Browse entries in the PDBbind-CN Database
HEADER 4X7Q_COMPLEX COMPND 4X7Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 14 ALA PHE GLU ALA GLU TYR ARG LEU GLY PRO LEU LEU GLY SEQRES 2 B 14 LYS SEQRES 1 B 24 GLY PHE GLY THR VAL PHE ALA GLY HIS ARG LEU THR ASP SEQRES 2 B 24 ARG LEU GLN VAL ALA ILE LYS VAL ILE PRO ARG SEQRES 1 B 29 CYS PRO LEU GLU VAL ALA LEU LEU TRP LYS VAL GLY ALA SEQRES 2 B 29 GLY GLY GLY HIS PRO GLY VAL ILE ARG LEU LEU ASP TRP SEQRES 3 B 29 PHE GLU THR SEQRES 1 B 176 PHE MET LEU VAL LEU GLU ARG PRO LEU PRO ALA GLN ASP SEQRES 2 B 176 LEU PHE ASP TYR ILE THR GLU LYS GLY PRO LEU GLY GLU SEQRES 3 B 176 GLY PRO SER ARG CYS PHE PHE GLY GLN VAL VAL ALA ALA SEQRES 4 B 176 ILE GLN HIS CYS HIS SER ARG GLY VAL VAL HIS ARG ASP SEQRES 5 B 176 ILE LYS ASP GLU ASN ILE LEU ILE ASP LEU ARG ARG GLY SEQRES 6 B 176 CYS ALA LYS LEU ILE ASP PHE GLY SER GLY ALA LEU LEU SEQRES 7 B 176 HIS ASP GLU PRO TYR THR ASP PHE ASP GLY THR ARG VAL SEQRES 8 B 176 TYR SER PRO PRO GLU TRP ILE SER ARG HIS GLN TYR HIS SEQRES 9 B 176 ALA LEU PRO ALA THR VAL TRP SER LEU GLY ILE LEU LEU SEQRES 10 B 176 TYR ASP MET VAL CYS GLY ASP ILE PRO PHE GLU ARG ASP SEQRES 11 B 176 GLN GLU ILE LEU GLU ALA GLU LEU HIS PHE PRO ALA HIS SEQRES 12 B 176 VAL SER PRO ASP CYS CYS ALA LEU ILE ARG ARG CYS LEU SEQRES 13 B 176 ALA PRO LYS PRO SER SER ARG PRO SER LEU GLU GLU ILE SEQRES 14 B 176 LEU LEU ASP PRO TRP MET GLN HET UNN A 289 45 ATOM 1 N ALA B 27 64.739 0.252 0.246 1.00 60.63 N ATOM 2 CA ALA B 27 65.072 1.243 -0.829 1.00 61.79 C ATOM 3 C ALA B 27 64.882 2.694 -0.393 1.00 61.16 C ATOM 4 O ALA B 27 65.748 3.531 -0.661 1.00 61.14 O ATOM 5 CB ALA B 27 64.251 0.977 -2.076 1.00 64.62 C ATOM 6 HN3 ALA B 27 63.744 0.368 0.526 1.00 0.00 H ATOM 7 HN2 ALA B 27 65.354 0.415 1.069 1.00 0.00 H ATOM 8 HN1 ALA B 27 64.889 -0.712 -0.114 1.00 0.00 H ATOM 9 N PHE B 28 63.773 3.007 0.276 1.00 57.33 N ATOM 10 CA PHE B 28 63.572 4.377 0.695 1.00 58.45 C ATOM 11 C PHE B 28 64.743 4.778 1.559 1.00 57.75 C ATOM 12 O PHE B 28 65.422 5.747 1.280 1.00 53.74 O ATOM 13 CB PHE B 28 62.293 4.598 1.509 1.00 59.86 C ATOM 14 CG PHE B 28 62.266 5.947 2.188 1.00 59.61 C ATOM 15 CD1 PHE B 28 61.832 7.074 1.503 1.00 60.29 C ATOM 16 CD2 PHE B 28 62.763 6.104 3.470 1.00 62.16 C ATOM 17 CE1 PHE B 28 61.843 8.320 2.102 1.00 60.23 C ATOM 18 CE2 PHE B 28 62.787 7.352 4.079 1.00 63.28 C ATOM 19 CZ PHE B 28 62.320 8.461 3.394 1.00 62.30 C ATOM 20 H PHE B 28 63.063 2.278 0.493 1.00 0.00 H ATOM 21 N GLU B 29 64.945 4.003 2.619 1.00 61.35 N ATOM 22 CA GLU B 29 65.986 4.247 3.600 1.00 63.74 C ATOM 23 C GLU B 29 67.385 4.140 3.001 1.00 60.02 C ATOM 24 O GLU B 29 68.352 4.539 3.640 1.00 57.14 O ATOM 25 CB GLU B 29 65.838 3.290 4.799 1.00 69.15 C ATOM 26 CG GLU B 29 64.744 3.693 5.788 1.00 73.45 C ATOM 27 CD GLU B 29 64.454 2.626 6.844 1.00 76.90 C ATOM 28 OE1 GLU B 29 64.227 1.456 6.462 1.00 80.56 O ATOM 29 OE2 GLU B 29 64.437 2.954 8.055 1.00 76.17 O ATOM 30 H GLU B 29 64.325 3.179 2.753 1.00 0.00 H ATOM 31 N ALA B 30 67.488 3.613 1.783 1.00 58.75 N ATOM 32 CA ALA B 30 68.738 3.666 1.037 1.00 58.88 C ATOM 33 C ALA B 30 68.960 5.022 0.378 1.00 53.25 C ATOM 34 O ALA B 30 70.051 5.544 0.489 1.00 53.02 O ATOM 35 CB ALA B 30 68.832 2.532 0.004 1.00 60.59 C ATOM 36 H ALA B 30 66.659 3.154 1.355 1.00 0.00 H ATOM 37 N GLU B 31 67.964 5.586 -0.310 1.00 50.47 N ATOM 38 CA GLU B 31 68.169 6.865 -1.057 1.00 49.61 C ATOM 39 C GLU B 31 67.940 8.204 -0.322 1.00 45.50 C ATOM 40 O GLU B 31 68.230 9.260 -0.889 1.00 42.14 O ATOM 41 CB GLU B 31 67.302 6.898 -2.294 1.00 52.40 C ATOM 42 CG GLU B 31 67.608 5.813 -3.287 1.00 57.73 C ATOM 43 CD GLU B 31 66.336 5.151 -3.751 1.00 60.49 C ATOM 44 OE1 GLU B 31 65.415 5.898 -4.100 1.00 63.30 O ATOM 45 OE2 GLU B 31 66.250 3.904 -3.745 1.00 67.24 O ATOM 46 H GLU B 31 67.030 5.128 -0.327 1.00 0.00 H ATOM 47 N TYR B 32 67.411 8.167 0.898 1.00 41.69 N ATOM 48 CA TYR B 32 66.902 9.360 1.551 1.00 43.13 C ATOM 49 C TYR B 32 67.062 9.208 3.040 1.00 45.17 C ATOM 50 O TYR B 32 66.903 8.109 3.568 1.00 49.25 O ATOM 51 CB TYR B 32 65.416 9.636 1.196 1.00 41.54 C ATOM 52 CG TYR B 32 65.188 9.870 -0.290 1.00 40.18 C ATOM 53 CD1 TYR B 32 65.332 11.134 -0.852 1.00 39.11 C ATOM 54 CD2 TYR B 32 64.844 8.826 -1.130 1.00 40.80 C ATOM 55 CE1 TYR B 32 65.169 11.349 -2.212 1.00 37.35 C ATOM 56 CE2 TYR B 32 64.658 9.038 -2.487 1.00 40.43 C ATOM 57 CZ TYR B 32 64.830 10.303 -3.021 1.00 39.05 C ATOM 58 OH TYR B 32 64.633 10.516 -4.386 1.00 40.99 O ATOM 59 HH TYR B 32 63.702 10.279 -4.625 1.00 0.00 H ATOM 60 H TYR B 32 67.360 7.257 1.399 1.00 0.00 H ATOM 61 N ARG B 33 67.414 10.308 3.698 1.00 45.71 N ATOM 62 CA ARG B 33 67.502 10.361 5.149 1.00 47.81 C ATOM 63 C ARG B 33 66.465 11.364 5.654 1.00 48.93 C ATOM 64 O ARG B 33 66.430 12.509 5.218 1.00 49.12 O ATOM 65 CB ARG B 33 68.905 10.775 5.579 1.00 48.17 C ATOM 66 H ARG B 33 67.636 11.166 3.153 1.00 0.00 H ATOM 67 N LEU B 34 65.598 10.897 6.540 1.00 50.69 N ATOM 68 CA LEU B 34 64.591 11.717 7.148 1.00 51.64 C ATOM 69 C LEU B 34 65.269 12.562 8.188 1.00 48.31 C ATOM 70 O LEU B 34 66.048 12.049 8.993 1.00 46.69 O ATOM 71 CB LEU B 34 63.532 10.878 7.873 1.00 56.25 C ATOM 72 CG LEU B 34 62.569 10.047 7.049 1.00 61.27 C ATOM 73 CD1 LEU B 34 61.718 9.193 7.974 1.00 68.48 C ATOM 74 CD2 LEU B 34 61.673 10.910 6.187 1.00 58.90 C ATOM 75 H LEU B 34 65.650 9.893 6.806 1.00 0.00 H ATOM 76 N GLY B 35 64.940 13.846 8.177 1.00 42.87 N ATOM 77 CA GLY B 35 65.362 14.763 9.201 1.00 40.19 C ATOM 78 C GLY B 35 64.167 15.186 10.018 1.00 39.38 C ATOM 79 O GLY B 35 63.198 14.435 10.172 1.00 38.01 O ATOM 80 H GLY B 35 64.353 14.204 7.397 1.00 0.00 H ATOM 81 N PRO B 36 64.212 16.409 10.539 1.00 39.47 N ATOM 82 CA PRO B 36 63.175 16.800 11.483 1.00 39.48 C ATOM 83 C PRO B 36 61.751 16.888 10.900 1.00 37.05 C ATOM 84 O PRO B 36 61.541 17.233 9.742 1.00 36.31 O ATOM 85 CB PRO B 36 63.636 18.177 11.989 1.00 40.84 C ATOM 86 CG PRO B 36 64.752 18.591 11.106 1.00 39.94 C ATOM 87 CD PRO B 36 65.318 17.371 10.466 1.00 39.00 C ATOM 88 N LEU B 37 60.802 16.540 11.743 1.00 35.66 N ATOM 89 CA LEU B 37 59.397 16.754 11.522 1.00 36.54 C ATOM 90 C LEU B 37 59.102 18.237 11.261 1.00 36.92 C ATOM 91 O LEU B 37 59.480 19.086 12.037 1.00 36.04 O ATOM 92 CB LEU B 37 58.662 16.250 12.774 1.00 39.24 C ATOM 93 CG LEU B 37 57.146 16.373 12.948 1.00 39.92 C ATOM 94 CD1 LEU B 37 56.411 15.589 11.893 1.00 38.69 C ATOM 95 CD2 LEU B 37 56.788 15.854 14.333 1.00 41.76 C ATOM 96 H LEU B 37 61.088 16.078 12.630 1.00 0.00 H ATOM 97 N LEU B 38 58.464 18.540 10.136 1.00 38.52 N ATOM 98 CA LEU B 38 58.079 19.917 9.788 1.00 41.20 C ATOM 99 C LEU B 38 56.576 20.188 10.032 1.00 47.63 C ATOM 100 O LEU B 38 56.163 21.327 10.241 1.00 50.35 O ATOM 101 CB LEU B 38 58.412 20.190 8.329 1.00 39.56 C ATOM 102 CG LEU B 38 59.891 20.210 7.990 1.00 39.35 C ATOM 103 CD1 LEU B 38 60.064 20.365 6.491 1.00 41.03 C ATOM 104 CD2 LEU B 38 60.600 21.345 8.699 1.00 39.40 C ATOM 105 H LEU B 38 58.227 17.773 9.475 1.00 0.00 H ATOM 106 N GLY B 39 55.756 19.143 9.991 1.00 54.17 N ATOM 107 CA GLY B 39 54.348 19.275 10.327 1.00 58.41 C ATOM 108 C GLY B 39 53.673 17.936 10.188 1.00 62.67 C ATOM 109 O GLY B 39 54.064 17.148 9.326 1.00 64.24 O ATOM 110 H GLY B 39 56.129 18.213 9.713 1.00 0.00 H ATOM 111 N LYS B 40 52.653 17.700 11.018 1.00 69.10 N ATOM 112 CA LYS B 40 51.961 16.396 11.129 1.00 74.17 C ATOM 113 C LYS B 40 50.445 16.464 10.894 1.00 73.50 C ATOM 114 O LYS B 40 49.895 17.498 10.534 1.00 71.54 O ATOM 115 CB LYS B 40 52.211 15.770 12.515 1.00 72.83 C ATOM 116 H LYS B 40 52.325 18.480 11.623 1.00 0.00 H TER 117 LYS B 40 ATOM 118 N GLY B 42 46.961 15.987 9.329 1.00 72.28 N ATOM 119 CA GLY B 42 45.841 16.013 8.376 1.00 73.82 C ATOM 120 C GLY B 42 46.289 15.470 7.028 1.00 71.57 C ATOM 121 O GLY B 42 45.830 14.432 6.573 1.00 73.32 O ATOM 122 HN3 GLY B 42 47.738 16.575 8.965 1.00 0.00 H ATOM 123 HN2 GLY B 42 47.291 15.008 9.447 1.00 0.00 H ATOM 124 HN1 GLY B 42 46.643 16.360 10.246 1.00 0.00 H ATOM 125 N PHE B 43 47.209 16.196 6.409 1.00 69.85 N ATOM 126 CA PHE B 43 47.952 15.736 5.231 1.00 67.71 C ATOM 127 C PHE B 43 48.582 14.347 5.407 1.00 70.23 C ATOM 128 O PHE B 43 48.754 13.582 4.447 1.00 72.74 O ATOM 129 CB PHE B 43 49.053 16.747 4.902 1.00 62.76 C ATOM 130 CG PHE B 43 49.632 17.460 6.106 1.00 58.05 C ATOM 131 CD1 PHE B 43 50.733 16.946 6.785 1.00 58.08 C ATOM 132 CD2 PHE B 43 49.099 18.672 6.538 1.00 55.63 C ATOM 133 CE1 PHE B 43 51.274 17.616 7.888 1.00 56.06 C ATOM 134 CE2 PHE B 43 49.644 19.347 7.634 1.00 55.12 C ATOM 135 CZ PHE B 43 50.732 18.813 8.313 1.00 53.82 C ATOM 136 H PHE B 43 47.416 17.146 6.779 1.00 0.00 H ATOM 137 N GLY B 44 48.896 14.024 6.654 1.00 68.65 N ATOM 138 CA GLY B 44 49.811 12.956 6.965 1.00 66.25 C ATOM 139 C GLY B 44 50.929 13.652 7.707 1.00 61.31 C ATOM 140 O GLY B 44 50.708 14.217 8.791 1.00 59.53 O ATOM 141 H GLY B 44 48.467 14.560 7.435 1.00 0.00 H ATOM 142 N THR B 45 52.117 13.675 7.114 1.00 53.06 N ATOM 143 CA THR B 45 53.278 14.119 7.855 1.00 46.94 C ATOM 144 C THR B 45 54.426 14.450 6.969 1.00 39.58 C ATOM 145 O THR B 45 54.772 13.674 6.113 1.00 45.01 O ATOM 146 CB THR B 45 53.692 13.033 8.835 1.00 50.81 C ATOM 147 OG1 THR B 45 52.543 12.664 9.601 1.00 57.44 O ATOM 148 CG2 THR B 45 54.742 13.538 9.771 1.00 52.72 C ATOM 149 HG1 THR B 45 52.206 13.456 10.091 1.00 0.00 H ATOM 150 H THR B 45 52.212 13.376 6.123 1.00 0.00 H ATOM 151 N VAL B 46 55.015 15.608 7.178 1.00 35.91 N ATOM 152 CA VAL B 46 56.093 16.103 6.339 1.00 36.13 C ATOM 153 C VAL B 46 57.390 16.301 7.119 1.00 35.77 C ATOM 154 O VAL B 46 57.382 16.836 8.240 1.00 34.10 O ATOM 155 CB VAL B 46 55.755 17.466 5.723 1.00 35.47 C ATOM 156 CG1 VAL B 46 56.831 17.865 4.698 1.00 36.03 C ATOM 157 CG2 VAL B 46 54.382 17.418 5.092 1.00 35.20 C ATOM 158 H VAL B 46 54.696 16.193 7.976 1.00 0.00 H ATOM 159 N PHE B 47 58.488 15.885 6.503 1.00 33.06 N ATOM 160 CA PHE B 47 59.773 15.914 7.169 1.00 35.62 C ATOM 161 C PHE B 47 60.696 16.715 6.312 1.00 34.38 C ATOM 162 O PHE B 47 60.515 16.739 5.090 1.00 35.17 O ATOM 163 CB PHE B 47 60.378 14.495 7.337 1.00 34.36 C ATOM 164 CG PHE B 47 59.609 13.619 8.274 1.00 34.09 C ATOM 165 CD1 PHE B 47 58.549 12.870 7.821 1.00 34.40 C ATOM 166 CD2 PHE B 47 59.959 13.529 9.602 1.00 34.45 C ATOM 167 CE1 PHE B 47 57.819 12.061 8.687 1.00 35.91 C ATOM 168 CE2 PHE B 47 59.256 12.707 10.475 1.00 35.42 C ATOM 169 CZ PHE B 47 58.174 11.978 10.022 1.00 35.86 C ATOM 170 H PHE B 47 58.425 15.533 5.527 1.00 0.00 H ATOM 171 N ALA B 48 61.702 17.315 6.931 1.00 31.53 N ATOM 172 CA ALA B 48 62.854 17.718 6.160 1.00 33.88 C ATOM 173 C ALA B 48 63.679 16.458 5.914 1.00 36.54 C ATOM 174 O ALA B 48 63.699 15.527 6.719 1.00 40.02 O ATOM 175 CB ALA B 48 63.662 18.786 6.885 1.00 33.29 C ATOM 176 H ALA B 48 61.662 17.493 7.955 1.00 0.00 H ATOM 177 N GLY B 49 64.315 16.376 4.768 1.00 36.48 N ATOM 178 CA GLY B 49 65.277 15.322 4.588 1.00 35.85 C ATOM 179 C GLY B 49 66.347 15.679 3.602 1.00 33.79 C ATOM 180 O GLY B 49 66.427 16.817 3.133 1.00 29.95 O ATOM 181 H GLY B 49 64.127 17.059 4.006 1.00 0.00 H ATOM 182 N HIS B 50 67.158 14.678 3.284 1.00 35.17 N ATOM 183 CA HIS B 50 68.158 14.808 2.231 1.00 37.08 C ATOM 184 C HIS B 50 68.105 13.592 1.353 1.00 36.62 C ATOM 185 O HIS B 50 67.792 12.503 1.803 1.00 37.28 O ATOM 186 CB HIS B 50 69.573 14.973 2.808 1.00 39.39 C ATOM 187 CG HIS B 50 69.741 16.174 3.685 1.00 41.60 C ATOM 188 ND1 HIS B 50 70.236 17.378 3.219 1.00 44.44 N ATOM 189 CD2 HIS B 50 69.469 16.360 4.998 1.00 42.39 C ATOM 190 CE1 HIS B 50 70.260 18.254 4.211 1.00 44.36 C ATOM 191 NE2 HIS B 50 69.806 17.658 5.301 1.00 45.13 N ATOM 192 H HIS B 50 67.078 13.778 3.799 1.00 0.00 H ATOM 193 N ARG B 51 68.382 13.775 0.079 1.00 37.78 N ATOM 194 CA ARG B 51 68.619 12.637 -0.783 1.00 40.05 C ATOM 195 C ARG B 51 70.080 12.220 -0.538 1.00 39.97 C ATOM 196 O ARG B 51 70.988 13.021 -0.675 1.00 38.58 O ATOM 197 CB ARG B 51 68.338 13.002 -2.252 1.00 43.11 C ATOM 198 CG ARG B 51 69.102 12.190 -3.290 1.00 47.26 C ATOM 199 CD ARG B 51 68.892 12.758 -4.676 1.00 50.85 C ATOM 200 NE ARG B 51 67.664 12.237 -5.256 1.00 58.82 N ATOM 201 CZ ARG B 51 66.923 12.852 -6.184 1.00 65.36 C ATOM 202 NH1 ARG B 51 67.293 14.044 -6.661 1.00 65.92 N ATOM 203 NH2 ARG B 51 65.804 12.266 -6.639 1.00 63.67 N ATOM 204 HE ARG B 51 67.335 11.309 -4.921 1.00 0.00 H ATOM 205 HH12 ARG B 51 66.713 14.518 -7.383 1.00 0.00 H ATOM 206 HH11 ARG B 51 68.161 14.498 -6.311 1.00 0.00 H ATOM 207 HH22 ARG B 51 65.225 12.741 -7.361 1.00 0.00 H ATOM 208 HH21 ARG B 51 65.516 11.337 -6.270 1.00 0.00 H ATOM 209 H ARG B 51 68.431 14.739 -0.309 1.00 0.00 H ATOM 210 N LEU B 52 70.278 10.973 -0.143 1.00 40.81 N ATOM 211 CA LEU B 52 71.582 10.469 0.250 1.00 44.34 C ATOM 212 C LEU B 52 72.721 10.738 -0.718 1.00 43.66 C ATOM 213 O LEU B 52 73.750 11.240 -0.303 1.00 44.10 O ATOM 214 CB LEU B 52 71.513 8.961 0.566 1.00 48.93 C ATOM 215 CG LEU B 52 71.340 8.722 2.074 1.00 52.60 C ATOM 216 CD1 LEU B 52 70.666 7.406 2.440 1.00 52.58 C ATOM 217 CD2 LEU B 52 72.705 8.821 2.748 1.00 54.27 C ATOM 218 H LEU B 52 69.465 10.326 -0.113 1.00 0.00 H ATOM 219 N THR B 53 72.553 10.421 -1.993 1.00 42.46 N ATOM 220 CA THR B 53 73.685 10.440 -2.908 1.00 44.55 C ATOM 221 C THR B 53 74.396 11.785 -2.970 1.00 42.84 C ATOM 222 O THR B 53 75.627 11.851 -2.895 1.00 40.54 O ATOM 223 CB THR B 53 73.289 10.033 -4.350 1.00 46.72 C ATOM 224 OG1 THR B 53 72.014 10.612 -4.684 1.00 48.53 O ATOM 225 CG2 THR B 53 73.225 8.517 -4.478 1.00 47.20 C ATOM 226 HG1 THR B 53 71.765 10.350 -5.606 1.00 0.00 H ATOM 227 H THR B 53 71.609 10.158 -2.342 1.00 0.00 H ATOM 228 N ASP B 54 73.615 12.834 -3.152 1.00 42.83 N ATOM 229 CA ASP B 54 74.137 14.183 -3.365 1.00 45.08 C ATOM 230 C ASP B 54 73.728 15.183 -2.267 1.00 43.43 C ATOM 231 O ASP B 54 73.943 16.381 -2.409 1.00 43.82 O ATOM 232 CB ASP B 54 73.656 14.696 -4.731 1.00 46.70 C ATOM 233 CG ASP B 54 72.125 14.676 -4.870 1.00 49.86 C ATOM 234 OD1 ASP B 54 71.412 14.338 -3.891 1.00 49.04 O ATOM 235 OD2 ASP B 54 71.627 14.997 -5.973 1.00 56.57 O ATOM 236 H ASP B 54 72.584 12.695 -3.143 1.00 0.00 H ATOM 237 N ARG B 55 73.103 14.693 -1.203 1.00 43.97 N ATOM 238 CA ARG B 55 72.528 15.548 -0.158 1.00 44.86 C ATOM 239 C ARG B 55 71.673 16.722 -0.628 1.00 40.84 C ATOM 240 O ARG B 55 71.612 17.746 0.026 1.00 39.70 O ATOM 241 CB ARG B 55 73.631 16.060 0.752 1.00 47.51 C ATOM 242 CG ARG B 55 73.988 15.037 1.775 1.00 51.54 C ATOM 243 CD ARG B 55 74.796 15.679 2.840 1.00 56.44 C ATOM 244 NE ARG B 55 74.029 16.075 4.010 1.00 60.50 N ATOM 245 CZ ARG B 55 73.465 15.240 4.882 1.00 65.37 C ATOM 246 NH1 ARG B 55 72.842 15.738 5.941 1.00 71.23 N ATOM 247 NH2 ARG B 55 73.488 13.922 4.705 1.00 65.03 N ATOM 248 HE ARG B 55 73.911 17.094 4.180 1.00 0.00 H ATOM 249 HH12 ARG B 55 72.397 15.099 6.631 1.00 0.00 H ATOM 250 HH11 ARG B 55 72.798 16.767 6.082 1.00 0.00 H ATOM 251 HH22 ARG B 55 73.039 13.296 5.403 1.00 0.00 H ATOM 252 HH21 ARG B 55 73.955 13.518 3.868 1.00 0.00 H ATOM 253 H ARG B 55 73.017 13.661 -1.106 1.00 0.00 H ATOM 254 N LEU B 56 70.998 16.571 -1.745 1.00 39.00 N ATOM 255 CA LEU B 56 69.925 17.486 -2.052 1.00 39.17 C ATOM 256 C LEU B 56 68.910 17.476 -0.896 1.00 37.44 C ATOM 257 O LEU B 56 68.462 16.405 -0.446 1.00 35.41 O ATOM 258 CB LEU B 56 69.209 17.079 -3.335 1.00 39.71 C ATOM 259 CG LEU B 56 68.103 18.033 -3.773 1.00 41.61 C ATOM 260 CD1 LEU B 56 68.577 19.456 -4.066 1.00 41.45 C ATOM 261 CD2 LEU B 56 67.457 17.421 -4.987 1.00 43.46 C ATOM 262 H LEU B 56 71.235 15.800 -2.401 1.00 0.00 H ATOM 263 N GLN B 57 68.545 18.680 -0.471 1.00 36.29 N ATOM 264 CA GLN B 57 67.498 18.917 0.498 1.00 36.94 C ATOM 265 C GLN B 57 66.161 18.687 -0.140 1.00 34.05 C ATOM 266 O GLN B 57 65.896 19.134 -1.241 1.00 34.07 O ATOM 267 CB GLN B 57 67.529 20.352 1.034 1.00 40.12 C ATOM 268 CG GLN B 57 68.858 20.741 1.644 1.00 44.92 C ATOM 269 CD GLN B 57 69.868 21.169 0.592 1.00 48.38 C ATOM 270 OE1 GLN B 57 69.518 21.363 -0.598 1.00 49.86 O ATOM 271 NE2 GLN B 57 71.124 21.322 1.009 1.00 51.82 N ATOM 272 HE22 GLN B 57 71.366 21.149 2.006 1.00 0.00 H ATOM 273 HE21 GLN B 57 71.863 21.614 0.338 1.00 0.00 H ATOM 274 H GLN B 57 69.044 19.505 -0.860 1.00 0.00 H ATOM 275 N VAL B 58 65.325 17.977 0.581 1.00 33.38 N ATOM 276 CA VAL B 58 64.008 17.627 0.139 1.00 32.99 C ATOM 277 C VAL B 58 63.080 17.638 1.338 1.00 32.74 C ATOM 278 O VAL B 58 63.496 17.740 2.511 1.00 34.92 O ATOM 279 CB VAL B 58 63.974 16.191 -0.429 1.00 34.30 C ATOM 280 CG1 VAL B 58 64.854 16.075 -1.656 1.00 36.17 C ATOM 281 CG2 VAL B 58 64.381 15.165 0.630 1.00 34.39 C ATOM 282 H VAL B 58 65.634 17.652 1.520 1.00 0.00 H ATOM 283 N ALA B 59 61.816 17.456 1.043 1.00 32.40 N ATOM 284 CA ALA B 59 60.833 17.246 2.072 1.00 31.86 C ATOM 285 C ALA B 59 60.217 15.907 1.714 1.00 31.50 C ATOM 286 O ALA B 59 60.097 15.554 0.571 1.00 33.28 O ATOM 287 CB ALA B 59 59.803 18.350 2.027 1.00 30.86 C ATOM 288 H ALA B 59 61.518 17.464 0.047 1.00 0.00 H ATOM 289 N ILE B 60 59.852 15.164 2.709 1.00 32.36 N ATOM 290 CA ILE B 60 59.379 13.826 2.539 1.00 34.01 C ATOM 291 C ILE B 60 58.070 13.809 3.224 1.00 32.94 C ATOM 292 O ILE B 60 58.008 14.133 4.394 1.00 32.89 O ATOM 293 CB ILE B 60 60.297 12.825 3.232 1.00 36.40 C ATOM 294 CG1 ILE B 60 61.550 12.643 2.388 1.00 37.60 C ATOM 295 CG2 ILE B 60 59.588 11.488 3.399 1.00 38.11 C ATOM 296 CD1 ILE B 60 62.811 12.840 3.161 1.00 39.93 C ATOM 297 H ILE B 60 59.905 15.556 3.671 1.00 0.00 H ATOM 298 N LYS B 61 57.019 13.478 2.482 1.00 33.08 N ATOM 299 CA LYS B 61 55.676 13.530 3.035 1.00 33.46 C ATOM 300 C LYS B 61 55.193 12.111 3.150 1.00 36.20 C ATOM 301 O LYS B 61 55.151 11.379 2.181 1.00 35.40 O ATOM 302 CB LYS B 61 54.741 14.359 2.154 1.00 31.58 C ATOM 303 CG LYS B 61 53.273 14.055 2.388 1.00 32.59 C ATOM 304 CD LYS B 61 52.410 14.967 1.562 1.00 32.97 C ATOM 305 CE LYS B 61 50.947 14.807 1.873 1.00 33.81 C ATOM 306 NZ LYS B 61 50.222 15.842 1.080 1.00 34.09 N ATOM 307 HZ1 LYS B 61 50.558 16.787 1.356 1.00 0.00 H ATOM 308 HZ2 LYS B 61 50.403 15.691 0.067 1.00 0.00 H ATOM 309 HZ3 LYS B 61 49.201 15.767 1.266 1.00 0.00 H ATOM 310 H LYS B 61 57.159 13.179 1.496 1.00 0.00 H ATOM 311 N VAL B 62 54.838 11.730 4.353 1.00 41.64 N ATOM 312 CA VAL B 62 54.384 10.387 4.613 1.00 46.23 C ATOM 313 C VAL B 62 52.878 10.415 4.613 1.00 48.93 C ATOM 314 O VAL B 62 52.278 11.293 5.237 1.00 45.23 O ATOM 315 CB VAL B 62 54.866 9.906 5.993 1.00 47.17 C ATOM 316 CG1 VAL B 62 54.359 8.504 6.279 1.00 50.31 C ATOM 317 CG2 VAL B 62 56.382 9.930 6.062 1.00 48.34 C ATOM 318 H VAL B 62 54.885 12.412 5.137 1.00 0.00 H ATOM 319 N ILE B 63 52.284 9.448 3.914 1.00 54.92 N ATOM 320 CA ILE B 63 50.831 9.201 3.950 1.00 59.48 C ATOM 321 C ILE B 63 50.544 7.715 4.287 1.00 65.02 C ATOM 322 O ILE B 63 51.252 6.823 3.792 1.00 66.92 O ATOM 323 CB ILE B 63 50.178 9.529 2.586 1.00 57.19 C ATOM 324 CG1 ILE B 63 50.814 10.759 1.962 1.00 52.98 C ATOM 325 CG2 ILE B 63 48.678 9.753 2.749 1.00 58.21 C ATOM 326 CD1 ILE B 63 50.608 10.830 0.475 1.00 53.57 C ATOM 327 H ILE B 63 52.875 8.838 3.314 1.00 0.00 H ATOM 328 N PRO B 64 49.515 7.444 5.125 1.00 71.88 N ATOM 329 CA PRO B 64 48.977 6.084 5.331 1.00 75.63 C ATOM 330 C PRO B 64 47.614 5.810 4.648 1.00 75.69 C ATOM 331 O PRO B 64 46.712 6.645 4.722 1.00 71.76 O ATOM 332 CB PRO B 64 48.791 6.041 6.849 1.00 77.13 C ATOM 333 CG PRO B 64 48.399 7.451 7.198 1.00 77.45 C ATOM 334 CD PRO B 64 48.991 8.372 6.146 1.00 73.62 C ATOM 335 N ARG B 65 47.460 4.640 4.023 1.00 78.97 N ATOM 336 CA ARG B 65 46.158 4.196 3.505 1.00 77.41 C ATOM 337 C ARG B 65 45.613 5.122 2.402 1.00 79.22 C ATOM 338 O ARG B 65 44.781 6.010 2.645 1.00 76.76 O ATOM 339 CB ARG B 65 45.150 4.089 4.650 1.00 75.45 C ATOM 340 H ARG B 65 48.288 4.023 3.899 1.00 0.00 H TER 341 ARG B 65 ATOM 342 N CYS B 80 47.778 3.677 -5.581 1.00 78.22 N ATOM 343 CA CYS B 80 48.599 4.897 -5.580 1.00 79.04 C ATOM 344 C CYS B 80 47.777 6.169 -5.274 1.00 70.02 C ATOM 345 O CYS B 80 46.729 6.389 -5.860 1.00 68.38 O ATOM 346 CB CYS B 80 49.320 5.037 -6.920 1.00 83.53 C ATOM 347 SG CYS B 80 50.478 6.426 -6.969 1.00 90.33 S ATOM 348 HN3 CYS B 80 47.037 3.760 -6.306 1.00 0.00 H ATOM 349 HN2 CYS B 80 47.338 3.556 -4.646 1.00 0.00 H ATOM 350 HN1 CYS B 80 48.380 2.856 -5.792 1.00 0.00 H ATOM 351 N PRO B 81 48.260 7.028 -4.367 1.00 67.37 N ATOM 352 CA PRO B 81 47.325 8.064 -3.978 1.00 63.67 C ATOM 353 C PRO B 81 47.242 9.128 -5.050 1.00 58.22 C ATOM 354 O PRO B 81 48.194 9.298 -5.836 1.00 53.75 O ATOM 355 CB PRO B 81 47.949 8.622 -2.694 1.00 65.32 C ATOM 356 CG PRO B 81 49.416 8.489 -2.915 1.00 64.76 C ATOM 357 CD PRO B 81 49.620 7.326 -3.871 1.00 68.34 C ATOM 358 N LEU B 82 46.107 9.834 -5.056 1.00 53.26 N ATOM 359 CA LEU B 82 45.785 10.832 -6.086 1.00 48.46 C ATOM 360 C LEU B 82 46.856 11.916 -6.161 1.00 43.41 C ATOM 361 O LEU B 82 47.201 12.396 -7.233 1.00 41.88 O ATOM 362 CB LEU B 82 44.429 11.464 -5.787 1.00 48.03 C ATOM 363 CG LEU B 82 43.752 12.327 -6.865 1.00 49.37 C ATOM 364 CD1 LEU B 82 43.692 11.634 -8.218 1.00 49.60 C ATOM 365 CD2 LEU B 82 42.340 12.679 -6.401 1.00 49.55 C ATOM 366 H LEU B 82 45.418 9.669 -4.295 1.00 0.00 H ATOM 367 N GLU B 83 47.390 12.265 -5.005 1.00 40.68 N ATOM 368 CA GLU B 83 48.355 13.334 -4.895 1.00 41.19 C ATOM 369 C GLU B 83 49.545 13.129 -5.811 1.00 40.20 C ATOM 370 O GLU B 83 50.032 14.093 -6.397 1.00 39.18 O ATOM 371 CB GLU B 83 48.850 13.470 -3.461 1.00 40.56 C ATOM 372 CG GLU B 83 49.894 14.551 -3.317 1.00 42.87 C ATOM 373 CD GLU B 83 50.008 15.117 -1.899 1.00 45.49 C ATOM 374 OE1 GLU B 83 49.372 14.532 -0.981 1.00 46.05 O ATOM 375 OE2 GLU B 83 50.730 16.157 -1.717 1.00 45.84 O ATOM 376 H GLU B 83 47.106 11.753 -4.145 1.00 0.00 H ATOM 377 N VAL B 84 50.004 11.888 -5.938 1.00 38.16 N ATOM 378 CA VAL B 84 51.150 11.630 -6.782 1.00 40.08 C ATOM 379 C VAL B 84 50.792 11.955 -8.230 1.00 39.34 C ATOM 380 O VAL B 84 51.600 12.511 -8.984 1.00 37.90 O ATOM 381 CB VAL B 84 51.646 10.174 -6.654 1.00 42.07 C ATOM 382 CG1 VAL B 84 52.732 9.872 -7.675 1.00 43.75 C ATOM 383 CG2 VAL B 84 52.194 9.928 -5.266 1.00 42.64 C ATOM 384 H VAL B 84 49.541 11.106 -5.433 1.00 0.00 H ATOM 385 N ALA B 85 49.568 11.614 -8.607 1.00 40.61 N ATOM 386 CA ALA B 85 49.116 11.797 -9.991 1.00 41.52 C ATOM 387 C ALA B 85 48.929 13.268 -10.271 1.00 39.62 C ATOM 388 O ALA B 85 49.352 13.775 -11.310 1.00 41.49 O ATOM 389 CB ALA B 85 47.822 11.046 -10.232 1.00 42.16 C ATOM 390 H ALA B 85 48.914 11.208 -7.907 1.00 0.00 H ATOM 391 N LEU B 86 48.315 13.965 -9.328 1.00 36.31 N ATOM 392 CA LEU B 86 48.105 15.383 -9.504 1.00 33.76 C ATOM 393 C LEU B 86 49.427 16.093 -9.537 1.00 33.10 C ATOM 394 O LEU B 86 49.623 16.984 -10.364 1.00 31.50 O ATOM 395 CB LEU B 86 47.269 15.952 -8.398 1.00 32.84 C ATOM 396 CG LEU B 86 45.916 15.304 -8.217 1.00 33.18 C ATOM 397 CD1 LEU B 86 45.312 15.882 -6.953 1.00 31.79 C ATOM 398 CD2 LEU B 86 45.049 15.493 -9.461 1.00 33.69 C ATOM 399 H LEU B 86 47.985 13.493 -8.462 1.00 0.00 H ATOM 400 N LEU B 87 50.345 15.717 -8.651 1.00 33.41 N ATOM 401 CA LEU B 87 51.656 16.361 -8.682 1.00 34.88 C ATOM 402 C LEU B 87 52.335 16.069 -10.024 1.00 38.23 C ATOM 403 O LEU B 87 52.913 16.966 -10.641 1.00 40.05 O ATOM 404 CB LEU B 87 52.529 15.964 -7.488 1.00 32.70 C ATOM 405 CG LEU B 87 52.279 16.844 -6.248 1.00 32.15 C ATOM 406 CD1 LEU B 87 52.772 16.182 -4.975 1.00 30.99 C ATOM 407 CD2 LEU B 87 52.841 18.259 -6.423 1.00 30.46 C ATOM 408 H LEU B 87 50.134 14.979 -7.950 1.00 0.00 H ATOM 409 N TRP B 88 52.241 14.826 -10.484 1.00 41.51 N ATOM 410 CA TRP B 88 52.820 14.451 -11.776 1.00 44.37 C ATOM 411 C TRP B 88 52.307 15.365 -12.870 1.00 43.87 C ATOM 412 O TRP B 88 53.098 16.036 -13.530 1.00 44.76 O ATOM 413 CB TRP B 88 52.496 12.992 -12.121 1.00 46.07 C ATOM 414 H TRP B 88 51.748 14.107 -9.917 1.00 0.00 H ATOM 415 N LYS B 89 50.982 15.449 -13.008 1.00 43.41 N ATOM 416 CA LYS B 89 50.368 16.226 -14.091 1.00 44.40 C ATOM 417 C LYS B 89 50.831 17.669 -14.119 1.00 42.03 C ATOM 418 O LYS B 89 51.059 18.249 -15.192 1.00 42.09 O ATOM 419 CB LYS B 89 48.836 16.216 -13.996 1.00 47.84 C ATOM 420 CG LYS B 89 48.174 14.867 -14.197 1.00 49.42 C ATOM 421 CD LYS B 89 46.735 15.013 -14.658 1.00 51.76 C ATOM 422 CE LYS B 89 46.655 15.035 -16.192 1.00 54.86 C ATOM 423 NZ LYS B 89 45.419 15.687 -16.700 1.00 54.91 N ATOM 424 HZ1 LYS B 89 44.587 15.173 -16.347 1.00 0.00 H ATOM 425 HZ2 LYS B 89 45.386 16.672 -16.367 1.00 0.00 H ATOM 426 HZ3 LYS B 89 45.422 15.671 -17.740 1.00 0.00 H ATOM 427 H LYS B 89 50.369 14.951 -12.331 1.00 0.00 H ATOM 428 N VAL B 90 50.991 18.243 -12.936 1.00 39.85 N ATOM 429 CA VAL B 90 51.301 19.660 -12.797 1.00 38.84 C ATOM 430 C VAL B 90 52.807 19.894 -12.838 1.00 39.18 C ATOM 431 O VAL B 90 53.257 20.997 -13.113 1.00 38.30 O ATOM 432 CB VAL B 90 50.715 20.213 -11.477 1.00 41.77 C ATOM 433 CG1 VAL B 90 50.734 21.724 -11.478 1.00 44.14 C ATOM 434 CG2 VAL B 90 49.276 19.747 -11.264 1.00 41.26 C ATOM 435 H VAL B 90 50.892 17.663 -12.078 1.00 0.00 H ATOM 436 N GLY B 91 53.591 18.861 -12.546 1.00 40.97 N ATOM 437 CA GLY B 91 55.047 18.956 -12.646 1.00 44.97 C ATOM 438 C GLY B 91 55.537 18.720 -14.075 1.00 48.17 C ATOM 439 O GLY B 91 56.110 19.598 -14.698 1.00 51.97 O ATOM 440 H GLY B 91 53.160 17.966 -12.240 1.00 0.00 H ATOM 441 N ALA B 92 55.305 17.518 -14.584 1.00 51.84 N ATOM 442 CA ALA B 92 55.577 17.155 -15.992 1.00 53.00 C ATOM 443 C ALA B 92 56.093 18.310 -16.832 1.00 52.37 C ATOM 444 O ALA B 92 55.380 19.312 -17.035 1.00 50.08 O ATOM 445 CB ALA B 92 54.322 16.590 -16.640 1.00 52.29 C ATOM 446 H ALA B 92 54.909 16.788 -13.957 1.00 0.00 H ATOM 447 N GLY B 93 57.334 18.152 -17.294 1.00 53.41 N ATOM 448 CA GLY B 93 57.973 19.077 -18.205 1.00 57.46 C ATOM 449 C GLY B 93 58.132 20.462 -17.635 1.00 58.81 C ATOM 450 O GLY B 93 57.687 21.433 -18.243 1.00 61.30 O ATOM 451 H GLY B 93 57.872 17.318 -16.982 1.00 0.00 H ATOM 452 N GLY B 94 58.757 20.548 -16.462 1.00 59.87 N ATOM 453 CA GLY B 94 58.926 21.828 -15.753 1.00 60.53 C ATOM 454 C GLY B 94 58.334 21.736 -14.351 1.00 62.01 C ATOM 455 O GLY B 94 59.075 21.599 -13.366 1.00 65.87 O ATOM 456 H GLY B 94 59.139 19.682 -16.032 1.00 0.00 H ATOM 457 N GLY B 95 57.015 21.852 -14.204 1.00 59.19 N ATOM 458 CA GLY B 95 56.134 22.504 -15.156 1.00 56.88 C ATOM 459 C GLY B 95 56.022 23.951 -14.719 1.00 52.39 C ATOM 460 O GLY B 95 55.911 24.848 -15.579 1.00 50.43 O ATOM 461 H GLY B 95 56.586 21.447 -13.347 1.00 0.00 H ATOM 462 N HIS B 96 56.068 24.184 -13.389 1.00 47.31 N ATOM 463 CA HIS B 96 55.825 25.521 -12.852 1.00 45.05 C ATOM 464 C HIS B 96 56.563 25.932 -11.580 1.00 46.35 C ATOM 465 O HIS B 96 56.642 25.164 -10.590 1.00 46.60 O ATOM 466 CB HIS B 96 54.341 25.733 -12.599 1.00 44.87 C ATOM 467 CG HIS B 96 53.959 27.174 -12.545 1.00 42.46 C ATOM 468 ND1 HIS B 96 53.789 27.938 -13.681 1.00 43.95 N ATOM 469 CD2 HIS B 96 53.714 27.993 -11.503 1.00 40.95 C ATOM 470 CE1 HIS B 96 53.484 29.177 -13.339 1.00 43.74 C ATOM 471 NE2 HIS B 96 53.432 29.238 -12.020 1.00 42.29 N ATOM 472 H HIS B 96 56.279 23.401 -12.738 1.00 0.00 H ATOM 473 N PRO B 97 57.058 27.184 -11.575 1.00 43.83 N ATOM 474 CA PRO B 97 57.816 27.596 -10.423 1.00 40.83 C ATOM 475 C PRO B 97 56.955 27.947 -9.225 1.00 38.76 C ATOM 476 O PRO B 97 57.476 28.023 -8.135 1.00 39.96 O ATOM 477 CB PRO B 97 58.540 28.847 -10.916 1.00 42.65 C ATOM 478 CG PRO B 97 57.602 29.449 -11.911 1.00 43.66 C ATOM 479 CD PRO B 97 56.980 28.261 -12.593 1.00 44.83 C ATOM 480 N GLY B 98 55.676 28.223 -9.426 1.00 36.23 N ATOM 481 CA GLY B 98 54.719 28.314 -8.344 1.00 32.78 C ATOM 482 C GLY B 98 54.202 26.998 -7.790 1.00 31.50 C ATOM 483 O GLY B 98 53.283 26.993 -7.018 1.00 27.98 O ATOM 484 H GLY B 98 55.346 28.381 -10.400 1.00 0.00 H ATOM 485 N VAL B 99 54.807 25.871 -8.124 1.00 32.99 N ATOM 486 CA VAL B 99 54.334 24.608 -7.572 1.00 32.54 C ATOM 487 C VAL B 99 55.476 23.759 -7.094 1.00 32.51 C ATOM 488 O VAL B 99 56.408 23.558 -7.818 1.00 34.55 O ATOM 489 CB VAL B 99 53.517 23.854 -8.632 1.00 32.34 C ATOM 490 CG1 VAL B 99 52.967 22.560 -8.073 1.00 32.66 C ATOM 491 CG2 VAL B 99 52.380 24.723 -9.058 1.00 31.59 C ATOM 492 H VAL B 99 55.616 25.886 -8.777 1.00 0.00 H ATOM 493 N ILE B 100 55.435 23.297 -5.846 1.00 33.19 N ATOM 494 CA ILE B 100 56.511 22.456 -5.334 1.00 33.85 C ATOM 495 C ILE B 100 56.491 21.212 -6.228 1.00 35.39 C ATOM 496 O ILE B 100 55.447 20.658 -6.501 1.00 38.41 O ATOM 497 CB ILE B 100 56.346 22.162 -3.808 1.00 34.26 C ATOM 498 CG1 ILE B 100 56.791 23.375 -2.957 1.00 35.40 C ATOM 499 CG2 ILE B 100 57.147 20.973 -3.318 1.00 33.30 C ATOM 500 CD1 ILE B 100 58.271 23.619 -2.881 1.00 34.65 C ATOM 501 H ILE B 100 54.631 23.537 -5.232 1.00 0.00 H ATOM 502 N ARG B 101 57.650 20.831 -6.727 1.00 36.53 N ATOM 503 CA ARG B 101 57.827 19.668 -7.577 1.00 37.20 C ATOM 504 C ARG B 101 57.859 18.375 -6.755 1.00 36.90 C ATOM 505 O ARG B 101 58.371 18.349 -5.662 1.00 38.00 O ATOM 506 CB ARG B 101 59.143 19.826 -8.354 1.00 38.81 C ATOM 507 H ARG B 101 58.490 21.399 -6.497 1.00 0.00 H ATOM 508 N LEU B 102 57.267 17.313 -7.287 1.00 37.82 N ATOM 509 CA LEU B 102 57.432 15.947 -6.774 1.00 38.45 C ATOM 510 C LEU B 102 58.715 15.418 -7.396 1.00 38.98 C ATOM 511 O LEU B 102 58.948 15.642 -8.577 1.00 37.96 O ATOM 512 CB LEU B 102 56.229 15.076 -7.193 1.00 39.42 C ATOM 513 CG LEU B 102 56.209 13.563 -6.955 1.00 40.14 C ATOM 514 CD1 LEU B 102 56.327 13.189 -5.503 1.00 40.58 C ATOM 515 CD2 LEU B 102 54.912 13.008 -7.490 1.00 41.34 C ATOM 516 H LEU B 102 56.652 17.456 -8.113 1.00 0.00 H ATOM 517 N LEU B 103 59.572 14.771 -6.621 1.00 39.07 N ATOM 518 CA LEU B 103 60.789 14.200 -7.207 1.00 42.93 C ATOM 519 C LEU B 103 60.809 12.671 -7.192 1.00 42.90 C ATOM 520 O LEU B 103 61.507 12.078 -7.988 1.00 43.91 O ATOM 521 CB LEU B 103 62.049 14.760 -6.533 1.00 45.94 C ATOM 522 CG LEU B 103 62.012 16.219 -6.025 1.00 47.05 C ATOM 523 CD1 LEU B 103 63.122 16.439 -5.029 1.00 46.29 C ATOM 524 CD2 LEU B 103 62.107 17.238 -7.153 1.00 49.11 C ATOM 525 H LEU B 103 59.383 14.668 -5.603 1.00 0.00 H ATOM 526 N ASP B 104 60.036 12.031 -6.319 1.00 42.43 N ATOM 527 CA ASP B 104 60.133 10.580 -6.135 1.00 45.36 C ATOM 528 C ASP B 104 59.005 10.120 -5.211 1.00 43.28 C ATOM 529 O ASP B 104 58.525 10.912 -4.403 1.00 41.48 O ATOM 530 CB ASP B 104 61.518 10.235 -5.516 1.00 47.45 C ATOM 531 CG ASP B 104 61.998 8.787 -5.803 1.00 52.96 C ATOM 532 OD1 ASP B 104 61.342 8.006 -6.566 1.00 54.81 O ATOM 533 OD2 ASP B 104 63.068 8.438 -5.236 1.00 54.89 O ATOM 534 H ASP B 104 59.349 12.571 -5.755 1.00 0.00 H ATOM 535 N TRP B 105 58.568 8.863 -5.329 1.00 45.00 N ATOM 536 CA TRP B 105 57.650 8.291 -4.332 1.00 45.16 C ATOM 537 C TRP B 105 57.839 6.787 -4.084 1.00 47.87 C ATOM 538 O TRP B 105 58.396 6.098 -4.914 1.00 47.33 O ATOM 539 CB TRP B 105 56.215 8.628 -4.685 1.00 46.23 C ATOM 540 CG TRP B 105 55.773 8.121 -6.012 1.00 48.80 C ATOM 541 CD1 TRP B 105 56.092 8.621 -7.255 1.00 46.64 C ATOM 542 CD2 TRP B 105 54.907 7.011 -6.231 1.00 49.82 C ATOM 543 NE1 TRP B 105 55.476 7.876 -8.228 1.00 46.85 N ATOM 544 CE2 TRP B 105 54.748 6.879 -7.629 1.00 49.33 C ATOM 545 CE3 TRP B 105 54.235 6.119 -5.373 1.00 51.15 C ATOM 546 CZ2 TRP B 105 53.942 5.893 -8.195 1.00 52.29 C ATOM 547 CZ3 TRP B 105 53.443 5.135 -5.927 1.00 52.27 C ATOM 548 CH2 TRP B 105 53.307 5.023 -7.337 1.00 54.26 C ATOM 549 HE1 TRP B 105 55.549 8.040 -9.252 1.00 0.00 H ATOM 550 H TRP B 105 58.880 8.283 -6.134 1.00 0.00 H ATOM 551 N PHE B 106 57.403 6.315 -2.911 1.00 49.99 N ATOM 552 CA PHE B 106 57.657 4.953 -2.428 1.00 55.68 C ATOM 553 C PHE B 106 56.474 4.404 -1.654 1.00 59.16 C ATOM 554 O PHE B 106 55.733 5.175 -1.039 1.00 56.27 O ATOM 555 CB PHE B 106 58.832 4.926 -1.456 1.00 60.29 C ATOM 556 CG PHE B 106 60.127 5.336 -2.056 1.00 61.90 C ATOM 557 CD1 PHE B 106 60.391 6.676 -2.291 1.00 63.79 C ATOM 558 CD2 PHE B 106 61.094 4.400 -2.346 1.00 67.01 C ATOM 559 CE1 PHE B 106 61.578 7.076 -2.840 1.00 66.62 C ATOM 560 CE2 PHE B 106 62.305 4.788 -2.892 1.00 70.18 C ATOM 561 CZ PHE B 106 62.542 6.128 -3.143 1.00 71.56 C ATOM 562 H PHE B 106 56.850 6.953 -2.304 1.00 0.00 H ATOM 563 N GLU B 107 56.349 3.071 -1.626 1.00 63.25 N ATOM 564 CA GLU B 107 55.155 2.407 -1.074 1.00 69.66 C ATOM 565 C GLU B 107 55.179 2.147 0.442 1.00 73.28 C ATOM 566 O GLU B 107 54.408 2.761 1.184 1.00 79.21 O ATOM 567 CB GLU B 107 54.870 1.093 -1.817 1.00 71.86 C ATOM 568 H GLU B 107 57.120 2.485 -2.006 1.00 0.00 H ATOM 569 N THR B 108 56.041 1.246 0.904 1.00 75.33 N ATOM 570 CA THR B 108 55.984 0.763 2.299 1.00 79.85 C ATOM 571 C THR B 108 54.563 0.752 2.897 1.00 77.67 C ATOM 572 O THR B 108 54.374 0.530 4.098 1.00 73.68 O ATOM 573 CB THR B 108 56.906 1.574 3.236 1.00 80.74 C ATOM 574 OG1 THR B 108 56.466 2.933 3.302 1.00 79.13 O ATOM 575 CG2 THR B 108 58.345 1.519 2.745 1.00 83.94 C ATOM 576 HG1 THR B 108 56.491 3.331 2.396 1.00 0.00 H ATOM 577 H THR B 108 56.774 0.872 0.267 1.00 0.00 H TER 578 THR B 108 ATOM 579 N PHE B 112 52.993 5.071 2.132 1.00 50.12 N ATOM 580 CA PHE B 112 53.309 5.946 0.990 1.00 52.06 C ATOM 581 C PHE B 112 54.163 7.140 1.358 1.00 50.48 C ATOM 582 O PHE B 112 53.854 7.846 2.307 1.00 51.70 O ATOM 583 CB PHE B 112 52.040 6.482 0.334 1.00 53.30 C ATOM 584 CG PHE B 112 51.449 5.563 -0.683 1.00 55.57 C ATOM 585 CD1 PHE B 112 52.128 5.301 -1.867 1.00 58.49 C ATOM 586 CD2 PHE B 112 50.215 4.958 -0.461 1.00 57.23 C ATOM 587 CE1 PHE B 112 51.594 4.436 -2.804 1.00 60.86 C ATOM 588 CE2 PHE B 112 49.672 4.093 -1.398 1.00 59.30 C ATOM 589 CZ PHE B 112 50.361 3.834 -2.573 1.00 61.25 C ATOM 590 HN3 PHE B 112 52.474 5.615 2.851 1.00 0.00 H ATOM 591 HN2 PHE B 112 53.876 4.706 2.543 1.00 0.00 H ATOM 592 HN1 PHE B 112 52.407 4.276 1.806 1.00 0.00 H ATOM 593 N MET B 113 55.200 7.398 0.571 1.00 49.30 N ATOM 594 CA MET B 113 56.097 8.473 0.856 1.00 49.40 C ATOM 595 C MET B 113 56.483 9.249 -0.367 1.00 46.60 C ATOM 596 O MET B 113 57.020 8.680 -1.301 1.00 43.14 O ATOM 597 CB MET B 113 57.334 7.907 1.505 1.00 57.37 C ATOM 598 CG MET B 113 57.058 7.520 2.942 1.00 63.28 C ATOM 599 SD MET B 113 58.551 6.956 3.720 1.00 74.75 S ATOM 600 CE MET B 113 58.617 5.315 3.007 1.00 74.93 C ATOM 601 H MET B 113 55.363 6.807 -0.269 1.00 0.00 H ATOM 602 N LEU B 114 56.208 10.558 -0.335 1.00 45.11 N ATOM 603 CA LEU B 114 56.499 11.474 -1.456 1.00 41.85 C ATOM 604 C LEU B 114 57.713 12.324 -1.150 1.00 37.69 C ATOM 605 O LEU B 114 57.843 12.893 -0.068 1.00 37.46 O ATOM 606 CB LEU B 114 55.329 12.421 -1.747 1.00 40.53 C ATOM 607 CG LEU B 114 54.139 11.809 -2.466 1.00 42.75 C ATOM 608 CD1 LEU B 114 53.518 10.769 -1.556 1.00 44.00 C ATOM 609 CD2 LEU B 114 53.114 12.865 -2.898 1.00 41.53 C ATOM 610 H LEU B 114 55.767 10.950 0.522 1.00 0.00 H ATOM 611 N VAL B 115 58.571 12.449 -2.136 1.00 36.74 N ATOM 612 CA VAL B 115 59.788 13.220 -1.987 1.00 35.97 C ATOM 613 C VAL B 115 59.564 14.479 -2.759 1.00 33.26 C ATOM 614 O VAL B 115 59.351 14.445 -3.959 1.00 33.20 O ATOM 615 CB VAL B 115 60.996 12.445 -2.533 1.00 35.87 C ATOM 616 CG1 VAL B 115 62.260 13.297 -2.458 1.00 36.71 C ATOM 617 CG2 VAL B 115 61.152 11.164 -1.727 1.00 35.24 C ATOM 618 H VAL B 115 58.372 11.984 -3.045 1.00 0.00 H ATOM 619 N LEU B 116 59.570 15.586 -2.054 1.00 31.23 N ATOM 620 CA LEU B 116 59.228 16.866 -2.647 1.00 31.28 C ATOM 621 C LEU B 116 60.421 17.795 -2.698 1.00 31.48 C ATOM 622 O LEU B 116 61.307 17.703 -1.841 1.00 31.04 O ATOM 623 CB LEU B 116 58.157 17.486 -1.773 1.00 30.82 C ATOM 624 CG LEU B 116 56.846 16.723 -1.842 1.00 31.66 C ATOM 625 CD1 LEU B 116 56.086 16.895 -0.547 1.00 32.78 C ATOM 626 CD2 LEU B 116 56.031 17.195 -3.038 1.00 30.90 C ATOM 627 H LEU B 116 59.826 15.545 -1.047 1.00 0.00 H ATOM 628 N GLU B 117 60.445 18.756 -3.607 1.00 32.50 N ATOM 629 CA GLU B 117 61.491 19.747 -3.439 1.00 35.55 C ATOM 630 C GLU B 117 61.343 20.489 -2.108 1.00 35.50 C ATOM 631 O GLU B 117 60.242 20.619 -1.534 1.00 31.98 O ATOM 632 CB GLU B 117 61.580 20.728 -4.575 1.00 39.95 C ATOM 633 CG GLU B 117 60.419 21.687 -4.664 1.00 43.18 C ATOM 634 CD GLU B 117 60.621 22.723 -5.750 1.00 46.41 C ATOM 635 OE1 GLU B 117 61.621 23.480 -5.625 1.00 53.36 O ATOM 636 OE2 GLU B 117 59.783 22.783 -6.689 1.00 45.61 O ATOM 637 H GLU B 117 59.760 18.798 -4.389 1.00 0.00 H ATOM 638 N ARG B 118 62.473 20.962 -1.613 1.00 35.46 N ATOM 639 CA ARG B 118 62.478 21.825 -0.446 1.00 34.35 C ATOM 640 C ARG B 118 63.354 23.038 -0.700 1.00 33.46 C ATOM 641 O ARG B 118 64.558 22.957 -0.701 1.00 34.94 O ATOM 642 CB ARG B 118 62.952 21.055 0.769 1.00 32.87 C ATOM 643 CG ARG B 118 63.327 21.963 1.926 1.00 33.55 C ATOM 644 CD ARG B 118 63.156 21.248 3.252 1.00 33.26 C ATOM 645 NE ARG B 118 64.160 20.192 3.409 1.00 34.53 N ATOM 646 CZ ARG B 118 65.339 20.389 3.985 1.00 36.67 C ATOM 647 NH1 ARG B 118 66.206 19.389 4.097 1.00 38.45 N ATOM 648 NH2 ARG B 118 65.660 21.597 4.437 1.00 34.60 N ATOM 649 HE ARG B 118 63.937 19.241 3.051 1.00 0.00 H ATOM 650 HH12 ARG B 118 67.129 19.549 4.549 1.00 0.00 H ATOM 651 HH11 ARG B 118 65.962 18.446 3.732 1.00 0.00 H ATOM 652 HH22 ARG B 118 66.583 21.755 4.889 1.00 0.00 H ATOM 653 HH21 ARG B 118 64.988 22.385 4.339 1.00 0.00 H ATOM 654 H ARG B 118 63.374 20.712 -2.067 1.00 0.00 H ATOM 655 N PRO B 119 62.741 24.181 -0.938 1.00 33.79 N ATOM 656 CA PRO B 119 63.585 25.353 -1.113 1.00 33.42 C ATOM 657 C PRO B 119 64.258 25.684 0.188 1.00 34.99 C ATOM 658 O PRO B 119 63.714 25.444 1.259 1.00 36.00 O ATOM 659 CB PRO B 119 62.590 26.446 -1.489 1.00 33.17 C ATOM 660 CG PRO B 119 61.387 25.698 -2.032 1.00 32.15 C ATOM 661 CD PRO B 119 61.325 24.444 -1.239 1.00 31.85 C ATOM 662 N LEU B 120 65.435 26.242 0.087 1.00 38.54 N ATOM 663 CA LEU B 120 66.264 26.502 1.227 1.00 43.00 C ATOM 664 C LEU B 120 66.700 27.946 1.054 1.00 42.68 C ATOM 665 O LEU B 120 67.476 28.217 0.146 1.00 44.18 O ATOM 666 CB LEU B 120 67.454 25.554 1.170 1.00 49.55 C ATOM 667 CG LEU B 120 68.578 25.600 2.211 1.00 57.14 C ATOM 668 CD1 LEU B 120 68.078 25.210 3.595 1.00 57.41 C ATOM 669 CD2 LEU B 120 69.708 24.670 1.751 1.00 60.97 C ATOM 670 H LEU B 120 65.784 26.508 -0.856 1.00 0.00 H ATOM 671 N PRO B 121 66.230 28.873 1.888 1.00 41.07 N ATOM 672 CA PRO B 121 65.400 28.596 3.047 1.00 40.03 C ATOM 673 C PRO B 121 63.942 28.916 2.739 1.00 38.68 C ATOM 674 O PRO B 121 63.660 29.730 1.871 1.00 38.40 O ATOM 675 CB PRO B 121 65.939 29.577 4.078 1.00 39.52 C ATOM 676 CG PRO B 121 66.271 30.773 3.265 1.00 39.91 C ATOM 677 CD PRO B 121 66.673 30.279 1.888 1.00 41.06 C ATOM 678 N ALA B 122 63.024 28.294 3.464 1.00 37.12 N ATOM 679 CA ALA B 122 61.614 28.402 3.131 1.00 34.92 C ATOM 680 C ALA B 122 60.760 28.455 4.378 1.00 34.95 C ATOM 681 O ALA B 122 61.124 27.957 5.457 1.00 32.81 O ATOM 682 CB ALA B 122 61.213 27.220 2.302 1.00 36.35 C ATOM 683 H ALA B 122 63.316 27.721 4.282 1.00 0.00 H ATOM 684 N GLN B 123 59.594 29.047 4.222 1.00 33.77 N ATOM 685 CA GLN B 123 58.681 29.168 5.328 1.00 34.36 C ATOM 686 C GLN B 123 57.323 29.222 4.731 1.00 30.38 C ATOM 687 O GLN B 123 57.128 29.927 3.756 1.00 29.35 O ATOM 688 CB GLN B 123 58.964 30.473 6.090 1.00 37.59 C ATOM 689 CG GLN B 123 58.296 30.567 7.452 1.00 40.84 C ATOM 690 CD GLN B 123 58.607 31.875 8.189 1.00 43.74 C ATOM 691 OE1 GLN B 123 59.288 32.757 7.677 1.00 45.92 O ATOM 692 NE2 GLN B 123 58.084 32.000 9.385 1.00 46.82 N ATOM 693 HE22 GLN B 123 57.512 31.229 9.786 1.00 0.00 H ATOM 694 HE21 GLN B 123 58.241 32.870 9.933 1.00 0.00 H ATOM 695 H GLN B 123 59.331 29.430 3.292 1.00 0.00 H ATOM 696 N ASP B 124 56.359 28.516 5.296 1.00 28.62 N ATOM 697 CA ASP B 124 55.038 28.777 4.839 1.00 29.18 C ATOM 698 C ASP B 124 54.536 30.150 5.265 1.00 25.82 C ATOM 699 O ASP B 124 55.052 30.780 6.195 1.00 24.44 O ATOM 700 CB ASP B 124 54.057 27.631 5.095 1.00 34.26 C ATOM 701 CG ASP B 124 53.575 27.535 6.496 1.00 37.64 C ATOM 702 OD1 ASP B 124 53.687 28.486 7.293 1.00 50.45 O ATOM 703 OD2 ASP B 124 53.025 26.464 6.787 1.00 43.57 O ATOM 704 H ASP B 124 56.556 27.809 6.033 1.00 0.00 H ATOM 705 N LEU B 125 53.504 30.567 4.558 1.00 22.71 N ATOM 706 CA LEU B 125 52.965 31.863 4.678 1.00 22.98 C ATOM 707 C LEU B 125 52.245 32.047 6.015 1.00 22.79 C ATOM 708 O LEU B 125 52.247 33.152 6.568 1.00 22.58 O ATOM 709 CB LEU B 125 52.046 32.149 3.488 1.00 23.10 C ATOM 710 CG LEU B 125 51.378 33.509 3.350 1.00 23.88 C ATOM 711 CD1 LEU B 125 52.384 34.624 3.459 1.00 24.91 C ATOM 712 CD2 LEU B 125 50.726 33.600 1.978 1.00 26.05 C ATOM 713 H LEU B 125 53.068 29.909 3.881 1.00 0.00 H ATOM 714 N PHE B 126 51.635 30.997 6.532 1.00 22.36 N ATOM 715 CA PHE B 126 50.963 31.111 7.820 1.00 23.62 C ATOM 716 C PHE B 126 51.971 31.515 8.910 1.00 25.90 C ATOM 717 O PHE B 126 51.738 32.491 9.676 1.00 25.65 O ATOM 718 CB PHE B 126 50.279 29.798 8.156 1.00 23.35 C ATOM 719 CG PHE B 126 49.548 29.793 9.477 1.00 24.15 C ATOM 720 CD1 PHE B 126 50.213 29.457 10.656 1.00 24.77 C ATOM 721 CD2 PHE B 126 48.192 30.054 9.539 1.00 23.04 C ATOM 722 CE1 PHE B 126 49.555 29.459 11.854 1.00 24.25 C ATOM 723 CE2 PHE B 126 47.534 30.049 10.744 1.00 24.14 C ATOM 724 CZ PHE B 126 48.205 29.726 11.897 1.00 24.43 C ATOM 725 H PHE B 126 51.634 30.091 6.022 1.00 0.00 H ATOM 726 N ASP B 127 53.094 30.788 8.963 1.00 28.34 N ATOM 727 CA ASP B 127 54.169 31.078 9.939 1.00 29.60 C ATOM 728 C ASP B 127 54.815 32.425 9.685 1.00 28.08 C ATOM 729 O ASP B 127 55.197 33.120 10.622 1.00 27.04 O ATOM 730 CB ASP B 127 55.281 30.037 9.911 1.00 31.77 C ATOM 731 CG ASP B 127 54.854 28.719 10.412 1.00 36.19 C ATOM 732 OD1 ASP B 127 53.743 28.599 10.996 1.00 43.15 O ATOM 733 OD2 ASP B 127 55.666 27.782 10.243 1.00 41.34 O ATOM 734 H ASP B 127 53.215 29.996 8.299 1.00 0.00 H ATOM 735 N TYR B 128 55.008 32.767 8.417 1.00 26.76 N ATOM 736 CA TYR B 128 55.487 34.072 8.104 1.00 27.20 C ATOM 737 C TYR B 128 54.586 35.154 8.755 1.00 25.55 C ATOM 738 O TYR B 128 55.049 36.059 9.484 1.00 24.09 O ATOM 739 CB TYR B 128 55.562 34.294 6.593 1.00 29.58 C ATOM 740 CG TYR B 128 56.112 35.674 6.288 1.00 31.74 C ATOM 741 CD1 TYR B 128 55.283 36.796 6.272 1.00 34.14 C ATOM 742 CD2 TYR B 128 57.464 35.863 6.093 1.00 35.86 C ATOM 743 CE1 TYR B 128 55.800 38.068 6.037 1.00 37.43 C ATOM 744 CE2 TYR B 128 57.986 37.118 5.833 1.00 38.11 C ATOM 745 CZ TYR B 128 57.158 38.213 5.810 1.00 39.14 C ATOM 746 OH TYR B 128 57.709 39.461 5.575 1.00 45.61 O ATOM 747 HH TYR B 128 56.993 40.144 5.588 1.00 0.00 H ATOM 748 H TYR B 128 54.811 32.086 7.656 1.00 0.00 H ATOM 749 N ILE B 129 53.304 35.060 8.475 1.00 24.56 N ATOM 750 CA ILE B 129 52.354 36.028 8.983 1.00 25.79 C ATOM 751 C ILE B 129 52.333 36.003 10.508 1.00 26.71 C ATOM 752 O ILE B 129 52.311 37.016 11.134 1.00 28.26 O ATOM 753 CB ILE B 129 50.959 35.788 8.439 1.00 25.61 C ATOM 754 CG1 ILE B 129 50.909 36.233 6.991 1.00 25.78 C ATOM 755 CG2 ILE B 129 49.916 36.609 9.217 1.00 26.80 C ATOM 756 CD1 ILE B 129 49.756 35.634 6.223 1.00 26.47 C ATOM 757 H ILE B 129 52.967 34.277 7.879 1.00 0.00 H ATOM 758 N THR B 130 52.413 34.838 11.093 1.00 27.48 N ATOM 759 CA THR B 130 52.478 34.751 12.552 1.00 29.03 C ATOM 760 C THR B 130 53.627 35.548 13.100 1.00 28.22 C ATOM 761 O THR B 130 53.464 36.222 14.069 1.00 27.36 O ATOM 762 CB THR B 130 52.597 33.282 13.008 1.00 28.40 C ATOM 763 OG1 THR B 130 51.432 32.586 12.554 1.00 29.80 O ATOM 764 CG2 THR B 130 52.677 33.183 14.504 1.00 29.13 C ATOM 765 HG1 THR B 130 51.383 32.636 11.567 1.00 0.00 H ATOM 766 H THR B 130 52.431 33.970 10.520 1.00 0.00 H ATOM 767 N GLU B 131 54.781 35.478 12.449 1.00 28.44 N ATOM 768 CA GLU B 131 55.963 36.080 12.966 1.00 29.94 C ATOM 769 C GLU B 131 56.050 37.543 12.607 1.00 28.61 C ATOM 770 O GLU B 131 56.584 38.345 13.378 1.00 27.55 O ATOM 771 CB GLU B 131 57.187 35.330 12.483 1.00 34.42 C ATOM 772 CG GLU B 131 58.369 35.433 13.414 1.00 42.01 C ATOM 773 CD GLU B 131 58.042 34.870 14.799 1.00 48.81 C ATOM 774 OE1 GLU B 131 57.337 33.824 14.886 1.00 54.76 O ATOM 775 OE2 GLU B 131 58.476 35.476 15.795 1.00 51.28 O ATOM 776 H GLU B 131 54.823 34.972 11.541 1.00 0.00 H ATOM 777 N LYS B 132 55.515 37.906 11.451 1.00 28.01 N ATOM 778 CA LYS B 132 55.797 39.211 10.871 1.00 29.39 C ATOM 779 C LYS B 132 54.588 40.076 10.654 1.00 26.82 C ATOM 780 O LYS B 132 54.725 41.238 10.368 1.00 27.26 O ATOM 781 CB LYS B 132 56.562 39.039 9.565 1.00 32.91 C ATOM 782 CG LYS B 132 57.913 38.337 9.716 1.00 38.62 C ATOM 783 CD LYS B 132 59.096 39.294 9.531 1.00 44.84 C ATOM 784 CE LYS B 132 60.412 38.691 10.019 1.00 49.33 C ATOM 785 NZ LYS B 132 60.578 38.846 11.505 1.00 52.74 N ATOM 786 HZ1 LYS B 132 60.570 39.857 11.750 1.00 0.00 H ATOM 787 HZ2 LYS B 132 59.796 38.364 11.992 1.00 0.00 H ATOM 788 HZ3 LYS B 132 61.483 38.424 11.797 1.00 0.00 H ATOM 789 H LYS B 132 54.884 37.249 10.950 1.00 0.00 H ATOM 790 N GLY B 133 53.402 39.528 10.815 1.00 25.60 N ATOM 791 CA GLY B 133 52.196 40.286 10.618 1.00 25.78 C ATOM 792 C GLY B 133 51.778 40.261 9.178 1.00 26.81 C ATOM 793 O GLY B 133 52.416 39.591 8.373 1.00 25.22 O ATOM 794 H GLY B 133 53.336 38.527 11.090 1.00 0.00 H ATOM 795 N PRO B 134 50.709 41.008 8.834 1.00 27.67 N ATOM 796 CA PRO B 134 50.254 40.996 7.463 1.00 28.04 C ATOM 797 C PRO B 134 51.354 41.457 6.519 1.00 28.46 C ATOM 798 O PRO B 134 52.178 42.277 6.891 1.00 27.72 O ATOM 799 CB PRO B 134 49.084 41.970 7.457 1.00 28.17 C ATOM 800 CG PRO B 134 49.242 42.803 8.666 1.00 29.75 C ATOM 801 CD PRO B 134 49.937 41.928 9.660 1.00 29.46 C ATOM 802 N LEU B 135 51.339 40.935 5.307 1.00 27.97 N ATOM 803 CA LEU B 135 52.319 41.295 4.322 1.00 30.58 C ATOM 804 C LEU B 135 52.223 42.736 3.891 1.00 31.39 C ATOM 805 O LEU B 135 53.203 43.302 3.498 1.00 36.28 O ATOM 806 CB LEU B 135 52.200 40.406 3.087 1.00 31.07 C ATOM 807 CG LEU B 135 52.634 38.961 3.250 1.00 32.67 C ATOM 808 CD1 LEU B 135 52.207 38.143 2.035 1.00 33.27 C ATOM 809 CD2 LEU B 135 54.136 38.946 3.378 1.00 34.05 C ATOM 810 H LEU B 135 50.600 40.247 5.060 1.00 0.00 H ATOM 811 N GLY B 136 51.092 43.390 3.912 1.00 32.04 N ATOM 812 CA GLY B 136 51.210 44.755 3.332 1.00 35.58 C ATOM 813 C GLY B 136 51.105 44.671 1.790 1.00 33.16 C ATOM 814 O GLY B 136 51.472 43.660 1.162 1.00 30.32 O ATOM 815 H GLY B 136 50.206 42.999 4.292 1.00 0.00 H ATOM 816 N GLU B 137 50.524 45.697 1.200 1.00 32.13 N ATOM 817 CA GLU B 137 49.865 45.490 -0.091 1.00 33.15 C ATOM 818 C GLU B 137 50.860 45.292 -1.240 1.00 32.49 C ATOM 819 O GLU B 137 50.598 44.517 -2.113 1.00 33.28 O ATOM 820 CB GLU B 137 48.785 46.542 -0.361 1.00 33.21 C ATOM 821 CG GLU B 137 47.548 46.325 0.503 1.00 32.67 C ATOM 822 CD GLU B 137 46.437 47.332 0.268 1.00 34.50 C ATOM 823 OE1 GLU B 137 46.174 47.687 -0.912 1.00 33.46 O ATOM 824 OE2 GLU B 137 45.802 47.771 1.268 1.00 35.16 O ATOM 825 H GLU B 137 50.534 46.637 1.644 1.00 0.00 H ATOM 826 N GLY B 138 52.008 45.950 -1.200 1.00 32.64 N ATOM 827 CA GLY B 138 53.043 45.729 -2.190 1.00 32.40 C ATOM 828 C GLY B 138 53.513 44.303 -2.349 1.00 30.86 C ATOM 829 O GLY B 138 53.442 43.746 -3.408 1.00 30.28 O ATOM 830 H GLY B 138 52.171 46.642 -0.441 1.00 0.00 H ATOM 831 N PRO B 139 53.982 43.679 -1.280 1.00 32.14 N ATOM 832 CA PRO B 139 54.345 42.249 -1.429 1.00 31.08 C ATOM 833 C PRO B 139 53.197 41.217 -1.557 1.00 30.66 C ATOM 834 O PRO B 139 53.394 40.128 -2.106 1.00 32.08 O ATOM 835 CB PRO B 139 55.213 41.967 -0.202 1.00 31.06 C ATOM 836 CG PRO B 139 55.111 43.179 0.684 1.00 32.48 C ATOM 837 CD PRO B 139 54.517 44.310 -0.059 1.00 32.81 C ATOM 838 N SER B 140 52.019 41.522 -1.022 1.00 30.25 N ATOM 839 CA SER B 140 50.837 40.714 -1.260 1.00 28.93 C ATOM 840 C SER B 140 50.499 40.635 -2.727 1.00 29.91 C ATOM 841 O SER B 140 50.241 39.586 -3.265 1.00 30.54 O ATOM 842 CB SER B 140 49.661 41.318 -0.527 1.00 29.31 C ATOM 843 OG SER B 140 49.874 41.233 0.857 1.00 30.84 O ATOM 844 HG SER B 140 50.699 41.727 1.094 1.00 0.00 H ATOM 845 H SER B 140 51.942 42.363 -0.416 1.00 0.00 H ATOM 846 N ARG B 141 50.509 41.765 -3.386 1.00 33.27 N ATOM 847 CA ARG B 141 50.201 41.828 -4.815 1.00 37.38 C ATOM 848 C ARG B 141 51.088 40.852 -5.593 1.00 35.89 C ATOM 849 O ARG B 141 50.621 39.972 -6.310 1.00 34.75 O ATOM 850 CB ARG B 141 50.368 43.297 -5.216 1.00 40.05 C ATOM 851 CG ARG B 141 50.097 43.722 -6.635 1.00 46.18 C ATOM 852 CD ARG B 141 49.537 45.173 -6.652 1.00 48.53 C ATOM 853 NE ARG B 141 49.872 45.974 -5.463 1.00 47.62 N ATOM 854 CZ ARG B 141 49.150 46.975 -4.947 1.00 50.11 C ATOM 855 NH1 ARG B 141 48.010 47.372 -5.482 1.00 54.39 N ATOM 856 NH2 ARG B 141 49.574 47.601 -3.861 1.00 52.18 N ATOM 857 HE ARG B 141 50.760 45.738 -4.975 1.00 0.00 H ATOM 858 HH12 ARG B 141 47.478 48.155 -5.051 1.00 0.00 H ATOM 859 HH11 ARG B 141 47.644 46.902 -6.335 1.00 0.00 H ATOM 860 HH22 ARG B 141 49.015 48.380 -3.458 1.00 0.00 H ATOM 861 HH21 ARG B 141 50.467 47.314 -3.411 1.00 0.00 H ATOM 862 H ARG B 141 50.742 42.643 -2.880 1.00 0.00 H ATOM 863 N CYS B 142 52.374 40.944 -5.352 1.00 37.07 N ATOM 864 CA CYS B 142 53.330 40.036 -5.959 1.00 38.39 C ATOM 865 C CYS B 142 53.087 38.584 -5.603 1.00 34.17 C ATOM 866 O CYS B 142 53.011 37.744 -6.511 1.00 32.96 O ATOM 867 CB CYS B 142 54.756 40.461 -5.588 1.00 43.51 C ATOM 868 SG CYS B 142 56.000 39.265 -6.071 1.00 54.23 S ATOM 869 H CYS B 142 52.717 41.686 -4.710 1.00 0.00 H ATOM 870 N PHE B 143 52.937 38.266 -4.311 1.00 30.27 N ATOM 871 CA PHE B 143 52.671 36.879 -3.916 1.00 29.37 C ATOM 872 C PHE B 143 51.298 36.422 -4.347 1.00 28.00 C ATOM 873 O PHE B 143 51.127 35.271 -4.773 1.00 27.94 O ATOM 874 CB PHE B 143 52.829 36.647 -2.410 1.00 32.77 C ATOM 875 CG PHE B 143 54.234 36.835 -1.911 1.00 36.82 C ATOM 876 CD1 PHE B 143 55.309 36.215 -2.532 1.00 37.84 C ATOM 877 CD2 PHE B 143 54.490 37.615 -0.790 1.00 42.03 C ATOM 878 CE1 PHE B 143 56.613 36.401 -2.066 1.00 41.05 C ATOM 879 CE2 PHE B 143 55.790 37.782 -0.305 1.00 43.56 C ATOM 880 CZ PHE B 143 56.855 37.171 -0.942 1.00 40.64 C ATOM 881 H PHE B 143 53.009 39.006 -3.584 1.00 0.00 H ATOM 882 N PHE B 144 50.312 37.309 -4.277 1.00 26.18 N ATOM 883 CA PHE B 144 48.993 36.920 -4.665 1.00 26.26 C ATOM 884 C PHE B 144 49.003 36.590 -6.137 1.00 27.06 C ATOM 885 O PHE B 144 48.465 35.575 -6.559 1.00 27.76 O ATOM 886 CB PHE B 144 47.963 38.015 -4.384 1.00 26.10 C ATOM 887 CG PHE B 144 46.543 37.539 -4.515 1.00 24.83 C ATOM 888 CD1 PHE B 144 46.053 36.540 -3.658 1.00 23.11 C ATOM 889 CD2 PHE B 144 45.714 38.044 -5.498 1.00 24.10 C ATOM 890 CE1 PHE B 144 44.746 36.085 -3.761 1.00 22.40 C ATOM 891 CE2 PHE B 144 44.399 37.591 -5.609 1.00 24.27 C ATOM 892 CZ PHE B 144 43.900 36.622 -4.714 1.00 23.28 C ATOM 893 H PHE B 144 50.498 38.276 -3.943 1.00 0.00 H ATOM 894 N GLY B 145 49.601 37.482 -6.908 1.00 29.69 N ATOM 895 CA GLY B 145 49.887 37.242 -8.327 1.00 30.32 C ATOM 896 C GLY B 145 50.498 35.890 -8.591 1.00 29.71 C ATOM 897 O GLY B 145 50.000 35.137 -9.416 1.00 28.71 O ATOM 898 H GLY B 145 49.881 38.393 -6.491 1.00 0.00 H ATOM 899 N GLN B 146 51.578 35.554 -7.887 1.00 30.18 N ATOM 900 CA GLN B 146 52.201 34.262 -8.124 1.00 29.17 C ATOM 901 C GLN B 146 51.237 33.128 -7.845 1.00 27.24 C ATOM 902 O GLN B 146 51.173 32.203 -8.599 1.00 26.40 O ATOM 903 CB GLN B 146 53.437 34.102 -7.295 1.00 30.59 C ATOM 904 CG GLN B 146 54.627 34.797 -7.897 1.00 35.40 C ATOM 905 CD GLN B 146 55.731 35.071 -6.865 1.00 39.01 C ATOM 906 OE1 GLN B 146 55.957 34.292 -5.963 1.00 37.77 O ATOM 907 NE2 GLN B 146 56.387 36.208 -6.998 1.00 43.21 N ATOM 908 HE22 GLN B 146 56.163 36.849 -7.786 1.00 0.00 H ATOM 909 HE21 GLN B 146 57.128 36.464 -6.315 1.00 0.00 H ATOM 910 H GLN B 146 51.970 36.206 -7.178 1.00 0.00 H ATOM 911 N VAL B 147 50.451 33.213 -6.769 1.00 26.03 N ATOM 912 CA VAL B 147 49.564 32.101 -6.435 1.00 24.96 C ATOM 913 C VAL B 147 48.548 31.931 -7.522 1.00 24.53 C ATOM 914 O VAL B 147 48.259 30.820 -7.958 1.00 25.22 O ATOM 915 CB VAL B 147 48.903 32.276 -5.053 1.00 24.64 C ATOM 916 CG1 VAL B 147 47.877 31.196 -4.797 1.00 23.31 C ATOM 917 CG2 VAL B 147 49.996 32.278 -3.962 1.00 24.64 C ATOM 918 H VAL B 147 50.470 34.065 -6.173 1.00 0.00 H ATOM 919 N VAL B 148 47.984 33.033 -7.964 1.00 24.89 N ATOM 920 CA VAL B 148 47.004 32.945 -9.005 1.00 26.32 C ATOM 921 C VAL B 148 47.572 32.271 -10.251 1.00 27.86 C ATOM 922 O VAL B 148 46.906 31.437 -10.835 1.00 29.05 O ATOM 923 CB VAL B 148 46.430 34.310 -9.349 1.00 27.46 C ATOM 924 CG1 VAL B 148 45.500 34.197 -10.522 1.00 28.76 C ATOM 925 CG2 VAL B 148 45.636 34.817 -8.179 1.00 28.30 C ATOM 926 H VAL B 148 48.246 33.956 -7.563 1.00 0.00 H ATOM 927 N ALA B 149 48.794 32.608 -10.650 1.00 27.96 N ATOM 928 CA ALA B 149 49.375 31.977 -11.836 1.00 29.38 C ATOM 929 C ALA B 149 49.644 30.497 -11.610 1.00 28.94 C ATOM 930 O ALA B 149 49.498 29.685 -12.526 1.00 29.72 O ATOM 931 CB ALA B 149 50.655 32.696 -12.263 1.00 29.89 C ATOM 932 H ALA B 149 49.337 33.319 -10.120 1.00 0.00 H ATOM 933 N ALA B 150 50.062 30.133 -10.406 1.00 27.18 N ATOM 934 CA ALA B 150 50.245 28.712 -10.092 1.00 27.25 C ATOM 935 C ALA B 150 48.891 27.971 -10.244 1.00 27.17 C ATOM 936 O ALA B 150 48.802 26.864 -10.806 1.00 28.85 O ATOM 937 CB ALA B 150 50.800 28.551 -8.683 1.00 27.06 C ATOM 938 H ALA B 150 50.260 30.855 -9.684 1.00 0.00 H ATOM 939 N ILE B 151 47.830 28.613 -9.799 1.00 26.44 N ATOM 940 CA ILE B 151 46.485 28.024 -9.881 1.00 27.09 C ATOM 941 C ILE B 151 46.029 27.920 -11.339 1.00 29.28 C ATOM 942 O ILE B 151 45.591 26.861 -11.808 1.00 29.63 O ATOM 943 CB ILE B 151 45.488 28.840 -9.023 1.00 26.30 C ATOM 944 CG1 ILE B 151 45.856 28.631 -7.536 1.00 25.94 C ATOM 945 CG2 ILE B 151 44.050 28.425 -9.343 1.00 27.09 C ATOM 946 CD1 ILE B 151 45.154 29.528 -6.587 1.00 26.31 C ATOM 947 H ILE B 151 47.946 29.558 -9.380 1.00 0.00 H ATOM 948 N GLN B 152 46.133 29.011 -12.064 1.00 30.88 N ATOM 949 CA GLN B 152 45.928 28.943 -13.510 1.00 36.03 C ATOM 950 C GLN B 152 46.727 27.826 -14.143 1.00 35.00 C ATOM 951 O GLN B 152 46.207 27.065 -14.940 1.00 37.09 O ATOM 952 CB GLN B 152 46.387 30.214 -14.168 1.00 39.15 C ATOM 953 CG GLN B 152 45.526 31.421 -13.867 1.00 41.31 C ATOM 954 CD GLN B 152 45.833 32.545 -14.854 1.00 46.48 C ATOM 955 OE1 GLN B 152 46.957 33.091 -14.871 1.00 45.94 O ATOM 956 NE2 GLN B 152 44.849 32.877 -15.698 1.00 47.44 N ATOM 957 HE22 GLN B 152 43.931 32.392 -15.643 1.00 0.00 H ATOM 958 HE21 GLN B 152 45.003 33.620 -16.409 1.00 0.00 H ATOM 959 H GLN B 152 46.360 29.919 -11.611 1.00 0.00 H ATOM 960 N HIS B 153 47.997 27.724 -13.793 1.00 34.48 N ATOM 961 CA HIS B 153 48.827 26.642 -14.333 1.00 35.20 C ATOM 962 C HIS B 153 48.174 25.310 -14.069 1.00 34.23 C ATOM 963 O HIS B 153 47.917 24.566 -15.006 1.00 34.72 O ATOM 964 CB HIS B 153 50.232 26.667 -13.745 1.00 35.50 C ATOM 965 CG HIS B 153 51.056 25.465 -14.076 1.00 37.71 C ATOM 966 ND1 HIS B 153 51.644 25.274 -15.312 1.00 41.54 N ATOM 967 CD2 HIS B 153 51.417 24.400 -13.319 1.00 38.33 C ATOM 968 CE1 HIS B 153 52.321 24.134 -15.303 1.00 42.71 C ATOM 969 NE2 HIS B 153 52.201 23.585 -14.102 1.00 40.27 N ATOM 970 H HIS B 153 48.409 28.413 -13.132 1.00 0.00 H ATOM 971 N CYS B 154 47.895 25.020 -12.793 1.00 32.84 N ATOM 972 CA CYS B 154 47.221 23.792 -12.394 1.00 32.23 C ATOM 973 C CYS B 154 45.939 23.513 -13.151 1.00 32.88 C ATOM 974 O CYS B 154 45.713 22.388 -13.576 1.00 31.16 O ATOM 975 CB CYS B 154 46.891 23.804 -10.905 1.00 33.33 C ATOM 976 SG CYS B 154 48.358 23.825 -9.883 1.00 33.90 S ATOM 977 H CYS B 154 48.171 25.700 -12.056 1.00 0.00 H ATOM 978 N HIS B 155 45.097 24.524 -13.300 1.00 34.73 N ATOM 979 CA HIS B 155 43.874 24.362 -14.017 1.00 38.11 C ATOM 980 C HIS B 155 44.191 23.949 -15.471 1.00 40.34 C ATOM 981 O HIS B 155 43.523 23.076 -16.020 1.00 38.43 O ATOM 982 CB HIS B 155 43.042 25.646 -13.985 1.00 41.85 C ATOM 983 CG HIS B 155 42.513 26.028 -12.627 1.00 44.66 C ATOM 984 ND1 HIS B 155 42.613 25.215 -11.509 1.00 45.94 N ATOM 985 CD2 HIS B 155 41.826 27.134 -12.231 1.00 46.08 C ATOM 986 CE1 HIS B 155 42.027 25.815 -10.487 1.00 46.27 C ATOM 987 NE2 HIS B 155 41.545 26.982 -10.898 1.00 48.99 N ATOM 988 H HIS B 155 45.331 25.450 -12.888 1.00 0.00 H ATOM 989 N SER B 156 45.234 24.538 -16.065 1.00 41.89 N ATOM 990 CA SER B 156 45.717 24.131 -17.433 1.00 44.52 C ATOM 991 C SER B 156 46.115 22.663 -17.557 1.00 43.25 C ATOM 992 O SER B 156 46.077 22.112 -18.634 1.00 41.97 O ATOM 993 CB SER B 156 46.958 24.932 -17.866 1.00 44.51 C ATOM 994 OG SER B 156 46.588 26.238 -18.240 1.00 47.41 O ATOM 995 HG SER B 156 46.161 26.692 -17.471 1.00 0.00 H ATOM 996 H SER B 156 45.729 25.304 -15.565 1.00 0.00 H ATOM 997 N ARG B 157 46.546 22.056 -16.458 1.00 40.75 N ATOM 998 CA ARG B 157 46.832 20.642 -16.446 1.00 40.09 C ATOM 999 C ARG B 157 45.608 19.843 -16.017 1.00 39.72 C ATOM 1000 O ARG B 157 45.737 18.655 -15.740 1.00 41.31 O ATOM 1001 CB ARG B 157 47.973 20.366 -15.475 1.00 41.54 C ATOM 1002 CG ARG B 157 49.218 21.234 -15.687 1.00 42.79 C ATOM 1003 CD ARG B 157 49.958 20.734 -16.915 1.00 46.06 C ATOM 1004 NE ARG B 157 50.909 21.690 -17.486 1.00 48.56 N ATOM 1005 CZ ARG B 157 52.231 21.540 -17.503 1.00 46.99 C ATOM 1006 NH1 ARG B 157 52.812 20.491 -16.938 1.00 47.19 N ATOM 1007 NH2 ARG B 157 52.972 22.481 -18.070 1.00 48.54 N ATOM 1008 HE ARG B 157 50.520 22.555 -17.912 1.00 0.00 H ATOM 1009 HH12 ARG B 157 53.847 20.394 -16.963 1.00 0.00 H ATOM 1010 HH11 ARG B 157 52.233 19.765 -16.470 1.00 0.00 H ATOM 1011 HH22 ARG B 157 54.007 22.384 -18.094 1.00 0.00 H ATOM 1012 HH21 ARG B 157 52.518 23.317 -18.491 1.00 0.00 H ATOM 1013 H ARG B 157 46.680 22.611 -15.589 1.00 0.00 H ATOM 1014 N GLY B 158 44.440 20.493 -15.946 1.00 38.25 N ATOM 1015 CA GLY B 158 43.232 19.899 -15.380 1.00 38.00 C ATOM 1016 C GLY B 158 43.309 19.471 -13.923 1.00 36.93 C ATOM 1017 O GLY B 158 42.714 18.464 -13.555 1.00 37.23 O ATOM 1018 H GLY B 158 44.391 21.466 -16.311 1.00 0.00 H ATOM 1019 N VAL B 159 43.984 20.258 -13.077 1.00 35.03 N ATOM 1020 CA VAL B 159 44.056 19.988 -11.643 1.00 31.89 C ATOM 1021 C VAL B 159 43.523 21.164 -10.845 1.00 31.54 C ATOM 1022 O VAL B 159 43.914 22.318 -11.069 1.00 30.95 O ATOM 1023 CB VAL B 159 45.507 19.677 -11.231 1.00 32.39 C ATOM 1024 CG1 VAL B 159 45.686 19.478 -9.710 1.00 30.94 C ATOM 1025 CG2 VAL B 159 45.977 18.431 -11.960 1.00 34.62 C ATOM 1026 H VAL B 159 44.476 21.093 -13.454 1.00 0.00 H ATOM 1027 N VAL B 160 42.641 20.856 -9.889 1.00 31.66 N ATOM 1028 CA VAL B 160 42.160 21.808 -8.890 1.00 31.43 C ATOM 1029 C VAL B 160 42.773 21.420 -7.559 1.00 29.30 C ATOM 1030 O VAL B 160 42.653 20.304 -7.126 1.00 29.78 O ATOM 1031 CB VAL B 160 40.618 21.791 -8.692 1.00 33.63 C ATOM 1032 CG1 VAL B 160 39.973 22.412 -9.872 1.00 37.93 C ATOM 1033 CG2 VAL B 160 40.054 20.379 -8.531 1.00 33.65 C ATOM 1034 H VAL B 160 42.276 19.883 -9.854 1.00 0.00 H ATOM 1035 N HIS B 161 43.413 22.372 -6.916 1.00 27.10 N ATOM 1036 CA HIS B 161 44.107 22.135 -5.697 1.00 25.61 C ATOM 1037 C HIS B 161 43.102 21.878 -4.551 1.00 26.85 C ATOM 1038 O HIS B 161 43.245 20.889 -3.821 1.00 25.91 O ATOM 1039 CB HIS B 161 45.014 23.354 -5.423 1.00 24.60 C ATOM 1040 CG HIS B 161 45.850 23.214 -4.192 1.00 23.95 C ATOM 1041 ND1 HIS B 161 45.365 23.483 -2.935 1.00 22.80 N ATOM 1042 CD2 HIS B 161 47.124 22.817 -4.019 1.00 24.69 C ATOM 1043 CE1 HIS B 161 46.303 23.293 -2.038 1.00 23.16 C ATOM 1044 NE2 HIS B 161 47.388 22.887 -2.671 1.00 25.82 N ATOM 1045 H HIS B 161 43.412 23.333 -7.313 1.00 0.00 H ATOM 1046 N ARG B 162 42.092 22.763 -4.430 1.00 27.40 N ATOM 1047 CA ARG B 162 40.967 22.667 -3.463 1.00 27.47 C ATOM 1048 C ARG B 162 41.259 22.885 -2.014 1.00 26.82 C ATOM 1049 O ARG B 162 40.395 22.704 -1.162 1.00 30.01 O ATOM 1050 CB ARG B 162 40.268 21.361 -3.559 1.00 29.74 C ATOM 1051 CG ARG B 162 39.690 21.136 -4.923 1.00 33.02 C ATOM 1052 CD ARG B 162 39.574 19.659 -5.082 1.00 35.47 C ATOM 1053 NE ARG B 162 38.226 19.263 -4.875 1.00 37.71 N ATOM 1054 CZ ARG B 162 37.850 18.068 -4.451 1.00 38.81 C ATOM 1055 NH1 ARG B 162 38.703 17.116 -4.114 1.00 38.43 N ATOM 1056 NH2 ARG B 162 36.576 17.853 -4.335 1.00 43.15 N ATOM 1057 HE ARG B 162 37.482 19.962 -5.071 1.00 0.00 H ATOM 1058 HH12 ARG B 162 38.350 16.194 -3.787 1.00 0.00 H ATOM 1059 HH11 ARG B 162 39.727 17.289 -4.176 1.00 0.00 H ATOM 1060 HH22 ARG B 162 36.233 16.928 -4.005 1.00 0.00 H ATOM 1061 HH21 ARG B 162 35.898 18.605 -4.572 1.00 0.00 H ATOM 1062 H ARG B 162 42.101 23.584 -5.068 1.00 0.00 H ATOM 1063 N ASP B 163 42.458 23.301 -1.724 1.00 25.27 N ATOM 1064 CA ASP B 163 42.861 23.570 -0.384 1.00 25.20 C ATOM 1065 C ASP B 163 43.826 24.743 -0.368 1.00 23.62 C ATOM 1066 O ASP B 163 44.835 24.743 0.317 1.00 23.09 O ATOM 1067 CB ASP B 163 43.498 22.318 0.236 1.00 28.03 C ATOM 1068 CG ASP B 163 43.487 22.367 1.756 1.00 31.57 C ATOM 1069 OD1 ASP B 163 42.655 23.162 2.302 1.00 30.79 O ATOM 1070 OD2 ASP B 163 44.348 21.676 2.378 1.00 34.70 O ATOM 1071 H ASP B 163 43.143 23.441 -2.494 1.00 0.00 H ATOM 1072 N ILE B 164 43.528 25.758 -1.168 1.00 24.36 N ATOM 1073 CA ILE B 164 44.323 26.951 -1.159 1.00 23.96 C ATOM 1074 C ILE B 164 44.183 27.567 0.243 1.00 23.50 C ATOM 1075 O ILE B 164 43.092 27.702 0.758 1.00 24.20 O ATOM 1076 CB ILE B 164 43.863 27.960 -2.198 1.00 24.94 C ATOM 1077 CG1 ILE B 164 44.036 27.406 -3.632 1.00 25.79 C ATOM 1078 CG2 ILE B 164 44.704 29.222 -2.063 1.00 25.50 C ATOM 1079 CD1 ILE B 164 45.443 27.036 -4.010 1.00 25.34 C ATOM 1080 H ILE B 164 42.711 25.688 -1.807 1.00 0.00 H ATOM 1081 N LYS B 165 45.298 27.841 0.894 1.00 22.96 N ATOM 1082 CA LYS B 165 45.276 28.573 2.146 1.00 21.80 C ATOM 1083 C LYS B 165 46.678 28.879 2.503 1.00 21.73 C ATOM 1084 O LYS B 165 47.595 28.339 1.929 1.00 20.78 O ATOM 1085 CB LYS B 165 44.607 27.771 3.253 1.00 20.82 C ATOM 1086 CG LYS B 165 45.321 26.468 3.495 1.00 20.69 C ATOM 1087 CD LYS B 165 44.700 25.734 4.639 1.00 20.85 C ATOM 1088 CE LYS B 165 45.283 24.362 4.655 1.00 21.78 C ATOM 1089 NZ LYS B 165 44.715 23.654 5.814 1.00 22.74 N ATOM 1090 HZ1 LYS B 165 44.962 24.165 6.686 1.00 0.00 H ATOM 1091 HZ2 LYS B 165 43.680 23.609 5.718 1.00 0.00 H ATOM 1092 HZ3 LYS B 165 45.103 22.690 5.854 1.00 0.00 H ATOM 1093 H LYS B 165 46.209 27.526 0.502 1.00 0.00 H ATOM 1094 N ASP B 166 46.866 29.752 3.482 1.00 23.44 N ATOM 1095 CA ASP B 166 48.216 30.205 3.750 1.00 23.03 C ATOM 1096 C ASP B 166 49.170 29.158 4.331 1.00 22.82 C ATOM 1097 O ASP B 166 50.382 29.217 4.079 1.00 22.89 O ATOM 1098 CB ASP B 166 48.190 31.439 4.574 1.00 24.25 C ATOM 1099 CG ASP B 166 47.681 31.202 5.945 1.00 25.59 C ATOM 1100 OD1 ASP B 166 47.367 30.064 6.334 1.00 26.74 O ATOM 1101 OD2 ASP B 166 47.599 32.209 6.633 1.00 29.64 O ATOM 1102 H ASP B 166 46.065 30.103 4.044 1.00 0.00 H ATOM 1103 N GLU B 167 48.638 28.155 4.994 1.00 22.88 N ATOM 1104 CA GLU B 167 49.461 26.996 5.387 1.00 24.85 C ATOM 1105 C GLU B 167 50.032 26.238 4.194 1.00 24.02 C ATOM 1106 O GLU B 167 51.002 25.497 4.357 1.00 23.37 O ATOM 1107 CB GLU B 167 48.668 26.034 6.265 1.00 28.48 C ATOM 1108 CG GLU B 167 48.721 26.497 7.707 1.00 36.35 C ATOM 1109 CD GLU B 167 47.557 26.064 8.599 1.00 46.06 C ATOM 1110 OE1 GLU B 167 46.375 26.280 8.195 1.00 51.86 O ATOM 1111 OE2 GLU B 167 47.838 25.574 9.748 1.00 52.95 O ATOM 1112 H GLU B 167 47.629 28.179 5.243 1.00 0.00 H ATOM 1113 N ASN B 168 49.413 26.419 3.016 1.00 22.49 N ATOM 1114 CA ASN B 168 49.751 25.686 1.823 1.00 22.96 C ATOM 1115 C ASN B 168 50.418 26.484 0.754 1.00 23.36 C ATOM 1116 O ASN B 168 50.443 26.087 -0.401 1.00 23.73 O ATOM 1117 CB ASN B 168 48.492 25.029 1.292 1.00 22.98 C ATOM 1118 CG ASN B 168 48.119 23.863 2.118 1.00 22.56 C ATOM 1119 OD1 ASN B 168 48.911 23.470 2.955 1.00 26.31 O ATOM 1120 ND2 ASN B 168 46.935 23.335 1.953 1.00 22.02 N ATOM 1121 HD22 ASN B 168 46.296 23.709 1.222 1.00 0.00 H ATOM 1122 HD21 ASN B 168 46.632 22.541 2.552 1.00 0.00 H ATOM 1123 H ASN B 168 48.651 27.124 2.962 1.00 0.00 H ATOM 1124 N ILE B 169 50.943 27.635 1.138 1.00 23.53 N ATOM 1125 CA ILE B 169 51.737 28.438 0.270 1.00 23.32 C ATOM 1126 C ILE B 169 53.119 28.454 0.941 1.00 25.48 C ATOM 1127 O ILE B 169 53.274 28.850 2.095 1.00 25.40 O ATOM 1128 CB ILE B 169 51.193 29.850 0.126 1.00 22.87 C ATOM 1129 CG1 ILE B 169 49.705 29.858 -0.218 1.00 22.55 C ATOM 1130 CG2 ILE B 169 51.974 30.640 -0.913 1.00 24.06 C ATOM 1131 CD1 ILE B 169 49.335 29.205 -1.509 1.00 23.48 C ATOM 1132 H ILE B 169 50.770 27.966 2.109 1.00 0.00 H ATOM 1133 N LEU B 170 54.130 27.999 0.223 1.00 27.31 N ATOM 1134 CA LEU B 170 55.452 28.024 0.751 1.00 30.58 C ATOM 1135 C LEU B 170 56.139 29.222 0.193 1.00 31.19 C ATOM 1136 O LEU B 170 56.083 29.411 -0.992 1.00 31.60 O ATOM 1137 CB LEU B 170 56.173 26.774 0.307 1.00 32.32 C ATOM 1138 CG LEU B 170 57.411 26.489 1.100 1.00 33.88 C ATOM 1139 CD1 LEU B 170 56.982 26.224 2.529 1.00 35.13 C ATOM 1140 CD2 LEU B 170 58.097 25.272 0.502 1.00 35.26 C ATOM 1141 H LEU B 170 53.960 27.621 -0.731 1.00 0.00 H ATOM 1142 N ILE B 171 56.775 30.038 1.034 1.00 32.59 N ATOM 1143 CA ILE B 171 57.548 31.173 0.568 1.00 34.07 C ATOM 1144 C ILE B 171 59.024 30.748 0.502 1.00 37.95 C ATOM 1145 O ILE B 171 59.627 30.412 1.519 1.00 38.01 O ATOM 1146 CB ILE B 171 57.397 32.387 1.496 1.00 35.03 C ATOM 1147 CG1 ILE B 171 55.947 32.843 1.621 1.00 35.26 C ATOM 1148 CG2 ILE B 171 58.267 33.528 1.035 1.00 35.77 C ATOM 1149 CD1 ILE B 171 55.199 32.974 0.316 1.00 37.11 C ATOM 1150 H ILE B 171 56.715 29.855 2.056 1.00 0.00 H ATOM 1151 N ASP B 172 59.586 30.724 -0.704 1.00 41.74 N ATOM 1152 CA ASP B 172 61.011 30.419 -0.905 1.00 44.07 C ATOM 1153 C ASP B 172 61.703 31.753 -0.764 1.00 48.15 C ATOM 1154 O ASP B 172 61.609 32.611 -1.662 1.00 47.63 O ATOM 1155 CB ASP B 172 61.241 29.765 -2.286 1.00 47.45 C ATOM 1156 CG ASP B 172 62.721 29.781 -2.752 1.00 50.94 C ATOM 1157 OD1 ASP B 172 63.656 30.018 -1.938 1.00 53.85 O ATOM 1158 OD2 ASP B 172 62.933 29.545 -3.965 1.00 49.77 O ATOM 1159 H ASP B 172 58.996 30.929 -1.535 1.00 0.00 H ATOM 1160 N LEU B 173 62.375 31.928 0.377 1.00 51.21 N ATOM 1161 CA LEU B 173 62.786 33.258 0.856 1.00 54.51 C ATOM 1162 C LEU B 173 64.081 33.742 0.221 1.00 57.00 C ATOM 1163 O LEU B 173 64.443 34.894 0.398 1.00 60.23 O ATOM 1164 CB LEU B 173 62.940 33.276 2.385 1.00 54.43 C ATOM 1165 CG LEU B 173 61.745 32.802 3.242 1.00 55.98 C ATOM 1166 CD1 LEU B 173 62.181 31.769 4.260 1.00 57.16 C ATOM 1167 CD2 LEU B 173 60.999 33.919 3.964 1.00 54.36 C ATOM 1168 H LEU B 173 62.617 31.093 0.948 1.00 0.00 H ATOM 1169 N ARG B 174 64.783 32.865 -0.497 1.00 59.76 N ATOM 1170 CA ARG B 174 65.930 33.281 -1.310 1.00 60.46 C ATOM 1171 C ARG B 174 65.433 33.984 -2.573 1.00 60.46 C ATOM 1172 O ARG B 174 65.783 35.141 -2.820 1.00 62.05 O ATOM 1173 CB ARG B 174 66.798 32.078 -1.688 1.00 61.34 C ATOM 1174 H ARG B 174 64.510 31.862 -0.480 1.00 0.00 H ATOM 1175 N ARG B 175 64.589 33.294 -3.345 1.00 56.91 N ATOM 1176 CA ARG B 175 64.090 33.808 -4.628 1.00 55.14 C ATOM 1177 C ARG B 175 62.876 34.764 -4.563 1.00 53.02 C ATOM 1178 O ARG B 175 62.513 35.326 -5.587 1.00 52.68 O ATOM 1179 CB ARG B 175 63.778 32.638 -5.581 1.00 56.94 C ATOM 1180 CG ARG B 175 64.988 31.763 -5.908 1.00 56.69 C ATOM 1181 H ARG B 175 64.273 32.356 -3.025 1.00 0.00 H ATOM 1182 N GLY B 176 62.267 34.952 -3.386 1.00 50.89 N ATOM 1183 CA GLY B 176 61.090 35.818 -3.230 1.00 50.01 C ATOM 1184 C GLY B 176 59.819 35.271 -3.865 1.00 49.99 C ATOM 1185 O GLY B 176 59.057 35.983 -4.521 1.00 49.22 O ATOM 1186 H GLY B 176 62.642 34.465 -2.547 1.00 0.00 H ATOM 1187 N CYS B 177 59.538 34.008 -3.616 1.00 49.30 N ATOM 1188 CA CYS B 177 58.652 33.291 -4.492 1.00 48.11 C ATOM 1189 C CYS B 177 57.688 32.363 -3.738 1.00 41.12 C ATOM 1190 O CYS B 177 58.109 31.599 -2.842 1.00 38.14 O ATOM 1191 CB CYS B 177 59.559 32.547 -5.465 1.00 53.61 C ATOM 1192 SG CYS B 177 58.771 31.476 -6.637 1.00 65.20 S ATOM 1193 H CYS B 177 59.955 33.533 -2.790 1.00 0.00 H ATOM 1194 N ALA B 178 56.399 32.467 -4.079 1.00 34.59 N ATOM 1195 CA ALA B 178 55.349 31.617 -3.502 1.00 32.74 C ATOM 1196 C ALA B 178 55.258 30.321 -4.257 1.00 32.32 C ATOM 1197 O ALA B 178 55.324 30.305 -5.485 1.00 35.43 O ATOM 1198 CB ALA B 178 53.994 32.304 -3.525 1.00 30.90 C ATOM 1199 H ALA B 178 56.128 33.182 -4.784 1.00 0.00 H ATOM 1200 N LYS B 179 55.091 29.228 -3.532 1.00 29.66 N ATOM 1201 CA LYS B 179 54.877 27.950 -4.157 1.00 29.74 C ATOM 1202 C LYS B 179 53.729 27.236 -3.494 1.00 27.91 C ATOM 1203 O LYS B 179 53.676 27.211 -2.271 1.00 28.59 O ATOM 1204 CB LYS B 179 56.139 27.125 -4.040 1.00 31.74 C ATOM 1205 CG LYS B 179 57.271 27.705 -4.853 1.00 33.25 C ATOM 1206 CD LYS B 179 58.442 26.763 -4.909 1.00 34.34 C ATOM 1207 CE LYS B 179 59.471 27.259 -5.904 1.00 35.47 C ATOM 1208 NZ LYS B 179 59.240 26.644 -7.224 1.00 37.65 N ATOM 1209 HZ1 LYS B 179 59.316 25.610 -7.141 1.00 0.00 H ATOM 1210 HZ2 LYS B 179 58.289 26.897 -7.561 1.00 0.00 H ATOM 1211 HZ3 LYS B 179 59.952 26.993 -7.897 1.00 0.00 H ATOM 1212 H LYS B 179 55.115 29.293 -2.494 1.00 0.00 H ATOM 1213 N LEU B 180 52.823 26.673 -4.289 1.00 25.24 N ATOM 1214 CA LEU B 180 51.765 25.812 -3.801 1.00 25.29 C ATOM 1215 C LEU B 180 52.244 24.443 -3.313 1.00 24.92 C ATOM 1216 O LEU B 180 52.972 23.765 -3.998 1.00 23.90 O ATOM 1217 CB LEU B 180 50.770 25.539 -4.903 1.00 27.77 C ATOM 1218 CG LEU B 180 49.525 26.368 -5.060 1.00 29.39 C ATOM 1219 CD1 LEU B 180 49.868 27.824 -5.122 1.00 31.17 C ATOM 1220 CD2 LEU B 180 48.832 25.957 -6.340 1.00 30.80 C ATOM 1221 H LEU B 180 52.877 26.860 -5.311 1.00 0.00 H ATOM 1222 N ILE B 181 51.768 24.016 -2.146 1.00 24.70 N ATOM 1223 CA ILE B 181 52.061 22.699 -1.623 1.00 23.65 C ATOM 1224 C ILE B 181 50.783 22.043 -1.231 1.00 24.68 C ATOM 1225 O ILE B 181 49.712 22.693 -1.219 1.00 24.64 O ATOM 1226 CB ILE B 181 52.995 22.717 -0.423 1.00 23.26 C ATOM 1227 CG1 ILE B 181 52.527 23.688 0.655 1.00 22.32 C ATOM 1228 CG2 ILE B 181 54.399 23.086 -0.883 1.00 23.81 C ATOM 1229 CD1 ILE B 181 53.226 23.467 1.988 1.00 21.77 C ATOM 1230 H ILE B 181 51.163 24.653 -1.589 1.00 0.00 H ATOM 1231 N ASP B 182 50.899 20.747 -0.968 1.00 26.23 N ATOM 1232 CA ASP B 182 49.828 19.888 -0.438 1.00 29.73 C ATOM 1233 C ASP B 182 48.655 19.606 -1.368 1.00 29.87 C ATOM 1234 O ASP B 182 47.554 20.068 -1.124 1.00 35.00 O ATOM 1235 CB ASP B 182 49.265 20.407 0.873 1.00 32.25 C ATOM 1236 CG ASP B 182 48.306 19.397 1.546 1.00 35.80 C ATOM 1237 OD1 ASP B 182 48.104 18.281 1.015 1.00 37.68 O ATOM 1238 OD2 ASP B 182 47.754 19.717 2.627 1.00 42.24 O ATOM 1239 H ASP B 182 51.821 20.303 -1.151 1.00 0.00 H ATOM 1240 N PHE B 183 48.874 18.743 -2.346 1.00 28.36 N ATOM 1241 CA PHE B 183 47.829 18.376 -3.264 1.00 27.50 C ATOM 1242 C PHE B 183 47.014 17.215 -2.784 1.00 28.82 C ATOM 1243 O PHE B 183 46.164 16.708 -3.511 1.00 28.71 O ATOM 1244 CB PHE B 183 48.422 18.096 -4.611 1.00 26.32 C ATOM 1245 CG PHE B 183 48.765 19.317 -5.320 1.00 24.87 C ATOM 1246 CD1 PHE B 183 49.941 19.971 -5.055 1.00 24.25 C ATOM 1247 CD2 PHE B 183 47.891 19.852 -6.227 1.00 25.83 C ATOM 1248 CE1 PHE B 183 50.235 21.155 -5.677 1.00 23.25 C ATOM 1249 CE2 PHE B 183 48.203 21.008 -6.898 1.00 24.95 C ATOM 1250 CZ PHE B 183 49.380 21.660 -6.613 1.00 24.37 C ATOM 1251 H PHE B 183 49.819 18.322 -2.453 1.00 0.00 H ATOM 1252 N GLY B 184 47.210 16.853 -1.526 1.00 30.07 N ATOM 1253 CA GLY B 184 46.493 15.737 -0.938 1.00 32.45 C ATOM 1254 C GLY B 184 44.974 15.770 -0.984 1.00 33.02 C ATOM 1255 O GLY B 184 44.351 14.741 -0.804 1.00 36.84 O ATOM 1256 H GLY B 184 47.893 17.380 -0.946 1.00 0.00 H ATOM 1257 N SER B 185 44.370 16.920 -1.222 1.00 31.43 N ATOM 1258 CA SER B 185 42.939 16.993 -1.274 1.00 32.50 C ATOM 1259 C SER B 185 42.393 17.623 -2.575 1.00 30.55 C ATOM 1260 O SER B 185 41.250 18.032 -2.647 1.00 30.48 O ATOM 1261 CB SER B 185 42.425 17.671 0.005 1.00 36.18 C ATOM 1262 OG SER B 185 42.612 19.072 -0.016 1.00 38.00 O ATOM 1263 HG SER B 185 42.122 19.458 -0.785 1.00 0.00 H ATOM 1264 H SER B 185 44.936 17.779 -1.373 1.00 0.00 H ATOM 1265 N GLY B 186 43.220 17.619 -3.620 1.00 30.54 N ATOM 1266 CA GLY B 186 42.861 18.129 -4.918 1.00 29.47 C ATOM 1267 C GLY B 186 42.099 17.080 -5.698 1.00 31.03 C ATOM 1268 O GLY B 186 41.831 15.963 -5.235 1.00 30.48 O ATOM 1269 H GLY B 186 44.175 17.227 -3.491 1.00 0.00 H ATOM 1270 N ALA B 187 41.765 17.464 -6.910 1.00 31.29 N ATOM 1271 CA ALA B 187 41.052 16.615 -7.809 1.00 33.35 C ATOM 1272 C ALA B 187 41.384 17.032 -9.238 1.00 35.24 C ATOM 1273 O ALA B 187 42.011 18.053 -9.462 1.00 33.44 O ATOM 1274 CB ALA B 187 39.546 16.709 -7.553 1.00 31.48 C ATOM 1275 H ALA B 187 42.029 18.419 -7.225 1.00 0.00 H ATOM 1276 N LEU B 188 40.942 16.220 -10.187 1.00 40.14 N ATOM 1277 CA LEU B 188 40.989 16.569 -11.591 1.00 44.33 C ATOM 1278 C LEU B 188 39.907 17.605 -11.833 1.00 47.15 C ATOM 1279 O LEU B 188 38.864 17.584 -11.204 1.00 48.14 O ATOM 1280 CB LEU B 188 40.788 15.329 -12.472 1.00 45.70 C ATOM 1281 CG LEU B 188 41.678 14.105 -12.199 1.00 46.98 C ATOM 1282 CD1 LEU B 188 41.382 13.019 -13.218 1.00 52.56 C ATOM 1283 CD2 LEU B 188 43.153 14.423 -12.243 1.00 46.24 C ATOM 1284 H LEU B 188 40.547 15.298 -9.913 1.00 0.00 H ATOM 1285 N LEU B 189 40.175 18.536 -12.730 1.00 51.41 N ATOM 1286 CA LEU B 189 39.303 19.677 -12.913 1.00 54.98 C ATOM 1287 C LEU B 189 38.175 19.347 -13.863 1.00 59.29 C ATOM 1288 O LEU B 189 38.423 18.837 -14.937 1.00 59.66 O ATOM 1289 CB LEU B 189 40.111 20.837 -13.480 1.00 57.62 C ATOM 1290 CG LEU B 189 39.395 22.100 -13.947 1.00 60.07 C ATOM 1291 CD1 LEU B 189 38.473 22.644 -12.876 1.00 62.67 C ATOM 1292 CD2 LEU B 189 40.411 23.163 -14.350 1.00 61.91 C ATOM 1293 H LEU B 189 41.029 18.448 -13.317 1.00 0.00 H ATOM 1294 N HIS B 190 36.938 19.637 -13.459 1.00 63.96 N ATOM 1295 CA HIS B 190 35.791 19.619 -14.364 1.00 66.25 C ATOM 1296 C HIS B 190 34.757 20.739 -14.084 1.00 69.82 C ATOM 1297 O HIS B 190 34.682 21.317 -12.982 1.00 64.35 O ATOM 1298 CB HIS B 190 35.111 18.236 -14.380 1.00 67.14 C ATOM 1299 CG HIS B 190 34.828 17.666 -13.022 1.00 68.46 C ATOM 1300 ND1 HIS B 190 33.897 18.207 -12.161 1.00 67.45 N ATOM 1301 CD2 HIS B 190 35.336 16.582 -12.387 1.00 69.04 C ATOM 1302 CE1 HIS B 190 33.846 17.487 -11.054 1.00 66.01 C ATOM 1303 NE2 HIS B 190 34.709 16.495 -11.165 1.00 68.03 N ATOM 1304 H HIS B 190 36.783 19.886 -12.461 1.00 0.00 H ATOM 1305 N ASP B 191 34.007 21.044 -15.142 1.00 74.01 N ATOM 1306 CA ASP B 191 32.794 21.872 -15.114 1.00 73.82 C ATOM 1307 C ASP B 191 31.772 21.402 -14.080 1.00 71.14 C ATOM 1308 O ASP B 191 31.133 22.209 -13.407 1.00 67.34 O ATOM 1309 CB ASP B 191 32.130 21.856 -16.509 1.00 77.89 C ATOM 1310 CG ASP B 191 32.168 20.458 -17.186 1.00 84.99 C ATOM 1311 OD1 ASP B 191 33.137 19.684 -16.951 1.00 86.48 O ATOM 1312 OD2 ASP B 191 31.241 20.142 -17.968 1.00 85.37 O ATOM 1313 H ASP B 191 34.305 20.665 -16.063 1.00 0.00 H ATOM 1314 N GLU B 192 31.614 20.085 -13.990 1.00 73.29 N ATOM 1315 CA GLU B 192 30.658 19.446 -13.088 1.00 75.73 C ATOM 1316 C GLU B 192 31.020 19.776 -11.629 1.00 71.44 C ATOM 1317 O GLU B 192 32.186 19.880 -11.277 1.00 75.22 O ATOM 1318 CB GLU B 192 30.640 17.923 -13.355 1.00 78.12 C ATOM 1319 CG GLU B 192 30.029 17.019 -12.286 1.00 81.45 C ATOM 1320 CD GLU B 192 30.902 15.796 -11.997 1.00 85.66 C ATOM 1321 OE1 GLU B 192 31.265 15.598 -10.809 1.00 89.94 O ATOM 1322 OE2 GLU B 192 31.249 15.048 -12.951 1.00 80.74 O ATOM 1323 H GLU B 192 32.203 19.477 -14.594 1.00 0.00 H ATOM 1324 N PRO B 193 30.016 19.990 -10.794 1.00 70.17 N ATOM 1325 CA PRO B 193 30.197 20.207 -9.361 1.00 68.97 C ATOM 1326 C PRO B 193 30.695 19.011 -8.546 1.00 63.63 C ATOM 1327 O PRO B 193 30.521 17.855 -8.943 1.00 66.07 O ATOM 1328 CB PRO B 193 28.793 20.601 -8.899 1.00 72.85 C ATOM 1329 CG PRO B 193 28.195 21.257 -10.109 1.00 75.48 C ATOM 1330 CD PRO B 193 28.768 20.598 -11.301 1.00 73.60 C ATOM 1331 N TYR B 194 31.282 19.307 -7.388 1.00 56.65 N ATOM 1332 CA TYR B 194 31.763 18.277 -6.481 1.00 53.69 C ATOM 1333 C TYR B 194 31.020 18.220 -5.132 1.00 53.46 C ATOM 1334 O TYR B 194 30.249 19.125 -4.739 1.00 52.71 O ATOM 1335 CB TYR B 194 33.260 18.431 -6.165 1.00 49.30 C ATOM 1336 CG TYR B 194 34.163 18.717 -7.321 1.00 47.38 C ATOM 1337 CD1 TYR B 194 35.244 17.887 -7.585 1.00 47.68 C ATOM 1338 CD2 TYR B 194 33.972 19.827 -8.143 1.00 47.18 C ATOM 1339 CE1 TYR B 194 36.111 18.136 -8.640 1.00 45.40 C ATOM 1340 CE2 TYR B 194 34.823 20.073 -9.210 1.00 44.90 C ATOM 1341 CZ TYR B 194 35.895 19.225 -9.429 1.00 44.10 C ATOM 1342 OH TYR B 194 36.781 19.416 -10.442 1.00 43.46 O ATOM 1343 HH TYR B 194 37.465 18.701 -10.420 1.00 0.00 H ATOM 1344 H TYR B 194 31.400 20.306 -7.124 1.00 0.00 H ATOM 1345 N THR B 195 31.257 17.070 -4.495 1.00 55.04 N ATOM 1346 CA THR B 195 30.979 16.747 -3.088 1.00 54.56 C ATOM 1347 C THR B 195 31.975 15.705 -2.550 1.00 55.80 C ATOM 1348 O THR B 195 31.829 15.209 -1.436 1.00 59.57 O ATOM 1349 CB THR B 195 29.631 16.080 -2.969 1.00 53.64 C ATOM 1350 OG1 THR B 195 29.682 14.838 -3.699 1.00 56.34 O ATOM 1351 CG2 THR B 195 28.556 16.991 -3.544 1.00 53.16 C ATOM 1352 HG1 THR B 195 30.386 14.258 -3.313 1.00 0.00 H ATOM 1353 H THR B 195 31.690 16.313 -5.062 1.00 0.00 H ATOM 1354 N ASP B 196 32.930 15.329 -3.400 1.00 56.10 N ATOM 1355 CA ASP B 196 34.210 14.718 -3.047 1.00 53.78 C ATOM 1356 C ASP B 196 35.040 15.497 -1.973 1.00 50.93 C ATOM 1357 O ASP B 196 36.084 15.029 -1.508 1.00 49.12 O ATOM 1358 CB ASP B 196 35.021 14.766 -4.359 1.00 55.43 C ATOM 1359 CG ASP B 196 36.245 13.890 -4.342 1.00 60.18 C ATOM 1360 OD1 ASP B 196 36.285 12.863 -3.593 1.00 62.95 O ATOM 1361 OD2 ASP B 196 37.151 14.218 -5.133 1.00 60.83 O ATOM 1362 H ASP B 196 32.747 15.485 -4.412 1.00 0.00 H ATOM 1363 N PHE B 197 34.582 16.692 -1.611 1.00 48.55 N ATOM 1364 CA PHE B 197 35.422 17.714 -0.968 1.00 44.28 C ATOM 1365 C PHE B 197 35.696 17.427 0.505 1.00 47.43 C ATOM 1366 O PHE B 197 34.763 17.099 1.270 1.00 50.08 O ATOM 1367 CB PHE B 197 34.688 19.047 -1.074 1.00 41.47 C ATOM 1368 CG PHE B 197 35.501 20.219 -0.669 1.00 38.40 C ATOM 1369 CD1 PHE B 197 36.716 20.478 -1.290 1.00 36.66 C ATOM 1370 CD2 PHE B 197 35.046 21.080 0.317 1.00 36.85 C ATOM 1371 CE1 PHE B 197 37.487 21.549 -0.900 1.00 34.75 C ATOM 1372 CE2 PHE B 197 35.818 22.153 0.726 1.00 34.66 C ATOM 1373 CZ PHE B 197 37.033 22.397 0.102 1.00 35.31 C ATOM 1374 H PHE B 197 33.582 16.914 -1.791 1.00 0.00 H ATOM 1375 N ASP B 198 36.975 17.548 0.881 1.00 49.52 N ATOM 1376 CA ASP B 198 37.407 17.571 2.283 1.00 51.23 C ATOM 1377 C ASP B 198 38.452 18.666 2.513 1.00 48.56 C ATOM 1378 O ASP B 198 39.621 18.403 2.776 1.00 51.96 O ATOM 1379 CB ASP B 198 37.969 16.205 2.683 1.00 53.94 C ATOM 1380 CG ASP B 198 37.756 15.893 4.176 1.00 53.34 C ATOM 1381 OD1 ASP B 198 37.316 16.788 4.938 1.00 50.20 O ATOM 1382 OD2 ASP B 198 38.008 14.730 4.563 1.00 52.88 O ATOM 1383 H ASP B 198 37.701 17.630 0.140 1.00 0.00 H ATOM 1384 N GLY B 199 38.044 19.914 2.376 1.00 49.13 N ATOM 1385 CA GLY B 199 39.013 21.002 2.463 1.00 45.44 C ATOM 1386 C GLY B 199 39.169 21.481 3.890 1.00 42.24 C ATOM 1387 O GLY B 199 38.881 20.770 4.870 1.00 40.82 O ATOM 1388 H GLY B 199 37.039 20.121 2.207 1.00 0.00 H ATOM 1389 N THR B 200 39.666 22.701 3.981 1.00 38.40 N ATOM 1390 CA THR B 200 39.676 23.454 5.206 1.00 33.84 C ATOM 1391 C THR B 200 38.404 24.256 5.218 1.00 31.11 C ATOM 1392 O THR B 200 38.161 25.039 4.293 1.00 27.08 O ATOM 1393 CB THR B 200 40.853 24.397 5.173 1.00 33.86 C ATOM 1394 OG1 THR B 200 42.024 23.609 4.981 1.00 34.80 O ATOM 1395 CG2 THR B 200 40.982 25.188 6.462 1.00 32.92 C ATOM 1396 HG1 THR B 200 41.951 23.114 4.127 1.00 0.00 H ATOM 1397 H THR B 200 40.069 23.137 3.127 1.00 0.00 H ATOM 1398 N ARG B 201 37.618 24.070 6.267 1.00 29.92 N ATOM 1399 CA ARG B 201 36.353 24.731 6.419 1.00 31.74 C ATOM 1400 C ARG B 201 36.392 26.241 6.267 1.00 29.78 C ATOM 1401 O ARG B 201 35.575 26.828 5.532 1.00 27.63 O ATOM 1402 CB ARG B 201 35.785 24.382 7.768 1.00 38.06 C ATOM 1403 CG ARG B 201 34.409 24.972 8.016 1.00 44.85 C ATOM 1404 CD ARG B 201 33.548 23.977 8.750 1.00 50.85 C ATOM 1405 NE ARG B 201 33.145 22.948 7.804 1.00 56.72 N ATOM 1406 CZ ARG B 201 31.896 22.559 7.544 1.00 59.77 C ATOM 1407 NH1 ARG B 201 30.846 23.092 8.171 1.00 59.13 N ATOM 1408 NH2 ARG B 201 31.705 21.607 6.634 1.00 62.17 N ATOM 1409 HE ARG B 201 33.905 22.469 7.279 1.00 0.00 H ATOM 1410 HH12 ARG B 201 29.885 22.766 7.945 1.00 0.00 H ATOM 1411 HH11 ARG B 201 30.989 23.834 8.886 1.00 0.00 H ATOM 1412 HH22 ARG B 201 30.741 21.285 6.412 1.00 0.00 H ATOM 1413 HH21 ARG B 201 32.520 21.185 6.144 1.00 0.00 H ATOM 1414 H ARG B 201 37.931 23.417 7.013 1.00 0.00 H ATOM 1415 N VAL B 202 37.339 26.892 6.949 1.00 28.16 N ATOM 1416 CA VAL B 202 37.357 28.350 6.956 1.00 25.29 C ATOM 1417 C VAL B 202 37.694 28.936 5.593 1.00 24.49 C ATOM 1418 O VAL B 202 37.517 30.131 5.401 1.00 25.35 O ATOM 1419 CB VAL B 202 38.201 28.940 8.129 1.00 26.66 C ATOM 1420 CG1 VAL B 202 37.581 28.537 9.496 1.00 28.03 C ATOM 1421 CG2 VAL B 202 39.671 28.520 8.081 1.00 26.75 C ATOM 1422 H VAL B 202 38.062 26.360 7.474 1.00 0.00 H ATOM 1423 N TYR B 203 38.172 28.115 4.650 1.00 22.34 N ATOM 1424 CA TYR B 203 38.406 28.542 3.285 1.00 22.08 C ATOM 1425 C TYR B 203 37.364 28.055 2.287 1.00 21.66 C ATOM 1426 O TYR B 203 37.508 28.257 1.098 1.00 21.19 O ATOM 1427 CB TYR B 203 39.802 28.083 2.808 1.00 21.71 C ATOM 1428 CG TYR B 203 40.925 28.918 3.359 1.00 21.63 C ATOM 1429 CD1 TYR B 203 41.397 28.757 4.670 1.00 23.56 C ATOM 1430 CD2 TYR B 203 41.538 29.851 2.578 1.00 21.68 C ATOM 1431 CE1 TYR B 203 42.450 29.564 5.151 1.00 23.13 C ATOM 1432 CE2 TYR B 203 42.588 30.590 3.015 1.00 21.31 C ATOM 1433 CZ TYR B 203 43.023 30.477 4.310 1.00 22.26 C ATOM 1434 OH TYR B 203 44.091 31.270 4.658 1.00 23.14 O ATOM 1435 HH TYR B 203 44.323 31.112 5.607 1.00 0.00 H ATOM 1436 H TYR B 203 38.384 27.130 4.908 1.00 0.00 H ATOM 1437 N SER B 204 36.327 27.416 2.797 1.00 22.05 N ATOM 1438 CA SER B 204 35.262 26.895 2.028 1.00 21.73 C ATOM 1439 C SER B 204 34.182 27.964 1.907 1.00 21.25 C ATOM 1440 O SER B 204 33.882 28.682 2.877 1.00 20.71 O ATOM 1441 CB SER B 204 34.702 25.677 2.755 1.00 23.67 C ATOM 1442 OG SER B 204 35.739 24.738 2.838 1.00 25.13 O ATOM 1443 HG SER B 204 36.497 25.129 3.341 1.00 0.00 H ATOM 1444 H SER B 204 36.292 27.288 3.829 1.00 0.00 H ATOM 1445 N PRO B 205 33.557 28.031 0.735 1.00 19.61 N ATOM 1446 CA PRO B 205 32.576 29.037 0.405 1.00 19.37 C ATOM 1447 C PRO B 205 31.228 28.700 0.984 1.00 19.54 C ATOM 1448 O PRO B 205 31.012 27.590 1.342 1.00 19.72 O ATOM 1449 CB PRO B 205 32.528 28.998 -1.126 1.00 19.49 C ATOM 1450 CG PRO B 205 32.937 27.639 -1.481 1.00 20.06 C ATOM 1451 CD PRO B 205 33.796 27.090 -0.361 1.00 19.61 C ATOM 1452 N PRO B 206 30.333 29.680 1.081 1.00 19.73 N ATOM 1453 CA PRO B 206 29.057 29.537 1.697 1.00 20.66 C ATOM 1454 C PRO B 206 28.214 28.417 1.107 1.00 22.22 C ATOM 1455 O PRO B 206 27.496 27.766 1.846 1.00 22.16 O ATOM 1456 CB PRO B 206 28.366 30.867 1.405 1.00 20.14 C ATOM 1457 CG PRO B 206 29.416 31.816 1.182 1.00 19.64 C ATOM 1458 CD PRO B 206 30.516 31.024 0.511 1.00 19.71 C ATOM 1459 N GLU B 207 28.277 28.241 -0.219 1.00 23.32 N ATOM 1460 CA GLU B 207 27.440 27.269 -0.895 1.00 25.41 C ATOM 1461 C GLU B 207 27.925 25.867 -0.617 1.00 25.91 C ATOM 1462 O GLU B 207 27.215 24.907 -0.873 1.00 27.16 O ATOM 1463 CB GLU B 207 27.386 27.532 -2.410 1.00 26.71 C ATOM 1464 CG GLU B 207 28.694 27.266 -3.146 1.00 27.31 C ATOM 1465 CD GLU B 207 29.646 28.468 -3.206 1.00 28.76 C ATOM 1466 OE1 GLU B 207 29.392 29.509 -2.500 1.00 31.94 O ATOM 1467 OE2 GLU B 207 30.653 28.384 -3.976 1.00 28.39 O ATOM 1468 H GLU B 207 28.941 28.815 -0.777 1.00 0.00 H ATOM 1469 N TRP B 208 29.147 25.711 -0.131 1.00 25.90 N ATOM 1470 CA TRP B 208 29.569 24.410 0.344 1.00 26.88 C ATOM 1471 C TRP B 208 29.015 24.221 1.729 1.00 27.43 C ATOM 1472 O TRP B 208 28.572 23.137 2.049 1.00 28.65 O ATOM 1473 CB TRP B 208 31.082 24.259 0.433 1.00 27.06 C ATOM 1474 CG TRP B 208 31.471 22.991 1.152 1.00 27.44 C ATOM 1475 CD1 TRP B 208 31.937 22.891 2.429 1.00 28.06 C ATOM 1476 CD2 TRP B 208 31.358 21.660 0.661 1.00 28.77 C ATOM 1477 NE1 TRP B 208 32.164 21.585 2.744 1.00 28.71 N ATOM 1478 CE2 TRP B 208 31.826 20.805 1.670 1.00 29.11 C ATOM 1479 CE3 TRP B 208 30.963 21.108 -0.565 1.00 30.50 C ATOM 1480 CZ2 TRP B 208 31.847 19.432 1.529 1.00 30.66 C ATOM 1481 CZ3 TRP B 208 30.993 19.743 -0.722 1.00 31.58 C ATOM 1482 CH2 TRP B 208 31.439 18.910 0.322 1.00 32.75 C ATOM 1483 HE1 TRP B 208 32.534 21.237 3.652 1.00 0.00 H ATOM 1484 H TRP B 208 29.800 26.519 -0.091 1.00 0.00 H ATOM 1485 N ILE B 209 29.089 25.262 2.554 1.00 27.04 N ATOM 1486 CA ILE B 209 28.667 25.155 3.949 1.00 27.67 C ATOM 1487 C ILE B 209 27.176 24.997 3.925 1.00 27.79 C ATOM 1488 O ILE B 209 26.641 24.194 4.652 1.00 28.16 O ATOM 1489 CB ILE B 209 28.980 26.404 4.804 1.00 27.21 C ATOM 1490 CG1 ILE B 209 30.456 26.733 4.782 1.00 27.28 C ATOM 1491 CG2 ILE B 209 28.566 26.201 6.243 1.00 27.79 C ATOM 1492 CD1 ILE B 209 31.306 25.736 5.534 1.00 28.02 C ATOM 1493 H ILE B 209 29.454 26.169 2.200 1.00 0.00 H ATOM 1494 N SER B 210 26.508 25.764 3.079 1.00 27.52 N ATOM 1495 CA SER B 210 25.073 25.776 3.115 1.00 28.90 C ATOM 1496 C SER B 210 24.462 24.593 2.311 1.00 31.43 C ATOM 1497 O SER B 210 23.493 23.985 2.759 1.00 32.40 O ATOM 1498 CB SER B 210 24.558 27.087 2.601 1.00 27.67 C ATOM 1499 OG SER B 210 24.693 27.128 1.228 1.00 26.94 O ATOM 1500 HG SER B 210 25.649 27.031 0.989 1.00 0.00 H ATOM 1501 H SER B 210 27.019 26.354 2.392 1.00 0.00 H ATOM 1502 N ARG B 211 25.048 24.258 1.169 1.00 32.19 N ATOM 1503 CA ARG B 211 24.402 23.367 0.210 1.00 35.21 C ATOM 1504 C ARG B 211 25.215 22.161 -0.180 1.00 36.44 C ATOM 1505 O ARG B 211 24.803 21.395 -1.027 1.00 37.55 O ATOM 1506 CB ARG B 211 24.031 24.152 -1.044 1.00 36.84 C ATOM 1507 CG ARG B 211 22.796 24.967 -0.791 1.00 40.62 C ATOM 1508 CD ARG B 211 22.529 26.048 -1.798 1.00 44.16 C ATOM 1509 NE ARG B 211 21.488 26.893 -1.228 1.00 50.98 N ATOM 1510 CZ ARG B 211 21.175 28.122 -1.618 1.00 58.08 C ATOM 1511 NH1 ARG B 211 20.206 28.780 -0.988 1.00 59.74 N ATOM 1512 NH2 ARG B 211 21.818 28.705 -2.626 1.00 64.57 N ATOM 1513 HE ARG B 211 20.938 26.495 -0.440 1.00 0.00 H ATOM 1514 HH12 ARG B 211 19.953 29.744 -1.286 1.00 0.00 H ATOM 1515 HH11 ARG B 211 19.701 28.331 -0.197 1.00 0.00 H ATOM 1516 HH22 ARG B 211 21.560 29.669 -2.919 1.00 0.00 H ATOM 1517 HH21 ARG B 211 22.579 28.197 -3.121 1.00 0.00 H ATOM 1518 H ARG B 211 25.991 24.640 0.952 1.00 0.00 H ATOM 1519 N HIS B 212 26.367 21.975 0.438 1.00 36.34 N ATOM 1520 CA HIS B 212 27.250 20.933 0.013 1.00 38.66 C ATOM 1521 C HIS B 212 27.548 21.055 -1.508 1.00 38.17 C ATOM 1522 O HIS B 212 27.701 20.065 -2.210 1.00 40.88 O ATOM 1523 CB HIS B 212 26.592 19.610 0.375 1.00 40.90 C ATOM 1524 CG HIS B 212 27.551 18.496 0.625 1.00 43.05 C ATOM 1525 ND1 HIS B 212 28.461 18.517 1.661 1.00 44.29 N ATOM 1526 CD2 HIS B 212 27.685 17.285 0.024 1.00 45.30 C ATOM 1527 CE1 HIS B 212 29.138 17.380 1.673 1.00 45.56 C ATOM 1528 NE2 HIS B 212 28.690 16.618 0.686 1.00 47.50 N ATOM 1529 H HIS B 212 26.633 22.587 1.235 1.00 0.00 H ATOM 1530 N GLN B 213 27.619 22.281 -1.999 1.00 39.12 N ATOM 1531 CA GLN B 213 27.862 22.542 -3.408 1.00 41.28 C ATOM 1532 C GLN B 213 29.285 23.010 -3.550 1.00 37.20 C ATOM 1533 O GLN B 213 29.675 23.987 -2.920 1.00 35.19 O ATOM 1534 CB GLN B 213 26.921 23.622 -3.923 1.00 46.22 C ATOM 1535 CG GLN B 213 25.470 23.203 -4.031 1.00 53.70 C ATOM 1536 CD GLN B 213 25.083 22.786 -5.436 1.00 62.24 C ATOM 1537 OE1 GLN B 213 25.561 21.763 -5.952 1.00 67.72 O ATOM 1538 NE2 GLN B 213 24.211 23.582 -6.072 1.00 65.29 N ATOM 1539 HE22 GLN B 213 23.838 24.429 -5.597 1.00 0.00 H ATOM 1540 HE21 GLN B 213 23.908 23.352 -7.040 1.00 0.00 H ATOM 1541 H GLN B 213 27.497 23.087 -1.354 1.00 0.00 H ATOM 1542 N TYR B 214 30.062 22.291 -4.352 1.00 36.81 N ATOM 1543 CA TYR B 214 31.457 22.624 -4.618 1.00 35.60 C ATOM 1544 C TYR B 214 31.653 22.765 -6.141 1.00 35.80 C ATOM 1545 O TYR B 214 31.698 21.777 -6.861 1.00 39.17 O ATOM 1546 CB TYR B 214 32.419 21.572 -4.038 1.00 34.28 C ATOM 1547 CG TYR B 214 33.844 22.088 -4.032 1.00 32.79 C ATOM 1548 CD1 TYR B 214 34.320 22.834 -2.978 1.00 32.14 C ATOM 1549 CD2 TYR B 214 34.662 21.913 -5.121 1.00 32.04 C ATOM 1550 CE1 TYR B 214 35.602 23.347 -2.978 1.00 31.45 C ATOM 1551 CE2 TYR B 214 35.932 22.403 -5.150 1.00 30.85 C ATOM 1552 CZ TYR B 214 36.413 23.120 -4.078 1.00 31.88 C ATOM 1553 OH TYR B 214 37.699 23.614 -4.137 1.00 28.67 O ATOM 1554 HH TYR B 214 37.902 24.103 -3.301 1.00 0.00 H ATOM 1555 H TYR B 214 29.657 21.451 -4.812 1.00 0.00 H ATOM 1556 N HIS B 215 31.726 24.002 -6.604 1.00 34.55 N ATOM 1557 CA HIS B 215 32.061 24.329 -7.968 1.00 34.19 C ATOM 1558 C HIS B 215 33.518 24.772 -8.006 1.00 32.13 C ATOM 1559 O HIS B 215 33.921 25.738 -7.317 1.00 29.63 O ATOM 1560 CB HIS B 215 31.137 25.432 -8.452 1.00 36.64 C ATOM 1561 CG HIS B 215 29.710 25.001 -8.560 1.00 40.81 C ATOM 1562 ND1 HIS B 215 28.641 25.799 -8.198 1.00 42.70 N ATOM 1563 CD2 HIS B 215 29.178 23.832 -8.978 1.00 43.38 C ATOM 1564 CE1 HIS B 215 27.515 25.146 -8.406 1.00 42.42 C ATOM 1565 NE2 HIS B 215 27.812 23.948 -8.879 1.00 44.24 N ATOM 1566 H HIS B 215 31.531 24.784 -5.946 1.00 0.00 H ATOM 1567 N ALA B 216 34.321 24.051 -8.778 1.00 32.02 N ATOM 1568 CA ALA B 216 35.777 24.138 -8.640 1.00 32.52 C ATOM 1569 C ALA B 216 36.265 25.575 -8.747 1.00 30.97 C ATOM 1570 O ALA B 216 36.936 26.074 -7.840 1.00 29.51 O ATOM 1571 CB ALA B 216 36.465 23.274 -9.681 1.00 34.42 C ATOM 1572 H ALA B 216 33.911 23.415 -9.491 1.00 0.00 H ATOM 1573 N LEU B 217 35.894 26.260 -9.830 1.00 30.27 N ATOM 1574 CA LEU B 217 36.435 27.593 -10.060 1.00 29.84 C ATOM 1575 C LEU B 217 35.910 28.613 -9.073 1.00 28.22 C ATOM 1576 O LEU B 217 36.706 29.339 -8.493 1.00 26.64 O ATOM 1577 CB LEU B 217 36.219 28.060 -11.495 1.00 32.78 C ATOM 1578 CG LEU B 217 36.820 27.089 -12.532 1.00 35.05 C ATOM 1579 CD1 LEU B 217 36.404 27.427 -13.950 1.00 38.93 C ATOM 1580 CD2 LEU B 217 38.324 27.022 -12.449 1.00 35.26 C ATOM 1581 H LEU B 217 35.222 25.845 -10.507 1.00 0.00 H ATOM 1582 N PRO B 218 34.562 28.694 -8.882 1.00 26.45 N ATOM 1583 CA PRO B 218 34.091 29.678 -7.927 1.00 24.43 C ATOM 1584 C PRO B 218 34.591 29.428 -6.489 1.00 22.89 C ATOM 1585 O PRO B 218 34.725 30.399 -5.700 1.00 20.82 O ATOM 1586 CB PRO B 218 32.571 29.518 -7.983 1.00 25.73 C ATOM 1587 CG PRO B 218 32.289 28.889 -9.309 1.00 26.51 C ATOM 1588 CD PRO B 218 33.454 28.004 -9.557 1.00 26.42 C ATOM 1589 N ALA B 219 34.772 28.152 -6.132 1.00 22.02 N ATOM 1590 CA ALA B 219 35.231 27.802 -4.787 1.00 21.78 C ATOM 1591 C ALA B 219 36.715 28.102 -4.631 1.00 20.85 C ATOM 1592 O ALA B 219 37.131 28.537 -3.567 1.00 20.39 O ATOM 1593 CB ALA B 219 34.932 26.351 -4.422 1.00 22.27 C ATOM 1594 H ALA B 219 34.584 27.396 -6.821 1.00 0.00 H ATOM 1595 N THR B 220 37.477 27.932 -5.705 1.00 20.64 N ATOM 1596 CA THR B 220 38.875 28.352 -5.751 1.00 20.08 C ATOM 1597 C THR B 220 39.043 29.865 -5.549 1.00 19.70 C ATOM 1598 O THR B 220 39.897 30.343 -4.769 1.00 18.69 O ATOM 1599 CB THR B 220 39.570 27.924 -7.078 1.00 20.75 C ATOM 1600 OG1 THR B 220 39.576 26.482 -7.181 1.00 21.21 O ATOM 1601 CG2 THR B 220 41.004 28.404 -7.100 1.00 20.25 C ATOM 1602 HG1 THR B 220 38.644 26.148 -7.175 1.00 0.00 H ATOM 1603 H THR B 220 37.062 27.482 -6.546 1.00 0.00 H ATOM 1604 N VAL B 221 38.238 30.607 -6.268 1.00 18.82 N ATOM 1605 CA VAL B 221 38.278 32.020 -6.165 1.00 18.55 C ATOM 1606 C VAL B 221 37.835 32.516 -4.780 1.00 17.38 C ATOM 1607 O VAL B 221 38.403 33.445 -4.249 1.00 17.67 O ATOM 1608 CB VAL B 221 37.369 32.653 -7.248 1.00 19.53 C ATOM 1609 CG1 VAL B 221 37.244 34.135 -7.006 1.00 19.50 C ATOM 1610 CG2 VAL B 221 37.952 32.385 -8.624 1.00 20.50 C ATOM 1611 H VAL B 221 37.564 30.156 -6.919 1.00 0.00 H ATOM 1612 N TRP B 222 36.806 31.921 -4.217 1.00 16.69 N ATOM 1613 CA TRP B 222 36.413 32.223 -2.875 1.00 15.87 C ATOM 1614 C TRP B 222 37.650 32.057 -1.976 1.00 16.28 C ATOM 1615 O TRP B 222 38.012 32.958 -1.221 1.00 16.53 O ATOM 1616 CB TRP B 222 35.288 31.294 -2.411 1.00 15.52 C ATOM 1617 CG TRP B 222 35.021 31.438 -0.936 1.00 14.54 C ATOM 1618 CD1 TRP B 222 35.654 30.775 0.079 1.00 14.24 C ATOM 1619 CD2 TRP B 222 34.110 32.340 -0.321 1.00 14.18 C ATOM 1620 NE1 TRP B 222 35.158 31.187 1.290 1.00 14.07 N ATOM 1621 CE2 TRP B 222 34.226 32.169 1.062 1.00 14.08 C ATOM 1622 CE3 TRP B 222 33.189 33.278 -0.813 1.00 14.51 C ATOM 1623 CZ2 TRP B 222 33.462 32.887 1.957 1.00 14.48 C ATOM 1624 CZ3 TRP B 222 32.398 33.990 0.084 1.00 14.45 C ATOM 1625 CH2 TRP B 222 32.532 33.783 1.447 1.00 14.69 C ATOM 1626 HE1 TRP B 222 35.440 30.819 2.221 1.00 0.00 H ATOM 1627 H TRP B 222 36.267 31.216 -4.759 1.00 0.00 H ATOM 1628 N SER B 223 38.328 30.927 -2.094 1.00 16.63 N ATOM 1629 CA SER B 223 39.442 30.653 -1.207 1.00 16.51 C ATOM 1630 C SER B 223 40.594 31.630 -1.426 1.00 15.77 C ATOM 1631 O SER B 223 41.332 31.963 -0.487 1.00 15.13 O ATOM 1632 CB SER B 223 39.911 29.213 -1.390 1.00 17.11 C ATOM 1633 OG SER B 223 40.669 29.139 -2.596 1.00 19.14 O ATOM 1634 HG SER B 223 40.100 29.411 -3.359 1.00 0.00 H ATOM 1635 H SER B 223 38.062 30.235 -2.823 1.00 0.00 H ATOM 1636 N LEU B 224 40.765 32.084 -2.662 1.00 15.91 N ATOM 1637 CA LEU B 224 41.736 33.150 -2.974 1.00 15.85 C ATOM 1638 C LEU B 224 41.390 34.469 -2.261 1.00 16.03 C ATOM 1639 O LEU B 224 42.255 35.253 -1.915 1.00 16.03 O ATOM 1640 CB LEU B 224 41.805 33.393 -4.469 1.00 16.35 C ATOM 1641 CG LEU B 224 42.406 32.236 -5.218 1.00 16.66 C ATOM 1642 CD1 LEU B 224 42.236 32.393 -6.715 1.00 17.39 C ATOM 1643 CD2 LEU B 224 43.872 32.157 -4.820 1.00 17.20 C ATOM 1644 H LEU B 224 40.198 31.676 -3.433 1.00 0.00 H ATOM 1645 N GLY B 225 40.113 34.704 -2.058 1.00 16.39 N ATOM 1646 CA GLY B 225 39.669 35.893 -1.385 1.00 16.39 C ATOM 1647 C GLY B 225 39.933 35.804 0.082 1.00 15.92 C ATOM 1648 O GLY B 225 40.258 36.772 0.737 1.00 15.99 O ATOM 1649 H GLY B 225 39.409 34.015 -2.392 1.00 0.00 H ATOM 1650 N ILE B 226 39.757 34.615 0.612 1.00 16.00 N ATOM 1651 CA ILE B 226 40.114 34.370 1.982 1.00 16.06 C ATOM 1652 C ILE B 226 41.613 34.592 2.167 1.00 16.15 C ATOM 1653 O ILE B 226 42.047 35.218 3.146 1.00 16.49 O ATOM 1654 CB ILE B 226 39.748 32.948 2.429 1.00 15.73 C ATOM 1655 CG1 ILE B 226 38.251 32.679 2.258 1.00 15.93 C ATOM 1656 CG2 ILE B 226 40.027 32.803 3.916 1.00 15.85 C ATOM 1657 CD1 ILE B 226 37.379 33.580 3.087 1.00 16.19 C ATOM 1658 H ILE B 226 39.357 33.847 0.037 1.00 0.00 H ATOM 1659 N LEU B 227 42.389 34.073 1.223 1.00 15.71 N ATOM 1660 CA LEU B 227 43.817 34.088 1.339 1.00 15.55 C ATOM 1661 C LEU B 227 44.273 35.526 1.255 1.00 16.77 C ATOM 1662 O LEU B 227 45.124 35.983 2.037 1.00 16.87 O ATOM 1663 CB LEU B 227 44.414 33.252 0.226 1.00 15.22 C ATOM 1664 CG LEU B 227 45.928 33.323 0.035 1.00 15.21 C ATOM 1665 CD1 LEU B 227 46.665 32.629 1.180 1.00 14.93 C ATOM 1666 CD2 LEU B 227 46.383 32.705 -1.271 1.00 14.98 C ATOM 1667 H LEU B 227 41.951 33.647 0.382 1.00 0.00 H ATOM 1668 N LEU B 228 43.742 36.259 0.272 1.00 17.16 N ATOM 1669 CA LEU B 228 44.161 37.599 0.130 1.00 17.71 C ATOM 1670 C LEU B 228 43.793 38.397 1.384 1.00 17.57 C ATOM 1671 O LEU B 228 44.578 39.264 1.841 1.00 17.01 O ATOM 1672 CB LEU B 228 43.583 38.215 -1.130 1.00 18.94 C ATOM 1673 CG LEU B 228 43.939 39.682 -1.349 1.00 19.78 C ATOM 1674 CD1 LEU B 228 45.430 39.866 -1.334 1.00 20.66 C ATOM 1675 CD2 LEU B 228 43.416 40.127 -2.695 1.00 21.08 C ATOM 1676 H LEU B 228 43.036 35.851 -0.374 1.00 0.00 H ATOM 1677 N TYR B 229 42.600 38.189 1.913 1.00 16.86 N ATOM 1678 CA TYR B 229 42.248 38.919 3.139 1.00 17.75 C ATOM 1679 C TYR B 229 43.245 38.540 4.238 1.00 17.99 C ATOM 1680 O TYR B 229 43.724 39.381 4.973 1.00 17.45 O ATOM 1681 CB TYR B 229 40.810 38.579 3.568 1.00 18.38 C ATOM 1682 CG TYR B 229 40.318 39.298 4.793 1.00 19.40 C ATOM 1683 CD1 TYR B 229 40.791 38.978 6.066 1.00 20.07 C ATOM 1684 CD2 TYR B 229 39.381 40.315 4.685 1.00 20.22 C ATOM 1685 CE1 TYR B 229 40.329 39.646 7.180 1.00 20.89 C ATOM 1686 CE2 TYR B 229 38.904 40.971 5.789 1.00 20.44 C ATOM 1687 CZ TYR B 229 39.390 40.643 7.030 1.00 21.68 C ATOM 1688 OH TYR B 229 38.925 41.349 8.117 1.00 24.09 O ATOM 1689 HH TYR B 229 39.358 41.008 8.940 1.00 0.00 H ATOM 1690 H TYR B 229 41.929 37.527 1.474 1.00 0.00 H ATOM 1691 N ASP B 230 43.526 37.249 4.351 1.00 19.33 N ATOM 1692 CA ASP B 230 44.522 36.750 5.260 1.00 22.48 C ATOM 1693 C ASP B 230 45.819 37.529 5.147 1.00 23.77 C ATOM 1694 O ASP B 230 46.362 37.996 6.153 1.00 25.68 O ATOM 1695 CB ASP B 230 44.786 35.277 4.953 1.00 25.28 C ATOM 1696 CG ASP B 230 45.613 34.562 6.027 1.00 28.42 C ATOM 1697 OD1 ASP B 230 45.198 34.528 7.199 1.00 29.54 O ATOM 1698 OD2 ASP B 230 46.688 34.006 5.659 1.00 32.75 O ATOM 1699 H ASP B 230 43.005 36.571 3.759 1.00 0.00 H ATOM 1700 N MET B 231 46.324 37.641 3.924 1.00 23.21 N ATOM 1701 CA MET B 231 47.640 38.205 3.665 1.00 24.51 C ATOM 1702 C MET B 231 47.731 39.686 4.041 1.00 23.38 C ATOM 1703 O MET B 231 48.715 40.092 4.635 1.00 21.77 O ATOM 1704 CB MET B 231 48.024 38.056 2.171 1.00 27.12 C ATOM 1705 CG MET B 231 48.230 36.640 1.636 1.00 30.34 C ATOM 1706 SD MET B 231 48.778 36.594 -0.123 1.00 35.92 S ATOM 1707 CE MET B 231 48.153 38.134 -0.717 1.00 39.66 C ATOM 1708 H MET B 231 45.755 37.312 3.118 1.00 0.00 H ATOM 1709 N VAL B 232 46.725 40.480 3.669 1.00 22.42 N ATOM 1710 CA VAL B 232 46.751 41.856 3.947 1.00 23.68 C ATOM 1711 C VAL B 232 46.238 42.232 5.314 1.00 25.49 C ATOM 1712 O VAL B 232 46.566 43.330 5.774 1.00 25.48 O ATOM 1713 CB VAL B 232 46.070 42.713 2.874 1.00 25.35 C ATOM 1714 CG1 VAL B 232 46.589 42.338 1.510 1.00 26.46 C ATOM 1715 CG2 VAL B 232 44.558 42.576 2.907 1.00 26.73 C ATOM 1716 H VAL B 232 45.910 40.074 3.166 1.00 0.00 H ATOM 1717 N CYS B 233 45.489 41.348 5.994 1.00 26.00 N ATOM 1718 CA CYS B 233 44.914 41.688 7.346 1.00 25.68 C ATOM 1719 C CYS B 233 45.533 40.960 8.476 1.00 25.69 C ATOM 1720 O CYS B 233 45.440 41.400 9.604 1.00 28.12 O ATOM 1721 CB CYS B 233 43.426 41.427 7.416 1.00 24.41 C ATOM 1722 SG CYS B 233 42.482 42.501 6.316 1.00 28.86 S ATOM 1723 H CYS B 233 45.302 40.412 5.580 1.00 0.00 H ATOM 1724 N GLY B 234 46.116 39.811 8.191 1.00 26.52 N ATOM 1725 CA GLY B 234 46.798 39.024 9.180 1.00 27.78 C ATOM 1726 C GLY B 234 45.917 37.970 9.808 1.00 29.32 C ATOM 1727 O GLY B 234 46.382 37.226 10.626 1.00 31.05 O ATOM 1728 H GLY B 234 46.080 39.462 7.212 1.00 0.00 H ATOM 1729 N ASP B 235 44.647 37.914 9.445 1.00 31.46 N ATOM 1730 CA ASP B 235 43.791 36.821 9.898 1.00 32.13 C ATOM 1731 C ASP B 235 42.775 36.480 8.839 1.00 29.04 C ATOM 1732 O ASP B 235 42.496 37.261 7.941 1.00 27.95 O ATOM 1733 CB ASP B 235 43.076 37.188 11.189 1.00 36.37 C ATOM 1734 CG ASP B 235 42.381 35.992 11.834 1.00 45.37 C ATOM 1735 OD1 ASP B 235 42.878 34.844 11.612 1.00 51.47 O ATOM 1736 OD2 ASP B 235 41.349 36.184 12.564 1.00 50.12 O ATOM 1737 H ASP B 235 44.254 38.656 8.831 1.00 0.00 H ATOM 1738 N ILE B 236 42.198 35.306 8.948 1.00 28.41 N ATOM 1739 CA ILE B 236 41.029 34.980 8.128 1.00 27.99 C ATOM 1740 C ILE B 236 39.797 35.821 8.469 1.00 25.72 C ATOM 1741 O ILE B 236 39.606 36.231 9.585 1.00 26.01 O ATOM 1742 CB ILE B 236 40.702 33.482 8.203 1.00 30.01 C ATOM 1743 CG1 ILE B 236 40.661 33.024 9.650 1.00 31.83 C ATOM 1744 CG2 ILE B 236 41.760 32.698 7.458 1.00 30.22 C ATOM 1745 CD1 ILE B 236 39.895 31.755 9.803 1.00 34.23 C ATOM 1746 H ILE B 236 42.572 34.605 9.619 1.00 0.00 H ATOM 1747 N PRO B 237 38.930 36.055 7.492 1.00 23.67 N ATOM 1748 CA PRO B 237 37.751 36.894 7.758 1.00 24.13 C ATOM 1749 C PRO B 237 36.644 36.216 8.569 1.00 25.61 C ATOM 1750 O PRO B 237 35.879 36.899 9.250 1.00 24.54 O ATOM 1751 CB PRO B 237 37.221 37.238 6.356 1.00 22.89 C ATOM 1752 CG PRO B 237 37.865 36.282 5.436 1.00 21.81 C ATOM 1753 CD PRO B 237 39.033 35.638 6.099 1.00 21.87 C ATOM 1754 N PHE B 238 36.543 34.897 8.456 1.00 26.08 N ATOM 1755 CA PHE B 238 35.384 34.191 8.986 1.00 27.70 C ATOM 1756 C PHE B 238 35.920 33.011 9.749 1.00 30.01 C ATOM 1757 O PHE B 238 36.628 32.211 9.183 1.00 30.98 O ATOM 1758 CB PHE B 238 34.463 33.717 7.850 1.00 26.03 C ATOM 1759 CG PHE B 238 34.118 34.804 6.821 1.00 24.53 C ATOM 1760 CD1 PHE B 238 33.565 36.013 7.203 1.00 24.82 C ATOM 1761 CD2 PHE B 238 34.299 34.577 5.470 1.00 22.47 C ATOM 1762 CE1 PHE B 238 33.208 36.966 6.256 1.00 23.60 C ATOM 1763 CE2 PHE B 238 33.969 35.515 4.521 1.00 21.36 C ATOM 1764 CZ PHE B 238 33.422 36.702 4.893 1.00 22.16 C ATOM 1765 H PHE B 238 37.300 34.362 7.984 1.00 0.00 H ATOM 1766 N GLU B 239 35.629 32.919 11.034 1.00 34.81 N ATOM 1767 CA GLU B 239 36.100 31.780 11.815 1.00 41.06 C ATOM 1768 C GLU B 239 35.070 30.643 11.923 1.00 39.09 C ATOM 1769 O GLU B 239 35.457 29.507 12.013 1.00 41.61 O ATOM 1770 CB GLU B 239 36.536 32.238 13.216 1.00 47.89 C ATOM 1771 CG GLU B 239 37.406 31.220 13.966 1.00 58.27 C ATOM 1772 CD GLU B 239 38.823 31.062 13.379 1.00 61.22 C ATOM 1773 OE1 GLU B 239 39.534 32.100 13.238 1.00 58.90 O ATOM 1774 OE2 GLU B 239 39.220 29.896 13.071 1.00 62.56 O ATOM 1775 H GLU B 239 35.062 33.661 11.491 1.00 0.00 H ATOM 1776 N ARG B 240 33.780 30.975 11.945 1.00 42.11 N ATOM 1777 CA ARG B 240 32.671 30.045 12.215 1.00 41.54 C ATOM 1778 C ARG B 240 31.812 29.920 10.970 1.00 37.29 C ATOM 1779 O ARG B 240 31.828 30.801 10.146 1.00 34.84 O ATOM 1780 CB ARG B 240 31.771 30.619 13.298 1.00 45.57 C ATOM 1781 CG ARG B 240 32.415 30.852 14.653 1.00 53.03 C ATOM 1782 CD ARG B 240 31.778 32.048 15.351 1.00 56.50 C ATOM 1783 NE ARG B 240 32.319 32.242 16.691 1.00 63.75 N ATOM 1784 CZ ARG B 240 31.673 32.017 17.843 1.00 72.22 C ATOM 1785 NH1 ARG B 240 30.402 31.581 17.878 1.00 70.68 N ATOM 1786 NH2 ARG B 240 32.316 32.242 18.992 1.00 77.13 N ATOM 1787 HE ARG B 240 33.298 32.587 16.759 1.00 0.00 H ATOM 1788 HH12 ARG B 240 29.933 31.418 18.792 1.00 0.00 H ATOM 1789 HH11 ARG B 240 29.887 31.407 16.991 1.00 0.00 H ATOM 1790 HH22 ARG B 240 31.835 32.074 19.899 1.00 0.00 H ATOM 1791 HH21 ARG B 240 33.298 32.585 18.980 1.00 0.00 H ATOM 1792 H ARG B 240 33.537 31.969 11.757 1.00 0.00 H ATOM 1793 N ASP B 241 31.018 28.851 10.881 1.00 37.26 N ATOM 1794 CA ASP B 241 30.132 28.579 9.741 1.00 35.90 C ATOM 1795 C ASP B 241 29.181 29.733 9.511 1.00 34.05 C ATOM 1796 O ASP B 241 28.973 30.172 8.394 1.00 29.89 O ATOM 1797 CB ASP B 241 29.316 27.312 9.982 1.00 38.20 C ATOM 1798 CG ASP B 241 30.122 26.050 9.815 1.00 41.58 C ATOM 1799 OD1 ASP B 241 31.283 26.162 9.314 1.00 45.23 O ATOM 1800 OD2 ASP B 241 29.586 24.938 10.160 1.00 42.87 O ATOM 1801 H ASP B 241 31.027 28.169 11.666 1.00 0.00 H ATOM 1802 N GLN B 242 28.626 30.229 10.598 1.00 35.05 N ATOM 1803 CA GLN B 242 27.669 31.323 10.544 1.00 36.92 C ATOM 1804 C GLN B 242 28.305 32.555 9.895 1.00 34.03 C ATOM 1805 O GLN B 242 27.655 33.282 9.122 1.00 30.24 O ATOM 1806 CB GLN B 242 27.170 31.650 11.965 1.00 39.65 C ATOM 1807 CG GLN B 242 28.256 32.230 12.882 1.00 41.18 C ATOM 1808 CD GLN B 242 28.114 31.892 14.346 1.00 44.78 C ATOM 1809 OE1 GLN B 242 27.784 32.767 15.162 1.00 50.99 O ATOM 1810 NE2 GLN B 242 28.406 30.646 14.709 1.00 45.25 N ATOM 1811 HE22 GLN B 242 28.678 29.945 13.990 1.00 0.00 H ATOM 1812 HE21 GLN B 242 28.362 30.373 15.711 1.00 0.00 H ATOM 1813 H GLN B 242 28.880 29.826 11.523 1.00 0.00 H ATOM 1814 N GLU B 243 29.586 32.778 10.179 1.00 33.35 N ATOM 1815 CA GLU B 243 30.244 33.968 9.605 1.00 34.65 C ATOM 1816 C GLU B 243 30.460 33.766 8.101 1.00 30.06 C ATOM 1817 O GLU B 243 30.202 34.665 7.305 1.00 27.70 O ATOM 1818 CB GLU B 243 31.527 34.325 10.362 1.00 38.34 C ATOM 1819 CG GLU B 243 31.255 34.821 11.788 1.00 43.02 C ATOM 1820 CD GLU B 243 32.524 35.201 12.561 1.00 50.52 C ATOM 1821 OE1 GLU B 243 33.654 34.956 12.047 1.00 51.70 O ATOM 1822 OE2 GLU B 243 32.388 35.743 13.699 1.00 56.10 O ATOM 1823 H GLU B 243 30.114 32.126 10.794 1.00 0.00 H ATOM 1824 N ILE B 244 30.858 32.566 7.719 1.00 27.90 N ATOM 1825 CA ILE B 244 31.004 32.253 6.295 1.00 28.57 C ATOM 1826 C ILE B 244 29.701 32.449 5.561 1.00 28.00 C ATOM 1827 O ILE B 244 29.664 33.123 4.540 1.00 27.60 O ATOM 1828 CB ILE B 244 31.505 30.828 6.036 1.00 27.45 C ATOM 1829 CG1 ILE B 244 32.915 30.655 6.588 1.00 26.75 C ATOM 1830 CG2 ILE B 244 31.521 30.534 4.548 1.00 27.65 C ATOM 1831 CD1 ILE B 244 33.362 29.218 6.795 1.00 26.68 C ATOM 1832 H ILE B 244 31.069 31.839 8.433 1.00 0.00 H ATOM 1833 N LEU B 245 28.635 31.907 6.122 1.00 29.12 N ATOM 1834 CA LEU B 245 27.319 31.960 5.493 1.00 30.78 C ATOM 1835 C LEU B 245 26.813 33.378 5.348 1.00 31.81 C ATOM 1836 O LEU B 245 26.181 33.679 4.337 1.00 30.80 O ATOM 1837 CB LEU B 245 26.279 31.119 6.244 1.00 30.45 C ATOM 1838 CG LEU B 245 26.544 29.616 6.286 1.00 31.06 C ATOM 1839 CD1 LEU B 245 25.750 28.978 7.405 1.00 32.44 C ATOM 1840 CD2 LEU B 245 26.204 28.938 4.962 1.00 31.59 C ATOM 1841 H LEU B 245 28.736 31.428 7.040 1.00 0.00 H ATOM 1842 N GLU B 246 27.059 34.239 6.336 1.00 32.12 N ATOM 1843 CA GLU B 246 26.643 35.627 6.204 1.00 35.85 C ATOM 1844 C GLU B 246 27.621 36.383 5.272 1.00 34.25 C ATOM 1845 O GLU B 246 27.244 37.298 4.561 1.00 32.81 O ATOM 1846 CB GLU B 246 26.530 36.341 7.571 1.00 41.21 C ATOM 1847 CG GLU B 246 26.518 37.853 7.385 1.00 47.88 C ATOM 1848 CD GLU B 246 26.038 38.671 8.573 1.00 59.07 C ATOM 1849 OE1 GLU B 246 26.500 38.442 9.723 1.00 66.50 O ATOM 1850 OE2 GLU B 246 25.214 39.592 8.330 1.00 66.60 O ATOM 1851 H GLU B 246 27.546 33.920 7.198 1.00 0.00 H ATOM 1852 N ALA B 247 28.887 36.014 5.313 1.00 33.61 N ATOM 1853 CA ALA B 247 29.861 36.570 4.396 1.00 35.34 C ATOM 1854 C ALA B 247 29.992 38.098 4.533 1.00 34.99 C ATOM 1855 O ALA B 247 30.189 38.783 3.521 1.00 34.29 O ATOM 1856 CB ALA B 247 29.495 36.191 2.950 1.00 35.50 C ATOM 1857 H ALA B 247 29.191 35.311 6.017 1.00 0.00 H ATOM 1858 N GLU B 248 29.843 38.635 5.742 1.00 35.27 N ATOM 1859 CA GLU B 248 29.873 40.099 5.906 1.00 39.10 C ATOM 1860 C GLU B 248 31.319 40.511 6.160 1.00 35.23 C ATOM 1861 O GLU B 248 32.012 39.920 6.974 1.00 31.14 O ATOM 1862 CB GLU B 248 28.954 40.601 7.030 1.00 44.23 C ATOM 1863 CG GLU B 248 29.651 40.805 8.373 1.00 51.60 C ATOM 1864 CD GLU B 248 28.740 41.253 9.510 1.00 57.67 C ATOM 1865 OE1 GLU B 248 27.727 41.964 9.254 1.00 62.53 O ATOM 1866 OE2 GLU B 248 29.087 40.919 10.678 1.00 60.48 O ATOM 1867 H GLU B 248 29.705 38.021 6.570 1.00 0.00 H ATOM 1868 N LEU B 249 31.778 41.513 5.430 1.00 34.51 N ATOM 1869 CA LEU B 249 33.177 41.899 5.505 1.00 32.25 C ATOM 1870 C LEU B 249 33.335 43.213 6.230 1.00 31.30 C ATOM 1871 O LEU B 249 32.712 44.163 5.885 1.00 30.56 O ATOM 1872 CB LEU B 249 33.753 41.999 4.117 1.00 30.76 C ATOM 1873 CG LEU B 249 34.034 40.644 3.442 1.00 30.40 C ATOM 1874 CD1 LEU B 249 34.315 40.880 1.971 1.00 29.93 C ATOM 1875 CD2 LEU B 249 35.196 39.935 4.099 1.00 29.21 C ATOM 1876 H LEU B 249 31.133 42.029 4.798 1.00 0.00 H ATOM 1877 N HIS B 250 34.195 43.246 7.223 1.00 32.14 N ATOM 1878 CA HIS B 250 34.548 44.508 7.898 1.00 36.18 C ATOM 1879 C HIS B 250 36.003 44.674 7.781 1.00 32.98 C ATOM 1880 O HIS B 250 36.738 43.979 8.409 1.00 33.97 O ATOM 1881 CB HIS B 250 34.180 44.465 9.373 1.00 38.64 C ATOM 1882 CG HIS B 250 32.745 44.180 9.580 1.00 42.27 C ATOM 1883 ND1 HIS B 250 31.759 44.852 8.888 1.00 45.10 N ATOM 1884 CD2 HIS B 250 32.122 43.251 10.336 1.00 45.21 C ATOM 1885 CE1 HIS B 250 30.582 44.359 9.232 1.00 47.29 C ATOM 1886 NE2 HIS B 250 30.776 43.398 10.121 1.00 46.44 N ATOM 1887 H HIS B 250 34.637 42.360 7.540 1.00 0.00 H ATOM 1888 N PHE B 251 36.428 45.569 6.927 1.00 32.16 N ATOM 1889 CA PHE B 251 37.834 45.694 6.680 1.00 30.69 C ATOM 1890 C PHE B 251 38.538 46.537 7.729 1.00 30.45 C ATOM 1891 O PHE B 251 38.051 47.563 8.145 1.00 31.25 O ATOM 1892 CB PHE B 251 38.029 46.305 5.321 1.00 29.47 C ATOM 1893 CG PHE B 251 37.622 45.405 4.215 1.00 28.66 C ATOM 1894 CD1 PHE B 251 38.501 44.427 3.751 1.00 29.78 C ATOM 1895 CD2 PHE B 251 36.411 45.534 3.614 1.00 27.23 C ATOM 1896 CE1 PHE B 251 38.136 43.592 2.711 1.00 27.57 C ATOM 1897 CE2 PHE B 251 36.063 44.691 2.590 1.00 27.67 C ATOM 1898 CZ PHE B 251 36.930 43.741 2.133 1.00 26.11 C ATOM 1899 H PHE B 251 35.752 46.184 6.432 1.00 0.00 H ATOM 1900 N PRO B 252 39.719 46.123 8.138 1.00 31.38 N ATOM 1901 CA PRO B 252 40.513 47.065 8.924 1.00 32.53 C ATOM 1902 C PRO B 252 40.750 48.306 8.114 1.00 32.30 C ATOM 1903 O PRO B 252 40.698 48.260 6.898 1.00 31.88 O ATOM 1904 CB PRO B 252 41.821 46.348 9.171 1.00 32.52 C ATOM 1905 CG PRO B 252 41.642 44.959 8.685 1.00 32.69 C ATOM 1906 CD PRO B 252 40.369 44.835 7.921 1.00 31.78 C ATOM 1907 N ALA B 253 40.991 49.412 8.799 1.00 34.40 N ATOM 1908 CA ALA B 253 41.110 50.726 8.158 1.00 35.18 C ATOM 1909 C ALA B 253 42.313 50.826 7.221 1.00 34.83 C ATOM 1910 O ALA B 253 42.278 51.568 6.218 1.00 34.93 O ATOM 1911 CB ALA B 253 41.219 51.790 9.236 1.00 37.98 C ATOM 1912 H ALA B 253 41.100 49.347 9.831 1.00 0.00 H ATOM 1913 N HIS B 254 43.367 50.062 7.526 1.00 33.00 N ATOM 1914 CA HIS B 254 44.553 50.089 6.679 1.00 32.00 C ATOM 1915 C HIS B 254 44.405 49.440 5.307 1.00 30.64 C ATOM 1916 O HIS B 254 45.269 49.619 4.491 1.00 30.10 O ATOM 1917 CB HIS B 254 45.757 49.525 7.384 1.00 31.66 C ATOM 1918 CG HIS B 254 45.753 48.047 7.516 1.00 33.91 C ATOM 1919 ND1 HIS B 254 46.187 47.222 6.509 1.00 33.56 N ATOM 1920 CD2 HIS B 254 45.392 47.234 8.540 1.00 34.89 C ATOM 1921 CE1 HIS B 254 46.088 45.970 6.897 1.00 33.38 C ATOM 1922 NE2 HIS B 254 45.627 45.947 8.131 1.00 34.05 N ATOM 1923 H HIS B 254 43.341 49.450 8.366 1.00 0.00 H ATOM 1924 N VAL B 255 43.355 48.658 5.055 1.00 28.31 N ATOM 1925 CA VAL B 255 43.243 48.014 3.753 1.00 26.55 C ATOM 1926 C VAL B 255 42.762 49.044 2.754 1.00 26.80 C ATOM 1927 O VAL B 255 41.751 49.690 2.935 1.00 26.92 O ATOM 1928 CB VAL B 255 42.311 46.768 3.767 1.00 24.91 C ATOM 1929 CG1 VAL B 255 42.262 46.087 2.418 1.00 24.15 C ATOM 1930 CG2 VAL B 255 42.836 45.749 4.743 1.00 24.31 C ATOM 1931 H VAL B 255 42.624 48.509 5.780 1.00 0.00 H ATOM 1932 N SER B 256 43.499 49.181 1.682 1.00 28.86 N ATOM 1933 CA SER B 256 43.099 50.082 0.603 1.00 30.67 C ATOM 1934 C SER B 256 41.748 49.684 0.041 1.00 31.09 C ATOM 1935 O SER B 256 41.395 48.492 0.060 1.00 30.25 O ATOM 1936 CB SER B 256 44.170 50.056 -0.490 1.00 30.28 C ATOM 1937 OG SER B 256 44.060 48.913 -1.315 1.00 30.21 O ATOM 1938 HG SER B 256 44.162 48.098 -0.763 1.00 0.00 H ATOM 1939 H SER B 256 44.383 48.640 1.596 1.00 0.00 H ATOM 1940 N PRO B 257 40.976 50.668 -0.460 1.00 32.87 N ATOM 1941 CA PRO B 257 39.726 50.354 -1.128 1.00 32.92 C ATOM 1942 C PRO B 257 39.868 49.506 -2.386 1.00 31.51 C ATOM 1943 O PRO B 257 38.960 48.754 -2.714 1.00 33.06 O ATOM 1944 CB PRO B 257 39.130 51.745 -1.476 1.00 34.42 C ATOM 1945 CG PRO B 257 39.776 52.684 -0.537 1.00 35.91 C ATOM 1946 CD PRO B 257 41.159 52.123 -0.308 1.00 35.51 C ATOM 1947 N ASP B 258 40.957 49.652 -3.111 1.00 32.02 N ATOM 1948 CA ASP B 258 41.240 48.761 -4.245 1.00 32.61 C ATOM 1949 C ASP B 258 41.337 47.321 -3.742 1.00 29.77 C ATOM 1950 O ASP B 258 40.794 46.394 -4.333 1.00 27.95 O ATOM 1951 CB ASP B 258 42.582 49.096 -4.920 1.00 36.21 C ATOM 1952 CG ASP B 258 42.521 50.318 -5.847 1.00 41.19 C ATOM 1953 OD1 ASP B 258 41.420 50.848 -6.114 1.00 42.07 O ATOM 1954 OD2 ASP B 258 43.622 50.752 -6.300 1.00 46.93 O ATOM 1955 H ASP B 258 41.629 50.411 -2.877 1.00 0.00 H ATOM 1956 N CYS B 259 42.052 47.123 -2.649 1.00 27.96 N ATOM 1957 CA CYS B 259 42.212 45.780 -2.166 1.00 27.06 C ATOM 1958 C CYS B 259 40.881 45.229 -1.657 1.00 25.60 C ATOM 1959 O CYS B 259 40.507 44.087 -1.973 1.00 22.89 O ATOM 1960 CB CYS B 259 43.280 45.746 -1.096 1.00 27.82 C ATOM 1961 SG CYS B 259 43.674 44.065 -0.610 1.00 28.33 S ATOM 1962 H CYS B 259 42.490 47.923 -2.149 1.00 0.00 H ATOM 1963 N CYS B 260 40.152 46.069 -0.915 1.00 26.29 N ATOM 1964 CA CYS B 260 38.773 45.755 -0.506 1.00 27.11 C ATOM 1965 C CYS B 260 37.888 45.320 -1.642 1.00 25.36 C ATOM 1966 O CYS B 260 37.158 44.346 -1.503 1.00 26.33 O ATOM 1967 CB CYS B 260 38.096 46.930 0.220 1.00 28.65 C ATOM 1968 SG CYS B 260 38.865 47.267 1.831 1.00 35.08 S ATOM 1969 H CYS B 260 40.572 46.973 -0.617 1.00 0.00 H ATOM 1970 N ALA B 261 37.906 46.047 -2.746 1.00 24.97 N ATOM 1971 CA ALA B 261 36.918 45.808 -3.799 1.00 24.49 C ATOM 1972 C ALA B 261 37.157 44.471 -4.421 1.00 23.56 C ATOM 1973 O ALA B 261 36.224 43.740 -4.655 1.00 24.47 O ATOM 1974 CB ALA B 261 36.944 46.919 -4.866 1.00 25.25 C ATOM 1975 H ALA B 261 38.624 46.790 -2.866 1.00 0.00 H ATOM 1976 N LEU B 262 38.410 44.141 -4.668 1.00 23.27 N ATOM 1977 CA LEU B 262 38.794 42.822 -5.189 1.00 23.70 C ATOM 1978 C LEU B 262 38.419 41.656 -4.261 1.00 23.36 C ATOM 1979 O LEU B 262 37.870 40.627 -4.699 1.00 23.53 O ATOM 1980 CB LEU B 262 40.308 42.788 -5.421 1.00 24.66 C ATOM 1981 CG LEU B 262 40.862 41.399 -5.738 1.00 25.61 C ATOM 1982 CD1 LEU B 262 40.162 40.777 -6.941 1.00 26.01 C ATOM 1983 CD2 LEU B 262 42.349 41.476 -6.014 1.00 27.02 C ATOM 1984 H LEU B 262 39.156 44.843 -4.487 1.00 0.00 H ATOM 1985 N ILE B 263 38.735 41.807 -2.981 1.00 22.95 N ATOM 1986 CA ILE B 263 38.363 40.807 -1.974 1.00 22.87 C ATOM 1987 C ILE B 263 36.850 40.658 -1.880 1.00 23.79 C ATOM 1988 O ILE B 263 36.336 39.538 -1.834 1.00 23.52 O ATOM 1989 CB ILE B 263 38.917 41.151 -0.563 1.00 21.83 C ATOM 1990 CG1 ILE B 263 40.452 41.071 -0.535 1.00 21.21 C ATOM 1991 CG2 ILE B 263 38.360 40.213 0.474 1.00 21.05 C ATOM 1992 CD1 ILE B 263 41.042 41.668 0.734 1.00 20.92 C ATOM 1993 H ILE B 263 39.259 42.655 -2.684 1.00 0.00 H ATOM 1994 N ARG B 264 36.118 41.756 -1.850 1.00 26.14 N ATOM 1995 CA ARG B 264 34.653 41.640 -1.882 1.00 27.84 C ATOM 1996 C ARG B 264 34.171 40.896 -3.117 1.00 27.14 C ATOM 1997 O ARG B 264 33.255 40.115 -3.001 1.00 26.06 O ATOM 1998 CB ARG B 264 33.951 42.994 -1.859 1.00 31.55 C ATOM 1999 CG ARG B 264 33.939 43.697 -0.525 1.00 35.76 C ATOM 2000 CD ARG B 264 33.131 44.996 -0.619 1.00 40.33 C ATOM 2001 NE ARG B 264 33.460 45.966 0.449 1.00 44.67 N ATOM 2002 CZ ARG B 264 33.045 45.891 1.715 1.00 48.41 C ATOM 2003 NH1 ARG B 264 32.308 44.853 2.151 1.00 44.87 N ATOM 2004 NH2 ARG B 264 33.409 46.855 2.564 1.00 52.33 N ATOM 2005 HE ARG B 264 34.064 46.772 0.192 1.00 0.00 H ATOM 2006 HH12 ARG B 264 31.996 44.817 3.142 1.00 0.00 H ATOM 2007 HH11 ARG B 264 32.050 44.087 1.496 1.00 0.00 H ATOM 2008 HH22 ARG B 264 33.098 46.819 3.556 1.00 0.00 H ATOM 2009 HH21 ARG B 264 34.003 47.642 2.233 1.00 0.00 H ATOM 2010 H ARG B 264 36.572 42.691 -1.804 1.00 0.00 H ATOM 2011 N ARG B 265 34.754 41.171 -4.283 1.00 28.21 N ATOM 2012 CA ARG B 265 34.441 40.438 -5.496 1.00 30.36 C ATOM 2013 C ARG B 265 34.665 38.934 -5.339 1.00 28.59 C ATOM 2014 O ARG B 265 33.762 38.142 -5.654 1.00 26.29 O ATOM 2015 CB ARG B 265 35.257 40.937 -6.699 1.00 35.78 C ATOM 2016 CG ARG B 265 34.891 42.336 -7.163 1.00 43.34 C ATOM 2017 CD ARG B 265 35.094 42.566 -8.671 1.00 49.27 C ATOM 2018 NE ARG B 265 36.487 42.490 -9.134 1.00 53.64 N ATOM 2019 CZ ARG B 265 36.867 42.214 -10.407 1.00 62.12 C ATOM 2020 NH1 ARG B 265 35.962 41.953 -11.369 1.00 60.58 N ATOM 2021 NH2 ARG B 265 38.173 42.185 -10.739 1.00 58.31 N ATOM 2022 HE ARG B 265 37.237 42.660 -8.434 1.00 0.00 H ATOM 2023 HH12 ARG B 265 36.278 41.744 -12.338 1.00 0.00 H ATOM 2024 HH11 ARG B 265 34.947 41.960 -11.144 1.00 0.00 H ATOM 2025 HH22 ARG B 265 38.456 41.973 -11.717 1.00 0.00 H ATOM 2026 HH21 ARG B 265 38.897 42.375 -10.017 1.00 0.00 H ATOM 2027 H ARG B 265 35.457 41.936 -4.325 1.00 0.00 H ATOM 2028 N CYS B 266 35.854 38.536 -4.860 1.00 27.06 N ATOM 2029 CA CYS B 266 36.137 37.118 -4.688 1.00 25.84 C ATOM 2030 C CYS B 266 35.241 36.470 -3.661 1.00 24.15 C ATOM 2031 O CYS B 266 35.009 35.282 -3.718 1.00 23.68 O ATOM 2032 CB CYS B 266 37.538 36.876 -4.206 1.00 26.23 C ATOM 2033 SG CYS B 266 38.741 37.419 -5.362 1.00 30.39 S ATOM 2034 H CYS B 266 36.575 39.243 -4.611 1.00 0.00 H ATOM 2035 N LEU B 267 34.813 37.232 -2.670 1.00 23.34 N ATOM 2036 CA LEU B 267 33.993 36.688 -1.596 1.00 22.02 C ATOM 2037 C LEU B 267 32.512 37.021 -1.784 1.00 22.97 C ATOM 2038 O LEU B 267 31.711 37.052 -0.843 1.00 21.94 O ATOM 2039 CB LEU B 267 34.507 37.211 -0.268 1.00 21.45 C ATOM 2040 CG LEU B 267 35.958 36.854 0.076 1.00 20.21 C ATOM 2041 CD1 LEU B 267 36.258 37.343 1.488 1.00 19.87 C ATOM 2042 CD2 LEU B 267 36.188 35.352 0.040 1.00 20.55 C ATOM 2043 H LEU B 267 35.067 38.240 -2.657 1.00 0.00 H ATOM 2044 N ALA B 268 32.098 37.213 -3.023 1.00 24.89 N ATOM 2045 CA ALA B 268 30.679 37.348 -3.254 1.00 25.71 C ATOM 2046 C ALA B 268 30.021 36.058 -2.790 1.00 27.21 C ATOM 2047 O ALA B 268 30.544 34.965 -3.068 1.00 27.41 O ATOM 2048 CB ALA B 268 30.422 37.543 -4.711 1.00 26.49 C ATOM 2049 H ALA B 268 32.775 37.266 -3.811 1.00 0.00 H ATOM 2050 N PRO B 269 28.876 36.170 -2.104 1.00 27.84 N ATOM 2051 CA PRO B 269 28.115 35.047 -1.610 1.00 28.64 C ATOM 2052 C PRO B 269 27.610 34.113 -2.707 1.00 29.08 C ATOM 2053 O PRO B 269 27.632 32.884 -2.545 1.00 29.59 O ATOM 2054 CB PRO B 269 26.886 35.715 -0.974 1.00 28.99 C ATOM 2055 CG PRO B 269 27.238 37.123 -0.804 1.00 28.13 C ATOM 2056 CD PRO B 269 28.133 37.427 -1.940 1.00 27.63 C ATOM 2057 N LYS B 270 27.085 34.699 -3.773 1.00 29.90 N ATOM 2058 CA LYS B 270 26.613 33.917 -4.913 1.00 30.56 C ATOM 2059 C LYS B 270 27.829 33.540 -5.760 1.00 28.84 C ATOM 2060 O LYS B 270 28.593 34.399 -6.183 1.00 29.64 O ATOM 2061 CB LYS B 270 25.598 34.716 -5.745 1.00 31.78 C ATOM 2062 H LYS B 270 27.007 35.736 -3.799 1.00 0.00 H ATOM 2063 N PRO B 271 28.016 32.260 -6.016 1.00 28.36 N ATOM 2064 CA PRO B 271 29.238 31.854 -6.687 1.00 29.26 C ATOM 2065 C PRO B 271 29.419 32.387 -8.134 1.00 31.33 C ATOM 2066 O PRO B 271 30.549 32.577 -8.566 1.00 31.30 O ATOM 2067 CB PRO B 271 29.191 30.316 -6.631 1.00 28.57 C ATOM 2068 CG PRO B 271 27.803 29.980 -6.287 1.00 29.98 C ATOM 2069 CD PRO B 271 27.230 31.122 -5.533 1.00 29.55 C ATOM 2070 N SER B 272 28.339 32.650 -8.859 1.00 33.79 N ATOM 2071 CA SER B 272 28.465 33.151 -10.232 1.00 37.01 C ATOM 2072 C SER B 272 28.749 34.659 -10.256 1.00 35.35 C ATOM 2073 O SER B 272 29.130 35.195 -11.264 1.00 33.53 O ATOM 2074 CB SER B 272 27.213 32.793 -11.050 1.00 40.18 C ATOM 2075 OG SER B 272 26.036 33.112 -10.309 1.00 44.68 O ATOM 2076 HG SER B 272 26.030 32.598 -9.463 1.00 0.00 H ATOM 2077 H SER B 272 27.395 32.500 -8.450 1.00 0.00 H ATOM 2078 N SER B 273 28.584 35.348 -9.129 1.00 36.12 N ATOM 2079 CA SER B 273 28.996 36.743 -9.059 1.00 34.55 C ATOM 2080 C SER B 273 30.525 36.841 -8.977 1.00 32.50 C ATOM 2081 O SER B 273 31.067 37.932 -9.145 1.00 33.18 O ATOM 2082 CB SER B 273 28.396 37.413 -7.827 1.00 35.24 C ATOM 2083 OG SER B 273 26.993 37.382 -7.879 1.00 37.03 O ATOM 2084 HG SER B 273 26.624 37.821 -7.072 1.00 0.00 H ATOM 2085 H SER B 273 28.160 34.889 -8.297 1.00 0.00 H ATOM 2086 N ARG B 274 31.215 35.722 -8.727 1.00 28.37 N ATOM 2087 CA ARG B 274 32.642 35.789 -8.426 1.00 27.58 C ATOM 2088 C ARG B 274 33.501 35.929 -9.661 1.00 28.48 C ATOM 2089 O ARG B 274 33.206 35.377 -10.701 1.00 31.24 O ATOM 2090 CB ARG B 274 33.100 34.563 -7.647 1.00 25.88 C ATOM 2091 CG ARG B 274 32.663 34.621 -6.221 1.00 24.61 C ATOM 2092 CD ARG B 274 33.004 33.374 -5.432 1.00 24.70 C ATOM 2093 NE ARG B 274 31.914 33.160 -4.489 1.00 25.16 N ATOM 2094 CZ ARG B 274 31.507 31.997 -4.010 1.00 24.11 C ATOM 2095 NH1 ARG B 274 32.109 30.855 -4.300 1.00 24.84 N ATOM 2096 NH2 ARG B 274 30.479 31.999 -3.218 1.00 23.91 N ATOM 2097 HE ARG B 274 31.406 34.006 -4.160 1.00 0.00 H ATOM 2098 HH12 ARG B 274 31.753 29.963 -3.900 1.00 0.00 H ATOM 2099 HH11 ARG B 274 32.938 30.849 -4.928 1.00 0.00 H ATOM 2100 HH22 ARG B 274 30.127 31.105 -2.820 1.00 0.00 H ATOM 2101 HH21 ARG B 274 30.007 32.895 -2.981 1.00 0.00 H ATOM 2102 H ARG B 274 30.733 34.801 -8.747 1.00 0.00 H ATOM 2103 N PRO B 275 34.596 36.649 -9.550 1.00 28.31 N ATOM 2104 CA PRO B 275 35.359 36.734 -10.786 1.00 30.38 C ATOM 2105 C PRO B 275 35.982 35.405 -11.187 1.00 31.38 C ATOM 2106 O PRO B 275 36.178 34.532 -10.370 1.00 31.23 O ATOM 2107 CB PRO B 275 36.446 37.762 -10.448 1.00 29.40 C ATOM 2108 CG PRO B 275 36.516 37.737 -8.966 1.00 28.48 C ATOM 2109 CD PRO B 275 35.134 37.501 -8.500 1.00 27.34 C ATOM 2110 N SER B 276 36.339 35.282 -12.448 1.00 33.76 N ATOM 2111 CA SER B 276 37.229 34.220 -12.871 1.00 33.95 C ATOM 2112 C SER B 276 38.647 34.621 -12.502 1.00 32.11 C ATOM 2113 O SER B 276 38.882 35.754 -12.092 1.00 32.96 O ATOM 2114 CB SER B 276 37.131 34.043 -14.383 1.00 35.55 C ATOM 2115 OG SER B 276 37.899 35.049 -15.012 1.00 37.74 O ATOM 2116 HG SER B 276 37.841 34.941 -15.994 1.00 0.00 H ATOM 2117 H SER B 276 35.977 35.957 -13.151 1.00 0.00 H ATOM 2118 N LEU B 277 39.580 33.692 -12.660 1.00 32.25 N ATOM 2119 CA LEU B 277 41.004 33.952 -12.449 1.00 33.20 C ATOM 2120 C LEU B 277 41.573 35.066 -13.301 1.00 35.11 C ATOM 2121 O LEU B 277 42.441 35.812 -12.834 1.00 36.01 O ATOM 2122 CB LEU B 277 41.812 32.680 -12.683 1.00 34.28 C ATOM 2123 CG LEU B 277 41.506 31.542 -11.702 1.00 35.71 C ATOM 2124 CD1 LEU B 277 42.350 30.323 -11.986 1.00 36.40 C ATOM 2125 CD2 LEU B 277 41.747 31.936 -10.246 1.00 36.23 C ATOM 2126 H LEU B 277 39.286 32.736 -12.947 1.00 0.00 H ATOM 2127 N GLU B 278 41.090 35.196 -14.540 1.00 36.63 N ATOM 2128 CA GLU B 278 41.582 36.238 -15.443 1.00 37.43 C ATOM 2129 C GLU B 278 41.123 37.586 -14.999 1.00 35.07 C ATOM 2130 O GLU B 278 41.908 38.523 -14.990 1.00 34.27 O ATOM 2131 CB GLU B 278 41.068 36.017 -16.869 1.00 41.62 C ATOM 2132 CG GLU B 278 41.745 34.880 -17.588 1.00 43.61 C ATOM 2133 CD GLU B 278 43.202 35.163 -17.788 1.00 47.15 C ATOM 2134 OE1 GLU B 278 43.543 36.360 -17.963 1.00 50.18 O ATOM 2135 OE2 GLU B 278 44.006 34.198 -17.769 1.00 48.60 O ATOM 2136 H GLU B 278 40.350 34.544 -14.869 1.00 0.00 H ATOM 2137 N GLU B 279 39.855 37.693 -14.631 1.00 33.87 N ATOM 2138 CA GLU B 279 39.359 38.935 -14.081 1.00 35.54 C ATOM 2139 C GLU B 279 40.211 39.398 -12.901 1.00 33.97 C ATOM 2140 O GLU B 279 40.485 40.598 -12.757 1.00 32.37 O ATOM 2141 CB GLU B 279 37.927 38.788 -13.586 1.00 39.80 C ATOM 2142 CG GLU B 279 36.905 38.408 -14.650 1.00 45.86 C ATOM 2143 CD GLU B 279 35.473 38.311 -14.098 1.00 50.06 C ATOM 2144 OE1 GLU B 279 34.933 39.345 -13.579 1.00 51.14 O ATOM 2145 OE2 GLU B 279 34.902 37.191 -14.201 1.00 49.94 O ATOM 2146 H GLU B 279 39.214 36.881 -14.738 1.00 0.00 H ATOM 2147 N ILE B 280 40.640 38.448 -12.057 1.00 32.26 N ATOM 2148 CA ILE B 280 41.387 38.791 -10.867 1.00 30.81 C ATOM 2149 C ILE B 280 42.721 39.336 -11.286 1.00 30.87 C ATOM 2150 O ILE B 280 43.180 40.325 -10.721 1.00 29.26 O ATOM 2151 CB ILE B 280 41.586 37.572 -9.940 1.00 31.28 C ATOM 2152 CG1 ILE B 280 40.297 37.270 -9.201 1.00 31.41 C ATOM 2153 CG2 ILE B 280 42.683 37.806 -8.919 1.00 30.61 C ATOM 2154 CD1 ILE B 280 40.382 35.992 -8.381 1.00 32.59 C ATOM 2155 H ILE B 280 40.432 37.450 -12.261 1.00 0.00 H ATOM 2156 N LEU B 281 43.352 38.719 -12.278 1.00 32.12 N ATOM 2157 CA LEU B 281 44.667 39.196 -12.700 1.00 34.58 C ATOM 2158 C LEU B 281 44.592 40.557 -13.330 1.00 35.28 C ATOM 2159 O LEU B 281 45.604 41.261 -13.428 1.00 34.65 O ATOM 2160 CB LEU B 281 45.330 38.255 -13.692 1.00 37.05 C ATOM 2161 CG LEU B 281 45.693 36.940 -13.028 1.00 38.91 C ATOM 2162 CD1 LEU B 281 45.932 35.863 -14.064 1.00 40.50 C ATOM 2163 CD2 LEU B 281 46.916 37.104 -12.136 1.00 38.79 C ATOM 2164 H LEU B 281 42.914 37.903 -12.751 1.00 0.00 H ATOM 2165 N LEU B 282 43.403 40.908 -13.790 1.00 36.11 N ATOM 2166 CA LEU B 282 43.212 42.176 -14.456 1.00 39.90 C ATOM 2167 C LEU B 282 42.659 43.203 -13.550 1.00 38.16 C ATOM 2168 O LEU B 282 42.481 44.327 -13.956 1.00 40.00 O ATOM 2169 CB LEU B 282 42.294 42.009 -15.652 1.00 43.44 C ATOM 2170 CG LEU B 282 42.914 41.096 -16.711 1.00 46.65 C ATOM 2171 CD1 LEU B 282 41.988 41.021 -17.891 1.00 48.20 C ATOM 2172 CD2 LEU B 282 44.288 41.568 -17.141 1.00 49.01 C ATOM 2173 H LEU B 282 42.595 40.264 -13.671 1.00 0.00 H ATOM 2174 N ASP B 283 42.413 42.836 -12.303 1.00 36.81 N ATOM 2175 CA ASP B 283 41.899 43.780 -11.349 1.00 34.93 C ATOM 2176 C ASP B 283 42.864 44.936 -11.123 1.00 33.95 C ATOM 2177 O ASP B 283 44.065 44.726 -11.058 1.00 31.34 O ATOM 2178 CB ASP B 283 41.670 43.102 -10.020 1.00 34.65 C ATOM 2179 CG ASP B 283 40.848 43.946 -9.099 1.00 34.43 C ATOM 2180 OD1 ASP B 283 41.404 44.808 -8.391 1.00 33.53 O ATOM 2181 OD2 ASP B 283 39.622 43.728 -9.105 1.00 37.31 O ATOM 2182 H ASP B 283 42.593 41.855 -12.010 1.00 0.00 H ATOM 2183 N PRO B 284 42.326 46.161 -10.990 1.00 34.14 N ATOM 2184 CA PRO B 284 43.211 47.309 -10.825 1.00 35.93 C ATOM 2185 C PRO B 284 44.148 47.209 -9.605 1.00 35.66 C ATOM 2186 O PRO B 284 45.280 47.710 -9.661 1.00 36.44 O ATOM 2187 CB PRO B 284 42.250 48.504 -10.723 1.00 35.71 C ATOM 2188 CG PRO B 284 40.882 47.941 -10.638 1.00 34.77 C ATOM 2189 CD PRO B 284 40.925 46.559 -11.183 1.00 33.88 C ATOM 2190 N TRP B 285 43.711 46.558 -8.531 1.00 33.81 N ATOM 2191 CA TRP B 285 44.609 46.377 -7.378 1.00 33.79 C ATOM 2192 C TRP B 285 45.791 45.526 -7.769 1.00 34.86 C ATOM 2193 O TRP B 285 46.841 45.755 -7.281 1.00 32.75 O ATOM 2194 CB TRP B 285 43.914 45.723 -6.193 1.00 31.73 C ATOM 2195 CG TRP B 285 44.832 45.548 -4.993 1.00 29.43 C ATOM 2196 CD1 TRP B 285 45.175 46.500 -4.086 1.00 27.88 C ATOM 2197 CD2 TRP B 285 45.521 44.336 -4.590 1.00 27.62 C ATOM 2198 NE1 TRP B 285 46.018 45.956 -3.134 1.00 27.72 N ATOM 2199 CE2 TRP B 285 46.237 44.635 -3.418 1.00 27.09 C ATOM 2200 CE3 TRP B 285 45.586 43.041 -5.100 1.00 26.12 C ATOM 2201 CZ2 TRP B 285 47.022 43.688 -2.766 1.00 26.61 C ATOM 2202 CZ3 TRP B 285 46.355 42.105 -4.451 1.00 25.84 C ATOM 2203 CH2 TRP B 285 47.081 42.433 -3.306 1.00 25.60 C ATOM 2204 HE1 TRP B 285 46.423 46.471 -2.327 1.00 0.00 H ATOM 2205 H TRP B 285 42.743 46.180 -8.506 1.00 0.00 H ATOM 2206 N MET B 286 45.598 44.559 -8.672 1.00 38.96 N ATOM 2207 CA MET B 286 46.684 43.711 -9.178 1.00 42.29 C ATOM 2208 C MET B 286 47.663 44.375 -10.138 1.00 47.29 C ATOM 2209 O MET B 286 48.454 43.672 -10.763 1.00 50.08 O ATOM 2210 CB MET B 286 46.128 42.496 -9.914 1.00 40.62 C ATOM 2211 CG MET B 286 45.481 41.490 -9.023 1.00 40.60 C ATOM 2212 SD MET B 286 46.617 40.857 -7.792 1.00 39.11 S ATOM 2213 CE MET B 286 47.892 40.060 -8.744 1.00 39.70 C ATOM 2214 H MET B 286 44.635 44.401 -9.032 1.00 0.00 H ATOM 2215 N GLN B 287 47.625 45.693 -10.281 1.00 51.51 N ATOM 2216 CA GLN B 287 48.652 46.384 -11.059 1.00 57.28 C ATOM 2217 C GLN B 287 49.255 47.532 -10.245 1.00 59.31 C ATOM 2218 O GLN B 287 48.597 48.554 -10.017 1.00 62.90 O ATOM 2219 CB GLN B 287 48.112 46.839 -12.437 1.00 61.66 C ATOM 2220 CG GLN B 287 46.623 47.187 -12.499 1.00 63.93 C ATOM 2221 CD GLN B 287 45.989 46.955 -13.870 1.00 68.66 C ATOM 2222 OE1 GLN B 287 45.503 45.855 -14.168 1.00 69.24 O ATOM 2223 NE2 GLN B 287 45.956 48.003 -14.700 1.00 68.67 N ATOM 2224 HE22 GLN B 287 46.376 48.909 -14.410 1.00 0.00 H ATOM 2225 HE21 GLN B 287 45.510 47.912 -15.635 1.00 0.00 H ATOM 2226 H GLN B 287 46.859 46.239 -9.837 1.00 0.00 H TER 2227 GLN B 287 HETATM 2228 O HOH 1 25.219 39.023 -6.834 1.00 37.50 O HETATM 2229 O HOH 2 25.317 31.582 -8.205 1.00 39.06 O HETATM 2230 O HOH 3 47.245 47.213 4.001 1.00 28.45 O HETATM 2231 O HOH 4 48.602 44.900 4.743 1.00 29.94 O HETATM 2232 O HOH 5 53.401 47.927 0.669 1.00 29.79 O HETATM 2233 O HOH 6 27.418 44.745 7.692 1.00 53.91 O HETATM 2234 O HOH 7 25.164 29.324 -9.891 1.00 49.23 O HETATM 2235 O HOH 8 32.499 45.674 13.285 1.00 46.33 O HETATM 2236 O HOH 9 37.669 32.754 6.658 1.00 25.93 O HETATM 2237 O HOH 10 35.388 30.663 4.157 1.00 13.43 O HETATM 2238 O HOH 11 25.424 24.618 7.342 1.00 28.14 O HETATM 2239 O HOH 12 43.286 25.054 -7.782 1.00 24.84 O HETATM 2240 O HOH 13 33.868 25.063 -11.711 1.00 29.77 O HETATM 2241 O HOH 14 41.256 26.353 -2.813 1.00 21.80 O HETATM 2242 O HOH 15 38.869 22.062 8.567 1.00 33.93 O HETATM 2243 O HOH 16 64.330 23.500 -4.245 1.00 54.18 O HETATM 2244 O HOH 17 41.725 25.849 1.844 1.00 28.98 O HETATM 2245 O HOH 18 30.181 37.059 8.255 1.00 31.60 O HETATM 2246 O HOH 19 39.816 49.590 4.679 1.00 34.12 O HETATM 2247 O HOH 20 31.648 15.406 1.459 1.00 58.19 O HETATM 2248 O HOH 21 35.898 41.055 8.061 1.00 32.77 O HETATM 2249 O HOH 22 34.745 47.466 5.582 1.00 38.41 O HETATM 2250 O HOH 23 24.855 31.778 2.965 1.00 30.45 O HETATM 2251 O HOH 24 38.232 12.050 4.180 1.00 42.14 O HETATM 2252 O HOH 25 63.941 24.521 3.683 1.00 34.29 O HETATM 2253 O HOH 26 32.463 36.880 -13.408 1.00 53.61 O HETATM 2254 O HOH 27 38.255 30.988 -13.302 1.00 29.60 O HETATM 2255 O HOH 28 64.684 20.069 -3.270 1.00 30.68 O HETATM 2256 O HOH 29 59.327 7.366 -8.647 1.00 50.83 O HETATM 2257 O HOH 30 45.923 3.412 -7.730 1.00 56.89 O HETATM 2258 O HOH 31 51.633 26.008 9.327 1.00 42.35 O HETATM 2259 O HOH 32 31.080 39.039 0.845 1.00 33.14 O HETATM 2260 O HOH 33 34.691 32.317 -10.255 1.00 31.95 O HETATM 2261 O HOH 34 59.305 7.156 -11.528 1.00 64.61 O HETATM 2262 O HOH 35 64.412 26.396 5.580 1.00 41.80 O HETATM 2263 O HOH 36 41.633 25.311 -5.786 1.00 27.52 O HETATM 2264 O HOH 37 27.332 23.936 9.111 1.00 35.47 O HETATM 2265 O HOH 38 40.329 40.963 10.427 1.00 35.22 O HETATM 2266 O HOH 39 57.620 44.726 -6.074 1.00 58.28 O HETATM 2267 O HOH 40 38.557 38.836 10.793 1.00 46.89 O HETATM 2268 O HOH 41 30.624 20.577 10.738 1.00 55.63 O HETATM 2269 O HOH 42 46.709 16.351 -19.420 1.00 46.11 O HETATM 2270 O HOH 43 62.781 26.252 7.093 1.00 47.62 O HETATM 2271 O HOH 44 37.012 22.766 11.480 1.00 43.30 O HETATM 2272 O HOH 45 34.301 21.770 4.626 1.00 60.79 O HETATM 2273 O2 UNN A 46 55.173 19.732 0.391 1.00 -0.38 O HETATM 2274 C10 UNN A 46 55.394 20.367 1.397 1.00 0.23 C HETATM 2275 C9 UNN A 46 56.685 21.032 1.576 1.00 0.10 C HETATM 2276 C8 UNN A 46 57.734 21.029 0.686 1.00 0.04 C HETATM 2277 S UNN A 46 58.957 21.921 1.330 1.00 0.00 S HETATM 2278 C7 UNN A 46 58.109 22.311 2.773 1.00 0.12 C HETATM 2279 C6 UNN A 46 58.624 23.097 3.811 1.00 0.09 C HETATM 2280 C5 UNN A 46 57.846 23.345 4.933 1.00 0.15 C HETATM 2281 C4 UNN A 46 58.323 24.127 5.987 1.00 -0.03 C HETATM 2282 C3 UNN A 46 59.596 24.665 5.925 1.00 -0.06 C HETATM 2283 C2 UNN A 46 60.371 24.411 4.813 1.00 -0.03 C HETATM 2284 C1 UNN A 46 59.887 23.625 3.759 1.00 0.15 C HETATM 2285 F1 UNN A 46 60.648 23.419 2.670 1.00 -0.18 F HETATM 2286 H4 UNN A 46 61.371 24.826 4.753 1.00 0.06 H HETATM 2287 H3 UNN A 46 59.977 25.275 6.736 1.00 0.06 H HETATM 2288 H5 UNN A 46 57.697 24.312 6.852 1.00 0.06 H HETATM 2289 F2 UNN A 46 56.608 22.820 5.039 1.00 -0.18 F HETATM 2290 N4 UNN A 46 56.913 21.734 2.693 1.00 -0.30 N HETATM 2291 H1 UNN A 46 57.752 20.523 -0.278 1.00 0.09 H HETATM 2292 N1 UNN A 46 54.543 20.548 2.391 1.00 -0.23 N HETATM 2293 C11 UNN A 46 53.352 19.918 2.498 1.00 0.12 C HETATM 2294 C12 UNN A 46 52.872 19.010 1.562 1.00 0.02 C HETATM 2295 N2 UNN A 46 51.705 18.431 1.781 1.00 -0.33 N HETATM 2296 C13 UNN A 46 50.985 18.684 2.887 1.00 -0.02 C HETATM 2297 C14 UNN A 46 51.418 19.565 3.860 1.00 -0.02 C HETATM 2298 C15 UNN A 46 52.630 20.194 3.655 1.00 0.13 C HETATM 2299 O1 UNN A 46 53.157 21.093 4.557 1.00 -0.31 O HETATM 2300 C16 UNN A 46 52.573 21.330 5.850 1.00 0.13 C HETATM 2301 C19 UNN A 46 51.450 22.356 5.702 1.00 -0.00 C HETATM 2302 N3 UNN A 46 52.185 23.592 5.814 1.00 0.23 N HETATM 2303 C18 UNN A 46 53.522 23.457 6.360 1.00 -0.03 C HETATM 2304 C17 UNN A 46 53.608 21.997 6.736 1.00 0.02 C HETATM 2305 H16 UNN A 46 54.613 21.599 6.532 1.00 0.03 H HETATM 2306 H17 UNN A 46 53.365 21.852 7.799 1.00 0.03 H HETATM 2307 H14 UNN A 46 53.651 24.098 7.244 1.00 0.08 H HETATM 2308 H15 UNN A 46 54.281 23.714 5.607 1.00 0.08 H HETATM 2309 H12 UNN A 46 51.663 24.214 6.412 1.00 0.20 H HETATM 2310 H13 UNN A 46 52.261 23.996 4.894 1.00 0.20 H HETATM 2311 H10 UNN A 46 50.704 22.256 6.504 1.00 0.08 H HETATM 2312 H11 UNN A 46 50.952 22.270 4.725 1.00 0.08 H HETATM 2313 H9 UNN A 46 52.207 20.392 6.292 1.00 0.07 H HETATM 2314 H7 UNN A 46 50.829 19.755 4.750 1.00 0.06 H HETATM 2315 H8 UNN A 46 50.034 18.181 3.020 1.00 0.07 H HETATM 2316 H2 UNN A 46 53.444 18.781 0.670 1.00 0.07 H HETATM 2317 H6 UNN A 46 54.797 21.193 3.111 1.00 0.22 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 118 119 122 123 124 CONECT 122 118 CONECT 123 118 CONECT 124 118 CONECT 342 343 348 349 350 CONECT 348 342 CONECT 349 342 CONECT 350 342 CONECT 579 580 590 591 592 CONECT 590 579 CONECT 591 579 CONECT 592 579 CONECT 2273 2274 CONECT 2274 2273 2275 2292 CONECT 2275 2274 2276 2290 CONECT 2276 2275 2277 2291 CONECT 2277 2276 2278 CONECT 2278 2277 2279 2290 CONECT 2279 2278 2280 2284 CONECT 2280 2279 2281 2289 CONECT 2281 2280 2282 2288 CONECT 2282 2281 2283 2287 CONECT 2283 2282 2284 2286 CONECT 2284 2279 2283 2285 CONECT 2285 2284 CONECT 2286 2283 CONECT 2287 2282 CONECT 2288 2281 CONECT 2289 2280 CONECT 2290 2275 2278 CONECT 2291 2276 CONECT 2292 2274 2293 2317 CONECT 2293 2292 2294 2298 CONECT 2294 2293 2295 2316 CONECT 2295 2294 2296 CONECT 2296 2295 2297 2315 CONECT 2297 2296 2298 2314 CONECT 2298 2293 2297 2299 CONECT 2299 2298 2300 CONECT 2300 2299 2301 2304 2313 CONECT 2301 2300 2302 2311 2312 CONECT 2302 2301 2303 2309 2310 CONECT 2303 2302 2304 2307 2308 CONECT 2304 2300 2303 2305 2306 CONECT 2305 2304 CONECT 2306 2304 CONECT 2307 2303 CONECT 2308 2303 CONECT 2309 2302 CONECT 2310 2302 CONECT 2311 2301 CONECT 2312 2301 CONECT 2313 2300 CONECT 2314 2297 CONECT 2315 2296 CONECT 2316 2294 CONECT 2317 2292 MASTER 0 0 0 0 0 0 0 0 2313 4 61 21 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 4x7q
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4xhk
RCSB PDB
PDBbind
3YR
Entry Information
PDB ID
4x7q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Serine/threonine-protein kinase pim-2
Ligand Name
3YR
EC.Number
E.C.2.7.11.1
Resolution
2.33(Å)
Affinity (Kd/Ki/IC50)
IC50=14nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Bioorg.Med.Chem.Lett. Vol. 25: pp. 474-480
Ligand Properties
Formula
C
1
9
H
1
7
F
2
N
4
O
2
S
Molecular Weight
403.426
Exact Mass
403.104
No. of atoms
45
No. of bonds
48
Polar Surface Area
108.96
LOGP Value
2.65 (
Computed with XLOGP3
)
4.09 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 4
Canonical SMILES
O=C(c1csc(n1)c1c(F)cccc1F)Nc1cnccc1O[C@@H]1C[NH2+]CC1
InChI String
InChI=1S/C19H16F2N4O2S/c20-12-2-1-3-13(21)17(12)19-25-15(10-28-19)18(26)24-14-9-23-7-5-16(14)27-11-4-6-22-8-11/h1-3,5,7,9-11,22H,4,6,8H2,(H,24,26)/p+1/t11-/m0/s1
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):
Q9P1W9
Entrez Gene ID
NCBI Entrez Gene ID:
11040
ASD
Information of known allosteric effects of PDB entries
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