEU A 643 58.049 72.574 22.315 1.00 56.66 C ATOM 3216 CD1 LEU A 643 57.599 72.928 20.927 1.00 54.30 C ATOM 3217 CD2 LEU A 643 59.395 71.845 22.261 1.00 55.98 C ATOM 3218 H LEU A 643 56.323 73.240 25.025 1.00 0.00 H ATOM 3219 N ASP A 644 60.094 75.464 24.865 1.00 62.14 N ATOM 3220 CA ASP A 644 60.601 76.812 25.097 1.00 63.81 C ATOM 3221 C ASP A 644 59.817 77.708 24.114 1.00 66.06 C ATOM 3222 O ASP A 644 59.513 77.273 22.999 1.00 64.58 O ATOM 3223 CB ASP A 644 62.112 76.862 24.816 1.00 66.60 C ATOM 3224 CG ASP A 644 62.723 78.246 24.811 1.00 83.16 C ATOM 3225 OD1 ASP A 644 62.949 78.796 25.905 1.00 88.46 O ATOM 3226 OD2 ASP A 644 63.011 78.765 23.709 1.00 87.97 O ATOM 3227 H ASP A 644 60.745 74.747 24.485 1.00 0.00 H ATOM 3228 N VAL A 645 59.447 78.910 24.558 1.00 62.87 N ATOM 3229 CA VAL A 645 58.638 79.892 23.830 1.00 62.79 C ATOM 3230 C VAL A 645 59.260 80.293 22.474 1.00 65.25 C ATOM 3231 O VAL A 645 58.533 80.345 21.478 1.00 63.15 O ATOM 3232 CB VAL A 645 58.323 81.098 24.751 1.00 68.94 C ATOM 3233 CG1 VAL A 645 57.958 82.358 23.964 1.00 69.64 C ATOM 3234 CG2 VAL A 645 57.212 80.727 25.729 1.00 69.03 C ATOM 3235 H VAL A 645 59.763 79.176 25.512 1.00 0.00 H ATOM 3236 N VAL A 646 60.583 80.545 22.434 1.00 62.43 N ATOM 3237 CA VAL A 646 61.302 80.893 21.195 1.00 62.21 C ATOM 3238 C VAL A 646 61.324 79.677 20.263 1.00 62.26 C ATOM 3239 O VAL A 646 61.177 79.838 19.049 1.00 62.92 O ATOM 3240 CB VAL A 646 62.728 81.470 21.462 1.00 68.20 C ATOM 3241 CG1 VAL A 646 63.459 81.782 20.155 1.00 68.19 C ATOM 3242 CG2 VAL A 646 62.658 82.720 22.334 1.00 70.17 C ATOM 3243 H VAL A 646 61.124 80.491 23.321 1.00 0.00 H ATOM 3244 N VAL A 647 61.475 78.464 20.842 1.00 55.02 N ATOM 3245 CA VAL A 647 61.458 77.197 20.111 1.00 52.39 C ATOM 3246 C VAL A 647 60.067 76.993 19.461 1.00 53.92 C ATOM 3247 O VAL A 647 60.003 76.681 18.269 1.00 53.14 O ATOM 3248 CB VAL A 647 61.874 75.998 21.016 1.00 55.78 C ATOM 3249 CG1 VAL A 647 61.553 74.654 20.364 1.00 53.91 C ATOM 3250 CG2 VAL A 647 63.350 76.071 21.398 1.00 56.54 C ATOM 3251 H VAL A 647 61.612 78.430 21.872 1.00 0.00 H ATOM 3252 N ALA A 648 58.965 77.180 20.241 1.00 48.80 N ATOM 3253 CA ALA A 648 57.584 77.017 19.750 1.00 47.13 C ATOM 3254 C ALA A 648 57.310 77.951 18.573 1.00 48.94 C ATOM 3255 O ALA A 648 56.756 77.515 17.574 1.00 47.19 O ATOM 3256 CB ALA A 648 56.576 77.251 20.874 1.00 48.05 C ATOM 3257 H ALA A 648 59.105 77.452 21.235 1.00 0.00 H ATOM 3258 N SER A 649 57.782 79.204 18.667 1.00 46.79 N ATOM 3259 CA SER A 649 57.637 80.231 17.632 1.00 47.50 C ATOM 3260 C SER A 649 58.304 79.822 16.295 1.00 50.37 C ATOM 3261 O SER A 649 57.690 79.953 15.235 1.00 49.48 O ATOM 3262 CB SER A 649 58.203 81.554 18.140 1.00 52.02 C ATOM 3263 OG SER A 649 58.043 82.570 17.168 1.00 63.55 O ATOM 3264 HG SER A 649 58.416 83.419 17.515 1.00 0.00 H ATOM 3265 H SER A 649 58.287 79.465 19.538 1.00 0.00 H ATOM 3266 N THR A 650 59.542 79.296 16.370 1.00 47.28 N ATOM 3267 CA THR A 650 60.331 78.840 15.220 1.00 46.43 C ATOM 3268 C THR A 650 59.762 77.562 14.598 1.00 48.62 C ATOM 3269 O THR A 650 59.710 77.462 13.376 1.00 48.28 O ATOM 3270 CB THR A 650 61.812 78.719 15.609 1.00 50.91 C ATOM 3271 OG1 THR A 650 62.179 79.911 16.306 1.00 55.34 O ATOM 3272 CG2 THR A 650 62.711 78.585 14.401 1.00 48.18 C ATOM 3273 HG1 THR A 650 61.617 80.005 17.116 1.00 0.00 H ATOM 3274 H THR A 650 59.970 79.206 17.313 1.00 0.00 H ATOM 3275 N VAL A 651 59.338 76.592 15.431 1.00 44.47 N ATOM 3276 CA VAL A 651 58.725 75.344 14.966 1.00 42.99 C ATOM 3277 C VAL A 651 57.445 75.670 14.217 1.00 47.51 C ATOM 3278 O VAL A 651 57.178 75.072 13.173 1.00 46.30 O ATOM 3279 CB VAL A 651 58.475 74.335 16.125 1.00 45.92 C ATOM 3280 CG1 VAL A 651 57.675 73.120 15.651 1.00 44.84 C ATOM 3281 CG2 VAL A 651 59.791 73.884 16.733 1.00 45.77 C ATOM 3282 H VAL A 651 59.451 76.736 16.455 1.00 0.00 H ATOM 3283 N GLN A 652 56.649 76.620 14.757 1.00 45.55 N ATOM 3284 CA GLN A 652 55.387 77.022 14.141 1.00 46.01 C ATOM 3285 C GLN A 652 55.596 77.497 12.677 1.00 47.28 C ATOM 3286 O GLN A 652 54.843 77.087 11.789 1.00 44.99 O ATOM 3287 CB GLN A 652 54.692 78.100 14.995 1.00 48.69 C ATOM 3288 CG GLN A 652 53.283 78.401 14.529 1.00 59.90 C ATOM 3289 CD GLN A 652 53.111 79.868 14.289 1.00 90.88 C ATOM 3290 OE1 GLN A 652 52.962 80.662 15.228 1.00 87.10 O ATOM 3291 NE2 GLN A 652 53.139 80.261 13.021 1.00 91.85 N ATOM 3292 HE22 GLN A 652 53.266 79.561 12.262 1.00 0.00 H ATOM 3293 HE21 GLN A 652 53.034 81.269 12.786 1.00 0.00 H ATOM 3294 H GLN A 652 56.945 77.080 15.641 1.00 0.00 H ATOM 3295 N LYS A 653 56.636 78.324 12.452 1.00 45.19 N ATOM 3296 CA LYS A 653 57.012 78.854 11.141 1.00 45.95 C ATOM 3297 C LYS A 653 57.406 77.742 10.142 1.00 48.48 C ATOM 3298 O LYS A 653 57.003 77.814 8.989 1.00 48.28 O ATOM 3299 CB LYS A 653 58.108 79.927 11.269 1.00 48.61 C ATOM 3300 CG LYS A 653 57.588 81.258 11.800 1.00 63.09 C ATOM 3301 CD LYS A 653 58.720 82.223 12.138 1.00 75.21 C ATOM 3302 H LYS A 653 57.213 78.606 13.270 1.00 0.00 H ATOM 3303 N ASP A 654 58.145 76.712 10.587 1.00 44.78 N ATOM 3304 CA ASP A 654 58.530 75.589 9.723 1.00 44.15 C ATOM 3305 C ASP A 654 57.312 74.704 9.432 1.00 47.41 C ATOM 3306 O ASP A 654 57.126 74.244 8.300 1.00 45.45 O ATOM 3307 CB ASP A 654 59.673 74.765 10.349 1.00 46.11 C ATOM 3308 CG ASP A 654 60.337 73.791 9.372 1.00 56.46 C ATOM 3309 OD1 ASP A 654 60.838 74.245 8.325 1.00 59.60 O ATOM 3310 OD2 ASP A 654 60.367 72.587 9.664 1.00 57.90 O ATOM 3311 H ASP A 654 58.456 76.710 11.580 1.00 0.00 H ATOM 3312 N MET A 655 56.461 74.501 10.465 1.00 44.86 N ATOM 3313 CA MET A 655 55.232 73.741 10.343 1.00 43.58 C ATOM 3314 C MET A 655 54.265 74.344 9.308 1.00 47.50 C ATOM 3315 O MET A 655 53.648 73.589 8.552 1.00 46.31 O ATOM 3316 CB MET A 655 54.576 73.548 11.708 1.00 45.87 C ATOM 3317 CG MET A 655 53.550 72.494 11.667 1.00 49.61 C ATOM 3318 SD MET A 655 52.984 71.900 13.247 1.00 53.95 S ATOM 3319 CE MET A 655 51.870 70.652 12.680 1.00 50.60 C ATOM 3320 H MET A 655 56.700 74.910 11.391 1.00 0.00 H ATOM 3321 N ALA A 656 54.180 75.693 9.234 1.00 46.08 N ATOM 3322 CA ALA A 656 53.351 76.399 8.252 1.00 46.77 C ATOM 3323 C ALA A 656 53.820 76.108 6.829 1.00 50.83 C ATOM 3324 O ALA A 656 52.976 75.868 5.973 1.00 51.43 O ATOM 3325 CB ALA A 656 53.346 77.899 8.523 1.00 48.88 C ATOM 3326 H ALA A 656 54.732 76.259 9.910 1.00 0.00 H ATOM 3327 N ILE A 657 55.155 76.045 6.595 1.00 47.19 N ATOM 3328 CA ILE A 657 55.732 75.701 5.287 1.00 46.79 C ATOM 3329 C ILE A 657 55.409 74.232 4.959 1.00 47.24 C ATOM 3330 O ILE A 657 54.876 73.946 3.892 1.00 45.95 O ATOM 3331 CB ILE A 657 57.256 76.061 5.193 1.00 50.22 C ATOM 3332 CG1 ILE A 657 57.432 77.586 5.085 1.00 51.82 C ATOM 3333 CG2 ILE A 657 57.966 75.358 3.998 1.00 49.56 C ATOM 3334 CD1 ILE A 657 58.731 78.115 5.654 1.00 56.32 C ATOM 3335 H ILE A 657 55.804 76.251 7.381 1.00 0.00 H ATOM 3336 N MET A 658 55.655 73.327 5.918 1.00 42.44 N ATOM 3337 CA MET A 658 55.376 71.906 5.786 1.00 40.35 C ATOM 3338 C MET A 658 53.908 71.672 5.374 1.00 46.24 C ATOM 3339 O MET A 658 53.664 70.899 4.455 1.00 46.26 O ATOM 3340 CB MET A 658 55.694 71.184 7.112 1.00 41.26 C ATOM 3341 CG MET A 658 55.492 69.672 7.071 1.00 43.29 C ATOM 3342 SD MET A 658 55.603 68.912 8.715 1.00 46.98 S ATOM 3343 CE MET A 658 53.974 69.367 9.413 1.00 43.92 C ATOM 3344 H MET A 658 56.071 73.662 6.810 1.00 0.00 H ATOM 3345 N ILE A 659 52.947 72.326 6.061 1.00 43.26 N ATOM 3346 CA ILE A 659 51.521 72.162 5.787 1.00 43.21 C ATOM 3347 C ILE A 659 51.154 72.653 4.380 1.00 49.83 C ATOM 3348 O ILE A 659 50.459 71.942 3.661 1.00 50.39 O ATOM 3349 CB ILE A 659 50.632 72.787 6.899 1.00 45.61 C ATOM 3350 CG1 ILE A 659 50.809 72.023 8.229 1.00 44.31 C ATOM 3351 CG2 ILE A 659 49.121 72.841 6.473 1.00 45.24 C ATOM 3352 CD1 ILE A 659 50.349 72.813 9.493 1.00 48.20 C ATOM 3353 H ILE A 659 53.235 72.976 6.820 1.00 0.00 H ATOM 3354 N GLU A 660 51.630 73.835 3.989 1.00 48.20 N ATOM 3355 CA GLU A 660 51.349 74.371 2.661 1.00 49.72 C ATOM 3356 C GLU A 660 51.970 73.528 1.541 1.00 52.70 C ATOM 3357 O GLU A 660 51.325 73.344 0.516 1.00 52.67 O ATOM 3358 CB GLU A 660 51.727 75.859 2.547 1.00 52.75 C ATOM 3359 CG GLU A 660 50.715 76.779 3.225 1.00 70.46 C ATOM 3360 CD GLU A 660 49.236 76.498 2.976 1.00 94.27 C ATOM 3361 OE1 GLU A 660 48.753 76.801 1.859 1.00 89.54 O ATOM 3362 OE2 GLU A 660 48.561 75.977 3.900 1.00 75.98 O ATOM 3363 H GLU A 660 52.216 74.389 4.646 1.00 0.00 H ATOM 3364 N ASP A 661 53.183 72.981 1.747 1.00 48.05 N ATOM 3365 CA ASP A 661 53.814 72.099 0.767 1.00 47.02 C ATOM 3366 C ASP A 661 53.061 70.783 0.653 1.00 49.10 C ATOM 3367 O ASP A 661 52.906 70.288 -0.462 1.00 48.56 O ATOM 3368 CB ASP A 661 55.291 71.833 1.085 1.00 48.28 C ATOM 3369 CG ASP A 661 56.197 73.050 0.989 1.00 64.70 C ATOM 3370 OD1 ASP A 661 55.711 74.128 0.552 1.00 66.71 O ATOM 3371 OD2 ASP A 661 57.384 72.941 1.398 1.00 70.62 O ATOM 3372 H ASP A 661 53.687 73.193 2.632 1.00 0.00 H ATOM 3373 N GLU A 662 52.606 70.220 1.805 1.00 44.98 N ATOM 3374 CA GLU A 662 51.852 68.967 1.901 1.00 43.96 C ATOM 3375 C GLU A 662 50.504 69.082 1.215 1.00 47.84 C ATOM 3376 O GLU A 662 50.111 68.183 0.476 1.00 47.48 O ATOM 3377 CB GLU A 662 51.687 68.536 3.378 1.00 44.71 C ATOM 3378 CG GLU A 662 51.157 67.124 3.588 1.00 49.06 C ATOM 3379 CD GLU A 662 51.919 65.963 2.958 1.00 58.87 C ATOM 3380 OE1 GLU A 662 53.098 66.125 2.575 1.00 59.36 O ATOM 3381 OE2 GLU A 662 51.323 64.870 2.860 1.00 52.76 O ATOM 3382 H GLU A 662 52.811 70.721 2.693 1.00 0.00 H ATOM 3383 N LYS A 663 49.806 70.193 1.453 1.00 45.22 N ATOM 3384 CA LYS A 663 48.527 70.517 0.836 1.00 46.19 C ATOM 3385 C LYS A 663 48.686 70.501 -0.710 1.00 50.61 C ATOM 3386 O LYS A 663 47.899 69.843 -1.396 1.00 49.68 O ATOM 3387 CB LYS A 663 48.044 71.893 1.346 1.00 48.63 C ATOM 3388 CG LYS A 663 46.690 72.350 0.829 1.00 54.06 C ATOM 3389 CD LYS A 663 46.282 73.646 1.528 1.00 65.40 C ATOM 3390 CE LYS A 663 45.056 74.274 0.905 1.00 77.70 C ATOM 3391 H LYS A 663 50.203 70.877 2.128 1.00 0.00 H ATOM 3392 N ALA A 664 49.737 71.162 -1.232 1.00 48.44 N ATOM 3393 CA ALA A 664 50.006 71.205 -2.681 1.00 49.25 C ATOM 3394 C ALA A 664 50.357 69.826 -3.254 1.00 51.96 C ATOM 3395 O ALA A 664 49.903 69.503 -4.348 1.00 51.17 O ATOM 3396 CB ALA A 664 51.110 72.207 -2.996 1.00 50.37 C ATOM 3397 H ALA A 664 50.384 71.661 -0.588 1.00 0.00 H ATOM 3398 N LEU A 665 51.159 69.022 -2.522 1.00 47.61 N ATOM 3399 CA LEU A 665 51.536 67.672 -2.965 1.00 46.94 C ATOM 3400 C LEU A 665 50.324 66.743 -3.043 1.00 46.77 C ATOM 3401 O LEU A 665 50.215 66.004 -4.005 1.00 46.58 O ATOM 3402 CB LEU A 665 52.619 67.041 -2.069 1.00 45.95 C ATOM 3403 CG LEU A 665 54.062 67.481 -2.330 1.00 51.13 C ATOM 3404 CD1 LEU A 665 54.966 67.072 -1.163 1.00 48.84 C ATOM 3405 CD2 LEU A 665 54.608 66.887 -3.646 1.00 52.60 C ATOM 3406 H LEU A 665 51.523 69.371 -1.612 1.00 0.00 H ATOM 3407 N ARG A 666 49.425 66.783 -2.040 1.00 42.73 N ATOM 3408 CA ARG A 666 48.216 65.950 -2.017 1.00 42.47 C ATOM 3409 C ARG A 666 47.272 66.330 -3.151 1.00 46.54 C ATOM 3410 O ARG A 666 46.708 65.439 -3.782 1.00 46.59 O ATOM 3411 CB ARG A 666 47.499 65.987 -0.661 1.00 40.04 C ATOM 3412 CG ARG A 666 48.285 65.278 0.423 1.00 43.33 C ATOM 3413 CD ARG A 666 47.610 65.348 1.789 1.00 39.50 C ATOM 3414 NE ARG A 666 48.564 64.931 2.828 1.00 46.41 N ATOM 3415 CZ ARG A 666 48.251 64.650 4.087 1.00 49.96 C ATOM 3416 NH1 ARG A 666 46.988 64.681 4.485 1.00 42.62 N ATOM 3417 NH2 ARG A 666 49.199 64.307 4.953 1.00 42.18 N ATOM 3418 HE ARG A 666 49.564 64.850 2.554 1.00 0.00 H ATOM 3419 HH12 ARG A 666 46.748 64.460 5.473 1.00 0.00 H ATOM 3420 HH11 ARG A 666 46.236 64.926 3.810 1.00 0.00 H ATOM 3421 HH22 ARG A 666 48.949 64.088 5.938 1.00 0.00 H ATOM 3422 HH21 ARG A 666 50.191 64.258 4.645 1.00 0.00 H ATOM 3423 H ARG A 666 49.595 67.433 -1.246 1.00 0.00 H ATOM 3424 N GLU A 667 47.142 67.632 -3.447 1.00 43.79 N ATOM 3425 CA GLU A 667 46.291 68.094 -4.550 1.00 45.80 C ATOM 3426 C GLU A 667 46.787 67.562 -5.907 1.00 49.40 C ATOM 3427 O GLU A 667 45.984 67.122 -6.721 1.00 49.29 O ATOM 3428 CB GLU A 667 46.179 69.623 -4.554 1.00 48.83 C ATOM 3429 CG GLU A 667 45.261 70.157 -3.463 1.00 64.89 C ATOM 3430 CD GLU A 667 45.353 71.647 -3.189 1.00 96.37 C ATOM 3431 OE1 GLU A 667 46.296 72.296 -3.698 1.00 95.31 O ATOM 3432 OE2 GLU A 667 44.490 72.162 -2.442 1.00 91.63 O ATOM 3433 H GLU A 667 47.659 68.334 -2.879 1.00 0.00 H ATOM 3434 N THR A 668 48.112 67.566 -6.115 1.00 46.87 N ATOM 3435 CA THR A 668 48.776 67.055 -7.312 1.00 47.36 C ATOM 3436 C THR A 668 48.549 65.533 -7.463 1.00 50.07 C ATOM 3437 O THR A 668 48.231 65.088 -8.562 1.00 51.40 O ATOM 3438 CB THR A 668 50.280 67.412 -7.269 1.00 52.30 C ATOM 3439 OG1 THR A 668 50.403 68.826 -7.288 1.00 58.05 O ATOM 3440 CG2 THR A 668 51.072 66.829 -8.437 1.00 49.37 C ATOM 3441 HG1 THR A 668 49.940 69.207 -6.500 1.00 0.00 H ATOM 3442 H THR A 668 48.714 67.964 -5.366 1.00 0.00 H ATOM 3443 N VAL A 669 48.715 64.745 -6.375 1.00 45.02 N ATOM 3444 CA VAL A 669 48.541 63.288 -6.474 1.00 44.04 C ATOM 3445 C VAL A 669 47.063 62.943 -6.699 1.00 45.18 C ATOM 3446 O VAL A 669 46.791 62.000 -7.432 1.00 43.87 O ATOM 3447 CB VAL A 669 49.224 62.440 -5.365 1.00 46.99 C ATOM 3448 CG1 VAL A 669 50.678 62.866 -5.208 1.00 46.41 C ATOM 3449 CG2 VAL A 669 48.492 62.517 -4.028 1.00 46.20 C ATOM 3450 H VAL A 669 48.968 65.173 -5.462 1.00 0.00 H ATOM 3451 N ARG A 670 46.126 63.740 -6.144 1.00 41.53 N ATOM 3452 CA ARG A 670 44.695 63.557 -6.398 1.00 42.78 C ATOM 3453 C ARG A 670 44.384 63.807 -7.897 1.00 46.93 C ATOM 3454 O ARG A 670 43.613 63.064 -8.485 1.00 47.92 O ATOM 3455 CB ARG A 670 43.838 64.465 -5.490 1.00 42.78 C ATOM 3456 CG ARG A 670 42.333 64.395 -5.776 1.00 46.02 C ATOM 3457 CD ARG A 670 41.802 62.990 -5.564 1.00 47.40 C ATOM 3458 NE ARG A 670 40.412 62.849 -5.981 1.00 50.15 N ATOM 3459 CZ ARG A 670 40.020 62.544 -7.211 1.00 56.76 C ATOM 3460 NH1 ARG A 670 40.911 62.375 -8.178 1.00 47.98 N ATOM 3461 NH2 ARG A 670 38.735 62.425 -7.489 1.00 47.09 N ATOM 3462 HE ARG A 670 39.675 62.998 -5.263 1.00 0.00 H ATOM 3463 HH12 ARG A 670 40.596 62.136 -9.140 1.00 0.00 H ATOM 3464 HH11 ARG A 670 41.925 62.481 -7.975 1.00 0.00 H ATOM 3465 HH22 ARG A 670 38.432 62.186 -8.455 1.00 0.00 H ATOM 3466 HH21 ARG A 670 38.026 62.571 -6.742 1.00 0.00 H ATOM 3467 H ARG A 670 46.430 64.510 -5.515 1.00 0.00 H ATOM 3468 N LYS A 671 45.041 64.792 -8.518 1.00 44.45 N ATOM 3469 CA LYS A 671 44.860 65.090 -9.943 1.00 46.00 C ATOM 3470 C LYS A 671 45.476 64.008 -10.858 1.00 49.52 C ATOM 3471 O LYS A 671 45.091 63.902 -12.020 1.00 49.52 O ATOM 3472 CB LYS A 671 45.348 66.502 -10.294 1.00 48.07 C ATOM 3473 CG LYS A 671 44.399 67.579 -9.809 1.00 54.74 C ATOM 3474 CD LYS A 671 44.970 68.975 -10.078 1.00 66.86 C ATOM 3475 CE LYS A 671 43.983 70.082 -9.791 1.00 77.07 C ATOM 3476 H LYS A 671 45.708 65.371 -7.968 1.00 0.00 H ATOM 3477 N LEU A 672 46.372 63.170 -10.312 1.00 45.75 N ATOM 3478 CA LEU A 672 46.979 62.048 -11.039 1.00 46.03 C ATOM 3479 C LEU A 672 46.067 60.805 -11.017 1.00 49.65 C ATOM 3480 O LEU A 672 46.290 59.857 -11.787 1.00 49.59 O ATOM 3481 CB LEU A 672 48.401 61.724 -10.517 1.00 45.16 C ATOM 3482 CG LEU A 672 49.499 62.772 -10.798 1.00 50.49 C ATOM 3483 CD1 LEU A 672 50.771 62.447 -10.025 1.00 50.55 C ATOM 3484 CD2 LEU A 672 49.790 62.924 -12.315 1.00 52.19 C ATOM 3485 H LEU A 672 46.651 63.324 -9.322 1.00 0.00 H ATOM 3486 N GLY A 673 45.013 60.853 -10.193 1.00 44.55 N ATOM 3487 CA GLY A 673 44.016 59.792 -10.124 1.00 44.63 C ATOM 3488 C GLY A 673 44.112 58.887 -8.909 1.00 47.90 C ATOM 3489 O GLY A 673 43.421 57.866 -8.851 1.00 48.72 O ATOM 3490 H GLY A 673 44.901 61.683 -9.576 1.00 0.00 H ATOM 3491 N VAL A 674 44.943 59.251 -7.919 1.00 42.43 N ATOM 3492 CA VAL A 674 45.016 58.497 -6.657 1.00 40.77 C ATOM 3493 C VAL A 674 43.796 58.970 -5.852 1.00 45.48 C ATOM 3494 O VAL A 674 43.674 60.157 -5.546 1.00 44.91 O ATOM 3495 CB VAL A 674 46.349 58.674 -5.867 1.00 41.82 C ATOM 3496 CG1 VAL A 674 46.334 57.824 -4.585 1.00 40.58 C ATOM 3497 CG2 VAL A 674 47.556 58.305 -6.728 1.00 41.32 C ATOM 3498 H VAL A 674 45.550 60.086 -8.047 1.00 0.00 H ATOM 3499 N ILE A 675 42.873 58.056 -5.568 1.00 44.41 N ATOM 3500 CA ILE A 675 41.635 58.410 -4.885 1.00 45.68 C ATOM 3501 C ILE A 675 41.538 57.796 -3.493 1.00 49.86 C ATOM 3502 O ILE A 675 41.186 58.507 -2.544 1.00 50.98 O ATOM 3503 CB ILE A 675 40.399 58.086 -5.754 1.00 51.06 C ATOM 3504 CG1 ILE A 675 40.459 58.822 -7.123 1.00 52.68 C ATOM 3505 CG2 ILE A 675 39.133 58.463 -4.988 1.00 54.71 C ATOM 3506 CD1 ILE A 675 39.524 58.262 -8.226 1.00 60.93 C ATOM 3507 H ILE A 675 43.038 57.066 -5.839 1.00 0.00 H ATOM 3508 N ASP A 676 41.828 56.492 -3.370 1.00 45.35 N ATOM 3509 CA ASP A 676 41.786 55.807 -2.084 1.00 45.89 C ATOM 3510 C ASP A 676 42.870 56.339 -1.126 1.00 47.17 C ATOM 3511 O ASP A 676 43.955 56.739 -1.551 1.00 43.05 O ATOM 3512 CB ASP A 676 41.945 54.302 -2.281 1.00 50.09 C ATOM 3513 CG ASP A 676 41.157 53.429 -1.323 1.00 77.53 C ATOM 3514 OD1 ASP A 676 40.131 53.913 -0.771 1.00 82.76 O ATOM 3515 OD2 ASP A 676 41.527 52.245 -1.163 1.00 88.16 O ATOM 3516 H ASP A 676 42.091 55.953 -4.219 1.00 0.00 H ATOM 3517 N SER A 677 42.554 56.369 0.166 1.00 43.92 N ATOM 3518 CA SER A 677 43.501 56.848 1.158 1.00 42.85 C ATOM 3519 C SER A 677 43.257 56.113 2.465 1.00 46.10 C ATOM 3520 O SER A 677 42.167 55.587 2.685 1.00 44.20 O ATOM 3521 CB SER A 677 43.378 58.362 1.348 1.00 44.96 C ATOM 3522 OG SER A 677 42.127 58.684 1.936 1.00 52.77 O ATOM 3523 HG SER A 677 41.396 58.371 1.346 1.00 0.00 H ATOM 3524 H SER A 677 41.614 56.044 0.471 1.00 0.00 H ATOM 3525 N GLU A 678 44.282 56.052 3.319 1.00 41.49 N ATOM 3526 CA GLU A 678 44.162 55.422 4.622 1.00 41.25 C ATOM 3527 C GLU A 678 45.229 56.016 5.522 1.00 42.58 C ATOM 3528 O GLU A 678 46.363 56.205 5.083 1.00 39.72 O ATOM 3529 CB GLU A 678 44.298 53.885 4.515 1.00 43.54 C ATOM 3530 CG GLU A 678 43.889 53.168 5.799 1.00 58.00 C ATOM 3531 CD GLU A 678 44.084 51.662 5.871 1.00 86.53 C ATOM 3532 OE1 GLU A 678 44.116 51.006 4.803 1.00 92.98 O ATOM 3533 OE2 GLU A 678 44.152 51.132 7.007 1.00 75.33 O ATOM 3534 H GLU A 678 45.194 56.468 3.042 1.00 0.00 H ATOM 3535 N ARG A 679 44.878 56.314 6.762 1.00 39.54 N ATOM 3536 CA ARG A 679 45.827 56.850 7.718 1.00 39.15 C ATOM 3537 C ARG A 679 46.858 55.790 8.077 1.00 42.00 C ATOM 3538 O ARG A 679 46.528 54.635 8.190 1.00 41.28 O ATOM 3539 CB ARG A 679 45.115 57.324 8.980 1.00 39.51 C ATOM 3540 CG ARG A 679 46.047 57.915 10.016 1.00 48.86 C ATOM 3541 CD ARG A 679 45.364 58.182 11.339 1.00 57.84 C ATOM 3542 NE ARG A 679 44.240 59.090 11.180 1.00 71.55 N ATOM 3543 CZ ARG A 679 44.278 60.394 11.422 1.00 81.11 C ATOM 3544 NH1 ARG A 679 45.387 60.973 11.854 1.00 49.80 N ATOM 3545 NH2 ARG A 679 43.187 61.118 11.235 1.00 73.82 N ATOM 3546 HE ARG A 679 43.339 58.687 10.852 1.00 0.00 H ATOM 3547 HH12 ARG A 679 45.401 61.996 12.039 1.00 0.00 H ATOM 3548 HH11 ARG A 679 46.244 60.405 12.008 1.00 0.00 H ATOM 3549 HH22 ARG A 679 43.204 62.141 11.421 1.00 0.00 H ATOM 3550 HH21 ARG A 679 42.313 60.664 10.902 1.00 0.00 H ATOM 3551 H ARG A 679 43.894 56.159 7.060 1.00 0.00 H ATOM 3552 N MET A 680 48.114 56.187 8.204 1.00 38.46 N ATOM 3553 CA MET A 680 49.169 55.265 8.574 1.00 38.58 C ATOM 3554 C MET A 680 50.116 55.898 9.575 1.00 41.35 C ATOM 3555 O MET A 680 50.544 57.013 9.374 1.00 39.58 O ATOM 3556 CB MET A 680 49.942 54.840 7.335 1.00 40.74 C ATOM 3557 CG MET A 680 50.847 53.646 7.535 1.00 45.18 C ATOM 3558 SD MET A 680 51.599 53.071 6.014 1.00 50.80 S ATOM 3559 CE MET A 680 52.780 54.351 5.713 1.00 46.78 C ATOM 3560 H MET A 680 48.350 57.186 8.034 1.00 0.00 H ATOM 3561 N ASP A 681 50.462 55.169 10.631 1.00 38.32 N ATOM 3562 CA ASP A 681 51.393 55.651 11.647 1.00 36.70 C ATOM 3563 C ASP A 681 52.818 55.326 11.222 1.00 39.30 C ATOM 3564 O ASP A 681 53.403 54.369 11.682 1.00 39.21 O ATOM 3565 CB ASP A 681 51.098 55.015 13.003 1.00 38.15 C ATOM 3566 CG ASP A 681 49.742 55.399 13.553 1.00 44.82 C ATOM 3567 OD1 ASP A 681 49.229 56.467 13.216 1.00 48.28 O ATOM 3568 OD2 ASP A 681 49.178 54.626 14.332 1.00 48.28 O ATOM 3569 H ASP A 681 50.054 54.218 10.738 1.00 0.00 H ATOM 3570 N PHE A 682 53.360 56.156 10.347 1.00 37.02 N ATOM 3571 CA PHE A 682 54.706 56.003 9.774 1.00 36.53 C ATOM 3572 C PHE A 682 55.808 55.896 10.826 1.00 41.07 C ATOM 3573 O PHE A 682 56.771 55.152 10.602 1.00 39.45 O ATOM 3574 CB PHE A 682 55.028 57.155 8.818 1.00 37.40 C ATOM 3575 CG PHE A 682 54.294 57.147 7.497 1.00 38.12 C ATOM 3576 CD1 PHE A 682 53.060 57.772 7.368 1.00 39.20 C ATOM 3577 CD2 PHE A 682 54.880 56.597 6.360 1.00 40.21 C ATOM 3578 CE1 PHE A 682 52.401 57.813 6.144 1.00 40.42 C ATOM 3579 CE2 PHE A 682 54.232 56.662 5.124 1.00 42.93 C ATOM 3580 CZ PHE A 682 52.987 57.260 5.025 1.00 40.58 C ATOM 3581 H PHE A 682 52.795 56.974 10.043 1.00 0.00 H ATOM 3582 N GLU A 683 55.653 56.596 11.999 1.00 37.05 N ATOM 3583 CA GLU A 683 56.673 56.541 13.065 1.00 38.04 C ATOM 3584 C GLU A 683 56.872 55.124 13.628 1.00 41.79 C ATOM 3585 O GLU A 683 57.915 54.854 14.210 1.00 42.70 O ATOM 3586 CB GLU A 683 56.423 57.580 14.195 1.00 39.22 C ATOM 3587 CG GLU A 683 55.240 57.288 15.116 1.00 43.16 C ATOM 3588 CD GLU A 683 53.839 57.562 14.593 1.00 54.41 C ATOM 3589 OE1 GLU A 683 53.678 57.921 13.403 1.00 45.78 O ATOM 3590 OE2 GLU A 683 52.894 57.458 15.406 1.00 55.82 O ATOM 3591 H GLU A 683 54.801 57.176 12.138 1.00 0.00 H ATOM 3592 N LEU A 684 55.897 54.220 13.436 1.00 37.32 N ATOM 3593 CA LEU A 684 56.023 52.830 13.932 1.00 37.21 C ATOM 3594 C LEU A 684 56.834 51.934 13.004 1.00 40.77 C ATOM 3595 O LEU A 684 57.290 50.853 13.389 1.00 42.04 O ATOM 3596 CB LEU A 684 54.623 52.209 14.177 1.00 36.41 C ATOM 3597 CG LEU A 684 53.685 52.975 15.108 1.00 38.14 C ATOM 3598 CD1 LEU A 684 52.317 52.311 15.122 1.00 38.08 C ATOM 3599 CD2 LEU A 684 54.265 53.058 16.558 1.00 38.25 C ATOM 3600 H LEU A 684 55.035 54.502 12.928 1.00 0.00 H ATOM 3601 N LEU A 685 56.995 52.345 11.778 1.00 39.69 N ATOM 3602 CA LEU A 685 57.762 51.514 10.851 1.00 41.31 C ATOM 3603 C LEU A 685 59.239 51.706 11.057 1.00 47.64 C ATOM 3604 O LEU A 685 59.668 52.852 11.149 1.00 48.06 O ATOM 3605 CB LEU A 685 57.430 51.845 9.393 1.00 40.31 C ATOM 3606 CG LEU A 685 56.123 51.320 8.839 1.00 45.09 C ATOM 3607 CD1 LEU A 685 55.748 52.076 7.576 1.00 44.71 C ATOM 3608 CD2 LEU A 685 56.180 49.801 8.584 1.00 45.85 C ATOM 3609 H LEU A 685 56.585 53.248 11.464 1.00 0.00 H ATOM 3610 N PRO A 686 60.062 50.634 11.045 1.00 47.21 N ATOM 3611 CA PRO A 686 61.528 50.846 11.021 1.00 48.12 C ATOM 3612 C PRO A 686 61.861 51.687 9.773 1.00 51.31 C ATOM 3613 O PRO A 686 61.106 51.649 8.791 1.00 47.56 O ATOM 3614 CB PRO A 686 62.092 49.433 10.852 1.00 50.89 C ATOM 3615 CG PRO A 686 60.997 48.521 11.272 1.00 55.95 C ATOM 3616 CD PRO A 686 59.721 49.205 10.889 1.00 49.79 C ATOM 3617 N ASP A 687 62.937 52.484 9.831 1.00 52.49 N ATOM 3618 CA ASP A 687 63.363 53.379 8.741 1.00 53.94 C ATOM 3619 C ASP A 687 63.465 52.704 7.380 1.00 58.91 C ATOM 3620 O ASP A 687 62.855 53.182 6.409 1.00 57.47 O ATOM 3621 CB ASP A 687 64.685 54.078 9.099 1.00 57.79 C ATOM 3622 CG ASP A 687 64.539 55.326 9.972 1.00 75.01 C ATOM 3623 OD1 ASP A 687 63.391 55.653 10.369 1.00 73.87 O ATOM 3624 OD2 ASP A 687 65.567 55.988 10.236 1.00 86.38 O ATOM 3625 H ASP A 687 63.507 52.470 10.701 1.00 0.00 H ATOM 3626 N ASP A 688 64.155 51.545 7.330 1.00 56.89 N ATOM 3627 CA ASP A 688 64.343 50.737 6.117 1.00 57.95 C ATOM 3628 C ASP A 688 63.015 50.297 5.517 1.00 58.06 C ATOM 3629 O ASP A 688 62.993 49.855 4.375 1.00 57.22 O ATOM 3630 CB ASP A 688 65.262 49.511 6.400 1.00 62.72 C ATOM 3631 CG ASP A 688 64.698 48.533 7.425 1.00 83.30 C ATOM 3632 OD1 ASP A 688 64.564 48.921 8.612 1.00 84.96 O ATOM 3633 OD2 ASP A 688 64.385 47.386 7.040 1.00 93.65 O ATOM 3634 H ASP A 688 64.584 51.199 8.212 1.00 0.00 H ATOM 3635 N GLU A 689 61.901 50.434 6.276 1.00 51.82 N ATOM 3636 CA GLU A 689 60.575 50.062 5.787 1.00 50.20 C ATOM 3637 C GLU A 689 59.753 51.285 5.345 1.00 49.28 C ATOM 3638 O GLU A 689 58.595 51.136 4.961 1.00 47.86 O ATOM 3639 CB GLU A 689 59.829 49.189 6.818 1.00 52.42 C ATOM 3640 CG GLU A 689 60.413 47.785 6.946 1.00 63.37 C ATOM 3641 CD GLU A 689 59.724 46.854 7.926 1.00 79.48 C ATOM 3642 OE1 GLU A 689 58.479 46.911 8.041 1.00 65.04 O ATOM 3643 OE2 GLU A 689 60.429 46.020 8.537 1.00 83.66 O ATOM 3644 H GLU A 689 61.993 50.817 7.239 1.00 0.00 H ATOM 3645 N ARG A 690 60.343 52.491 5.363 1.00 45.13 N ATOM 3646 CA ARG A 690 59.559 53.652 4.953 1.00 44.50 C ATOM 3647 C ARG A 690 60.361 54.655 4.092 1.00 45.64 C ATOM 3648 O ARG A 690 60.057 55.841 4.057 1.00 43.88 O ATOM 3649 CB ARG A 690 58.845 54.326 6.153 1.00 44.32 C ATOM 3650 CG ARG A 690 59.690 54.554 7.391 1.00 45.59 C ATOM 3651 CD ARG A 690 58.985 55.608 8.212 1.00 47.92 C ATOM 3652 NE ARG A 690 59.556 55.739 9.546 1.00 42.16 N ATOM 3653 CZ ARG A 690 59.571 56.865 10.253 1.00 48.71 C ATOM 3654 NH1 ARG A 690 59.088 57.992 9.736 1.00 35.61 N ATOM 3655 NH2 ARG A 690 60.068 56.876 11.477 1.00 38.70 N ATOM 3656 HE ARG A 690 59.982 54.893 9.975 1.00 0.00 H ATOM 3657 HH12 ARG A 690 59.103 58.869 10.295 1.00 0.00 H ATOM 3658 HH11 ARG A 690 58.695 57.996 8.773 1.00 0.00 H ATOM 3659 HH22 ARG A 690 60.078 57.759 12.026 1.00 0.00 H ATOM 3660 HH21 ARG A 690 60.450 56.002 11.891 1.00 0.00 H ATOM 3661 H ARG A 690 61.334 52.595 5.662 1.00 0.00 H ATOM 3662 N GLN A 691 61.319 54.148 3.332 1.00 42.20 N ATOM 3663 CA GLN A 691 62.088 54.963 2.391 1.00 42.14 C ATOM 3664 C GLN A 691 61.452 54.919 1.010 1.00 44.56 C ATOM 3665 O GLN A 691 61.021 53.850 0.580 1.00 44.99 O ATOM 3666 CB GLN A 691 63.545 54.500 2.324 1.00 43.78 C ATOM 3667 CG GLN A 691 64.281 54.951 3.584 1.00 56.52 C ATOM 3668 CD GLN A 691 65.398 54.049 4.023 1.00 80.68 C ATOM 3669 OE1 GLN A 691 65.511 52.888 3.603 1.00 74.38 O ATOM 3670 NE2 GLN A 691 66.233 54.570 4.919 1.00 78.19 N ATOM 3671 HE22 GLN A 691 66.102 55.549 5.244 1.00 0.00 H ATOM 3672 HE21 GLN A 691 67.017 53.998 5.294 1.00 0.00 H ATOM 3673 H GLN A 691 61.533 53.133 3.406 1.00 0.00 H ATOM 3674 N CYS A 692 61.398 56.073 0.320 1.00 38.92 N ATOM 3675 CA CYS A 692 60.893 56.179 -1.054 1.00 37.82 C ATOM 3676 C CYS A 692 61.803 55.284 -1.920 1.00 45.20 C ATOM 3677 O CYS A 692 63.026 55.361 -1.801 1.00 46.21 O ATOM 3678 CB CYS A 692 60.926 57.636 -1.523 1.00 36.69 C ATOM 3679 SG CYS A 692 60.486 57.887 -3.279 1.00 40.11 S ATOM 3680 H CYS A 692 61.733 56.940 0.787 1.00 0.00 H ATOM 3681 N VAL A 693 61.206 54.402 -2.727 1.00 43.36 N ATOM 3682 CA VAL A 693 61.887 53.471 -3.646 1.00 45.83 C ATOM 3683 C VAL A 693 62.856 54.251 -4.571 1.00 50.36 C ATOM 3684 O VAL A 693 63.959 53.791 -4.849 1.00 50.27 O ATOM 3685 CB VAL A 693 60.805 52.670 -4.463 1.00 51.81 C ATOM 3686 CG1 VAL A 693 61.348 52.134 -5.783 1.00 53.46 C ATOM 3687 CG2 VAL A 693 60.221 51.537 -3.631 1.00 51.91 C ATOM 3688 H VAL A 693 60.167 54.369 -2.705 1.00 0.00 H ATOM 3689 N LYS A 694 62.423 55.433 -5.028 1.00 47.25 N ATOM 3690 CA LYS A 694 63.179 56.291 -5.922 1.00 46.68 C ATOM 3691 C LYS A 694 64.238 57.158 -5.245 1.00 48.89 C ATOM 3692 O LYS A 694 65.402 57.047 -5.609 1.00 49.00 O ATOM 3693 CB LYS A 694 62.223 57.181 -6.755 1.00 47.69 C ATOM 3694 CG LYS A 694 62.892 57.954 -7.909 1.00 54.60 C ATOM 3695 CD LYS A 694 63.529 57.021 -8.958 1.00 59.39 C ATOM 3696 CE LYS A 694 63.918 57.719 -10.245 1.00 70.16 C ATOM 3697 H LYS A 694 61.483 55.757 -4.722 1.00 0.00 H ATOM 3698 N CYS A 695 63.830 58.095 -4.358 1.00 43.53 N ATOM 3699 CA CYS A 695 64.740 59.100 -3.797 1.00 42.75 C ATOM 3700 C CYS A 695 65.312 58.757 -2.425 1.00 45.86 C ATOM 3701 O CYS A 695 66.199 59.490 -1.928 1.00 45.45 O ATOM 3702 CB CYS A 695 64.067 60.467 -3.790 1.00 42.54 C ATOM 3703 SG CYS A 695 62.856 60.678 -2.466 1.00 45.41 S ATOM 3704 H CYS A 695 62.833 58.103 -4.063 1.00 0.00 H ATOM 3705 N LYS A 696 64.823 57.649 -1.811 1.00 40.82 N ATOM 3706 CA LYS A 696 65.272 57.132 -0.503 1.00 40.23 C ATOM 3707 C LYS A 696 64.866 58.013 0.680 1.00 42.35 C ATOM 3708 O LYS A 696 65.340 57.774 1.789 1.00 43.14 O ATOM 3709 CB LYS A 696 66.813 56.839 -0.471 1.00 44.34 C ATOM 3710 CG LYS A 696 67.370 56.071 -1.687 1.00 51.81 C ATOM 3711 CD LYS A 696 66.779 54.667 -1.859 1.00 61.49 C ATOM 3712 CE LYS A 696 66.998 54.122 -3.254 1.00 76.16 C ATOM 3713 NZ LYS A 696 66.355 52.791 -3.418 1.00 90.77 N ATOM 3714 HZ1 LYS A 696 66.763 52.124 -2.732 1.00 0.00 H ATOM 3715 HZ2 LYS A 696 65.332 52.879 -3.252 1.00 0.00 H ATOM 3716 HZ3 LYS A 696 66.522 52.443 -4.384 1.00 0.00 H ATOM 3717 H LYS A 696 64.072 57.122 -2.301 1.00 0.00 H ATOM 3718 N THR A 697 64.022 59.034 0.462 1.00 40.00 N ATOM 3719 CA THR A 697 63.580 59.899 1.558 1.00 39.60 C ATOM 3720 C THR A 697 62.801 59.087 2.603 1.00 42.67 C ATOM 3721 O THR A 697 62.073 58.167 2.223 1.00 40.80 O ATOM 3722 CB THR A 697 62.828 61.150 1.048 1.00 44.48 C ATOM 3723 OG1 THR A 697 62.934 62.160 2.045 1.00 44.53 O ATOM 3724 CG2 THR A 697 61.327 60.900 0.765 1.00 39.36 C ATOM 3725 HG1 THR A 697 63.889 62.372 2.198 1.00 0.00 H ATOM 3726 H THR A 697 63.676 59.214 -0.502 1.00 0.00 H ATOM 3727 N THR A 698 62.994 59.399 3.905 1.00 39.24 N ATOM 3728 CA THR A 698 62.246 58.743 4.985 1.00 38.73 C ATOM 3729 C THR A 698 60.848 59.351 4.979 1.00 41.60 C ATOM 3730 O THR A 698 60.710 60.546 5.228 1.00 41.09 O ATOM 3731 CB THR A 698 62.953 58.927 6.337 1.00 39.89 C ATOM 3732 OG1 THR A 698 64.205 58.294 6.224 1.00 45.03 O ATOM 3733 CG2 THR A 698 62.175 58.286 7.516 1.00 38.67 C ATOM 3734 HG1 THR A 698 64.699 58.387 7.077 1.00 0.00 H ATOM 3735 H THR A 698 63.695 60.127 4.149 1.00 0.00 H ATOM 3736 N CYS A 699 59.833 58.563 4.665 1.00 38.05 N ATOM 3737 CA CYS A 699 58.463 59.056 4.632 1.00 37.99 C ATOM 3738 C CYS A 699 57.806 59.216 6.012 1.00 38.96 C ATOM 3739 O CYS A 699 58.045 58.431 6.902 1.00 38.74 O ATOM 3740 CB CYS A 699 57.605 58.164 3.730 1.00 40.15 C ATOM 3741 SG CYS A 699 58.112 58.086 2.000 1.00 46.11 S ATOM 3742 H CYS A 699 60.018 57.566 4.436 1.00 0.00 H ATOM 3743 N PHE A 700 57.059 60.296 6.197 1.00 35.15 N ATOM 3744 CA PHE A 700 56.300 60.530 7.422 1.00 34.22 C ATOM 3745 C PHE A 700 54.905 61.102 7.174 1.00 39.43 C ATOM 3746 O PHE A 700 53.915 60.528 7.576 1.00 39.33 O ATOM 3747 CB PHE A 700 57.038 61.380 8.451 1.00 35.36 C ATOM 3748 CG PHE A 700 56.242 61.614 9.701 1.00 35.19 C ATOM 3749 CD1 PHE A 700 56.090 60.616 10.629 1.00 36.77 C ATOM 3750 CD2 PHE A 700 55.622 62.818 9.924 1.00 34.24 C ATOM 3751 CE1 PHE A 700 55.348 60.815 11.766 1.00 37.58 C ATOM 3752 CE2 PHE A 700 54.879 63.027 11.061 1.00 37.15 C ATOM 3753 CZ PHE A 700 54.742 62.023 11.985 1.00 35.54 C ATOM 3754 H PHE A 700 57.012 61.006 5.438 1.00 0.00 H ATOM 3755 N MET A 701 54.854 62.269 6.544 1.00 38.49 N ATOM 3756 CA MET A 701 53.601 62.942 6.263 1.00 38.03 C ATOM 3757 C MET A 701 52.699 62.148 5.342 1.00 40.70 C ATOM 3758 O MET A 701 51.523 62.035 5.597 1.00 39.64 O ATOM 3759 CB MET A 701 53.856 64.328 5.685 1.00 40.92 C ATOM 3760 CG MET A 701 54.400 65.318 6.694 1.00 45.97 C ATOM 3761 SD MET A 701 53.228 65.831 7.953 1.00 51.10 S ATOM 3762 CE MET A 701 52.233 66.930 6.984 1.00 47.35 C ATOM 3763 H MET A 701 55.743 62.716 6.242 1.00 0.00 H ATOM 3764 N SER A 702 53.271 61.581 4.295 1.00 37.63 N ATOM 3765 CA SER A 702 52.524 60.764 3.345 1.00 37.85 C ATOM 3766 C SER A 702 53.387 59.946 2.401 1.00 40.28 C ATOM 3767 O SER A 702 54.601 60.150 2.303 1.00 39.82 O ATOM 3768 CB SER A 702 51.541 61.615 2.545 1.00 42.18 C ATOM 3769 OG SER A 702 52.233 62.684 1.935 1.00 48.10 O ATOM 3770 HG SER A 702 52.660 63.241 2.634 1.00 0.00 H ATOM 3771 H SER A 702 54.290 61.722 4.143 1.00 0.00 H ATOM 3772 N ALA A 703 52.751 58.971 1.745 1.00 36.91 N ATOM 3773 CA ALA A 703 53.394 58.057 0.798 1.00 36.18 C ATOM 3774 C ALA A 703 52.316 57.378 -0.041 1.00 40.38 C ATOM 3775 O ALA A 703 51.129 57.459 0.283 1.00 39.49 O ATOM 3776 CB ALA A 703 54.238 57.009 1.536 1.00 36.13 C ATOM 3777 H ALA A 703 51.732 58.853 1.918 1.00 0.00 H ATOM 3778 N ILE A 704 52.734 56.737 -1.129 1.00 37.42 N ATOM 3779 CA ILE A 704 51.840 56.022 -2.020 1.00 37.35 C ATOM 3780 C ILE A 704 52.194 54.539 -1.991 1.00 40.85 C ATOM 3781 O ILE A 704 53.363 54.187 -2.074 1.00 38.06 O ATOM 3782 CB ILE A 704 51.904 56.601 -3.454 1.00 41.43 C ATOM 3783 CG1 ILE A 704 51.550 58.124 -3.502 1.00 42.46 C ATOM 3784 CG2 ILE A 704 51.046 55.768 -4.431 1.00 41.07 C ATOM 3785 CD1 ILE A 704 50.052 58.544 -3.145 1.00 42.23 C ATOM 3786 H ILE A 704 53.750 56.749 -1.351 1.00 0.00 H ATOM 3787 N SER A 705 51.174 53.672 -1.866 1.00 38.76 N ATOM 3788 CA SER A 705 51.401 52.238 -1.893 1.00 39.40 C ATOM 3789 C SER A 705 50.499 51.640 -2.949 1.00 44.07 C ATOM 3790 O SER A 705 49.512 52.261 -3.339 1.00 42.64 O ATOM 3791 CB SER A 705 51.120 51.607 -0.524 1.00 41.13 C ATOM 3792 OG SER A 705 49.773 51.774 -0.113 1.00 47.12 O ATOM 3793 HG SER A 705 49.172 51.347 -0.774 1.00 0.00 H ATOM 3794 H SER A 705 50.206 54.034 -1.748 1.00 0.00 H ATOM 3795 N CYS A 706 50.854 50.445 -3.427 1.00 43.05 N ATOM 3796 CA CYS A 706 50.033 49.639 -4.326 1.00 44.69 C ATOM 3797 C CYS A 706 50.055 48.218 -3.758 1.00 51.22 C ATOM 3798 O CYS A 706 51.107 47.746 -3.294 1.00 50.43 O ATOM 3799 CB CYS A 706 50.528 49.667 -5.767 1.00 45.19 C ATOM 3800 SG CYS A 706 49.416 48.828 -6.936 1.00 50.52 S ATOM 3801 H CYS A 706 51.777 50.063 -3.140 1.00 0.00 H ATOM 3802 N SER A 707 48.915 47.537 -3.805 1.00 49.04 N ATOM 3803 CA SER A 707 48.817 46.156 -3.320 1.00 51.01 C ATOM 3804 C SER A 707 49.699 45.163 -4.142 1.00 56.63 C ATOM 3805 O SER A 707 50.044 44.097 -3.623 1.00 56.94 O ATOM 3806 CB SER A 707 47.357 45.705 -3.264 1.00 54.44 C ATOM 3807 OG SER A 707 46.778 45.795 -4.556 1.00 67.55 O ATOM 3808 HG SER A 707 45.833 45.502 -4.514 1.00 0.00 H ATOM 3809 H SER A 707 48.068 47.996 -4.197 1.00 0.00 H ATOM 3810 N CYS A 708 50.102 45.536 -5.385 1.00 53.37 N ATOM 3811 CA CYS A 708 50.967 44.699 -6.227 1.00 54.80 C ATOM 3812 C CYS A 708 52.423 44.645 -5.730 1.00 58.40 C ATOM 3813 O CYS A 708 53.132 43.696 -6.063 1.00 58.83 O ATOM 3814 CB CYS A 708 50.886 45.110 -7.694 1.00 56.51 C ATOM 3815 SG CYS A 708 52.048 46.419 -8.172 1.00 59.87 S ATOM 3816 H CYS A 708 49.784 46.454 -5.756 1.00 0.00 H ATOM 3817 N LYS A 709 52.874 45.658 -4.950 1.00 53.64 N ATOM 3818 CA LYS A 709 54.230 45.700 -4.384 1.00 52.37 C ATOM 3819 C LYS A 709 54.162 45.828 -2.852 1.00 55.50 C ATOM 3820 O LYS A 709 54.361 46.920 -2.299 1.00 53.20 O ATOM 3821 CB LYS A 709 55.087 46.773 -5.089 1.00 54.16 C ATOM 3822 CG LYS A 709 55.547 46.271 -6.471 1.00 59.69 C ATOM 3823 CD LYS A 709 56.446 47.224 -7.210 1.00 66.36 C ATOM 3824 CE LYS A 709 56.674 46.777 -8.639 1.00 58.53 C ATOM 3825 H LYS A 709 52.228 46.446 -4.741 1.00 0.00 H ATOM 3826 N PRO A 710 53.805 44.718 -2.145 1.00 54.12 N ATOM 3827 CA PRO A 710 53.641 44.798 -0.682 1.00 53.47 C ATOM 3828 C PRO A 710 54.856 45.342 0.053 1.00 55.90 C ATOM 3829 O PRO A 710 55.979 44.926 -0.232 1.00 55.64 O ATOM 3830 CB PRO A 710 53.317 43.354 -0.271 1.00 56.85 C ATOM 3831 CG PRO A 710 52.801 42.710 -1.506 1.00 61.98 C ATOM 3832 CD PRO A 710 53.548 43.344 -2.633 1.00 57.20 C ATOM 3833 N GLY A 711 54.613 46.321 0.925 1.00 50.64 N ATOM 3834 CA GLY A 711 55.661 46.967 1.707 1.00 50.50 C ATOM 3835 C GLY A 711 56.399 48.109 1.024 1.00 53.87 C ATOM 3836 O GLY A 711 57.040 48.908 1.707 1.00 54.02 O ATOM 3837 H GLY A 711 53.631 46.639 1.053 1.00 0.00 H ATOM 3838 N LEU A 712 56.343 48.203 -0.316 1.00 49.26 N ATOM 3839 CA LEU A 712 57.049 49.281 -1.015 1.00 47.98 C ATOM 3840 C LEU A 712 56.296 50.606 -0.955 1.00 48.57 C ATOM 3841 O LEU A 712 55.069 50.636 -0.994 1.00 47.79 O ATOM 3842 CB LEU A 712 57.431 48.907 -2.459 1.00 48.80 C ATOM 3843 CG LEU A 712 58.375 47.693 -2.631 1.00 55.52 C ATOM 3844 CD1 LEU A 712 58.717 47.475 -4.100 1.00 56.71 C ATOM 3845 CD2 LEU A 712 59.682 47.847 -1.820 1.00 54.74 C ATOM 3846 H LEU A 712 55.795 47.506 -0.860 1.00 0.00 H ATOM 3847 N LEU A 713 57.033 51.698 -0.822 1.00 43.49 N ATOM 3848 CA LEU A 713 56.449 53.039 -0.763 1.00 42.15 C ATOM 3849 C LEU A 713 57.198 54.000 -1.683 1.00 45.88 C ATOM 3850 O LEU A 713 58.402 53.852 -1.907 1.00 44.40 O ATOM 3851 CB LEU A 713 56.533 53.610 0.677 1.00 41.12 C ATOM 3852 CG LEU A 713 55.733 52.922 1.806 1.00 45.35 C ATOM 3853 CD1 LEU A 713 56.105 53.539 3.169 1.00 43.40 C ATOM 3854 CD2 LEU A 713 54.201 53.057 1.576 1.00 47.59 C ATOM 3855 H LEU A 713 58.066 51.599 -0.757 1.00 0.00 H ATOM 3856 N VAL A 714 56.482 55.016 -2.172 1.00 41.62 N ATOM 3857 CA VAL A 714 57.085 56.140 -2.873 1.00 40.32 C ATOM 3858 C VAL A 714 56.602 57.404 -2.144 1.00 43.95 C ATOM 3859 O VAL A 714 55.480 57.415 -1.646 1.00 42.88 O ATOM 3860 CB VAL A 714 56.852 56.222 -4.410 1.00 42.61 C ATOM 3861 CG1 VAL A 714 57.662 55.163 -5.168 1.00 42.03 C ATOM 3862 CG2 VAL A 714 55.361 56.211 -4.793 1.00 41.23 C ATOM 3863 H VAL A 714 55.450 55.003 -2.047 1.00 0.00 H ATOM 3864 N CYS A 715 57.433 58.461 -2.087 1.00 41.25 N ATOM 3865 CA CYS A 715 56.999 59.751 -1.545 1.00 40.24 C ATOM 3866 C CYS A 715 56.087 60.408 -2.632 1.00 42.19 C ATOM 3867 O CYS A 715 56.010 59.895 -3.760 1.00 40.88 O ATOM 3868 CB CYS A 715 58.199 60.633 -1.172 1.00 39.86 C ATOM 3869 SG CYS A 715 59.070 61.377 -2.575 1.00 44.72 S ATOM 3870 H CYS A 715 58.407 58.360 -2.436 1.00 0.00 H ATOM 3871 N LEU A 716 55.429 61.525 -2.311 1.00 38.25 N ATOM 3872 CA LEU A 716 54.481 62.150 -3.240 1.00 39.36 C ATOM 3873 C LEU A 716 55.146 62.838 -4.432 1.00 44.88 C ATOM 3874 O LEU A 716 54.445 63.143 -5.379 1.00 45.68 O ATOM 3875 CB LEU A 716 53.459 63.085 -2.559 1.00 39.24 C ATOM 3876 CG LEU A 716 52.644 62.559 -1.348 1.00 43.61 C ATOM 3877 CD1 LEU A 716 51.342 63.318 -1.203 1.00 43.31 C ATOM 3878 CD2 LEU A 716 52.350 61.065 -1.420 1.00 44.12 C ATOM 3879 H LEU A 716 55.592 61.962 -1.381 1.00 0.00 H ATOM 3880 N HIS A 717 56.482 62.992 -4.441 1.00 42.56 N ATOM 3881 CA HIS A 717 57.193 63.509 -5.614 1.00 43.25 C ATOM 3882 C HIS A 717 57.397 62.380 -6.633 1.00 47.30 C ATOM 3883 O HIS A 717 57.603 62.655 -7.806 1.00 48.27 O ATOM 3884 CB HIS A 717 58.571 64.092 -5.217 1.00 44.16 C ATOM 3885 CG HIS A 717 58.466 65.313 -4.369 1.00 46.98 C ATOM 3886 ND1 HIS A 717 58.578 65.244 -2.988 1.00 47.90 N ATOM 3887 CD2 HIS A 717 58.181 66.585 -4.723 1.00 49.11 C ATOM 3888 CE1 HIS A 717 58.373 66.477 -2.549 1.00 46.94 C ATOM 3889 NE2 HIS A 717 58.134 67.319 -3.554 1.00 48.50 N ATOM 3890 H HIS A 717 57.026 62.737 -3.592 1.00 0.00 H ATOM 3891 N HIS A 718 57.347 61.115 -6.189 1.00 43.99 N ATOM 3892 CA HIS A 718 57.665 59.967 -7.045 1.00 43.41 C ATOM 3893 C HIS A 718 56.523 58.960 -7.255 1.00 46.83 C ATOM 3894 O HIS A 718 56.778 57.768 -7.429 1.00 45.85 O ATOM 3895 CB HIS A 718 58.931 59.284 -6.482 1.00 42.55 C ATOM 3896 CG HIS A 718 60.112 60.197 -6.584 1.00 46.27 C ATOM 3897 ND1 HIS A 718 60.762 60.669 -5.457 1.00 46.72 N ATOM 3898 CD2 HIS A 718 60.624 60.819 -7.679 1.00 49.04 C ATOM 3899 CE1 HIS A 718 61.670 61.524 -5.907 1.00 47.30 C ATOM 3900 NE2 HIS A 718 61.633 61.636 -7.233 1.00 49.04 N ATOM 3901 H HIS A 718 57.073 60.942 -5.201 1.00 0.00 H ATOM 3902 N VAL A 719 55.285 59.457 -7.337 1.00 45.78 N ATOM 3903 CA VAL A 719 54.059 58.677 -7.592 1.00 46.59 C ATOM 3904 C VAL A 719 54.184 57.770 -8.846 1.00 50.39 C ATOM 3905 O VAL A 719 53.737 56.620 -8.800 1.00 49.68 O ATOM 3906 CB VAL A 719 52.816 59.606 -7.636 1.00 51.72 C ATOM 3907 CG1 VAL A 719 51.528 58.831 -7.931 1.00 51.37 C ATOM 3908 CG2 VAL A 719 52.680 60.342 -6.310 1.00 51.57 C ATOM 3909 H VAL A 719 55.176 60.483 -7.210 1.00 0.00 H ATOM 3910 N LYS A 720 54.854 58.254 -9.911 1.00 47.61 N ATOM 3911 CA LYS A 720 55.052 57.516 -11.170 1.00 49.27 C ATOM 3912 C LYS A 720 56.178 56.449 -11.139 1.00 53.26 C ATOM 3913 O LYS A 720 56.377 55.756 -12.135 1.00 54.17 O ATOM 3914 CB LYS A 720 55.281 58.506 -12.340 1.00 53.64 C ATOM 3915 CG LYS A 720 54.128 59.507 -12.491 1.00 72.60 C ATOM 3916 CD LYS A 720 54.420 60.644 -13.461 1.00 79.14 C ATOM 3917 CE LYS A 720 53.300 61.659 -13.469 1.00 74.83 C ATOM 3918 H LYS A 720 55.257 59.210 -9.839 1.00 0.00 H ATOM 3919 N GLU A 721 56.866 56.278 -10.003 1.00 48.81 N ATOM 3920 CA GLU A 721 58.011 55.360 -9.866 1.00 49.75 C ATOM 3921 C GLU A 721 57.725 54.080 -9.066 1.00 53.34 C ATOM 3922 O GLU A 721 58.659 53.333 -8.763 1.00 53.92 O ATOM 3923 CB GLU A 721 59.199 56.093 -9.179 1.00 50.84 C ATOM 3924 CG GLU A 721 59.481 57.504 -9.666 1.00 60.73 C ATOM 3925 CD GLU A 721 59.969 57.668 -11.091 1.00 79.09 C ATOM 3926 OE1 GLU A 721 60.573 56.717 -11.639 1.00 68.17 O ATOM 3927 OE2 GLU A 721 59.784 58.776 -11.643 1.00 73.58 O ATOM 3928 H GLU A 721 56.575 56.825 -9.168 1.00 0.00 H ATOM 3929 N LEU A 722 56.480 53.863 -8.653 1.00 48.32 N ATOM 3930 CA LEU A 722 56.165 52.687 -7.846 1.00 47.42 C ATOM 3931 C LEU A 722 56.020 51.400 -8.680 1.00 52.73 C ATOM 3932 O LEU A 722 56.697 50.417 -8.396 1.00 52.39 O ATOM 3933 CB LEU A 722 54.908 52.951 -6.999 1.00 45.91 C ATOM 3934 CG LEU A 722 54.487 51.884 -5.988 1.00 49.42 C ATOM 3935 CD1 LEU A 722 55.574 51.634 -4.941 1.00 49.04 C ATOM 3936 CD2 LEU A 722 53.184 52.291 -5.319 1.00 48.57 C ATOM 3937 H LEU A 722 55.727 54.534 -8.906 1.00 0.00 H ATOM 3938 N CYS A 723 55.097 51.394 -9.663 1.00 50.51 N ATOM 3939 CA CYS A 723 54.766 50.231 -10.491 1.00 51.44 C ATOM 3940 C CYS A 723 54.016 50.698 -11.722 1.00 56.34 C ATOM 3941 O CYS A 723 53.759 51.890 -11.862 1.00 55.06 O ATOM 3942 CB CYS A 723 53.938 49.229 -9.689 1.00 51.82 C ATOM 3943 SG CYS A 723 52.318 49.859 -9.168 1.00 55.01 S ATOM 3944 H CYS A 723 54.583 52.279 -9.847 1.00 0.00 H ATOM 3945 N SER A 724 53.620 49.758 -12.585 1.00 55.44 N ATOM 3946 CA SER A 724 52.918 50.045 -13.830 1.00 57.15 C ATOM 3947 C SER A 724 51.375 50.083 -13.698 1.00 59.47 C ATOM 3948 O SER A 724 50.709 50.392 -14.679 1.00 60.43 O ATOM 3949 CB SER A 724 53.360 49.066 -14.915 1.00 63.70 C ATOM 3950 OG SER A 724 53.201 47.726 -14.476 1.00 78.70 O ATOM 3951 HG SER A 724 53.751 47.578 -13.667 1.00 0.00 H ATOM 3952 H SER A 724 53.824 48.764 -12.355 1.00 0.00 H ATOM 3953 N CYS A 725 50.809 49.799 -12.501 1.00 54.14 N ATOM 3954 CA CYS A 725 49.349 49.855 -12.285 1.00 53.78 C ATOM 3955 C CYS A 725 48.817 51.272 -12.536 1.00 57.54 C ATOM 3956 O CYS A 725 49.518 52.229 -12.213 1.00 56.08 O ATOM 3957 CB CYS A 725 48.982 49.411 -10.871 1.00 52.87 C ATOM 3958 SG CYS A 725 49.253 47.658 -10.531 1.00 57.66 S ATOM 3959 H CYS A 725 51.424 49.532 -11.706 1.00 0.00 H ATOM 3960 N PRO A 726 47.563 51.451 -13.010 1.00 54.82 N ATOM 3961 CA PRO A 726 47.021 52.822 -13.095 1.00 54.19 C ATOM 3962 C PRO A 726 46.886 53.415 -11.679 1.00 56.00 C ATOM 3963 O PRO A 726 46.620 52.666 -10.731 1.00 54.37 O ATOM 3964 CB PRO A 726 45.649 52.625 -13.742 1.00 56.58 C ATOM 3965 CG PRO A 726 45.293 51.212 -13.464 1.00 61.14 C ATOM 3966 CD PRO A 726 46.562 50.443 -13.422 1.00 56.63 C ATOM 3967 N PRO A 727 47.049 54.743 -11.505 1.00 52.56 N ATOM 3968 CA PRO A 727 46.979 55.335 -10.145 1.00 50.67 C ATOM 3969 C PRO A 727 45.686 55.123 -9.335 1.00 51.96 C ATOM 3970 O PRO A 727 45.749 55.279 -8.109 1.00 50.62 O ATOM 3971 CB PRO A 727 47.249 56.819 -10.394 1.00 52.98 C ATOM 3972 CG PRO A 727 48.103 56.821 -11.652 1.00 57.97 C ATOM 3973 CD PRO A 727 47.444 55.760 -12.503 1.00 54.39 C ATOM 3974 N TYR A 728 44.560 54.672 -9.948 1.00 47.85 N ATOM 3975 CA TYR A 728 43.350 54.369 -9.161 1.00 47.23 C ATOM 3976 C TYR A 728 43.523 53.107 -8.276 1.00 49.89 C ATOM 3977 O TYR A 728 42.748 52.887 -7.342 1.00 47.97 O ATOM 3978 CB TYR A 728 42.077 54.295 -10.026 1.00 50.21 C ATOM 3979 CG TYR A 728 41.986 53.118 -10.973 1.00 51.80 C ATOM 3980 CD1 TYR A 728 41.594 51.860 -10.522 1.00 52.88 C ATOM 3981 CD2 TYR A 728 42.210 53.278 -12.336 1.00 54.29 C ATOM 3982 CE1 TYR A 728 41.471 50.781 -11.401 1.00 55.09 C ATOM 3983 CE2 TYR A 728 42.009 52.227 -13.233 1.00 56.75 C ATOM 3984 CZ TYR A 728 41.671 50.973 -12.758 1.00 61.82 C ATOM 3985 OH TYR A 728 41.557 49.930 -13.639 1.00 68.32 O ATOM 3986 HH TYR A 728 41.312 49.108 -13.145 1.00 0.00 H ATOM 3987 H TYR A 728 44.552 54.540 -10.979 1.00 0.00 H ATOM 3988 N LYS A 729 44.565 52.303 -8.554 1.00 46.80 N ATOM 3989 CA LYS A 729 44.884 51.098 -7.771 1.00 45.92 C ATOM 3990 C LYS A 729 45.691 51.456 -6.511 1.00 48.26 C ATOM 3991 O LYS A 729 45.824 50.632 -5.602 1.00 48.10 O ATOM 3992 CB LYS A 729 45.667 50.093 -8.645 1.00 48.23 C ATOM 3993 CG LYS A 729 44.858 49.544 -9.833 1.00 54.55 C ATOM 3994 CD LYS A 729 44.137 48.261 -9.490 1.00 60.66 C ATOM 3995 CE LYS A 729 43.438 47.657 -10.686 1.00 60.55 C ATOM 3996 H LYS A 729 45.175 52.544 -9.361 1.00 0.00 H ATOM 3997 N TYR A 730 46.211 52.696 -6.458 1.00 43.46 N ATOM 3998 CA TYR A 730 47.055 53.183 -5.370 1.00 41.85 C ATOM 3999 C TYR A 730 46.291 53.638 -4.149 1.00 44.19 C ATOM 4000 O TYR A 730 45.111 53.960 -4.222 1.00 42.94 O ATOM 4001 CB TYR A 730 47.970 54.330 -5.844 1.00 41.85 C ATOM 4002 CG TYR A 730 48.933 54.002 -6.966 1.00 43.89 C ATOM 4003 CD1 TYR A 730 49.101 52.690 -7.414 1.00 47.38 C ATOM 4004 CD2 TYR A 730 49.669 55.003 -7.593 1.00 44.13 C ATOM 4005 CE1 TYR A 730 49.967 52.387 -8.458 1.00 48.09 C ATOM 4006 CE2 TYR A 730 50.578 54.705 -8.608 1.00 46.27 C ATOM 4007 CZ TYR A 730 50.724 53.394 -9.035 1.00 54.43 C ATOM 4008 OH TYR A 730 51.618 53.082 -10.022 1.00 52.63 O ATOM 4009 HH TYR A 730 52.529 53.339 -9.733 1.00 0.00 H ATOM 4010 H TYR A 730 45.999 53.348 -7.240 1.00 0.00 H ATOM 4011 N LYS A 731 46.986 53.711 -3.028 1.00 40.72 N ATOM 4012 CA LYS A 731 46.399 54.253 -1.816 1.00 40.88 C ATOM 4013 C LYS A 731 47.309 55.358 -1.345 1.00 43.50 C ATOM 4014 O LYS A 731 48.531 55.190 -1.318 1.00 42.90 O ATOM 4015 CB LYS A 731 46.288 53.189 -0.698 1.00 42.44 C ATOM 4016 CG LYS A 731 44.889 52.709 -0.419 1.00 57.72 C ATOM 4017 CD LYS A 731 44.878 51.679 0.696 1.00 63.94 C ATOM 4018 CE LYS A 731 43.921 50.548 0.409 1.00 68.54 C ATOM 4019 H LYS A 731 47.970 53.375 -3.014 1.00 0.00 H ATOM 4020 N LEU A 732 46.722 56.467 -0.927 1.00 39.76 N ATOM 4021 CA LEU A 732 47.494 57.517 -0.307 1.00 38.86 C ATOM 4022 C LEU A 732 47.544 57.178 1.196 1.00 41.76 C ATOM 4023 O LEU A 732 46.503 57.095 1.844 1.00 41.21 O ATOM 4024 CB LEU A 732 46.886 58.913 -0.549 1.00 39.27 C ATOM 4025 CG LEU A 732 47.426 60.044 0.384 1.00 44.08 C ATOM 4026 CD1 LEU A 732 48.869 60.424 0.055 1.00 43.20 C ATOM 4027 CD2 LEU A 732 46.509 61.258 0.378 1.00 45.71 C ATOM 4028 H LEU A 732 45.695 56.583 -1.046 1.00 0.00 H ATOM 4029 N ARG A 733 48.758 56.986 1.724 1.00 37.64 N ATOM 4030 CA ARG A 733 48.999 56.694 3.136 1.00 36.91 C ATOM 4031 C ARG A 733 49.372 58.005 3.787 1.00 39.88 C ATOM 4032 O ARG A 733 50.286 58.658 3.312 1.00 39.79 O ATOM 4033 CB ARG A 733 50.126 55.647 3.297 1.00 36.49 C ATOM 4034 CG ARG A 733 49.898 54.336 2.519 1.00 37.80 C ATOM 4035 CD ARG A 733 48.780 53.497 3.107 1.00 37.28 C ATOM 4036 NE ARG A 733 48.622 52.228 2.403 1.00 40.66 N ATOM 4037 CZ ARG A 733 47.797 51.258 2.778 1.00 52.46 C ATOM 4038 NH1 ARG A 733 47.718 50.137 2.073 1.00 40.62 N ATOM 4039 NH2 ARG A 733 47.038 51.403 3.859 1.00 35.84 N ATOM 4040 HE ARG A 733 49.195 52.073 1.549 1.00 0.00 H ATOM 4041 HH12 ARG A 733 47.070 49.380 2.371 1.00 0.00 H ATOM 4042 HH11 ARG A 733 48.304 50.015 1.222 1.00 0.00 H ATOM 4043 HH22 ARG A 733 46.393 50.640 4.148 1.00 0.00 H ATOM 4044 HH21 ARG A 733 47.088 52.280 4.416 1.00 0.00 H ATOM 4045 H ARG A 733 49.581 57.048 1.091 1.00 0.00 H ATOM 4046 N TYR A 734 48.639 58.436 4.819 1.00 37.13 N ATOM 4047 CA TYR A 734 48.921 59.738 5.436 1.00 36.75 C ATOM 4048 C TYR A 734 48.978 59.672 6.941 1.00 37.66 C ATOM 4049 O TYR A 734 48.250 58.887 7.532 1.00 36.22 O ATOM 4050 CB TYR A 734 47.875 60.792 4.940 1.00 37.23 C ATOM 4051 CG TYR A 734 46.448 60.460 5.337 1.00 38.18 C ATOM 4052 CD1 TYR A 734 45.645 59.653 4.529 1.00 38.87 C ATOM 4053 CD2 TYR A 734 45.917 60.912 6.543 1.00 39.21 C ATOM 4054 CE1 TYR A 734 44.345 59.318 4.907 1.00 36.16 C ATOM 4055 CE2 TYR A 734 44.628 60.561 6.942 1.00 41.61 C ATOM 4056 CZ TYR A 734 43.842 59.775 6.114 1.00 45.36 C ATOM 4057 OH TYR A 734 42.588 59.420 6.524 1.00 48.11 O ATOM 4058 HH TYR A 734 42.159 58.864 5.826 1.00 0.00 H ATOM 4059 H TYR A 734 47.865 57.846 5.186 1.00 0.00 H ATOM 4060 N ARG A 735 49.851 60.469 7.561 1.00 34.10 N ATOM 4061 CA ARG A 735 49.913 60.464 9.016 1.00 34.38 C ATOM 4062 C ARG A 735 48.734 61.283 9.601 1.00 38.27 C ATOM 4063 O ARG A 735 48.092 60.858 10.559 1.00 38.36 O ATOM 4064 CB ARG A 735 51.265 61.021 9.525 1.00 34.01 C ATOM 4065 CG ARG A 735 51.454 60.913 11.042 1.00 36.15 C ATOM 4066 CD ARG A 735 51.254 59.475 11.523 1.00 39.11 C ATOM 4067 NE ARG A 735 51.345 59.336 12.972 1.00 42.03 N ATOM 4068 CZ ARG A 735 50.350 59.542 13.830 1.00 50.28 C ATOM 4069 NH1 ARG A 735 49.167 59.961 13.401 1.00 38.60 N ATOM 4070 NH2 ARG A 735 50.534 59.339 15.127 1.00 45.89 N ATOM 4071 HE ARG A 735 52.264 59.052 13.367 1.00 0.00 H ATOM 4072 HH12 ARG A 735 48.394 60.120 14.079 1.00 0.00 H ATOM 4073 HH11 ARG A 735 49.012 60.131 12.387 1.00 0.00 H ATOM 4074 HH22 ARG A 735 49.753 59.501 15.795 1.00 0.00 H ATOM 4075 HH21 ARG A 735 51.459 59.017 15.477 1.00 0.00 H ATOM 4076 H ARG A 735 50.481 61.087 7.011 1.00 0.00 H ATOM 4077 N TYR A 736 48.476 62.449 9.020 1.00 34.52 N ATOM 4078 CA TYR A 736 47.468 63.387 9.493 1.00 35.83 C ATOM 4079 C TYR A 736 46.683 63.945 8.349 1.00 40.93 C ATOM 4080 O TYR A 736 47.249 64.204 7.284 1.00 40.62 O ATOM 4081 CB TYR A 736 48.157 64.607 10.169 1.00 36.26 C ATOM 4082 CG TYR A 736 49.030 64.301 11.362 1.00 37.99 C ATOM 4083 CD1 TYR A 736 48.476 63.884 12.570 1.00 39.35 C ATOM 4084 CD2 TYR A 736 50.411 64.477 11.302 1.00 38.96 C ATOM 4085 CE1 TYR A 736 49.282 63.564 13.659 1.00 39.92 C ATOM 4086 CE2 TYR A 736 51.220 64.211 12.402 1.00 40.03 C ATOM 4087 CZ TYR A 736 50.654 63.742 13.573 1.00 45.63 C ATOM 4088 OH TYR A 736 51.465 63.478 14.648 1.00 50.36 O ATOM 4089 HH TYR A 736 50.914 63.152 15.403 1.00 0.00 H ATOM 4090 H TYR A 736 49.027 62.708 8.177 1.00 0.00 H ATOM 4091 N THR A 737 45.410 64.259 8.600 1.00 40.18 N ATOM 4092 CA THR A 737 44.610 65.016 7.637 1.00 41.98 C ATOM 4093 C THR A 737 45.029 66.511 7.875 1.00 49.34 C ATOM 4094 O THR A 737 45.587 66.846 8.942 1.00 46.85 O ATOM 4095 CB THR A 737 43.103 64.882 7.926 1.00 47.51 C ATOM 4096 OG1 THR A 737 42.834 65.494 9.183 1.00 48.97 O ATOM 4097 CG2 THR A 737 42.595 63.419 7.922 1.00 43.97 C ATOM 4098 HG1 THR A 737 41.868 65.417 9.386 1.00 0.00 H ATOM 4099 H THR A 737 44.979 63.960 9.498 1.00 0.00 H ATOM 4100 N LEU A 738 44.727 67.396 6.916 1.00 51.06 N ATOM 4101 CA LEU A 738 44.968 68.840 7.058 1.00 53.88 C ATOM 4102 C LEU A 738 44.228 69.401 8.284 1.00 58.58 C ATOM 4103 O LEU A 738 44.773 70.244 8.994 1.00 59.18 O ATOM 4104 CB LEU A 738 44.592 69.601 5.774 1.00 55.69 C ATOM 4105 CG LEU A 738 45.564 69.377 4.601 1.00 61.71 C ATOM 4106 CD1 LEU A 738 44.890 69.638 3.268 1.00 63.82 C ATOM 4107 CD2 LEU A 738 46.831 70.229 4.750 1.00 64.56 C ATOM 4108 H LEU A 738 44.304 67.047 6.033 1.00 0.00 H ATOM 4109 N ASP A 739 43.051 68.845 8.591 1.00 54.95 N ATOM 4110 CA ASP A 739 42.258 69.195 9.761 1.00 56.08 C ATOM 4111 C ASP A 739 42.934 68.827 11.079 1.00 58.60 C ATOM 4112 O ASP A 739 42.646 69.473 12.075 1.00 60.82 O ATOM 4113 CB ASP A 739 40.839 68.588 9.684 1.00 60.06 C ATOM 4114 CG ASP A 739 39.894 69.223 8.661 1.00 76.16 C ATOM 4115 OD1 ASP A 739 40.335 70.144 7.925 1.00 76.26 O ATOM 4116 OD2 ASP A 739 38.713 68.782 8.584 1.00 85.48 O ATOM 4117 H ASP A 739 42.677 68.114 7.952 1.00 0.00 H ATOM 4118 N ASP A 740 43.784 67.785 11.123 1.00 52.33 N ATOM 4119 CA ASP A 740 44.512 67.434 12.351 1.00 51.11 C ATOM 4120 C ASP A 740 45.694 68.407 12.513 1.00 51.86 C ATOM 4121 O ASP A 740 46.087 68.718 13.634 1.00 52.15 O ATOM 4122 CB ASP A 740 45.118 66.000 12.280 1.00 52.94 C ATOM 4123 CG ASP A 740 44.159 64.823 12.175 1.00 64.45 C ATOM 4124 OD1 ASP A 740 43.039 64.906 12.754 1.00 69.26 O ATOM 4125 OD2 ASP A 740 44.552 63.786 11.569 1.00 59.29 O ATOM 4126 H ASP A 740 43.930 67.213 10.267 1.00 0.00 H ATOM 4127 N LEU A 741 46.282 68.845 11.389 1.00 46.35 N ATOM 4128 CA LEU A 741 47.487 69.664 11.394 1.00 46.05 C ATOM 4129 C LEU A 741 47.308 71.107 11.878 1.00 51.43 C ATOM 4130 O LEU A 741 48.184 71.594 12.600 1.00 50.08 O ATOM 4131 CB LEU A 741 48.175 69.641 10.022 1.00 45.12 C ATOM 4132 CG LEU A 741 48.810 68.314 9.624 1.00 47.24 C ATOM 4133 CD1 LEU A 741 49.006 68.248 8.131 1.00 47.64 C ATOM 4134 CD2 LEU A 741 50.102 68.022 10.414 1.00 44.47 C ATOM 4135 H LEU A 741 45.859 68.589 10.474 1.00 0.00 H ATOM 4136 N TYR A 742 46.231 71.804 11.453 1.00 50.21 N ATOM 4137 CA TYR A 742 45.971 73.206 11.839 1.00 51.83 C ATOM 4138 C TYR A 742 45.840 73.381 13.397 1.00 54.70 C ATOM 4139 O TYR A 742 46.562 74.221 13.924 1.00 54.20 O ATOM 4140 CB TYR A 742 44.801 73.808 11.035 1.00 54.95 C ATOM 4141 CG TYR A 742 45.167 74.033 9.578 1.00 57.90 C ATOM 4142 CD1 TYR A 742 46.109 74.995 9.214 1.00 60.12 C ATOM 4143 CD2 TYR A 742 44.545 73.311 8.558 1.00 58.85 C ATOM 4144 CE1 TYR A 742 46.451 75.210 7.877 1.00 61.02 C ATOM 4145 CE2 TYR A 742 44.897 73.500 7.216 1.00 59.75 C ATOM 4146 CZ TYR A 742 45.845 74.460 6.880 1.00 66.83 C ATOM 4147 OH TYR A 742 46.197 74.686 5.565 1.00 66.49 O ATOM 4148 HH TYR A 742 46.881 75.401 5.526 1.00 0.00 H ATOM 4149 H TYR A 742 45.552 71.330 10.823 1.00 0.00 H ATOM 4150 N PRO A 743 45.115 72.524 14.167 1.00 51.51 N ATOM 4151 CA PRO A 743 45.135 72.649 15.642 1.00 51.12 C ATOM 4152 C PRO A 743 46.511 72.419 16.294 1.00 54.55 C ATOM 4153 O PRO A 743 46.787 73.025 17.339 1.00 55.28 O ATOM 4154 CB PRO A 743 44.133 71.576 16.104 1.00 52.70 C ATOM 4155 CG PRO A 743 43.257 71.338 14.927 1.00 57.58 C ATOM 4156 CD PRO A 743 44.177 71.462 13.751 1.00 52.95 C ATOM 4157 N MET A 744 47.369 71.546 15.700 1.00 48.85 N ATOM 4158 CA MET A 744 48.732 71.281 16.201 1.00 48.49 C ATOM 4159 C MET A 744 49.575 72.556 16.048 1.00 51.39 C ATOM 4160 O MET A 744 50.304 72.948 16.966 1.00 49.69 O ATOM 4161 CB MET A 744 49.398 70.114 15.433 1.00 49.90 C ATOM 4162 CG MET A 744 48.763 68.752 15.708 1.00 54.04 C ATOM 4163 SD MET A 744 49.330 67.427 14.581 1.00 58.19 S ATOM 4164 CE MET A 744 51.062 67.253 15.130 1.00 54.00 C ATOM 4165 H MET A 744 47.048 71.040 14.850 1.00 0.00 H ATOM 4166 N MET A 745 49.432 73.223 14.892 1.00 48.07 N ATOM 4167 CA MET A 745 50.131 74.470 14.643 1.00 49.08 C ATOM 4168 C MET A 745 49.591 75.601 15.545 1.00 52.92 C ATOM 4169 O MET A 745 50.395 76.391 16.045 1.00 52.99 O ATOM 4170 CB MET A 745 50.107 74.830 13.157 1.00 51.60 C ATOM 4171 CG MET A 745 50.997 75.983 12.848 1.00 56.32 C ATOM 4172 SD MET A 745 51.273 76.203 11.109 1.00 60.91 S ATOM 4173 CE MET A 745 49.728 76.953 10.608 1.00 58.50 C ATOM 4174 H MET A 745 48.805 72.837 14.157 1.00 0.00 H ATOM 4175 N ASN A 746 48.263 75.618 15.824 1.00 48.69 N ATOM 4176 CA ASN A 746 47.655 76.584 16.745 1.00 49.78 C ATOM 4177 C ASN A 746 48.153 76.441 18.187 1.00 51.16 C ATOM 4178 O ASN A 746 48.271 77.444 18.886 1.00 50.92 O ATOM 4179 CB ASN A 746 46.121 76.517 16.710 1.00 55.29 C ATOM 4180 CG ASN A 746 45.503 77.245 15.548 1.00 84.71 C ATOM 4181 OD1 ASN A 746 46.043 78.243 15.050 1.00 86.43 O ATOM 4182 ND2 ASN A 746 44.336 76.778 15.109 1.00 74.61 N ATOM 4183 HD22 ASN A 746 43.913 75.937 15.552 1.00 0.00 H ATOM 4184 HD21 ASN A 746 43.848 77.254 14.324 1.00 0.00 H ATOM 4185 H ASN A 746 47.649 74.915 15.365 1.00 0.00 H ATOM 4186 N ALA A 747 48.428 75.205 18.633 1.00 47.52 N ATOM 4187 CA ALA A 747 48.965 74.923 19.982 1.00 47.49 C ATOM 4188 C ALA A 747 50.319 75.625 20.135 1.00 50.22 C ATOM 4189 O ALA A 747 50.553 76.291 21.146 1.00 50.69 O ATOM 4190 CB ALA A 747 49.114 73.408 20.194 1.00 46.60 C ATOM 4191 H ALA A 747 48.254 74.402 17.995 1.00 0.00 H ATOM 4192 N LEU A 748 51.175 75.536 19.087 1.00 45.41 N ATOM 4193 CA LEU A 748 52.479 76.199 19.029 1.00 44.84 C ATOM 4194 C LEU A 748 52.324 77.714 19.083 1.00 47.64 C ATOM 4195 O LEU A 748 53.096 78.371 19.773 1.00 47.56 O ATOM 4196 CB LEU A 748 53.261 75.801 17.757 1.00 43.60 C ATOM 4197 CG LEU A 748 53.715 74.371 17.648 1.00 46.86 C ATOM 4198 CD1 LEU A 748 54.025 74.024 16.214 1.00 46.45 C ATOM 4199 CD2 LEU A 748 54.916 74.093 18.550 1.00 48.26 C ATOM 4200 H LEU A 748 50.886 74.959 18.271 1.00 0.00 H ATOM 4201 N LYS A 749 51.338 78.264 18.352 1.00 45.57 N ATOM 4202 CA LYS A 749 51.044 79.698 18.336 1.00 47.86 C ATOM 4203 C LYS A 749 50.673 80.192 19.748 1.00 53.44 C ATOM 4204 O LYS A 749 51.230 81.194 20.208 1.00 54.20 O ATOM 4205 CB LYS A 749 49.932 80.035 17.331 1.00 50.37 C ATOM 4206 CG LYS A 749 49.913 81.522 16.968 1.00 67.05 C ATOM 4207 CD LYS A 749 48.717 81.901 16.103 1.00 83.08 C ATOM 4208 H LYS A 749 50.752 77.636 17.766 1.00 0.00 H ATOM 4209 N LEU A 750 49.781 79.458 20.442 1.00 49.64 N ATOM 4210 CA LEU A 750 49.383 79.793 21.817 1.00 51.27 C ATOM 4211 C LEU A 750 50.587 79.760 22.754 1.00 53.99 C ATOM 4212 O LEU A 750 50.793 80.709 23.495 1.00 54.43 O ATOM 4213 CB LEU A 750 48.265 78.858 22.331 1.00 51.24 C ATOM 4214 CG LEU A 750 46.862 79.065 21.750 1.00 56.81 C ATOM 4215 CD1 LEU A 750 45.841 78.216 22.485 1.00 57.76 C ATOM 4216 CD2 LEU A 750 46.434 80.539 21.806 1.00 56.92 C ATOM 4217 H LEU A 750 49.358 78.623 19.988 1.00 0.00 H ATOM 4218 N ARG A 751 51.407 78.701 22.678 1.00 49.46 N ATOM 4219 CA ARG A 751 52.613 78.584 23.480 1.00 50.73 C ATOM 4220 C ARG A 751 53.602 79.735 23.180 1.00 57.46 C ATOM 4221 O ARG A 751 54.154 80.320 24.111 1.00 57.54 O ATOM 4222 CB ARG A 751 53.281 77.208 23.276 1.00 50.94 C ATOM 4223 CG ARG A 751 54.578 77.031 24.076 1.00 61.03 C ATOM 4224 CD ARG A 751 54.346 76.934 25.575 1.00 58.93 C ATOM 4225 NE ARG A 751 55.597 77.136 26.295 1.00 68.31 N ATOM 4226 CZ ARG A 751 55.746 76.999 27.608 1.00 91.88 C ATOM 4227 NH1 ARG A 751 54.713 76.652 28.369 1.00 81.23 N ATOM 4228 NH2 ARG A 751 56.930 77.201 28.172 1.00 81.97 N ATOM 4229 HE ARG A 751 56.434 77.407 25.741 1.00 0.00 H ATOM 4230 HH12 ARG A 751 54.836 76.546 29.396 1.00 0.00 H ATOM 4231 HH11 ARG A 751 53.782 76.486 27.937 1.00 0.00 H ATOM 4232 HH22 ARG A 751 57.041 77.092 29.200 1.00 0.00 H ATOM 4233 HH21 ARG A 751 57.747 77.468 27.586 1.00 0.00 H ATOM 4234 H ARG A 751 51.170 77.933 22.018 1.00 0.00 H ATOM 4235 N ALA A 752 53.792 80.071 21.894 1.00 55.94 N ATOM 4236 CA ALA A 752 54.698 81.143 21.476 1.00 58.01 C ATOM 4237 C ALA A 752 54.206 82.523 21.892 1.00 69.44 C ATOM 4238 O ALA A 752 55.029 83.383 22.203 1.00 71.63 O ATOM 4239 CB ALA A 752 54.916 81.101 19.972 1.00 57.36 C ATOM 4240 H ALA A 752 53.272 79.546 21.162 1.00 0.00 H ATOM 4241 N GLU A 753 52.879 82.739 21.903 1.00 69.76 N ATOM 4242 CA GLU A 753 52.291 84.035 22.266 1.00 73.48 C ATOM 4243 C GLU A 753 52.121 84.238 23.785 1.00 82.94 C ATOM 4244 O GLU A 753 51.746 85.337 24.203 1.00 84.72 O ATOM 4245 CB GLU A 753 50.975 84.276 21.512 1.00 75.06 C ATOM 4246 CG GLU A 753 51.187 84.568 20.033 1.00 86.12 C ATOM 4247 CD GLU A 753 49.953 84.680 19.156 1.00107.47 C ATOM 4248 OE1 GLU A 753 48.837 84.350 19.624 1.00103.67 O ATOM 4249 OE2 GLU A 753 50.113 85.077 17.979 1.00100.64 O ATOM 4250 H GLU A 753 52.244 81.957 21.644 1.00 0.00 H ATOM 4251 N SER A 754 52.437 83.208 24.609 1.00 81.71 N ATOM 4252 CA SER A 754 52.345 83.300 26.072 1.00 84.46 C ATOM 4253 C SER A 754 53.550 84.065 26.675 1.00 92.36 C ATOM 4254 O SER A 754 54.664 83.528 26.756 1.00 91.84 O ATOM 4255 CB SER A 754 52.162 81.920 26.706 1.00 87.12 C ATOM 4256 OG SER A 754 53.329 81.118 26.632 1.00 95.39 O ATOM 4257 HG SER A 754 53.576 80.983 25.683 1.00 0.00 H ATOM 4258 H SER A 754 52.759 82.314 24.186 1.00 0.00 H ATOM 4259 N TYR A 755 53.317 85.339 27.057 1.00 91.47 N ATOM 4260 CA TYR A 755 54.325 86.226 27.639 1.00120.41 C ATOM 4261 CB TYR A 755 54.525 87.461 26.753 1.00122.61 C ATOM 4262 H TYR A 755 52.356 85.715 26.929 1.00 0.00 H TER 4263 TYR A 755 HETATM 4264 ZN ZN A 1 60.703 60.086 -3.438 1.00 43.68 ZN HETATM 4265 ZN ZN A 2 50.862 48.176 -8.636 1.00 48.44 ZN HETATM 4266 MN MN A 3 101.223 59.590 -0.258 1.00 66.45 MN HETATM 4267 MN MN A 4 82.552 66.690 11.325 1.00 43.17 MN HETATM 4268 O HOH 5 61.338 76.497 7.163 1.00 41.18 O HETATM 4269 O HOH 6 85.356 64.462 0.973 1.00 44.83 O HETATM 4270 O HOH 7 94.475 68.717 -4.659 1.00 67.00 O HETATM 4271 O HOH 8 70.423 69.541 19.156 1.00 56.66 O HETATM 4272 O HOH 9 53.233 49.384 -2.387 1.00 51.08 O HETATM 4273 O HOH 10 59.681 62.747 6.239 1.00 41.47 O HETATM 4274 O HOH 11 92.011 51.430 38.144 1.00 55.00 O HETATM 4275 O HOH 12 48.281 49.769 -0.987 1.00 40.86 O HETATM 4276 O HOH 13 60.154 56.910 14.841 1.00 53.40 O HETATM 4277 O HOH 14 61.449 54.524 12.181 1.00 60.71 O HETATM 4278 O HOH 15 45.228 53.506 10.208 1.00 50.86 O HETATM 4279 O HOH 16 66.043 57.836 4.366 1.00 46.87 O HETATM 4280 O HOH 17 82.295 67.571 13.334 1.00 58.48 O HETATM 4281 O HOH 18 89.711 77.028 30.830 1.00 56.44 O HETATM 4282 O HOH 19 65.296 63.315 1.554 1.00 43.34 O HETATM 4283 O HOH 20 76.373 78.060 7.984 1.00 46.88 O HETATM 4284 O HOH 21 57.557 68.112 3.894 1.00 33.49 O HETATM 4285 O HOH 22 47.547 74.320 -2.467 1.00 76.12 O HETATM 4286 O HOH 23 66.378 61.313 0.136 1.00 41.49 O HETATM 4287 O HOH 24 100.402 64.088 23.122 1.00 55.85 O HETATM 4288 O HOH 25 54.134 63.150 -8.044 1.00 62.59 O HETATM 4289 O HOH 26 56.707 49.298 4.448 1.00 62.83 O HETATM 4290 O HOH 27 110.571 60.257 3.287 1.00 61.75 O HETATM 4291 O HOH 28 97.045 70.887 22.722 1.00 46.16 O HETATM 4292 O HOH 29 65.613 58.225 8.510 1.00 53.72 O HETATM 4293 O HOH 30 104.990 53.334 16.594 1.00 62.19 O HETATM 4294 O HOH 31 102.208 62.237 23.748 1.00 54.31 O HETATM 4295 O HOH 32 91.459 63.376 18.566 1.00 39.07 O HETATM 4296 O HOH 33 87.753 53.005 16.913 1.00 65.06 O HETATM 4297 O HOH 34 84.020 54.624 23.071 1.00 69.50 O HETATM 4298 O HOH 35 50.212 62.876 16.952 1.00 64.84 O HETATM 4299 O HOH 36 44.248 61.318 -3.187 1.00 51.35 O HETATM 4300 O HOH 37 92.039 60.438 1.079 1.00 55.78 O HETATM 4301 O HOH 38 43.141 55.252 -5.528 1.00 44.46 O HETATM 4302 O HOH 39 97.818 48.950 28.903 1.00 53.94 O HETATM 4303 O HOH 40 84.224 84.305 4.000 1.00 61.87 O HETATM 4304 O HOH 41 106.695 55.307 22.842 1.00 64.32 O HETATM 4305 O HOH 42 74.889 66.240 4.828 1.00 44.56 O HETATM 4306 O HOH 43 100.082 73.686 -1.784 1.00 64.98 O HETATM 4307 O HOH 44 95.661 78.642 15.326 1.00 50.61 O HETATM 4308 O HOH 45 87.303 83.157 27.496 1.00 49.79 O HETATM 4309 O HOH 46 57.320 63.710 5.405 1.00 40.82 O HETATM 4310 O HOH 47 66.178 50.658 9.907 1.00 83.82 O HETATM 4311 O HOH 48 56.266 80.030 7.628 1.00 59.04 O HETATM 4312 O HOH 49 43.094 65.010 -13.469 1.00 48.69 O HETATM 4313 O HOH 50 49.584 74.952 -0.789 1.00 65.07 O HETATM 4314 O HOH 51 59.174 50.850 15.331 1.00 79.13 O HETATM 4315 O HOH 52 61.405 78.026 11.343 1.00 51.27 O HETATM 4316 O HOH 53 63.576 57.469 12.369 1.00 67.69 O HETATM 4317 O HOH 54 102.109 49.854 21.629 1.00 63.91 O HETATM 4318 O HOH 55 40.134 58.883 0.113 1.00 54.13 O HETATM 4319 O HOH 56 56.465 61.603 3.629 1.00 39.63 O HETATM 4320 O HOH 57 75.762 70.160 0.237 1.00 44.58 O HETATM 4321 O HOH 58 92.192 55.006 1.456 1.00 80.07 O HETATM 4322 O HOH 59 75.080 77.084 0.750 1.00 62.99 O HETATM 4323 O HOH 60 90.411 55.186 5.448 1.00 69.68 O HETATM 4324 O HOH 61 46.587 49.588 -3.214 1.00 52.63 O HETATM 4325 O HOH 62 48.424 50.874 8.547 1.00 67.14 O HETATM 4326 O HOH 63 49.372 43.679 -1.024 1.00 77.46 O HETATM 4327 O HOH 64 103.753 69.124 16.569 1.00 53.75 O HETATM 4328 O HOH 65 89.899 69.508 29.673 1.00 70.52 O HETATM 4329 O HOH 66 41.021 58.228 4.649 1.00 57.19 O HETATM 4330 O HOH 67 96.092 74.115 25.953 1.00 57.63 O HETATM 4331 O HOH 68 50.296 87.577 23.676 1.00 93.90 O HETATM 4332 O HOH 69 54.024 54.329 -10.260 1.00 48.55 O HETATM 4333 O HOH 70 97.548 46.674 23.079 1.00 69.12 O HETATM 4334 O HOH 71 102.323 57.978 25.622 1.00 66.97 O HETATM 4335 O HOH 72 62.400 59.825 12.078 1.00 45.15 O HETATM 4336 O HOH 73 103.996 70.980 1.922 1.00 51.62 O HETATM 4337 O HOH 74 86.158 66.429 31.807 1.00 62.71 O HETATM 4338 O HOH 75 117.729 59.364 17.626 1.00 61.81 O HETATM 4339 O HOH 76 110.452 53.424 18.393 1.00 72.78 O HETATM 4340 O HOH 77 87.091 58.401 28.799 1.00 72.89 O HETATM 4341 O HOH 78 102.865 49.084 27.846 1.00 81.75 O HETATM 4342 O HOH 79 79.101 78.560 7.651 1.00 46.83 O HETATM 4343 O HOH 80 81.491 72.370 43.458 1.00 87.07 O HETATM 4344 O HOH 81 100.375 77.226 10.123 1.00 62.98 O HETATM 4345 O HOH 82 77.760 80.846 5.332 1.00 54.03 O HETATM 4346 O HOH 83 61.838 72.441 1.301 1.00 85.13 O HETATM 4347 O HOH 84 89.872 86.580 27.823 1.00 78.23 O HETATM 4348 O HOH 85 78.547 71.817 10.888 1.00 46.51 O HETATM 4349 O HOH 86 72.792 79.612 16.685 1.00 76.44 O HETATM 4350 O HOH 87 82.452 70.615 -11.491 1.00 71.83 O HETATM 4351 O HOH 88 49.412 71.338 -6.316 1.00 61.24 O HETATM 4352 O HOH 89 105.044 75.048 16.946 1.00 55.84 O HETATM 4353 O HOH 90 54.740 71.058 -2.340 1.00 58.30 O HETATM 4354 O HOH 91 58.646 61.170 -10.960 1.00 70.12 O HETATM 4355 O HOH 92 96.894 82.412 3.063 1.00 75.26 O HETATM 4356 O HOH 93 87.721 65.495 40.495 1.00 85.65 O HETATM 4357 O HOH 94 99.588 56.196 2.540 1.00 73.90 O HETATM 4358 O HOH 95 84.442 59.841 41.501 1.00 96.88 O HETATM 4359 O HOH 96 116.677 65.801 15.035 1.00 56.01 O HETATM 4360 O HOH 97 41.487 60.080 9.352 1.00 79.58 O HETATM 4361 O HOH 98 81.048 60.341 -10.839 1.00 85.69 O HETATM 4362 O HOH 99 80.235 80.028 -3.538 1.00 73.26 O HETATM 4363 O HOH 100 59.649 74.473 1.112 1.00 76.13 O HETATM 4364 O HOH 101 76.698 70.848 8.583 1.00 39.53 O HETATM 4365 O HOH 102 88.464 67.265 30.244 1.00 51.54 O HETATM 4366 O HOH 103 101.725 60.810 17.475 1.00 41.97 O HETATM 4367 O HOH 104 66.227 57.286 12.727 1.00 63.05 O HETATM 4368 O HOH 105 50.426 76.714 6.591 1.00 60.03 O HETATM 4369 O HOH 106 59.377 50.200 -7.776 1.00 69.11 O HETATM 4370 O HOH 107 93.612 57.985 1.682 1.00 65.49 O HETATM 4371 O HOH 108 92.475 80.672 14.482 1.00 50.18 O HETATM 4372 O HOH 109 57.873 60.064 16.654 1.00 60.52 O HETATM 4373 O HOH 110 45.233 67.705 16.060 1.00 64.37 O HETATM 4374 O HOH 111 55.406 76.720 1.464 1.00 74.42 O HETATM 4375 O HOH 112 56.914 46.938 5.761 1.00 69.63 O HETATM 4376 O HOH 113 80.982 74.710 3.061 1.00 40.61 O HETATM 4377 O HOH 114 107.890 60.055 5.179 1.00 54.74 O HETATM 4378 O HOH 115 76.947 64.397 5.790 1.00 56.49 O HETATM 4379 O HOH 116 101.180 58.596 1.638 1.00 67.80 O HETATM 4380 O HOH 117 55.939 62.895 0.045 1.00 49.62 O HETATM 4381 O HOH 118 102.564 74.916 7.567 1.00 52.38 O HETATM 4382 O HOH 119 79.406 70.672 8.673 1.00 43.49 O HETATM 4383 O HOH 120 98.929 68.271 -0.738 1.00 54.47 O HETATM 4384 O HOH 121 61.784 66.949 0.736 1.00 63.11 O HETATM 4385 O HOH 122 94.984 78.081 20.359 1.00 62.26 O HETATM 4386 O HOH 123 81.676 60.569 35.005 1.00 70.97 O HETATM 4387 O HOH 124 88.051 54.084 4.228 1.00 74.19 O HETATM 4388 O HOH 125 62.325 50.400 -0.958 1.00 72.37 O HETATM 4389 O HOH 126 89.224 47.091 30.823 1.00 72.58 O HETATM 4390 O HOH 127 68.520 63.345 20.881 1.00 93.08 O HETATM 4391 O HOH 128 96.771 52.524 35.288 1.00 63.43 O HETATM 4392 O HOH 129 79.756 75.490 32.875 1.00 72.18 O HETATM 4393 O HOH 130 66.639 67.935 8.719 1.00 42.73 O HETATM 4394 O HOH 131 95.172 84.821 9.385 1.00 62.88 O HETATM 4395 O HOH 132 108.614 68.866 5.292 1.00 74.21 O HETATM 4396 O HOH 133 50.565 63.923 7.438 1.00 41.68 O HETATM 4397 O HOH 134 61.988 65.091 -5.952 1.00 58.75 O HETATM 4398 O HOH 135 64.271 63.424 -6.345 1.00 47.46 O HETATM 4399 O HOH 136 45.456 63.587 -2.051 1.00 38.37 O HETATM 4400 O HOH 137 91.064 81.553 2.164 1.00 58.54 O HETATM 4401 O HOH 138 91.455 84.943 14.193 1.00 56.64 O HETATM 4402 O HOH 139 102.471 62.133 19.861 1.00 51.11 O HETATM 4403 O HOH 140 94.718 49.348 35.928 1.00 60.04 O HETATM 4404 O HOH 141 103.884 54.926 32.777 1.00 53.91 O HETATM 4405 O HOH 142 43.432 66.356 4.598 1.00 60.97 O HETATM 4406 O HOH 143 65.339 51.111 1.375 1.00 81.52 O HETATM 4407 O HOH 144 75.690 80.684 -1.554 1.00 74.28 O HETATM 4408 O HOH 145 101.218 55.741 26.702 1.00 67.10 O HETATM 4409 O HOH 146 63.867 63.878 6.784 1.00 63.73 O HETATM 4410 O HOH 147 83.667 75.956 -7.811 1.00 68.19 O HETATM 4411 O HOH 148 102.477 70.757 26.763 1.00 68.59 O HETATM 4412 O HOH 149 97.344 81.433 8.890 1.00 59.30 O HETATM 4413 O HOH 150 100.757 76.010 12.791 1.00 52.97 O HETATM 4414 O HOH 151 86.577 51.646 30.553 1.00 78.34 O HETATM 4415 O HOH 152 95.547 46.390 30.283 1.00 77.48 O HETATM 4416 O HOH 153 62.201 68.836 3.051 1.00 52.43 O HETATM 4417 O HOH 154 94.723 80.905 17.943 1.00 67.35 O HETATM 4418 O HOH 155 102.435 69.653 19.378 1.00 64.88 O HETATM 4419 O HOH 156 78.640 77.821 -3.272 1.00 51.11 O HETATM 4420 O HOH 157 77.463 63.974 10.826 1.00 51.77 O HETATM 4421 O HOH 158 76.555 63.577 17.781 1.00 57.66 O HETATM 4422 O HOH 159 56.021 60.931 -10.020 1.00 57.00 O HETATM 4423 O HOH 160 39.248 56.160 0.899 1.00 63.81 O HETATM 4424 O HOH 161 85.395 56.372 10.980 1.00 83.38 O HETATM 4425 O HOH 162 108.468 65.069 -1.721 1.00 75.65 O HETATM 4426 O HOH 163 88.836 74.258 29.306 1.00 77.55 O HETATM 4427 O HOH 164 105.675 53.209 5.512 1.00 84.98 O HETATM 4428 O HOH 165 97.365 68.270 27.192 1.00 54.31 O HETATM 4429 O HOH 166 69.351 56.460 11.287 1.00 83.13 O HETATM 4430 O HOH 167 43.232 68.077 -6.170 1.00 63.51 O HETATM 4431 O HOH 168 100.115 49.569 34.801 1.00 63.55 O HETATM 4432 O HOH 169 48.755 66.200 -11.266 1.00 63.41 O HETATM 4433 O HOH 170 90.456 56.163 -4.640 1.00 72.57 O HETATM 4434 O HOH 171 60.325 53.211 14.779 1.00 66.49 O HETATM 4435 O HOH 172 86.075 87.259 22.113 1.00 56.41 O HETATM 4436 O HOH 173 45.299 68.881 -0.282 1.00 62.69 O HETATM 4437 O HOH 174 66.831 59.676 20.641 1.00 75.30 O HETATM 4438 O HOH 175 60.229 70.599 -1.196 1.00 77.58 O HETATM 4439 O HOH 176 75.618 89.536 16.899 1.00 75.31 O HETATM 4440 O HOH 177 91.643 67.238 3.642 1.00 50.81 O HETATM 4441 O HOH 178 60.984 67.759 5.382 1.00 60.60 O HETATM 4442 O HOH 179 92.614 54.340 4.108 1.00 59.74 O HETATM 4443 O HOH 180 42.714 74.897 16.798 1.00 72.63 O HETATM 4444 O HOH 181 111.455 57.355 9.958 1.00 70.98 O HETATM 4445 O HOH 182 114.571 58.174 16.169 1.00 63.69 O HETATM 4446 O HOH 183 74.369 59.817 12.222 1.00 79.60 O HETATM 4447 O HOH 184 41.994 55.911 7.603 1.00 56.44 O HETATM 4448 O HOH 185 107.569 56.658 11.882 1.00 64.43 O HETATM 4449 O HOH 186 51.478 47.566 -0.288 1.00 66.10 O HETATM 4450 O HOH 187 44.736 74.319 19.165 1.00 78.02 O HETATM 4451 O HOH 188 94.386 68.698 29.587 1.00 63.67 O HETATM 4452 O HOH 189 74.473 79.296 9.823 1.00 70.18 O HETATM 4453 O HOH 190 39.760 55.816 4.532 1.00 82.42 O HETATM 4454 O HOH 191 74.369 67.780 1.180 1.00 30.23 O HETATM 4455 O HOH 192 62.357 62.072 13.621 1.00 52.92 O HETATM 4456 O HOH 193 60.946 65.113 6.429 1.00 41.36 O HETATM 4457 O HOH 194 99.840 53.949 1.013 1.00 91.66 O HETATM 4458 O HOH 195 53.185 69.415 -6.180 1.00 68.67 O HETATM 4459 O HOH 196 71.884 75.293 -2.229 1.00 87.18 O HETATM 4460 O HOH 197 79.827 58.924 -1.851 1.00 86.85 O HETATM 4461 O HOH 198 59.304 70.719 2.501 1.00 69.67 O HETATM 4462 O HOH 199 76.973 61.318 12.765 1.00 74.89 O HETATM 4463 O HOH 200 40.230 64.514 10.459 1.00 74.19 O HETATM 4464 O HOH 201 76.508 76.589 -1.445 1.00 55.93 O HETATM 4465 O HOH 202 96.016 56.097 34.109 1.00 62.43 O HETATM 4466 O HOH 203 41.849 61.453 -1.998 1.00 60.39 O HETATM 4467 O HOH 204 89.949 54.611 8.098 1.00 72.77 O HETATM 4468 O HOH 205 51.906 66.727 25.410 1.00 74.35 O HETATM 4469 O HOH 206 80.061 70.159 44.006 1.00 71.77 O HETATM 4470 O HOH 207 90.497 71.036 32.092 1.00 84.35 O HETATM 4471 O HOH 208 92.300 65.486 5.807 1.00 56.57 O HETATM 4472 O HOH 209 89.773 86.238 15.911 1.00 61.75 O HETATM 4473 O HOH 210 79.126 63.168 7.857 1.00 74.48 O HETATM 4474 O HOH 211 80.420 74.613 35.367 1.00 79.86 O HETATM 4475 O HOH 212 67.944 73.245 29.215 1.00 79.44 O HETATM 4476 O HOH 213 79.929 65.147 3.623 1.00 46.53 O HETATM 4477 O HOH 214 103.609 53.866 8.105 1.00 64.47 O HETATM 4478 O HOH 215 68.593 71.398 -2.969 1.00 78.90 O HETATM 4479 O HOH 216 99.258 60.308 -3.250 1.00 68.29 O HETATM 4480 O HOH 217 50.355 69.687 -10.288 1.00 80.10 O HETATM 4481 O HOH 218 103.172 54.787 28.930 1.00 72.30 O HETATM 4482 O HOH 219 100.465 52.806 13.269 1.00 71.78 O HETATM 4483 O HOH 220 53.754 87.497 23.131 1.00 85.74 O HETATM 4484 O HOH 221 112.753 71.500 16.663 1.00 57.26 O HETATM 4485 O HOH 222 87.339 58.671 31.508 1.00 86.97 O HETATM 4486 O HOH 223 47.071 60.898 15.552 1.00 70.51 O HETATM 4487 O HOH 224 86.364 50.544 19.401 1.00 67.40 O HETATM 4488 O HOH 225 64.829 52.800 12.337 1.00 74.88 O HETATM 4489 O HOH 226 84.583 60.760 44.841 1.00 73.83 O HETATM 4490 O HOH 227 60.435 79.607 27.671 1.00 79.00 O HETATM 4491 O HOH 228 60.717 68.471 25.776 1.00 84.83 O HETATM 4492 O HOH 229 91.737 61.625 -8.614 1.00 84.64 O HETATM 4493 O HOH 230 72.184 57.102 14.036 1.00 72.07 O HETATM 4494 O HOH 231 67.178 62.884 24.164 1.00 66.75 O HETATM 4495 O HOH 232 72.297 78.370 11.361 1.00 46.37 O HETATM 4496 O HOH 233 44.221 56.275 -12.714 1.00 58.69 O HETATM 4497 O HOH 234 45.362 48.282 3.242 1.00 84.47 O HETATM 4498 O HOH 235 97.831 72.573 -3.979 1.00 80.97 O HETATM 4499 O HOH 236 47.256 65.452 -13.873 1.00 70.59 O HETATM 4500 O HOH 237 99.980 51.698 10.814 1.00 77.60 O HETATM 4501 O HOH 238 109.194 65.653 24.170 1.00 54.34 O HETATM 4502 O HOH 239 57.623 69.899 -1.638 1.00 72.88 O HETATM 4503 O HOH 240 78.179 77.107 31.381 1.00 75.77 O HETATM 4504 O HOH 241 84.022 72.620 44.977 1.00 73.84 O HETATM 4505 O HOH 242 43.549 77.695 12.084 1.00 83.24 O HETATM 4506 O HOH 243 56.527 51.562 -13.586 1.00 62.94 O HETATM 4507 O HOH 244 68.260 84.927 13.782 1.00 96.51 O HETATM 4508 O HOH 245 97.297 46.302 18.397 1.00 81.61 O HETATM 4509 O HOH 246 44.382 66.537 1.935 1.00 91.25 O HETATM 4510 O HOH 247 62.550 76.342 28.058 1.00 91.40 O HETATM 4511 O HOH 248 77.502 70.292 -6.272 1.00 77.22 O HETATM 4512 O HOH 249 86.599 87.909 19.222 1.00 86.91 O HETATM 4513 O HOH 250 83.034 64.010 -0.796 1.00 68.43 O HETATM 4514 O HOH 251 86.951 54.356 8.459 1.00 84.26 O HETATM 4515 O HOH 252 58.937 43.998 10.718 1.00 79.40 O HETATM 4516 O HOH 253 83.501 86.565 22.787 1.00 81.76 O HETATM 4517 O HOH 254 98.231 64.874 -5.108 1.00 77.20 O HETATM 4518 O HOH 255 68.970 88.689 17.092 1.00 88.16 O HETATM 4519 O HOH 256 70.019 56.009 -7.368 1.00 73.71 O HETATM 4520 O HOH 257 101.067 76.042 -3.413 1.00 86.36 O HETATM 4521 O HOH 258 58.999 64.195 0.171 1.00 57.84 O HETATM 4522 O HOH 259 89.420 83.616 2.581 1.00 70.19 O HETATM 4523 O HOH 260 87.669 85.540 29.549 1.00 81.81 O HETATM 4524 O HOH 261 93.285 76.464 26.681 1.00 76.46 O HETATM 4525 O HOH 262 55.683 46.735 -12.424 1.00 67.83 O HETATM 4526 O HOH 263 64.244 52.313 -0.819 1.00 60.81 O HETATM 4527 O HOH 264 57.361 43.920 -3.155 1.00 76.36 O HETATM 4528 O HOH 265 39.263 65.596 7.572 1.00 73.49 O HETATM 4529 O HOH 266 85.456 51.142 22.623 1.00 80.04 O HETATM 4530 O HOH 267 85.986 61.150 32.818 1.00 84.80 O HETATM 4531 O HOH 268 44.331 47.063 -2.561 1.00 83.11 O HETATM 4532 O HOH 269 93.533 79.796 35.253 1.00 73.00 O HETATM 4533 O HOH 270 85.364 89.176 24.690 1.00 92.74 O HETATM 4534 O HOH 271 81.419 87.620 21.386 1.00 83.78 O HETATM 4535 O HOH 272 58.611 51.929 -11.873 1.00 82.90 O HETATM 4536 O HOH 273 60.851 62.101 16.523 1.00 68.62 O HETATM 4537 O HOH 274 75.090 63.376 41.060 1.00 75.61 O HETATM 4538 O HOH 275 92.782 72.030 33.913 1.00 78.20 O HETATM 4539 O HOH 276 79.156 46.454 -0.530 1.00 92.95 O HETATM 4540 O HOH 277 107.953 73.466 18.826 1.00 72.77 O HETATM 4541 O HOH 278 62.645 76.335 4.779 1.00 75.77 O HETATM 4542 O HOH 279 88.535 83.206 -2.099 1.00 80.75 O HETATM 4543 O HOH 280 82.270 66.586 -1.399 1.00 73.46 O HETATM 4544 O HOH 281 80.382 63.187 -2.189 1.00 79.04 O HETATM 4545 O HOH 282 52.025 71.535 -8.812 1.00 90.46 O HETATM 4546 O HOH 283 97.134 77.616 18.760 1.00 53.61 O HETATM 4547 O HOH 284 90.120 83.400 28.258 1.00 87.26 O HETATM 4548 O HOH 285 59.753 56.794 17.819 1.00 73.73 O HETATM 4549 O HOH 286 99.631 79.847 10.167 1.00 76.15 O HETATM 4550 O HOH 287 94.459 82.530 15.812 1.00 63.52 O HETATM 4551 O HOH 288 94.340 49.872 38.908 1.00 67.97 O HETATM 4552 O HOH 289 98.759 70.470 25.888 1.00 61.27 O HETATM 4553 O HOH 290 86.995 87.443 16.594 1.00 83.06 O HETATM 4554 O HOH 291 43.600 66.335 -1.932 1.00 75.20 O HETATM 4555 O HOH 292 45.703 63.645 15.178 1.00 83.44 O HETATM 4556 O HOH 293 99.005 75.584 18.385 1.00 70.76 O HETATM 4557 O HOH 294 48.795 47.120 -0.001 1.00 77.75 O HETATM 4558 O HOH 295 54.412 81.222 9.525 1.00 77.83 O HETATM 4559 O HOH 296 108.566 57.796 22.547 1.00 60.41 O HETATM 4560 O HOH 297 39.948 65.510 -3.127 1.00 88.36 O HETATM 4561 O HOH 298 77.055 66.314 -3.170 1.00 77.72 O HETATM 4562 O HOH 299 47.322 46.219 -8.437 1.00 66.94 O HETATM 4563 O HOH 300 39.556 61.611 7.878 1.00 85.04 O HETATM 4564 O HOH 301 39.346 66.728 -6.083 1.00 71.35 O HETATM 4565 O HOH 302 77.795 78.003 -6.127 1.00 79.85 O HETATM 4566 O HOH 303 45.616 47.010 0.623 1.00 83.09 O HETATM 4567 O HOH 304 61.394 72.400 30.091 1.00 83.14 O HETATM 4568 O HOH 305 110.829 61.051 22.584 1.00 73.25 O HETATM 4569 O HOH 306 95.843 73.782 -7.774 1.00 72.82 O HETATM 4570 O HOH 307 57.855 67.151 -7.724 1.00 79.53 O HETATM 4571 O HOH 308 58.805 69.596 -7.031 1.00 95.03 O HETATM 4572 O HOH 309 100.323 47.955 28.572 1.00 68.66 O HETATM 4573 O HOH 310 62.398 55.004 14.682 1.00 82.55 O HETATM 4574 O HOH 311 97.180 46.409 32.933 1.00 77.36 O HETATM 4575 O HOH 312 114.228 55.387 13.577 1.00 64.63 O HETATM 4576 O HOH 313 54.574 80.177 5.392 1.00 71.58 O HETATM 4577 O HOH 314 77.136 65.138 -0.575 1.00 96.61 O HETATM 4578 O HOH 315 94.567 47.039 34.473 1.00 71.13 O HETATM 4579 O HOH 316 105.108 50.848 18.375 1.00 69.95 O HETATM 4580 O HOH 317 88.858 63.883 38.376 1.00 70.19 O HETATM 4581 O HOH 318 54.777 67.537 -7.312 1.00 66.90 O HETATM 4582 O HOH 319 59.878 46.837 -7.692 1.00 83.63 O HETATM 4583 O HOH 320 46.253 44.326 0.039 1.00 83.41 O HETATM 4584 O HOH 321 99.501 72.772 22.675 1.00 60.61 O HETATM 4585 O HOH 322 42.248 67.915 -3.651 1.00 81.94 O HETATM 4586 O HOH 323 51.921 65.741 -11.759 1.00 75.53 O HETATM 4587 O HOH 324 101.911 72.100 20.458 1.00 71.07 O HETATM 4588 O HOH 325 94.340 85.099 15.079 1.00 65.32 O HETATM 4589 C5 FQN A 326 87.802 64.540 14.261 1.00 0.25 C HETATM 4590 N1 FQN A 326 87.955 63.235 14.099 1.00 -0.20 N HETATM 4591 C6 FQN A 326 87.075 62.472 13.416 1.00 0.13 C HETATM 4592 N2 FQN A 326 85.973 62.907 12.849 1.00 -0.29 N HETATM 4593 C3 FQN A 326 85.744 64.252 12.951 1.00 0.09 C HETATM 4594 C4 FQN A 326 86.632 65.112 13.612 1.00 0.08 C HETATM 4595 C FQN A 326 86.441 66.487 13.599 1.00 -0.03 C HETATM 4596 C1 FQN A 326 85.365 66.971 12.891 1.00 0.00 C HETATM 4597 N FQN A 326 84.471 66.198 12.268 1.00 -0.27 N HETATM 4598 C2 FQN A 326 84.624 64.879 12.347 1.00 0.20 C HETATM 4599 N3 FQN A 326 83.484 64.147 11.948 1.00 -0.16 N HETATM 4600 C9 FQN A 326 83.310 62.811 11.966 1.00 0.06 C HETATM 4601 C8 FQN A 326 82.011 62.560 11.612 1.00 -0.03 C HETATM 4602 C7 FQN A 326 81.463 63.839 11.405 1.00 0.00 C HETATM 4603 N4 FQN A 326 82.342 64.803 11.599 1.00 -0.21 N HETATM 4604 H1 FQN A 326 80.428 64.014 11.117 1.00 0.06 H HETATM 4605 C10 FQN A 326 81.327 61.233 11.445 1.00 -0.01 C HETATM 4606 C11 FQN A 326 80.559 60.811 12.698 1.00 -0.00 C HETATM 4607 C12 FQN A 326 79.896 59.460 12.467 1.00 -0.03 C HETATM 4608 N5 FQN A 326 78.975 59.505 11.327 1.00 0.23 N HETATM 4609 C13 FQN A 326 79.729 59.844 10.117 1.00 -0.03 C HETATM 4610 C14 FQN A 326 80.385 61.213 10.241 1.00 -0.00 C HETATM 4611 H8 FQN A 326 80.958 61.427 9.326 1.00 0.03 H HETATM 4612 H9 FQN A 326 79.607 61.979 10.374 1.00 0.03 H HETATM 4613 H12 FQN A 326 80.509 59.086 9.957 1.00 0.08 H HETATM 4614 H13 FQN A 326 79.043 59.852 9.257 1.00 0.08 H HETATM 4615 H14 FQN A 326 78.537 58.605 11.211 1.00 0.20 H HETATM 4616 H15 FQN A 326 78.268 60.204 11.491 1.00 0.20 H HETATM 4617 H16 FQN A 326 79.335 59.178 13.370 1.00 0.08 H HETATM 4618 H17 FQN A 326 80.674 58.708 12.269 1.00 0.08 H HETATM 4619 H4 FQN A 326 79.788 61.562 12.924 1.00 0.03 H HETATM 4620 H5 FQN A 326 81.256 60.735 13.545 1.00 0.03 H HETATM 4621 H6 FQN A 326 82.113 60.484 11.267 1.00 0.04 H HETATM 4622 H7 FQN A 326 84.064 62.067 12.216 1.00 0.09 H HETATM 4623 H11 FQN A 326 85.235 68.046 12.835 1.00 0.07 H HETATM 4624 H10 FQN A 326 87.114 67.154 14.126 1.00 0.07 H HETATM 4625 H3 FQN A 326 87.297 61.410 13.328 1.00 0.15 H HETATM 4626 H2 FQN A 326 88.758 62.795 14.500 1.00 0.26 H HETATM 4627 O FQN A 326 88.552 65.182 14.978 1.00 -0.38 O CONECT 634 633 4266 CONECT 718 719 727 728 729 CONECT 727 718 CONECT 728 718 CONECT 729 718 CONECT 1103 1102 4266 CONECT 1128 1127 4266 CONECT 1357 1354 1358 1359 1360 CONECT 1358 1357 CONECT 1359 1357 CONECT 1360 1357 CONECT 1362 1363 1368 1369 1370 CONECT 1368 1362 CONECT 1369 1362 CONECT 1370 1362 CONECT 1856 1854 1855 4267 CONECT 1875 1873 4267 CONECT 2690 2688 2689 4267 CONECT 3679 3678 4264 CONECT 3703 3702 4264 CONECT 3800 3799 4265 CONECT 3815 3814 4265 CONECT 3869 3868 4264 CONECT 3897 3896 3899 4264 CONECT 3943 3942 4265 CONECT 3958 3957 4265 CONECT 4264 3679 3703 3869 3897 CONECT 4265 3800 3815 3943 3958 CONECT 4266 634 1103 1128 CONECT 4267 1856 1875 2690 CONECT 4589 4590 4594 4627 CONECT 4590 4589 4591 4626 CONECT 4591 4590 4592 4625 CONECT 4592 4591 4593 CONECT 4593 4592 4594 4598 CONECT 4594 4589 4593 4595 CONECT 4595 4594 4596 4624 CONECT 4596 4595 4597 4623 CONECT 4597 4596 4598 CONECT 4598 4593 4597 4599 CONECT 4599 4598 4600 4603 CONECT 4600 4599 4601 4622 CONECT 4601 4600 4602 4605 CONECT 4602 4601 4603 4604 CONECT 4603 4599 4602 CONECT 4604 4602 CONECT 4605 4601 4606 4610 4621 CONECT 4606 4605 4607 4619 4620 CONECT 4607 4606 4608 4617 4618 CONECT 4608 4607 4609 4615 4616 CONECT 4609 4608 4610 4613 4614 CONECT 4610 4605 4609 4611 4612 CONECT 4611 4610 CONECT 4612 4610 CONECT 4613 4609 CONECT 4614 4609 CONECT 4615 4608 CONECT 4616 4608 CONECT 4617 4607 CONECT 4618 4607 CONECT 4619 4606 CONECT 4620 4606 CONECT 4621 4605 CONECT 4622 4600 CONECT 4623 4596 CONECT 4624 4595 CONECT 4625 4591 CONECT 4626 4590 CONECT 4627 4589 MASTER 0 0 0 0 0 0 0 0 4624 3 69 36 END
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Structure:
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Related entries of code: 6h52
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5a1f
RCSB PDB
PDBbind
475aa, >5A1F_1|Chain... at 100%
5a3n
RCSB PDB
PDBbind
481aa, >5A3N_1|Chain... *
5a3t
RCSB PDB
PDBbind
481aa, >5A3T_1|Chain... at 100%
5a3w
RCSB PDB
PDBbind
481aa, >5A3W_1|Chain... at 100%
5fpu
RCSB PDB
PDBbind
481aa, >5FPU_1|Chain... at 100%
5fun
RCSB PDB
PDBbind
481aa, >5FUN_1|Chain... at 100%
6h51
RCSB PDB
PDBbind
481aa, >6H51_1|Chain... at 100%
6h50
RCSB PDB
PDBbind
481aa, >6H50_1|Chain... at 100%
6h4z
RCSB PDB
PDBbind
481aa, >6H4Z_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6h4v
RCSB PDB
PDBbind
FQN
Entry Information
PDB ID
6h52
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
KDM5B
Ligand Name
FQN
EC.Number
E.C.-.-.-.-
Resolution
2.14(Å)
Affinity (Kd/Ki/IC50)
IC50=0.068uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Eur.J.Med.Chem. Vol. 177: pp. 316-337
Ligand Properties
Formula
C
1
5
H
1
7
N
6
O
Molecular Weight
297.335
Exact Mass
297.146
No. of atoms
39
No. of bonds
42
Polar Surface Area
93.07
LOGP Value
0.05 (
Computed with XLOGP3
)
1.51 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
O=c1[nH]cnc2c1ccnc2n1ncc(c1)C1CC[NH2+]CC1
InChI String
InChI=1S/C15H16N6O/c22-15-12-3-6-17-14(13(12)18-9-19-15)21-8-11(7-20-21)10-1-4-16-5-2-10/h3,6-10,16H,1-2,4-5H2,(H,18,19,22)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9UGL1
Entrez Gene ID
NCBI Entrez Gene ID:
10765
ASD
Information of known allosteric effects of PDB entries
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