Browse entries in the PDBbind-CN Database
HEADER 4ZYV_COMPLEX COMPND 4ZYV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 201 ALA ARG VAL ALA VAL LEU ILE SER GLY THR GLY SER ASN SEQRES 2 A 201 LEU GLN ALA LEU ILE ASP SER THR ARG GLU PRO ASN SER SEQRES 3 A 201 SER ALA GLN ILE ASP ILE VAL ILE SER ASN LYS ALA ALA SEQRES 4 A 201 VAL ALA GLY LEU ASP LYS ALA GLU ARG ALA GLY ILE PRO SEQRES 5 A 201 THR ARG VAL ILE ASN HIS LYS LEU TYR LYS ASN ARG VAL SEQRES 6 A 201 GLU PHE ASP SER ALA ILE ASP LEU VAL LEU GLU GLU PHE SEQRES 7 A 201 SER ILE ASP ILE VAL CYS LEU ALA GLY PHE MET ARG ILE SEQRES 8 A 201 LEU SER GLY PRO PHE VAL GLN LYS TRP ASN GLY LYS MET SEQRES 9 A 201 LEU ASN ILE HIS PRO SER LEU LEU PRO SER PHE LYS GLY SEQRES 10 A 201 SER ASN ALA HIS GLU GLN ALA LEU GLU THR GLY VAL THR SEQRES 11 A 201 VAL THR GLY CYS THR VAL HIS PHE VAL ALA GLU ASP VAL SEQRES 12 A 201 ASP ALA GLY GLN ILE ILE LEU GLN GLU ALA VAL PRO VAL SEQRES 13 A 201 LYS ARG GLY ASP THR VAL ALA THR LEU SER GLU ARG VAL SEQRES 14 A 201 LYS LEU ALA GLU HIS LYS ILE PHE PRO ALA ALA LEU GLN SEQRES 15 A 201 LEU VAL ALA SER GLY THR VAL GLN LEU GLY GLU ASN GLY SEQRES 16 A 201 LYS ILE CYS TRP VAL LYS HET G A 71 53 ATOM 1 N ALA A 808 -2.370 42.020 46.650 1.00 26.65 N ATOM 2 CA ALA A 808 -0.999 42.024 47.141 1.00 32.07 C ATOM 3 C ALA A 808 -0.843 41.025 48.268 1.00 29.42 C ATOM 4 O ALA A 808 -1.641 40.996 49.208 1.00 30.38 O ATOM 5 CB ALA A 808 -0.599 43.411 47.615 1.00 27.87 C ATOM 6 HN3 ALA A 808 -3.015 42.277 47.424 1.00 0.00 H ATOM 7 HN2 ALA A 808 -2.608 41.071 46.299 1.00 0.00 H ATOM 8 HN1 ALA A 808 -2.462 42.710 45.877 1.00 0.00 H ATOM 9 N ARG A 809 0.194 40.211 48.165 1.00 29.14 N ATOM 10 CA ARG A 809 0.464 39.176 49.143 1.00 31.24 C ATOM 11 C ARG A 809 1.385 39.715 50.231 1.00 28.40 C ATOM 12 O ARG A 809 2.452 40.249 49.938 1.00 30.33 O ATOM 13 CB ARG A 809 1.064 37.968 48.440 1.00 27.30 C ATOM 14 CG ARG A 809 0.214 37.557 47.235 1.00 28.55 C ATOM 15 CD ARG A 809 0.902 36.503 46.377 1.00 46.97 C ATOM 16 NE ARG A 809 1.327 35.403 47.223 1.00 49.86 N ATOM 17 CZ ARG A 809 0.559 34.366 47.529 1.00 53.15 C ATOM 18 NH1 ARG A 809 1.036 33.415 48.329 1.00 52.97 N ATOM 19 NH2 ARG A 809 -0.678 34.284 47.028 1.00 38.92 N ATOM 20 HE ARG A 809 2.291 35.430 47.612 1.00 0.00 H ATOM 21 HH12 ARG A 809 0.443 32.597 48.576 1.00 0.00 H ATOM 22 HH11 ARG A 809 2.002 33.490 48.707 1.00 0.00 H ATOM 23 HH22 ARG A 809 -1.283 33.472 47.266 1.00 0.00 H ATOM 24 HH21 ARG A 809 -1.035 35.032 46.400 1.00 0.00 H ATOM 25 H ARG A 809 0.838 40.317 47.355 1.00 0.00 H ATOM 26 N VAL A 810 0.954 39.576 51.483 1.00 24.04 N ATOM 27 CA VAL A 810 1.613 40.237 52.605 1.00 25.65 C ATOM 28 C VAL A 810 2.204 39.233 53.608 1.00 30.19 C ATOM 29 O VAL A 810 1.589 38.216 53.936 1.00 26.23 O ATOM 30 CB VAL A 810 0.627 41.199 53.341 1.00 25.08 C ATOM 31 CG1 VAL A 810 1.299 41.886 54.543 1.00 19.10 C ATOM 32 CG2 VAL A 810 0.084 42.236 52.382 1.00 23.59 C ATOM 33 H VAL A 810 0.123 38.979 51.667 1.00 0.00 H ATOM 34 N ALA A 811 3.420 39.520 54.061 1.00 26.31 N ATOM 35 CA ALA A 811 4.002 38.870 55.227 1.00 26.89 C ATOM 36 C ALA A 811 3.930 39.819 56.419 1.00 27.75 C ATOM 37 O ALA A 811 4.235 41.001 56.282 1.00 28.81 O ATOM 38 CB ALA A 811 5.451 38.479 54.961 1.00 26.76 C ATOM 39 H ALA A 811 3.980 40.240 53.561 1.00 0.00 H ATOM 40 N VAL A 812 3.528 39.317 57.585 1.00 26.26 N ATOM 41 CA VAL A 812 3.599 40.123 58.804 1.00 24.35 C ATOM 42 C VAL A 812 4.676 39.558 59.731 1.00 32.58 C ATOM 43 O VAL A 812 4.690 38.366 60.032 1.00 32.72 O ATOM 44 CB VAL A 812 2.255 40.170 59.553 1.00 23.22 C ATOM 45 CG1 VAL A 812 2.367 41.041 60.821 1.00 22.22 C ATOM 46 CG2 VAL A 812 1.151 40.687 58.635 1.00 23.77 C ATOM 47 H VAL A 812 3.161 38.345 57.629 1.00 0.00 H ATOM 48 N LEU A 813 5.583 40.419 60.173 1.00 31.95 N ATOM 49 CA LEU A 813 6.660 40.004 61.073 1.00 31.43 C ATOM 50 C LEU A 813 6.375 40.519 62.476 1.00 30.19 C ATOM 51 O LEU A 813 6.023 41.691 62.650 1.00 31.23 O ATOM 52 CB LEU A 813 8.009 40.524 60.580 1.00 29.29 C ATOM 53 CG LEU A 813 8.774 39.722 59.520 1.00 32.40 C ATOM 54 CD1 LEU A 813 7.913 39.397 58.326 1.00 29.92 C ATOM 55 CD2 LEU A 813 10.021 40.505 59.085 1.00 29.64 C ATOM 56 H LEU A 813 5.528 41.413 59.873 1.00 0.00 H ATOM 57 N ILE A 814 6.508 39.642 63.467 1.00 28.63 N ATOM 58 CA ILE A 814 6.188 39.977 64.856 1.00 31.61 C ATOM 59 C ILE A 814 7.277 39.556 65.840 1.00 35.28 C ATOM 60 O ILE A 814 8.167 38.764 65.492 1.00 36.54 O ATOM 61 CB ILE A 814 4.864 39.312 65.301 1.00 33.86 C ATOM 62 CG1 ILE A 814 4.992 37.784 65.239 1.00 31.87 C ATOM 63 CG2 ILE A 814 3.700 39.800 64.433 1.00 29.68 C ATOM 64 CD1 ILE A 814 3.786 37.042 65.806 1.00 29.35 C ATOM 65 H ILE A 814 6.851 38.685 63.248 1.00 0.00 H ATOM 66 N SER A 815 7.200 40.083 67.066 1.00 31.76 N ATOM 67 CA SER A 815 8.080 39.643 68.156 1.00 34.11 C ATOM 68 C SER A 815 7.330 39.324 69.460 1.00 34.65 C ATOM 69 O SER A 815 7.922 38.784 70.401 1.00 33.60 O ATOM 70 CB SER A 815 9.158 40.696 68.441 1.00 30.34 C ATOM 71 OG SER A 815 9.951 40.921 67.288 1.00 32.55 O ATOM 72 HG SER A 815 10.390 40.075 67.021 1.00 0.00 H ATOM 73 H SER A 815 6.497 40.826 67.253 1.00 0.00 H ATOM 74 N GLY A 816 6.038 39.639 69.523 1.00 33.50 N ATOM 75 CA GLY A 816 5.295 39.413 70.752 1.00 29.63 C ATOM 76 C GLY A 816 3.787 39.237 70.643 1.00 37.78 C ATOM 77 O GLY A 816 3.303 38.347 69.941 1.00 36.95 O ATOM 78 H GLY A 816 5.561 40.046 68.694 1.00 0.00 H ATOM 79 N THR A 817 3.053 40.097 71.351 1.00 32.37 N ATOM 80 CA THR A 817 1.612 39.942 71.570 1.00 38.57 C ATOM 81 C THR A 817 0.794 39.843 70.276 1.00 36.09 C ATOM 82 O THR A 817 -0.099 38.999 70.150 1.00 31.09 O ATOM 83 CB THR A 817 1.057 41.118 72.412 1.00 39.51 C ATOM 84 OG1 THR A 817 1.778 41.210 73.649 1.00 45.16 O ATOM 85 CG2 THR A 817 -0.432 40.927 72.693 1.00 37.92 C ATOM 86 HG1 THR A 817 1.420 41.963 74.183 1.00 0.00 H ATOM 87 H THR A 817 3.529 40.922 71.770 1.00 0.00 H ATOM 88 N GLY A 818 1.087 40.722 69.327 1.00 31.70 N ATOM 89 CA GLY A 818 0.449 40.657 68.031 1.00 31.67 C ATOM 90 C GLY A 818 -0.902 41.340 67.922 1.00 31.49 C ATOM 91 O GLY A 818 -1.719 40.947 67.085 1.00 26.97 O ATOM 92 H GLY A 818 1.785 41.469 69.518 1.00 0.00 H ATOM 93 N SER A 819 -1.148 42.371 68.731 1.00 26.83 N ATOM 94 CA SER A 819 -2.399 43.110 68.585 1.00 25.75 C ATOM 95 C SER A 819 -2.459 43.832 67.223 1.00 28.26 C ATOM 96 O SER A 819 -3.528 43.900 66.612 1.00 25.35 O ATOM 97 CB SER A 819 -2.604 44.101 69.741 1.00 24.63 C ATOM 98 OG SER A 819 -1.791 45.254 69.599 1.00 26.71 O ATOM 99 HG SER A 819 -2.017 45.714 68.752 1.00 0.00 H ATOM 100 H SER A 819 -0.457 42.646 69.458 1.00 0.00 H ATOM 101 N ASN A 820 -1.334 44.354 66.728 1.00 22.10 N ATOM 102 CA ASN A 820 -1.350 44.959 65.389 1.00 19.76 C ATOM 103 C ASN A 820 -1.577 43.917 64.289 1.00 20.62 C ATOM 104 O ASN A 820 -2.295 44.176 63.324 1.00 24.30 O ATOM 105 CB ASN A 820 -0.060 45.740 65.108 1.00 17.38 C ATOM 106 CG ASN A 820 -0.129 47.176 65.619 1.00 22.14 C ATOM 107 OD1 ASN A 820 -0.805 48.020 65.035 1.00 22.38 O ATOM 108 ND2 ASN A 820 0.554 47.448 66.718 1.00 19.42 N ATOM 109 HD22 ASN A 820 1.113 46.703 67.180 1.00 0.00 H ATOM 110 HD21 ASN A 820 0.532 48.407 67.120 1.00 0.00 H ATOM 111 H ASN A 820 -0.456 44.333 67.284 1.00 0.00 H ATOM 112 N LEU A 821 -0.971 42.747 64.440 1.00 21.51 N ATOM 113 CA LEU A 821 -1.255 41.611 63.554 1.00 26.36 C ATOM 114 C LEU A 821 -2.756 41.300 63.467 1.00 25.73 C ATOM 115 O LEU A 821 -3.306 41.153 62.379 1.00 24.28 O ATOM 116 CB LEU A 821 -0.516 40.361 64.029 1.00 22.47 C ATOM 117 CG LEU A 821 -0.918 39.043 63.350 1.00 22.50 C ATOM 118 CD1 LEU A 821 -0.650 39.106 61.839 1.00 22.16 C ATOM 119 CD2 LEU A 821 -0.183 37.848 63.987 1.00 23.48 C ATOM 120 H LEU A 821 -0.277 42.631 65.206 1.00 0.00 H ATOM 121 N GLN A 822 -3.415 41.211 64.618 1.00 19.88 N ATOM 122 CA GLN A 822 -4.846 40.923 64.644 1.00 21.35 C ATOM 123 C GLN A 822 -5.638 42.002 63.894 1.00 26.21 C ATOM 124 O GLN A 822 -6.561 41.688 63.137 1.00 21.76 O ATOM 125 CB GLN A 822 -5.352 40.806 66.088 1.00 21.73 C ATOM 126 CG GLN A 822 -6.800 40.313 66.171 1.00 25.02 C ATOM 127 CD GLN A 822 -6.980 38.960 65.495 1.00 32.38 C ATOM 128 OE1 GLN A 822 -6.297 37.993 65.834 1.00 28.60 O ATOM 129 NE2 GLN A 822 -7.897 38.889 64.531 1.00 30.47 N ATOM 130 HE22 GLN A 822 -8.451 39.732 64.277 1.00 0.00 H ATOM 131 HE21 GLN A 822 -8.059 37.991 64.032 1.00 0.00 H ATOM 132 H GLN A 822 -2.904 41.349 65.513 1.00 0.00 H ATOM 133 N ALA A 823 -5.285 43.271 64.104 1.00 21.17 N ATOM 134 CA ALA A 823 -5.969 44.356 63.393 1.00 21.21 C ATOM 135 C ALA A 823 -5.777 44.226 61.872 1.00 21.02 C ATOM 136 O ALA A 823 -6.702 44.495 61.099 1.00 21.58 O ATOM 137 CB ALA A 823 -5.483 45.715 63.878 1.00 17.66 C ATOM 138 H ALA A 823 -4.522 43.492 64.775 1.00 0.00 H ATOM 139 N LEU A 824 -4.579 43.830 61.452 1.00 17.84 N ATOM 140 CA LEU A 824 -4.297 43.618 60.027 1.00 20.02 C ATOM 141 C LEU A 824 -5.075 42.415 59.488 1.00 23.27 C ATOM 142 O LEU A 824 -5.652 42.488 58.404 1.00 24.37 O ATOM 143 CB LEU A 824 -2.795 43.425 59.791 1.00 20.05 C ATOM 144 CG LEU A 824 -1.923 44.652 60.084 1.00 24.30 C ATOM 145 CD1 LEU A 824 -0.441 44.325 59.989 1.00 22.57 C ATOM 146 CD2 LEU A 824 -2.273 45.812 59.145 1.00 22.66 C ATOM 147 H LEU A 824 -3.825 43.667 62.149 1.00 0.00 H ATOM 148 N ILE A 825 -5.087 41.312 60.239 1.00 22.25 N ATOM 149 CA ILE A 825 -5.890 40.147 59.859 1.00 21.91 C ATOM 150 C ILE A 825 -7.362 40.534 59.654 1.00 26.57 C ATOM 151 O ILE A 825 -7.948 40.264 58.599 1.00 25.58 O ATOM 152 CB ILE A 825 -5.794 39.030 60.914 1.00 26.64 C ATOM 153 CG1 ILE A 825 -4.369 38.456 60.948 1.00 26.15 C ATOM 154 CG2 ILE A 825 -6.822 37.927 60.620 1.00 23.75 C ATOM 155 CD1 ILE A 825 -4.090 37.506 62.117 1.00 26.07 C ATOM 156 H ILE A 825 -4.517 41.279 61.108 1.00 0.00 H ATOM 157 N ASP A 826 -7.949 41.182 60.657 1.00 23.87 N ATOM 158 CA ASP A 826 -9.322 41.670 60.555 1.00 27.94 C ATOM 159 C ASP A 826 -9.541 42.537 59.299 1.00 27.84 C ATOM 160 O ASP A 826 -10.484 42.312 58.546 1.00 24.73 O ATOM 161 CB ASP A 826 -9.712 42.474 61.808 1.00 25.52 C ATOM 162 CG ASP A 826 -9.717 41.625 63.095 1.00 30.39 C ATOM 163 OD1 ASP A 826 -9.578 40.388 63.021 1.00 30.00 O ATOM 164 OD2 ASP A 826 -9.857 42.210 64.190 1.00 30.87 O ATOM 165 H ASP A 826 -7.417 41.345 61.536 1.00 0.00 H ATOM 166 N SER A 827 -8.683 43.526 59.064 1.00 19.87 N ATOM 167 CA SER A 827 -8.909 44.435 57.940 1.00 18.88 C ATOM 168 C SER A 827 -8.760 43.731 56.574 1.00 25.54 C ATOM 169 O SER A 827 -9.533 43.993 55.637 1.00 23.85 O ATOM 170 CB SER A 827 -7.953 45.634 58.014 1.00 21.42 C ATOM 171 OG SER A 827 -6.633 45.251 57.655 1.00 31.45 O ATOM 172 HG SER A 827 -6.314 44.549 58.276 1.00 0.00 H ATOM 173 H SER A 827 -7.853 43.653 59.678 1.00 0.00 H ATOM 174 N THR A 828 -7.789 42.829 56.452 1.00 26.13 N ATOM 175 CA THR A 828 -7.531 42.212 55.145 1.00 32.85 C ATOM 176 C THR A 828 -8.578 41.177 54.773 1.00 30.49 C ATOM 177 O THR A 828 -8.547 40.624 53.675 1.00 38.59 O ATOM 178 CB THR A 828 -6.129 41.542 55.056 1.00 28.23 C ATOM 179 OG1 THR A 828 -6.001 40.520 56.052 1.00 29.36 O ATOM 180 CG2 THR A 828 -5.032 42.568 55.209 1.00 26.42 C ATOM 181 HG1 THR A 828 -6.111 40.921 56.950 1.00 0.00 H ATOM 182 H THR A 828 -7.216 42.563 57.278 1.00 0.00 H ATOM 183 N ARG A 829 -9.529 40.933 55.662 1.00 27.77 N ATOM 184 CA ARG A 829 -10.576 39.977 55.356 1.00 29.75 C ATOM 185 C ARG A 829 -11.870 40.663 54.951 1.00 29.64 C ATOM 186 O ARG A 829 -12.829 40.002 54.573 1.00 30.75 O ATOM 187 CB ARG A 829 -10.812 39.057 56.549 1.00 37.42 C ATOM 188 CG ARG A 829 -9.633 38.157 56.784 1.00 44.23 C ATOM 189 CD ARG A 829 -9.906 37.095 57.813 1.00 49.29 C ATOM 190 NE ARG A 829 -8.922 36.028 57.662 1.00 57.33 N ATOM 191 CZ ARG A 829 -8.702 35.074 58.555 1.00 59.07 C ATOM 192 NH1 ARG A 829 -7.778 34.154 58.313 1.00 59.24 N ATOM 193 NH2 ARG A 829 -9.394 35.046 59.690 1.00 60.76 N ATOM 194 HE ARG A 829 -8.353 36.015 56.792 1.00 0.00 H ATOM 195 HH12 ARG A 829 -7.599 33.402 59.008 1.00 0.00 H ATOM 196 HH11 ARG A 829 -7.233 34.185 57.428 1.00 0.00 H ATOM 197 HH22 ARG A 829 -9.218 34.295 60.388 1.00 0.00 H ATOM 198 HH21 ARG A 829 -10.111 35.775 59.880 1.00 0.00 H ATOM 199 H ARG A 829 -9.525 41.426 56.578 1.00 0.00 H ATOM 200 N GLU A 830 -11.892 41.988 55.038 1.00 26.46 N ATOM 201 CA GLU A 830 -12.990 42.771 54.477 1.00 24.43 C ATOM 202 C GLU A 830 -13.019 42.539 52.971 1.00 21.22 C ATOM 203 O GLU A 830 -11.960 42.444 52.356 1.00 22.83 O ATOM 204 CB GLU A 830 -12.805 44.259 54.791 1.00 20.84 C ATOM 205 CG GLU A 830 -13.029 44.634 56.246 1.00 40.47 C ATOM 206 CD GLU A 830 -14.491 44.516 56.641 1.00 60.60 C ATOM 207 OE1 GLU A 830 -15.297 45.369 56.201 1.00 67.46 O ATOM 208 OE2 GLU A 830 -14.835 43.566 57.379 1.00 64.09 O ATOM 209 H GLU A 830 -11.110 42.479 55.516 1.00 0.00 H ATOM 210 N PRO A 831 -14.221 42.437 52.378 1.00 21.19 N ATOM 211 CA PRO A 831 -14.338 42.182 50.937 1.00 22.00 C ATOM 212 C PRO A 831 -13.486 43.109 50.078 1.00 23.33 C ATOM 213 O PRO A 831 -12.911 42.634 49.103 1.00 23.59 O ATOM 214 CB PRO A 831 -15.829 42.411 50.660 1.00 25.97 C ATOM 215 CG PRO A 831 -16.503 42.081 51.965 1.00 28.93 C ATOM 216 CD PRO A 831 -15.537 42.548 53.034 1.00 22.15 C ATOM 217 N ASN A 832 -13.390 44.392 50.427 1.00 20.98 N ATOM 218 CA ASN A 832 -12.681 45.332 49.557 1.00 28.99 C ATOM 219 C ASN A 832 -11.185 45.430 49.822 1.00 25.98 C ATOM 220 O ASN A 832 -10.501 46.249 49.209 1.00 24.39 O ATOM 221 CB ASN A 832 -13.306 46.727 49.652 1.00 26.17 C ATOM 222 CG ASN A 832 -14.686 46.777 49.034 1.00 28.89 C ATOM 223 OD1 ASN A 832 -15.056 45.907 48.247 1.00 30.25 O ATOM 224 ND2 ASN A 832 -15.455 47.793 49.387 1.00 33.70 N ATOM 225 HD22 ASN A 832 -15.100 48.506 50.056 1.00 0.00 H ATOM 226 HD21 ASN A 832 -16.415 47.879 48.996 1.00 0.00 H ATOM 227 H ASN A 832 -13.818 44.724 51.315 1.00 0.00 H ATOM 228 N SER A 833 -10.669 44.593 50.717 1.00 20.66 N ATOM 229 CA SER A 833 -9.231 44.610 51.003 1.00 23.12 C ATOM 230 C SER A 833 -8.383 44.246 49.777 1.00 25.28 C ATOM 231 O SER A 833 -8.659 43.264 49.083 1.00 24.06 O ATOM 232 CB SER A 833 -8.887 43.653 52.137 1.00 21.29 C ATOM 233 OG SER A 833 -7.482 43.515 52.227 1.00 22.44 O ATOM 234 HG SER A 833 -7.075 44.400 52.406 1.00 0.00 H ATOM 235 H SER A 833 -11.288 43.923 51.217 1.00 0.00 H ATOM 236 N SER A 834 -7.347 45.040 49.531 1.00 27.35 N ATOM 237 CA SER A 834 -6.416 44.785 48.432 1.00 27.74 C ATOM 238 C SER A 834 -5.226 43.953 48.903 1.00 26.24 C ATOM 239 O SER A 834 -4.335 43.627 48.119 1.00 28.28 O ATOM 240 CB SER A 834 -5.924 46.103 47.825 1.00 31.93 C ATOM 241 OG SER A 834 -6.992 46.817 47.227 1.00 30.15 O ATOM 242 HG SER A 834 -7.394 46.267 46.509 1.00 0.00 H ATOM 243 H SER A 834 -7.193 45.869 50.139 1.00 0.00 H ATOM 244 N ALA A 835 -5.212 43.617 50.187 1.00 22.88 N ATOM 245 CA ALA A 835 -4.122 42.833 50.756 1.00 26.60 C ATOM 246 C ALA A 835 -4.626 41.499 51.289 1.00 25.36 C ATOM 247 O ALA A 835 -5.758 41.396 51.753 1.00 24.15 O ATOM 248 CB ALA A 835 -3.421 43.621 51.879 1.00 23.45 C ATOM 249 H ALA A 835 -5.995 43.919 50.801 1.00 0.00 H ATOM 250 N GLN A 836 -3.774 40.482 51.225 1.00 25.02 N ATOM 251 CA GLN A 836 -4.026 39.201 51.876 1.00 23.08 C ATOM 252 C GLN A 836 -2.769 38.794 52.660 1.00 29.77 C ATOM 253 O GLN A 836 -1.649 38.910 52.155 1.00 28.09 O ATOM 254 CB GLN A 836 -4.397 38.124 50.847 1.00 27.85 C ATOM 255 CG GLN A 836 -3.310 37.878 49.790 1.00 24.57 C ATOM 256 CD GLN A 836 -3.644 36.744 48.835 1.00 36.58 C ATOM 257 OE1 GLN A 836 -3.877 36.977 47.653 1.00 39.19 O ATOM 258 NE2 GLN A 836 -3.631 35.511 49.334 1.00 27.78 N ATOM 259 HE22 GLN A 836 -3.428 35.360 50.343 1.00 0.00 H ATOM 260 HE21 GLN A 836 -3.823 34.698 48.715 1.00 0.00 H ATOM 261 H GLN A 836 -2.891 40.604 50.689 1.00 0.00 H ATOM 262 N ILE A 837 -2.943 38.324 53.890 1.00 30.48 N ATOM 263 CA ILE A 837 -1.795 37.919 54.696 1.00 27.36 C ATOM 264 C ILE A 837 -1.544 36.443 54.502 1.00 31.34 C ATOM 265 O ILE A 837 -2.390 35.628 54.856 1.00 31.27 O ATOM 266 CB ILE A 837 -2.006 38.189 56.186 1.00 26.71 C ATOM 267 CG1 ILE A 837 -2.215 39.688 56.442 1.00 24.16 C ATOM 268 CG2 ILE A 837 -0.819 37.657 56.982 1.00 26.59 C ATOM 269 CD1 ILE A 837 -2.737 39.990 57.828 1.00 23.83 C ATOM 270 H ILE A 837 -3.903 38.244 54.281 1.00 0.00 H ATOM 271 N ASP A 838 -0.383 36.102 53.948 1.00 32.34 N ATOM 272 CA ASP A 838 -0.087 34.726 53.565 1.00 34.53 C ATOM 273 C ASP A 838 0.895 34.040 54.512 1.00 37.19 C ATOM 274 O ASP A 838 1.033 32.816 54.495 1.00 36.16 O ATOM 275 CB ASP A 838 0.453 34.690 52.130 1.00 35.17 C ATOM 276 CG ASP A 838 -0.618 35.026 51.096 1.00 44.78 C ATOM 277 OD1 ASP A 838 -1.798 34.694 51.325 1.00 40.13 O ATOM 278 OD2 ASP A 838 -0.291 35.648 50.068 1.00 52.80 O ATOM 279 H ASP A 838 0.334 36.838 53.783 1.00 0.00 H ATOM 280 N ILE A 839 1.579 34.818 55.341 1.00 34.10 N ATOM 281 CA ILE A 839 2.572 34.235 56.242 1.00 34.86 C ATOM 282 C ILE A 839 2.835 35.187 57.401 1.00 35.54 C ATOM 283 O ILE A 839 2.812 36.414 57.232 1.00 31.40 O ATOM 284 CB ILE A 839 3.895 33.905 55.488 1.00 32.88 C ATOM 285 CG1 ILE A 839 4.889 33.155 56.379 1.00 34.37 C ATOM 286 CG2 ILE A 839 4.530 35.161 54.920 1.00 32.49 C ATOM 287 CD1 ILE A 839 4.363 31.845 56.917 1.00 41.58 C ATOM 288 H ILE A 839 1.409 35.844 55.350 1.00 0.00 H ATOM 289 N VAL A 840 3.038 34.615 58.583 1.00 35.95 N ATOM 290 CA VAL A 840 3.435 35.370 59.759 1.00 37.18 C ATOM 291 C VAL A 840 4.774 34.831 60.242 1.00 36.43 C ATOM 292 O VAL A 840 4.953 33.621 60.384 1.00 36.74 O ATOM 293 CB VAL A 840 2.391 35.282 60.888 1.00 32.47 C ATOM 294 CG1 VAL A 840 2.939 35.902 62.172 1.00 31.60 C ATOM 295 CG2 VAL A 840 1.089 35.957 60.463 1.00 24.59 C ATOM 296 H VAL A 840 2.908 33.587 58.670 1.00 0.00 H ATOM 297 N ILE A 841 5.719 35.729 60.484 1.00 32.23 N ATOM 298 CA ILE A 841 7.062 35.319 60.887 1.00 38.17 C ATOM 299 C ILE A 841 7.414 35.961 62.219 1.00 38.98 C ATOM 300 O ILE A 841 7.214 37.166 62.398 1.00 37.31 O ATOM 301 CB ILE A 841 8.111 35.707 59.828 1.00 34.94 C ATOM 302 CG1 ILE A 841 7.796 35.017 58.494 1.00 34.86 C ATOM 303 CG2 ILE A 841 9.518 35.366 60.301 1.00 32.18 C ATOM 304 CD1 ILE A 841 8.653 35.485 57.328 1.00 33.50 C ATOM 305 H ILE A 841 5.501 36.741 60.385 1.00 0.00 H ATOM 306 N SER A 842 7.914 35.158 63.155 1.00 34.98 N ATOM 307 CA SER A 842 8.338 35.667 64.456 1.00 36.56 C ATOM 308 C SER A 842 9.808 35.365 64.720 1.00 38.25 C ATOM 309 O SER A 842 10.319 34.326 64.302 1.00 40.89 O ATOM 310 CB SER A 842 7.478 35.074 65.577 1.00 36.34 C ATOM 311 OG SER A 842 7.921 35.531 66.851 1.00 37.20 O ATOM 312 HG SER A 842 7.352 35.136 67.558 1.00 0.00 H ATOM 313 H SER A 842 8.005 34.142 62.955 1.00 0.00 H ATOM 314 N ASN A 843 10.491 36.270 65.417 1.00 38.95 N ATOM 315 CA ASN A 843 11.862 35.991 65.852 1.00 45.28 C ATOM 316 C ASN A 843 11.899 35.407 67.275 1.00 51.95 C ATOM 317 O ASN A 843 12.947 34.965 67.757 1.00 50.86 O ATOM 318 CB ASN A 843 12.728 37.256 65.769 1.00 41.08 C ATOM 319 CG ASN A 843 12.274 38.352 66.724 1.00 43.32 C ATOM 320 OD1 ASN A 843 11.083 38.677 66.812 1.00 38.39 O ATOM 321 ND2 ASN A 843 13.226 38.923 67.454 1.00 39.47 N ATOM 322 HD22 ASN A 843 14.215 38.619 67.348 1.00 0.00 H ATOM 323 HD21 ASN A 843 12.982 39.674 68.131 1.00 0.00 H ATOM 324 H ASN A 843 10.049 37.181 65.654 1.00 0.00 H ATOM 325 N LYS A 844 10.744 35.422 67.940 1.00 55.23 N ATOM 326 CA LYS A 844 10.597 34.872 69.287 1.00 51.93 C ATOM 327 C LYS A 844 9.593 33.718 69.283 1.00 48.33 C ATOM 328 O LYS A 844 8.522 33.802 68.664 1.00 43.07 O ATOM 329 CB LYS A 844 10.143 35.947 70.280 1.00 51.43 C ATOM 330 CG LYS A 844 11.032 37.181 70.365 1.00 56.38 C ATOM 331 CD LYS A 844 12.406 36.845 70.922 1.00 60.23 C ATOM 332 CE LYS A 844 13.216 38.108 71.202 1.00 58.24 C ATOM 333 NZ LYS A 844 14.518 37.820 71.888 1.00 55.79 N ATOM 334 HZ1 LYS A 844 14.333 37.351 72.798 1.00 0.00 H ATOM 335 HZ2 LYS A 844 15.095 37.197 71.287 1.00 0.00 H ATOM 336 HZ3 LYS A 844 15.026 38.712 72.053 1.00 0.00 H ATOM 337 H LYS A 844 9.911 35.843 67.481 1.00 0.00 H ATOM 338 N ALA A 845 9.945 32.642 69.977 1.00 44.89 N ATOM 339 CA ALA A 845 9.087 31.471 70.052 1.00 46.67 C ATOM 340 C ALA A 845 7.984 31.675 71.090 1.00 52.36 C ATOM 341 O ALA A 845 8.125 32.496 72.005 1.00 56.15 O ATOM 342 CB ALA A 845 9.915 30.232 70.390 1.00 46.93 C ATOM 343 H ALA A 845 10.856 32.637 70.479 1.00 0.00 H ATOM 344 N ALA A 846 6.890 30.934 70.931 1.00 49.05 N ATOM 345 CA ALA A 846 5.820 30.863 71.928 1.00 49.05 C ATOM 346 C ALA A 846 5.226 32.214 72.310 1.00 46.42 C ATOM 347 O ALA A 846 4.777 32.386 73.443 1.00 43.85 O ATOM 348 CB ALA A 846 6.324 30.154 73.193 1.00 47.49 C ATOM 349 H ALA A 846 6.790 30.379 70.057 1.00 0.00 H ATOM 350 N VAL A 847 5.217 33.170 71.385 1.00 44.88 N ATOM 351 CA VAL A 847 4.580 34.449 71.667 1.00 42.59 C ATOM 352 C VAL A 847 3.124 34.419 71.203 1.00 41.82 C ATOM 353 O VAL A 847 2.749 33.614 70.339 1.00 39.24 O ATOM 354 CB VAL A 847 5.338 35.628 71.012 1.00 40.31 C ATOM 355 CG1 VAL A 847 6.716 35.765 71.638 1.00 39.82 C ATOM 356 CG2 VAL A 847 5.442 35.442 69.504 1.00 39.88 C ATOM 357 H VAL A 847 5.665 33.004 70.461 1.00 0.00 H ATOM 358 N ALA A 848 2.309 35.303 71.774 1.00 38.74 N ATOM 359 CA ALA A 848 0.865 35.232 71.597 1.00 34.71 C ATOM 360 C ALA A 848 0.435 35.575 70.171 1.00 36.03 C ATOM 361 O ALA A 848 -0.628 35.143 69.724 1.00 40.35 O ATOM 362 CB ALA A 848 0.166 36.139 72.602 1.00 34.76 C ATOM 363 H ALA A 848 2.712 36.062 72.360 1.00 0.00 H ATOM 364 N GLY A 849 1.264 36.333 69.455 1.00 35.33 N ATOM 365 CA GLY A 849 0.989 36.662 68.067 1.00 29.11 C ATOM 366 C GLY A 849 0.937 35.426 67.178 1.00 32.63 C ATOM 367 O GLY A 849 0.226 35.412 66.178 1.00 32.27 O ATOM 368 H GLY A 849 2.130 36.698 69.901 1.00 0.00 H ATOM 369 N LEU A 850 1.691 34.388 67.536 1.00 34.55 N ATOM 370 CA LEU A 850 1.661 33.130 66.784 1.00 37.06 C ATOM 371 C LEU A 850 0.324 32.424 66.967 1.00 40.14 C ATOM 372 O LEU A 850 -0.206 31.831 66.027 1.00 40.44 O ATOM 373 CB LEU A 850 2.802 32.209 67.214 1.00 35.21 C ATOM 374 CG LEU A 850 4.231 32.635 66.878 1.00 44.10 C ATOM 375 CD1 LEU A 850 5.248 31.669 67.503 1.00 39.63 C ATOM 376 CD2 LEU A 850 4.427 32.706 65.378 1.00 42.77 C ATOM 377 H LEU A 850 2.313 34.472 68.365 1.00 0.00 H ATOM 378 N ASP A 851 -0.208 32.478 68.187 1.00 43.07 N ATOM 379 CA ASP A 851 -1.514 31.894 68.488 1.00 44.67 C ATOM 380 C ASP A 851 -2.597 32.566 67.656 1.00 44.01 C ATOM 381 O ASP A 851 -3.516 31.915 67.159 1.00 46.76 O ATOM 382 CB ASP A 851 -1.855 32.036 69.976 1.00 50.90 C ATOM 383 CG ASP A 851 -0.861 31.335 70.884 1.00 58.80 C ATOM 384 OD1 ASP A 851 -0.240 30.337 70.450 1.00 61.79 O ATOM 385 OD2 ASP A 851 -0.710 31.786 72.042 1.00 57.59 O ATOM 386 H ASP A 851 0.321 32.950 68.948 1.00 0.00 H ATOM 387 N LYS A 852 -2.481 33.883 67.522 1.00 38.17 N ATOM 388 CA LYS A 852 -3.453 34.666 66.779 1.00 38.07 C ATOM 389 C LYS A 852 -3.449 34.273 65.304 1.00 39.15 C ATOM 390 O LYS A 852 -4.507 34.135 64.687 1.00 35.67 O ATOM 391 CB LYS A 852 -3.170 36.169 66.932 1.00 32.55 C ATOM 392 CG LYS A 852 -3.517 36.728 68.309 1.00 34.21 C ATOM 393 CD LYS A 852 -3.104 38.189 68.447 1.00 32.70 C ATOM 394 CE LYS A 852 -3.500 38.753 69.812 1.00 31.95 C ATOM 395 NZ LYS A 852 -2.754 38.122 70.926 1.00 32.38 N ATOM 396 HZ1 LYS A 852 -2.945 37.100 70.934 1.00 0.00 H ATOM 397 HZ2 LYS A 852 -1.735 38.285 70.795 1.00 0.00 H ATOM 398 HZ3 LYS A 852 -3.060 38.540 71.828 1.00 0.00 H ATOM 399 H LYS A 852 -1.672 34.367 67.961 1.00 0.00 H ATOM 400 N ALA A 853 -2.255 34.105 64.744 1.00 35.04 N ATOM 401 CA ALA A 853 -2.117 33.741 63.337 1.00 40.15 C ATOM 402 C ALA A 853 -2.681 32.346 63.100 1.00 45.01 C ATOM 403 O ALA A 853 -3.489 32.127 62.196 1.00 43.17 O ATOM 404 CB ALA A 853 -0.664 33.807 62.907 1.00 34.59 C ATOM 405 H ALA A 853 -1.400 34.236 65.321 1.00 0.00 H ATOM 406 N GLU A 854 -2.244 31.410 63.933 1.00 47.44 N ATOM 407 CA GLU A 854 -2.694 30.028 63.865 1.00 51.71 C ATOM 408 C GLU A 854 -4.215 29.928 63.948 1.00 52.16 C ATOM 409 O GLU A 854 -4.848 29.220 63.164 1.00 50.30 O ATOM 410 CB GLU A 854 -2.050 29.234 64.987 1.00 55.93 C ATOM 411 CG GLU A 854 -2.558 27.834 65.125 1.00 73.24 C ATOM 412 CD GLU A 854 -2.035 27.184 66.379 1.00 85.37 C ATOM 413 OE1 GLU A 854 -0.835 27.373 66.686 1.00 85.73 O ATOM 414 OE2 GLU A 854 -2.824 26.498 67.060 1.00 94.86 O ATOM 415 H GLU A 854 -1.553 31.675 64.663 1.00 0.00 H ATOM 416 N ARG A 855 -4.795 30.657 64.896 1.00 51.04 N ATOM 417 CA ARG A 855 -6.242 30.691 65.073 1.00 56.89 C ATOM 418 C ARG A 855 -6.948 31.250 63.833 1.00 49.43 C ATOM 419 O ARG A 855 -8.086 30.890 63.540 1.00 45.00 O ATOM 420 CB ARG A 855 -6.595 31.522 66.309 1.00 65.50 C ATOM 421 CG ARG A 855 -8.075 31.617 66.610 1.00 75.38 C ATOM 422 CD ARG A 855 -8.334 32.600 67.737 1.00 86.04 C ATOM 423 NE ARG A 855 -9.753 32.922 67.865 1.00 96.36 N ATOM 424 CZ ARG A 855 -10.234 33.878 68.653 1.00101.76 C ATOM 425 NH1 ARG A 855 -9.407 34.615 69.386 1.00102.60 N ATOM 426 NH2 ARG A 855 -11.542 34.102 68.705 1.00103.35 N ATOM 427 HE ARG A 855 -10.430 32.368 67.303 1.00 0.00 H ATOM 428 HH12 ARG A 855 -9.784 35.363 70.002 1.00 0.00 H ATOM 429 HH11 ARG A 855 -8.382 34.444 69.344 1.00 0.00 H ATOM 430 HH22 ARG A 855 -11.917 34.850 69.322 1.00 0.00 H ATOM 431 HH21 ARG A 855 -12.191 33.529 68.129 1.00 0.00 H ATOM 432 H ARG A 855 -4.197 31.222 65.533 1.00 0.00 H ATOM 433 N ALA A 856 -6.263 32.128 63.107 1.00 37.96 N ATOM 434 CA ALA A 856 -6.818 32.735 61.905 1.00 36.35 C ATOM 435 C ALA A 856 -6.557 31.891 60.653 1.00 37.42 C ATOM 436 O ALA A 856 -6.973 32.251 59.554 1.00 38.46 O ATOM 437 CB ALA A 856 -6.253 34.146 61.723 1.00 37.65 C ATOM 438 H ALA A 856 -5.302 32.389 63.406 1.00 0.00 H ATOM 439 N GLY A 857 -5.862 30.771 60.812 1.00 40.49 N ATOM 440 CA GLY A 857 -5.607 29.890 59.686 1.00 41.35 C ATOM 441 C GLY A 857 -4.462 30.341 58.806 1.00 43.80 C ATOM 442 O GLY A 857 -4.365 29.939 57.653 1.00 43.79 O ATOM 443 H GLY A 857 -5.496 30.522 61.753 1.00 0.00 H ATOM 444 N ILE A 858 -3.591 31.182 59.354 1.00 44.15 N ATOM 445 CA ILE A 858 -2.422 31.670 58.632 1.00 35.05 C ATOM 446 C ILE A 858 -1.167 30.931 59.068 1.00 34.40 C ATOM 447 O ILE A 858 -0.929 30.774 60.266 1.00 37.13 O ATOM 448 CB ILE A 858 -2.220 33.181 58.857 1.00 36.05 C ATOM 449 CG1 ILE A 858 -3.503 33.943 58.504 1.00 28.97 C ATOM 450 CG2 ILE A 858 -1.018 33.685 58.059 1.00 32.19 C ATOM 451 CD1 ILE A 858 -3.489 35.404 58.931 1.00 28.45 C ATOM 452 H ILE A 858 -3.749 31.503 60.331 1.00 0.00 H ATOM 453 N PRO A 859 -0.362 30.461 58.100 1.00 35.14 N ATOM 454 CA PRO A 859 0.880 29.774 58.473 1.00 37.44 C ATOM 455 C PRO A 859 1.887 30.681 59.191 1.00 40.43 C ATOM 456 O PRO A 859 1.896 31.906 59.003 1.00 36.08 O ATOM 457 CB PRO A 859 1.438 29.271 57.127 1.00 39.65 C ATOM 458 CG PRO A 859 0.676 29.996 56.066 1.00 40.35 C ATOM 459 CD PRO A 859 -0.650 30.372 56.658 1.00 39.07 C ATOM 460 N THR A 860 2.717 30.061 60.027 1.00 45.19 N ATOM 461 CA THR A 860 3.704 30.768 60.840 1.00 44.51 C ATOM 462 C THR A 860 5.087 30.142 60.709 1.00 47.18 C ATOM 463 O THR A 860 5.213 28.939 60.481 1.00 47.76 O ATOM 464 CB THR A 860 3.326 30.767 62.342 1.00 44.64 C ATOM 465 OG1 THR A 860 3.237 29.415 62.817 1.00 52.99 O ATOM 466 CG2 THR A 860 1.997 31.469 62.575 1.00 38.12 C ATOM 467 HG1 THR A 860 4.111 28.966 62.697 1.00 0.00 H ATOM 468 H THR A 860 2.660 29.025 60.105 1.00 0.00 H ATOM 469 N ARG A 861 6.119 30.969 60.856 1.00 45.42 N ATOM 470 CA ARG A 861 7.500 30.501 60.891 1.00 47.74 C ATOM 471 C ARG A 861 8.260 31.256 61.972 1.00 48.34 C ATOM 472 O ARG A 861 8.148 32.479 62.071 1.00 46.16 O ATOM 473 CB ARG A 861 8.189 30.696 59.538 1.00 47.98 C ATOM 474 CG ARG A 861 7.561 29.943 58.382 1.00 48.07 C ATOM 475 CD ARG A 861 7.750 28.438 58.507 1.00 52.95 C ATOM 476 NE ARG A 861 7.074 27.738 57.418 1.00 55.56 N ATOM 477 CZ ARG A 861 7.617 27.509 56.226 1.00 56.24 C ATOM 478 NH1 ARG A 861 6.923 26.874 55.291 1.00 57.71 N ATOM 479 NH2 ARG A 861 8.854 27.916 55.968 1.00 53.49 N ATOM 480 HE ARG A 861 6.106 27.397 57.586 1.00 0.00 H ATOM 481 HH12 ARG A 861 7.348 26.695 54.359 1.00 0.00 H ATOM 482 HH11 ARG A 861 5.953 26.555 55.490 1.00 0.00 H ATOM 483 HH22 ARG A 861 9.277 27.736 55.035 1.00 0.00 H ATOM 484 HH21 ARG A 861 9.400 28.415 56.699 1.00 0.00 H ATOM 485 H ARG A 861 5.934 31.988 60.950 1.00 0.00 H ATOM 486 N VAL A 862 9.028 30.533 62.781 1.00 48.97 N ATOM 487 CA VAL A 862 9.856 31.162 63.805 1.00 51.65 C ATOM 488 C VAL A 862 11.314 31.118 63.369 1.00 54.44 C ATOM 489 O VAL A 862 11.796 30.084 62.908 1.00 53.87 O ATOM 490 CB VAL A 862 9.690 30.487 65.186 1.00 49.82 C ATOM 491 CG1 VAL A 862 10.743 30.980 66.159 1.00 52.45 C ATOM 492 CG2 VAL A 862 8.305 30.775 65.747 1.00 44.43 C ATOM 493 H VAL A 862 9.039 29.498 62.682 1.00 0.00 H ATOM 494 N ILE A 863 12.000 32.252 63.485 1.00 52.38 N ATOM 495 CA ILE A 863 13.424 32.332 63.162 1.00 61.50 C ATOM 496 C ILE A 863 14.218 32.969 64.307 1.00 68.61 C ATOM 497 O ILE A 863 14.123 34.171 64.527 1.00 69.27 O ATOM 498 CB ILE A 863 13.663 33.150 61.877 1.00 59.42 C ATOM 499 CG1 ILE A 863 12.823 32.607 60.722 1.00 60.73 C ATOM 500 CG2 ILE A 863 15.127 33.137 61.504 1.00 57.16 C ATOM 501 CD1 ILE A 863 13.037 33.347 59.418 1.00 59.34 C ATOM 502 H ILE A 863 11.509 33.107 63.815 1.00 0.00 H ATOM 503 N ASN A 864 15.003 32.179 65.034 1.00 75.71 N ATOM 504 CA ASN A 864 15.747 32.726 66.170 1.00 81.73 C ATOM 505 C ASN A 864 17.163 33.161 65.791 1.00 83.84 C ATOM 506 O ASN A 864 17.803 32.552 64.935 1.00 85.60 O ATOM 507 CB ASN A 864 15.810 31.712 67.314 1.00 83.93 C ATOM 508 CG ASN A 864 16.819 30.614 67.065 1.00 90.89 C ATOM 509 OD1 ASN A 864 16.985 30.147 65.939 1.00 94.44 O ATOM 510 ND2 ASN A 864 17.509 30.200 68.117 1.00 93.80 N ATOM 511 HD22 ASN A 864 17.336 30.623 69.051 1.00 0.00 H ATOM 512 HD21 ASN A 864 18.224 29.452 68.009 1.00 0.00 H ATOM 513 H ASN A 864 15.088 31.170 64.795 1.00 0.00 H ATOM 514 N HIS A 865 17.650 34.213 66.442 1.00 80.17 N ATOM 515 CA HIS A 865 18.966 34.759 66.139 1.00 77.77 C ATOM 516 C HIS A 865 20.087 33.799 66.529 1.00 86.38 C ATOM 517 O HIS A 865 21.192 33.876 65.992 1.00 90.47 O ATOM 518 CB HIS A 865 19.152 36.092 66.836 1.00 73.89 C ATOM 519 H HIS A 865 17.076 34.658 67.187 1.00 0.00 H ATOM 520 N LYS A 866 19.800 32.884 67.451 1.00 87.65 N ATOM 521 CA LYS A 866 20.831 32.000 67.986 1.00 90.21 C ATOM 522 C LYS A 866 21.310 30.960 66.973 1.00 89.42 C ATOM 523 O LYS A 866 22.323 30.296 67.195 1.00 91.68 O ATOM 524 CB LYS A 866 20.330 31.306 69.248 1.00 91.29 C ATOM 525 H LYS A 866 18.823 32.797 67.797 1.00 0.00 H ATOM 526 N LEU A 867 20.595 30.819 65.862 1.00 82.52 N ATOM 527 CA LEU A 867 20.976 29.825 64.862 1.00 77.35 C ATOM 528 C LEU A 867 21.752 30.443 63.695 1.00 79.49 C ATOM 529 O LEU A 867 22.095 29.747 62.732 1.00 79.06 O ATOM 530 CB LEU A 867 19.745 29.097 64.353 1.00 69.86 C ATOM 531 H LEU A 867 19.760 31.419 65.704 1.00 0.00 H ATOM 532 N TYR A 868 22.036 31.743 63.788 1.00 77.92 N ATOM 533 CA TYR A 868 22.714 32.462 62.708 1.00 77.05 C ATOM 534 C TYR A 868 23.913 33.265 63.203 1.00 76.21 C ATOM 535 O TYR A 868 23.897 33.805 64.307 1.00 73.16 O ATOM 536 CB TYR A 868 21.721 33.380 61.980 1.00 72.17 C ATOM 537 CG TYR A 868 20.550 32.610 61.411 1.00 69.34 C ATOM 538 CD1 TYR A 868 20.656 31.945 60.193 1.00 69.97 C ATOM 539 CD2 TYR A 868 19.351 32.517 62.107 1.00 64.80 C ATOM 540 CE1 TYR A 868 19.593 31.220 59.679 1.00 67.38 C ATOM 541 CE2 TYR A 868 18.287 31.797 61.604 1.00 62.84 C ATOM 542 CZ TYR A 868 18.411 31.149 60.391 1.00 65.58 C ATOM 543 OH TYR A 868 17.348 30.431 59.890 1.00 64.97 O ATOM 544 HH TYR A 868 17.601 30.033 59.020 1.00 0.00 H ATOM 545 H TYR A 868 21.769 32.259 64.650 1.00 0.00 H ATOM 546 N LYS A 869 24.952 33.332 62.374 1.00 80.18 N ATOM 547 CA LYS A 869 26.183 34.037 62.724 1.00 80.26 C ATOM 548 C LYS A 869 25.949 35.531 62.909 1.00 81.43 C ATOM 549 O LYS A 869 26.175 36.077 63.988 1.00 84.80 O ATOM 550 CB LYS A 869 27.252 33.818 61.650 1.00 76.13 C ATOM 551 CG LYS A 869 27.749 32.395 61.546 1.00 77.64 C ATOM 552 CD LYS A 869 28.740 32.247 60.401 1.00 83.20 C ATOM 553 CE LYS A 869 29.266 30.826 60.299 1.00 85.32 C ATOM 554 NZ LYS A 869 30.184 30.653 59.137 1.00 90.81 N ATOM 555 HZ1 LYS A 869 29.674 30.875 58.258 1.00 0.00 H ATOM 556 HZ2 LYS A 869 30.996 31.294 59.240 1.00 0.00 H ATOM 557 HZ3 LYS A 869 30.519 29.669 59.105 1.00 0.00 H ATOM 558 H LYS A 869 24.885 32.867 61.446 1.00 0.00 H ATOM 559 N ASN A 870 25.488 36.185 61.849 1.00 77.13 N ATOM 560 CA ASN A 870 25.317 37.632 61.855 1.00 71.98 C ATOM 561 C ASN A 870 23.917 38.066 61.433 1.00 72.27 C ATOM 562 O ASN A 870 23.052 37.235 61.156 1.00 74.79 O ATOM 563 CB ASN A 870 26.351 38.280 60.941 1.00 73.34 C ATOM 564 CG ASN A 870 26.412 37.617 59.581 1.00 76.73 C ATOM 565 OD1 ASN A 870 25.602 37.908 58.702 1.00 78.95 O ATOM 566 ND2 ASN A 870 27.369 36.714 59.402 1.00 79.05 N ATOM 567 HD22 ASN A 870 28.032 36.499 60.174 1.00 0.00 H ATOM 568 HD21 ASN A 870 27.455 36.221 58.490 1.00 0.00 H ATOM 569 H ASN A 870 25.242 35.650 60.992 1.00 0.00 H ATOM 570 N ARG A 871 23.709 39.378 61.375 1.00 66.31 N ATOM 571 CA ARG A 871 22.407 39.945 61.047 1.00 64.12 C ATOM 572 C ARG A 871 21.993 39.660 59.591 1.00 63.08 C ATOM 573 O ARG A 871 20.808 39.461 59.307 1.00 61.69 O ATOM 574 CB ARG A 871 22.416 41.456 61.317 1.00 61.00 C ATOM 575 CG ARG A 871 21.055 42.127 61.204 1.00 55.94 C ATOM 576 CD ARG A 871 21.108 43.599 61.626 1.00 53.96 C ATOM 577 NE ARG A 871 21.629 43.785 62.983 1.00 55.18 N ATOM 578 CZ ARG A 871 20.880 43.845 64.082 1.00 53.81 C ATOM 579 NH1 ARG A 871 19.559 43.733 64.003 1.00 55.02 N ATOM 580 NH2 ARG A 871 21.450 44.017 65.269 1.00 48.89 N ATOM 581 HE ARG A 871 22.659 43.877 63.096 1.00 0.00 H ATOM 582 HH12 ARG A 871 18.981 43.781 64.866 1.00 0.00 H ATOM 583 HH11 ARG A 871 19.103 43.597 63.078 1.00 0.00 H ATOM 584 HH22 ARG A 871 20.863 44.064 66.126 1.00 0.00 H ATOM 585 HH21 ARG A 871 22.484 44.105 65.342 1.00 0.00 H ATOM 586 H ARG A 871 24.502 40.021 61.570 1.00 0.00 H ATOM 587 N VAL A 872 22.963 39.638 58.677 1.00 58.85 N ATOM 588 CA VAL A 872 22.680 39.403 57.260 1.00 56.13 C ATOM 589 C VAL A 872 22.148 37.990 56.997 1.00 59.58 C ATOM 590 O VAL A 872 21.207 37.806 56.216 1.00 59.65 O ATOM 591 CB VAL A 872 23.933 39.650 56.394 1.00 58.43 C ATOM 592 CG1 VAL A 872 23.743 39.101 54.985 1.00 59.83 C ATOM 593 CG2 VAL A 872 24.240 41.130 56.347 1.00 59.73 C ATOM 594 H VAL A 872 23.946 39.792 58.978 1.00 0.00 H ATOM 595 N GLU A 873 22.734 36.994 57.653 1.00 60.65 N ATOM 596 CA GLU A 873 22.286 35.618 57.461 1.00 65.13 C ATOM 597 C GLU A 873 20.911 35.419 58.084 1.00 61.31 C ATOM 598 O GLU A 873 20.090 34.660 57.567 1.00 57.86 O ATOM 599 CB GLU A 873 23.284 34.625 58.051 1.00 72.81 C ATOM 600 CG GLU A 873 24.677 34.705 57.443 1.00 85.52 C ATOM 601 CD GLU A 873 24.697 34.347 55.967 1.00 96.33 C ATOM 602 OE1 GLU A 873 24.044 33.353 55.581 1.00 99.05 O ATOM 603 OE2 GLU A 873 25.371 35.061 55.194 1.00100.91 O ATOM 604 H GLU A 873 23.517 37.196 58.307 1.00 0.00 H ATOM 605 N PHE A 874 20.662 36.104 59.194 1.00 56.36 N ATOM 606 CA PHE A 874 19.337 36.081 59.804 1.00 54.81 C ATOM 607 C PHE A 874 18.278 36.606 58.829 1.00 51.51 C ATOM 608 O PHE A 874 17.253 35.957 58.607 1.00 49.64 O ATOM 609 CB PHE A 874 19.322 36.899 61.097 1.00 59.20 C ATOM 610 CG PHE A 874 17.961 36.989 61.737 1.00 62.90 C ATOM 611 CD1 PHE A 874 17.504 35.982 62.574 1.00 66.02 C ATOM 612 CD2 PHE A 874 17.137 38.076 61.494 1.00 56.04 C ATOM 613 CE1 PHE A 874 16.254 36.058 63.151 1.00 62.97 C ATOM 614 CE2 PHE A 874 15.884 38.157 62.071 1.00 55.02 C ATOM 615 CZ PHE A 874 15.444 37.149 62.900 1.00 56.62 C ATOM 616 H PHE A 874 21.420 36.663 59.634 1.00 0.00 H ATOM 617 N ASP A 875 18.532 37.779 58.250 1.00 50.18 N ATOM 618 CA ASP A 875 17.608 38.381 57.292 1.00 48.76 C ATOM 619 C ASP A 875 17.437 37.516 56.041 1.00 54.68 C ATOM 620 O ASP A 875 16.347 37.458 55.469 1.00 47.27 O ATOM 621 CB ASP A 875 18.072 39.787 56.890 1.00 46.14 C ATOM 622 CG ASP A 875 18.053 40.773 58.055 1.00 50.82 C ATOM 623 OD1 ASP A 875 17.391 40.493 59.082 1.00 49.74 O ATOM 624 OD2 ASP A 875 18.680 41.848 57.930 1.00 49.09 O ATOM 625 H ASP A 875 19.412 38.280 58.487 1.00 0.00 H ATOM 626 N SER A 876 18.505 36.845 55.619 1.00 52.15 N ATOM 627 CA SER A 876 18.420 35.956 54.466 1.00 54.18 C ATOM 628 C SER A 876 17.462 34.807 54.731 1.00 54.10 C ATOM 629 O SER A 876 16.790 34.329 53.821 1.00 54.25 O ATOM 630 CB SER A 876 19.798 35.397 54.092 1.00 62.76 C ATOM 631 OG SER A 876 20.656 36.413 53.608 1.00 68.38 O ATOM 632 HG SER A 876 20.776 37.103 54.308 1.00 0.00 H ATOM 633 H SER A 876 19.411 36.956 56.117 1.00 0.00 H ATOM 634 N ALA A 877 17.417 34.354 55.977 1.00 54.04 N ATOM 635 CA ALA A 877 16.508 33.282 56.349 1.00 54.04 C ATOM 636 C ALA A 877 15.073 33.787 56.271 1.00 50.58 C ATOM 637 O ALA A 877 14.166 33.059 55.866 1.00 53.45 O ATOM 638 CB ALA A 877 16.820 32.770 57.733 1.00 54.86 C ATOM 639 H ALA A 877 18.040 34.771 56.697 1.00 0.00 H ATOM 640 N ILE A 878 14.876 35.043 56.658 1.00 51.12 N ATOM 641 CA ILE A 878 13.577 35.681 56.504 1.00 45.23 C ATOM 642 C ILE A 878 13.232 35.760 55.024 1.00 47.05 C ATOM 643 O ILE A 878 12.165 35.309 54.603 1.00 47.88 O ATOM 644 CB ILE A 878 13.549 37.089 57.118 1.00 42.16 C ATOM 645 CG1 ILE A 878 13.686 37.002 58.635 1.00 41.83 C ATOM 646 CG2 ILE A 878 12.254 37.803 56.751 1.00 39.25 C ATOM 647 CD1 ILE A 878 13.682 38.359 59.322 1.00 40.11 C ATOM 648 H ILE A 878 15.663 35.579 57.078 1.00 0.00 H ATOM 649 N ASP A 879 14.160 36.304 54.240 1.00 46.01 N ATOM 650 CA ASP A 879 13.956 36.496 52.809 1.00 49.50 C ATOM 651 C ASP A 879 13.582 35.198 52.091 1.00 54.61 C ATOM 652 O ASP A 879 12.758 35.203 51.172 1.00 47.56 O ATOM 653 CB ASP A 879 15.207 37.085 52.167 1.00 48.08 C ATOM 654 CG ASP A 879 14.923 37.721 50.826 1.00 47.70 C ATOM 655 OD1 ASP A 879 13.931 38.472 50.712 1.00 47.96 O ATOM 656 OD2 ASP A 879 15.682 37.457 49.874 1.00 54.63 O ATOM 657 H ASP A 879 15.062 36.603 54.663 1.00 0.00 H ATOM 658 N LEU A 880 14.189 34.095 52.510 1.00 50.84 N ATOM 659 CA LEU A 880 13.888 32.804 51.914 1.00 52.99 C ATOM 660 C LEU A 880 12.398 32.496 52.023 1.00 58.21 C ATOM 661 O LEU A 880 11.755 32.105 51.049 1.00 51.22 O ATOM 662 CB LEU A 880 14.714 31.699 52.575 1.00 60.97 C ATOM 663 CG LEU A 880 14.634 30.344 51.871 1.00 68.76 C ATOM 664 CD1 LEU A 880 15.091 30.476 50.429 1.00 60.65 C ATOM 665 CD2 LEU A 880 15.484 29.324 52.607 1.00 62.04 C ATOM 666 H LEU A 880 14.890 34.155 53.276 1.00 0.00 H ATOM 667 N VAL A 881 11.853 32.704 53.214 1.00 54.08 N ATOM 668 CA VAL A 881 10.442 32.456 53.457 1.00 49.08 C ATOM 669 C VAL A 881 9.578 33.427 52.655 1.00 49.74 C ATOM 670 O VAL A 881 8.559 33.037 52.074 1.00 43.92 O ATOM 671 CB VAL A 881 10.121 32.559 54.954 1.00 45.73 C ATOM 672 CG1 VAL A 881 8.626 32.399 55.195 1.00 47.17 C ATOM 673 CG2 VAL A 881 10.907 31.496 55.724 1.00 48.04 C ATOM 674 H VAL A 881 12.449 33.053 53.992 1.00 0.00 H ATOM 675 N LEU A 882 9.997 34.686 52.608 1.00 42.98 N ATOM 676 CA LEU A 882 9.285 35.679 51.826 1.00 42.73 C ATOM 677 C LEU A 882 9.160 35.213 50.375 1.00 50.65 C ATOM 678 O LEU A 882 8.065 35.244 49.799 1.00 49.09 O ATOM 679 CB LEU A 882 9.986 37.033 51.912 1.00 39.89 C ATOM 680 CG LEU A 882 10.032 37.627 53.328 1.00 38.64 C ATOM 681 CD1 LEU A 882 10.576 39.037 53.315 1.00 37.03 C ATOM 682 CD2 LEU A 882 8.665 37.601 53.963 1.00 35.87 C ATOM 683 H LEU A 882 10.847 34.964 53.139 1.00 0.00 H ATOM 684 N GLU A 883 10.270 34.748 49.805 1.00 45.37 N ATOM 685 CA GLU A 883 10.275 34.253 48.426 1.00 47.33 C ATOM 686 C GLU A 883 9.432 32.992 48.259 1.00 50.49 C ATOM 687 O GLU A 883 8.732 32.838 47.254 1.00 49.37 O ATOM 688 CB GLU A 883 11.704 33.987 47.958 1.00 50.50 C ATOM 689 CG GLU A 883 12.512 35.257 47.756 1.00 62.97 C ATOM 690 CD GLU A 883 11.981 36.096 46.615 1.00 66.59 C ATOM 691 OE1 GLU A 883 11.555 35.511 45.594 1.00 71.91 O ATOM 692 OE2 GLU A 883 11.973 37.338 46.746 1.00 65.70 O ATOM 693 H GLU A 883 11.155 34.736 50.352 1.00 0.00 H ATOM 694 N GLU A 884 9.507 32.094 49.239 1.00 49.05 N ATOM 695 CA GLU A 884 8.691 30.883 49.239 1.00 50.41 C ATOM 696 C GLU A 884 7.201 31.204 49.091 1.00 54.93 C ATOM 697 O GLU A 884 6.497 30.562 48.310 1.00 48.04 O ATOM 698 CB GLU A 884 8.921 30.077 50.521 1.00 56.14 C ATOM 699 CG GLU A 884 8.028 28.843 50.644 1.00 61.97 C ATOM 700 CD GLU A 884 8.116 28.160 52.006 1.00 65.61 C ATOM 701 OE1 GLU A 884 8.804 28.680 52.914 1.00 61.75 O ATOM 702 OE2 GLU A 884 7.485 27.093 52.168 1.00 67.99 O ATOM 703 H GLU A 884 10.165 32.260 50.027 1.00 0.00 H ATOM 704 N PHE A 885 6.724 32.206 49.830 1.00 44.98 N ATOM 705 CA PHE A 885 5.306 32.553 49.793 1.00 41.86 C ATOM 706 C PHE A 885 5.000 33.662 48.796 1.00 40.46 C ATOM 707 O PHE A 885 3.908 34.227 48.821 1.00 41.71 O ATOM 708 CB PHE A 885 4.819 32.940 51.197 1.00 39.63 C ATOM 709 CG PHE A 885 4.695 31.766 52.125 1.00 42.70 C ATOM 710 CD1 PHE A 885 5.808 31.258 52.771 1.00 43.44 C ATOM 711 CD2 PHE A 885 3.469 31.142 52.319 1.00 47.30 C ATOM 712 CE1 PHE A 885 5.703 30.156 53.611 1.00 49.87 C ATOM 713 CE2 PHE A 885 3.355 30.043 53.158 1.00 50.45 C ATOM 714 CZ PHE A 885 4.472 29.548 53.803 1.00 52.54 C ATOM 715 H PHE A 885 7.370 32.747 50.440 1.00 0.00 H ATOM 716 N SER A 886 5.961 33.958 47.921 1.00 41.97 N ATOM 717 CA SER A 886 5.785 34.942 46.851 1.00 41.20 C ATOM 718 C SER A 886 5.221 36.272 47.369 1.00 45.78 C ATOM 719 O SER A 886 4.285 36.825 46.794 1.00 36.72 O ATOM 720 CB SER A 886 4.871 34.376 45.752 1.00 41.87 C ATOM 721 OG SER A 886 5.340 33.117 45.286 1.00 51.98 O ATOM 722 HG SER A 886 4.732 32.780 44.581 1.00 0.00 H ATOM 723 H SER A 886 6.875 33.469 48.002 1.00 0.00 H ATOM 724 N ILE A 887 5.809 36.768 48.454 1.00 42.55 N ATOM 725 CA ILE A 887 5.358 37.977 49.129 1.00 34.51 C ATOM 726 C ILE A 887 5.624 39.257 48.342 1.00 34.76 C ATOM 727 O ILE A 887 6.708 39.439 47.778 1.00 35.55 O ATOM 728 CB ILE A 887 6.022 38.084 50.518 1.00 34.11 C ATOM 729 CG1 ILE A 887 5.559 36.929 51.402 1.00 39.37 C ATOM 730 CG2 ILE A 887 5.724 39.424 51.177 1.00 31.59 C ATOM 731 CD1 ILE A 887 4.056 36.785 51.464 1.00 36.27 C ATOM 732 H ILE A 887 6.634 36.266 48.841 1.00 0.00 H ATOM 733 N ASP A 888 4.620 40.134 48.317 1.00 31.72 N ATOM 734 CA ASP A 888 4.710 41.457 47.701 1.00 35.69 C ATOM 735 C ASP A 888 5.049 42.559 48.710 1.00 37.18 C ATOM 736 O ASP A 888 5.797 43.504 48.413 1.00 29.56 O ATOM 737 CB ASP A 888 3.384 41.812 47.022 1.00 33.68 C ATOM 738 CG ASP A 888 3.026 40.854 45.897 1.00 34.52 C ATOM 739 OD1 ASP A 888 3.835 40.702 44.974 1.00 33.35 O ATOM 740 OD2 ASP A 888 1.935 40.250 45.950 1.00 30.81 O ATOM 741 H ASP A 888 3.720 39.861 48.762 1.00 0.00 H ATOM 742 N ILE A 889 4.461 42.455 49.895 1.00 27.81 N ATOM 743 CA ILE A 889 4.572 43.507 50.899 1.00 26.16 C ATOM 744 C ILE A 889 4.884 42.912 52.274 1.00 29.58 C ATOM 745 O ILE A 889 4.316 41.893 52.654 1.00 27.14 O ATOM 746 CB ILE A 889 3.266 44.340 50.973 1.00 28.25 C ATOM 747 CG1 ILE A 889 3.054 45.129 49.674 1.00 30.17 C ATOM 748 CG2 ILE A 889 3.272 45.288 52.189 1.00 22.43 C ATOM 749 CD1 ILE A 889 1.673 45.768 49.585 1.00 26.24 C ATOM 750 H ILE A 889 3.907 41.602 50.113 1.00 0.00 H ATOM 751 N VAL A 890 5.794 43.548 53.003 1.00 25.99 N ATOM 752 CA VAL A 890 6.142 43.134 54.360 1.00 25.94 C ATOM 753 C VAL A 890 5.690 44.172 55.388 1.00 24.09 C ATOM 754 O VAL A 890 6.031 45.350 55.283 1.00 28.20 O ATOM 755 CB VAL A 890 7.668 42.919 54.515 1.00 28.99 C ATOM 756 CG1 VAL A 890 8.005 42.454 55.931 1.00 31.40 C ATOM 757 CG2 VAL A 890 8.170 41.927 53.484 1.00 30.15 C ATOM 758 H VAL A 890 6.277 44.372 52.592 1.00 0.00 H ATOM 759 N CYS A 891 4.912 43.733 56.372 1.00 24.16 N ATOM 760 CA CYS A 891 4.562 44.581 57.504 1.00 23.83 C ATOM 761 C CYS A 891 5.328 44.193 58.782 1.00 26.03 C ATOM 762 O CYS A 891 5.277 43.039 59.211 1.00 25.55 O ATOM 763 CB CYS A 891 3.060 44.511 57.754 1.00 23.62 C ATOM 764 SG CYS A 891 2.056 45.281 56.447 1.00 24.16 S ATOM 765 H CYS A 891 4.544 42.761 56.333 1.00 0.00 H ATOM 766 N LEU A 892 6.038 45.153 59.378 1.00 22.52 N ATOM 767 CA LEU A 892 6.669 44.953 60.684 1.00 24.66 C ATOM 768 C LEU A 892 5.686 45.364 61.788 1.00 22.00 C ATOM 769 O LEU A 892 5.381 46.538 61.948 1.00 21.30 O ATOM 770 CB LEU A 892 7.972 45.756 60.800 1.00 24.59 C ATOM 771 CG LEU A 892 9.008 45.521 59.703 1.00 26.28 C ATOM 772 CD1 LEU A 892 10.350 46.113 60.088 1.00 27.57 C ATOM 773 CD2 LEU A 892 9.129 44.038 59.442 1.00 26.57 C ATOM 774 H LEU A 892 6.146 46.071 58.901 1.00 0.00 H ATOM 775 N ALA A 893 5.172 44.385 62.526 1.00 24.40 N ATOM 776 CA ALA A 893 4.113 44.629 63.507 1.00 26.63 C ATOM 777 C ALA A 893 4.565 44.192 64.899 1.00 27.30 C ATOM 778 O ALA A 893 4.306 43.062 65.333 1.00 27.46 O ATOM 779 CB ALA A 893 2.822 43.898 63.105 1.00 20.12 C ATOM 780 H ALA A 893 5.533 43.417 62.403 1.00 0.00 H ATOM 781 N GLY A 894 5.258 45.092 65.586 1.00 28.96 N ATOM 782 CA GLY A 894 5.889 44.754 66.854 1.00 25.86 C ATOM 783 C GLY A 894 7.128 43.907 66.644 1.00 29.98 C ATOM 784 O GLY A 894 7.567 43.195 67.549 1.00 29.87 O ATOM 785 H GLY A 894 5.352 46.058 65.211 1.00 0.00 H ATOM 786 N PHE A 895 7.691 43.973 65.440 1.00 34.07 N ATOM 787 CA PHE A 895 8.945 43.282 65.152 1.00 33.97 C ATOM 788 C PHE A 895 10.102 44.108 65.702 1.00 35.94 C ATOM 789 O PHE A 895 10.391 45.205 65.211 1.00 36.31 O ATOM 790 CB PHE A 895 9.110 43.056 63.649 1.00 29.29 C ATOM 791 CG PHE A 895 10.275 42.165 63.286 1.00 28.79 C ATOM 792 CD1 PHE A 895 10.224 40.804 63.531 1.00 30.13 C ATOM 793 CD2 PHE A 895 11.405 42.691 62.678 1.00 31.36 C ATOM 794 CE1 PHE A 895 11.290 39.982 63.191 1.00 32.66 C ATOM 795 CE2 PHE A 895 12.472 41.877 62.330 1.00 32.07 C ATOM 796 CZ PHE A 895 12.413 40.523 62.584 1.00 40.55 C ATOM 797 H PHE A 895 7.230 44.527 64.690 1.00 0.00 H ATOM 798 N MET A 896 10.755 43.594 66.734 1.00 34.31 N ATOM 799 CA MET A 896 11.736 44.396 67.459 1.00 36.68 C ATOM 800 C MET A 896 13.163 44.005 67.100 1.00 42.84 C ATOM 801 O MET A 896 13.967 43.682 67.973 1.00 42.91 O ATOM 802 CB MET A 896 11.506 44.275 68.973 1.00 32.99 C ATOM 803 CG MET A 896 10.128 44.780 69.426 1.00 28.11 C ATOM 804 SD MET A 896 9.823 46.521 69.030 1.00 39.41 S ATOM 805 CE MET A 896 10.909 47.323 70.220 1.00 49.17 C ATOM 806 H MET A 896 10.568 42.614 67.029 1.00 0.00 H ATOM 807 N ARG A 897 13.465 44.031 65.803 1.00 43.06 N ATOM 808 CA ARG A 897 14.832 43.852 65.326 1.00 40.60 C ATOM 809 C ARG A 897 15.162 44.862 64.238 1.00 42.06 C ATOM 810 O ARG A 897 14.302 45.237 63.446 1.00 37.08 O ATOM 811 CB ARG A 897 15.052 42.441 64.789 1.00 38.19 C ATOM 812 CG ARG A 897 15.208 41.397 65.854 1.00 47.40 C ATOM 813 CD ARG A 897 15.539 40.070 65.216 1.00 57.35 C ATOM 814 NE ARG A 897 16.742 40.171 64.397 1.00 62.87 N ATOM 815 CZ ARG A 897 17.954 39.823 64.807 1.00 62.19 C ATOM 816 NH1 ARG A 897 18.125 39.332 66.029 1.00 65.58 N ATOM 817 NH2 ARG A 897 18.988 39.956 63.989 1.00 58.62 N ATOM 818 HE ARG A 897 16.643 40.540 63.430 1.00 0.00 H ATOM 819 HH12 ARG A 897 19.075 39.059 66.351 1.00 0.00 H ATOM 820 HH11 ARG A 897 17.309 39.221 66.664 1.00 0.00 H ATOM 821 HH22 ARG A 897 19.940 39.684 64.306 1.00 0.00 H ATOM 822 HH21 ARG A 897 18.847 40.332 63.030 1.00 0.00 H ATOM 823 H ARG A 897 12.704 44.183 65.110 1.00 0.00 H ATOM 824 N ILE A 898 16.414 45.299 64.214 1.00 39.52 N ATOM 825 CA ILE A 898 16.932 46.119 63.130 1.00 40.89 C ATOM 826 C ILE A 898 17.255 45.232 61.938 1.00 42.82 C ATOM 827 O ILE A 898 17.916 44.212 62.095 1.00 44.76 O ATOM 828 CB ILE A 898 18.197 46.873 63.569 1.00 45.15 C ATOM 829 CG1 ILE A 898 17.854 47.850 64.691 1.00 48.61 C ATOM 830 CG2 ILE A 898 18.843 47.586 62.396 1.00 41.92 C ATOM 831 CD1 ILE A 898 19.036 48.637 65.178 1.00 52.92 C ATOM 832 H ILE A 898 17.048 45.046 64.999 1.00 0.00 H ATOM 833 N LEU A 899 16.788 45.611 60.751 1.00 41.25 N ATOM 834 CA LEU A 899 17.093 44.853 59.537 1.00 41.92 C ATOM 835 C LEU A 899 18.336 45.398 58.834 1.00 38.63 C ATOM 836 O LEU A 899 18.569 46.599 58.823 1.00 39.98 O ATOM 837 CB LEU A 899 15.902 44.881 58.583 1.00 39.34 C ATOM 838 CG LEU A 899 14.608 44.352 59.199 1.00 36.53 C ATOM 839 CD1 LEU A 899 13.424 44.918 58.468 1.00 32.80 C ATOM 840 CD2 LEU A 899 14.607 42.832 59.133 1.00 38.21 C ATOM 841 H LEU A 899 16.195 46.463 60.685 1.00 0.00 H ATOM 842 N SER A 900 19.110 44.512 58.227 1.00 41.29 N ATOM 843 CA SER A 900 20.332 44.910 57.527 1.00 44.99 C ATOM 844 C SER A 900 20.070 45.674 56.230 1.00 45.44 C ATOM 845 O SER A 900 18.986 45.585 55.638 1.00 45.51 O ATOM 846 CB SER A 900 21.184 43.676 57.221 1.00 53.45 C ATOM 847 OG SER A 900 20.529 42.822 56.291 1.00 56.42 O ATOM 848 HG SER A 900 19.664 42.525 56.670 1.00 0.00 H ATOM 849 H SER A 900 18.843 43.507 58.248 1.00 0.00 H ATOM 850 N GLY A 901 21.086 46.411 55.787 1.00 44.47 N ATOM 851 CA GLY A 901 21.014 47.223 54.582 1.00 44.42 C ATOM 852 C GLY A 901 20.504 46.556 53.313 1.00 45.10 C ATOM 853 O GLY A 901 19.555 47.045 52.703 1.00 46.26 O ATOM 854 H GLY A 901 21.974 46.406 56.328 1.00 0.00 H ATOM 855 N PRO A 902 21.137 45.452 52.892 1.00 53.32 N ATOM 856 CA PRO A 902 20.723 44.837 51.621 1.00 54.97 C ATOM 857 C PRO A 902 19.289 44.308 51.649 1.00 53.87 C ATOM 858 O PRO A 902 18.571 44.408 50.646 1.00 46.00 O ATOM 859 CB PRO A 902 21.728 43.692 51.434 1.00 52.26 C ATOM 860 CG PRO A 902 22.335 43.467 52.772 1.00 63.95 C ATOM 861 CD PRO A 902 22.335 44.803 53.451 1.00 59.75 C ATOM 862 N PHE A 903 18.878 43.759 52.786 1.00 47.44 N ATOM 863 CA PHE A 903 17.509 43.300 52.944 1.00 43.31 C ATOM 864 C PHE A 903 16.537 44.475 52.824 1.00 42.81 C ATOM 865 O PHE A 903 15.514 44.381 52.141 1.00 41.03 O ATOM 866 CB PHE A 903 17.332 42.598 54.286 1.00 46.30 C ATOM 867 CG PHE A 903 15.948 42.070 54.507 1.00 46.76 C ATOM 868 CD1 PHE A 903 15.597 40.807 54.060 1.00 46.36 C ATOM 869 CD2 PHE A 903 14.987 42.848 55.138 1.00 44.78 C ATOM 870 CE1 PHE A 903 14.320 40.319 54.253 1.00 45.94 C ATOM 871 CE2 PHE A 903 13.707 42.371 55.330 1.00 40.59 C ATOM 872 CZ PHE A 903 13.373 41.104 54.891 1.00 41.51 C ATOM 873 H PHE A 903 19.547 43.656 53.576 1.00 0.00 H ATOM 874 N VAL A 904 16.856 45.578 53.495 1.00 40.36 N ATOM 875 CA VAL A 904 16.038 46.785 53.405 1.00 36.86 C ATOM 876 C VAL A 904 16.008 47.279 51.963 1.00 43.20 C ATOM 877 O VAL A 904 14.955 47.643 51.434 1.00 35.99 O ATOM 878 CB VAL A 904 16.560 47.903 54.332 1.00 41.03 C ATOM 879 CG1 VAL A 904 15.851 49.227 54.038 1.00 35.33 C ATOM 880 CG2 VAL A 904 16.370 47.507 55.783 1.00 35.07 C ATOM 881 H VAL A 904 17.705 45.581 54.096 1.00 0.00 H ATOM 882 N GLN A 905 17.167 47.253 51.316 1.00 40.10 N ATOM 883 CA GLN A 905 17.265 47.723 49.947 1.00 49.71 C ATOM 884 C GLN A 905 16.416 46.862 49.009 1.00 47.61 C ATOM 885 O GLN A 905 15.701 47.389 48.161 1.00 40.53 O ATOM 886 CB GLN A 905 18.726 47.744 49.486 1.00 60.79 C ATOM 887 CG GLN A 905 18.937 48.497 48.178 1.00 72.67 C ATOM 888 CD GLN A 905 18.294 49.878 48.188 1.00 81.15 C ATOM 889 OE1 GLN A 905 18.416 50.632 49.158 1.00 84.06 O ATOM 890 NE2 GLN A 905 17.593 50.210 47.107 1.00 83.49 N ATOM 891 HE22 GLN A 905 17.516 49.544 46.312 1.00 0.00 H ATOM 892 HE21 GLN A 905 17.122 51.136 47.057 1.00 0.00 H ATOM 893 H GLN A 905 18.015 46.891 51.797 1.00 0.00 H ATOM 894 N LYS A 906 16.484 45.544 49.167 1.00 44.03 N ATOM 895 CA LYS A 906 15.679 44.656 48.335 1.00 48.00 C ATOM 896 C LYS A 906 14.179 44.982 48.435 1.00 48.74 C ATOM 897 O LYS A 906 13.467 45.028 47.426 1.00 39.70 O ATOM 898 CB LYS A 906 15.926 43.192 48.707 1.00 44.39 C ATOM 899 CG LYS A 906 15.114 42.230 47.848 1.00 49.86 C ATOM 900 CD LYS A 906 15.324 40.773 48.221 1.00 51.94 C ATOM 901 CE LYS A 906 14.488 39.871 47.315 1.00 57.30 C ATOM 902 NZ LYS A 906 14.615 38.425 47.637 1.00 61.85 N ATOM 903 HZ1 LYS A 906 15.608 38.134 47.535 1.00 0.00 H ATOM 904 HZ2 LYS A 906 14.303 38.260 48.615 1.00 0.00 H ATOM 905 HZ3 LYS A 906 14.023 37.873 46.985 1.00 0.00 H ATOM 906 H LYS A 906 17.116 45.143 49.889 1.00 0.00 H ATOM 907 N TRP A 907 13.703 45.239 49.648 1.00 44.41 N ATOM 908 CA TRP A 907 12.270 45.439 49.855 1.00 38.73 C ATOM 909 C TRP A 907 11.899 46.915 49.883 1.00 37.45 C ATOM 910 O TRP A 907 10.805 47.293 50.328 1.00 32.31 O ATOM 911 CB TRP A 907 11.828 44.729 51.132 1.00 34.02 C ATOM 912 CG TRP A 907 11.949 43.240 50.977 1.00 35.82 C ATOM 913 CD1 TRP A 907 13.038 42.468 51.274 1.00 38.08 C ATOM 914 CD2 TRP A 907 10.963 42.350 50.435 1.00 35.76 C ATOM 915 NE1 TRP A 907 12.779 41.149 50.973 1.00 39.92 N ATOM 916 CE2 TRP A 907 11.514 41.051 50.458 1.00 38.03 C ATOM 917 CE3 TRP A 907 9.662 42.524 49.947 1.00 39.55 C ATOM 918 CZ2 TRP A 907 10.810 39.933 50.005 1.00 42.42 C ATOM 919 CZ3 TRP A 907 8.964 41.412 49.501 1.00 40.16 C ATOM 920 CH2 TRP A 907 9.539 40.135 49.531 1.00 42.03 C ATOM 921 HE1 TRP A 907 13.437 40.356 51.114 1.00 0.00 H ATOM 922 H TRP A 907 14.355 45.298 50.456 1.00 0.00 H ATOM 923 N ASN A 908 12.807 47.746 49.381 1.00 39.11 N ATOM 924 CA ASN A 908 12.566 49.182 49.339 1.00 38.47 C ATOM 925 C ASN A 908 11.234 49.501 48.675 1.00 35.55 C ATOM 926 O ASN A 908 10.973 49.080 47.549 1.00 36.99 O ATOM 927 CB ASN A 908 13.693 49.899 48.596 1.00 37.92 C ATOM 928 CG ASN A 908 13.610 51.403 48.745 1.00 41.87 C ATOM 929 OD1 ASN A 908 13.394 51.909 49.839 1.00 38.26 O ATOM 930 ND2 ASN A 908 13.764 52.123 47.644 1.00 47.62 N ATOM 931 HD22 ASN A 908 13.946 51.651 46.735 1.00 0.00 H ATOM 932 HD21 ASN A 908 13.703 53.160 47.688 1.00 0.00 H ATOM 933 H ASN A 908 13.702 47.365 49.013 1.00 0.00 H ATOM 934 N GLY A 909 10.391 50.237 49.383 1.00 31.77 N ATOM 935 CA GLY A 909 9.086 50.602 48.873 1.00 32.68 C ATOM 936 C GLY A 909 8.055 49.505 49.045 1.00 32.32 C ATOM 937 O GLY A 909 6.920 49.664 48.621 1.00 30.01 O ATOM 938 H GLY A 909 10.674 50.561 50.330 1.00 0.00 H ATOM 939 N LYS A 910 8.447 48.401 49.677 1.00 29.82 N ATOM 940 CA LYS A 910 7.543 47.270 49.856 1.00 32.98 C ATOM 941 C LYS A 910 7.406 46.829 51.319 1.00 33.95 C ATOM 942 O LYS A 910 6.706 45.856 51.618 1.00 32.51 O ATOM 943 CB LYS A 910 8.009 46.082 49.005 1.00 29.50 C ATOM 944 CG LYS A 910 7.896 46.309 47.496 1.00 38.81 C ATOM 945 CD LYS A 910 6.525 46.878 47.136 1.00 55.84 C ATOM 946 CE LYS A 910 5.923 46.217 45.905 1.00 67.22 C ATOM 947 NZ LYS A 910 4.685 45.465 46.262 1.00 66.03 N ATOM 948 HZ1 LYS A 910 4.917 44.729 46.960 1.00 0.00 H ATOM 949 HZ2 LYS A 910 3.987 46.121 46.667 1.00 0.00 H ATOM 950 HZ3 LYS A 910 4.291 45.022 45.407 1.00 0.00 H ATOM 951 H LYS A 910 9.416 48.344 50.050 1.00 0.00 H ATOM 952 N MET A 911 8.065 47.541 52.223 1.00 27.71 N ATOM 953 CA MET A 911 8.069 47.159 53.632 1.00 25.12 C ATOM 954 C MET A 911 7.649 48.318 54.532 1.00 24.02 C ATOM 955 O MET A 911 8.210 49.408 54.457 1.00 25.30 O ATOM 956 CB MET A 911 9.450 46.644 54.028 1.00 27.98 C ATOM 957 CG MET A 911 9.584 46.206 55.483 1.00 30.50 C ATOM 958 SD MET A 911 11.013 45.104 55.674 1.00 37.57 S ATOM 959 CE MET A 911 12.279 45.999 54.773 1.00 30.81 C ATOM 960 H MET A 911 8.589 48.388 51.923 1.00 0.00 H ATOM 961 N LEU A 912 6.654 48.053 55.378 1.00 22.46 N ATOM 962 CA LEU A 912 6.043 49.039 56.261 1.00 20.80 C ATOM 963 C LEU A 912 6.317 48.694 57.721 1.00 22.43 C ATOM 964 O LEU A 912 6.395 47.520 58.080 1.00 22.61 O ATOM 965 CB LEU A 912 4.528 49.109 56.045 1.00 24.26 C ATOM 966 CG LEU A 912 3.929 49.674 54.756 1.00 32.40 C ATOM 967 CD1 LEU A 912 4.265 48.818 53.550 1.00 35.27 C ATOM 968 CD2 LEU A 912 2.419 49.779 54.922 1.00 30.82 C ATOM 969 H LEU A 912 6.290 47.079 55.410 1.00 0.00 H ATOM 970 N ASN A 913 6.460 49.723 58.550 1.00 19.01 N ATOM 971 CA ASN A 913 6.659 49.555 59.975 1.00 18.77 C ATOM 972 C ASN A 913 5.679 50.446 60.733 1.00 21.12 C ATOM 973 O ASN A 913 5.398 51.553 60.284 1.00 22.80 O ATOM 974 CB ASN A 913 8.101 49.901 60.354 1.00 22.98 C ATOM 975 CG ASN A 913 8.357 49.806 61.843 1.00 26.34 C ATOM 976 OD1 ASN A 913 8.169 48.749 62.452 1.00 25.23 O ATOM 977 ND2 ASN A 913 8.823 50.904 62.436 1.00 23.84 N ATOM 978 HD22 ASN A 913 8.966 51.773 61.883 1.00 0.00 H ATOM 979 HD21 ASN A 913 9.044 50.892 63.452 1.00 0.00 H ATOM 980 H ASN A 913 6.428 50.687 58.160 1.00 0.00 H ATOM 981 N ILE A 914 5.150 49.964 61.861 1.00 23.19 N ATOM 982 CA ILE A 914 4.377 50.821 62.773 1.00 23.48 C ATOM 983 C ILE A 914 5.281 51.225 63.957 1.00 22.39 C ATOM 984 O ILE A 914 6.006 50.404 64.530 1.00 21.97 O ATOM 985 CB ILE A 914 3.077 50.120 63.282 1.00 17.96 C ATOM 986 CG1 ILE A 914 2.259 51.038 64.207 1.00 20.33 C ATOM 987 CG2 ILE A 914 3.406 48.838 64.035 1.00 17.02 C ATOM 988 CD1 ILE A 914 1.392 52.055 63.511 1.00 19.15 C ATOM 989 H ILE A 914 5.288 48.961 62.100 1.00 0.00 H ATOM 990 N HIS A 915 5.272 52.508 64.289 1.00 17.27 N ATOM 991 CA HIS A 915 6.095 53.020 65.376 1.00 16.16 C ATOM 992 C HIS A 915 5.223 53.876 66.303 1.00 16.96 C ATOM 993 O HIS A 915 4.460 54.724 65.832 1.00 18.40 O ATOM 994 CB HIS A 915 7.279 53.828 64.830 1.00 20.53 C ATOM 995 CG HIS A 915 8.192 54.361 65.896 1.00 21.35 C ATOM 996 ND1 HIS A 915 9.160 53.592 66.499 1.00 21.80 N ATOM 997 CD2 HIS A 915 8.260 55.581 66.485 1.00 17.51 C ATOM 998 CE1 HIS A 915 9.802 54.317 67.403 1.00 20.40 C ATOM 999 NE2 HIS A 915 9.268 55.526 67.420 1.00 20.51 N ATOM 1000 H HIS A 915 4.663 53.165 63.761 1.00 0.00 H ATOM 1001 N PRO A 916 5.317 53.643 67.626 1.00 19.97 N ATOM 1002 CA PRO A 916 4.395 54.316 68.549 1.00 14.90 C ATOM 1003 C PRO A 916 4.896 55.692 69.002 1.00 17.86 C ATOM 1004 O PRO A 916 4.943 55.983 70.201 1.00 17.33 O ATOM 1005 CB PRO A 916 4.315 53.334 69.724 1.00 14.08 C ATOM 1006 CG PRO A 916 5.721 52.760 69.780 1.00 19.85 C ATOM 1007 CD PRO A 916 6.168 52.658 68.319 1.00 19.00 C ATOM 1008 N SER A 917 5.279 56.533 68.048 1.00 15.02 N ATOM 1009 CA SER A 917 5.419 57.962 68.314 1.00 18.84 C ATOM 1010 C SER A 917 5.044 58.725 67.045 1.00 15.91 C ATOM 1011 O SER A 917 4.830 58.129 65.975 1.00 16.93 O ATOM 1012 CB SER A 917 6.844 58.317 68.759 1.00 14.62 C ATOM 1013 OG SER A 917 7.713 58.256 67.642 1.00 17.21 O ATOM 1014 HG SER A 917 8.633 58.485 67.928 1.00 0.00 H ATOM 1015 H SER A 917 5.483 56.168 67.096 1.00 0.00 H ATOM 1016 N LEU A 918 4.967 60.041 67.160 1.00 18.34 N ATOM 1017 CA LEU A 918 4.891 60.881 65.975 1.00 15.88 C ATOM 1018 C LEU A 918 6.307 61.171 65.502 1.00 18.08 C ATOM 1019 O LEU A 918 6.944 62.135 65.957 1.00 19.09 O ATOM 1020 CB LEU A 918 4.125 62.166 66.273 1.00 13.78 C ATOM 1021 CG LEU A 918 2.647 61.973 66.639 1.00 14.32 C ATOM 1022 CD1 LEU A 918 2.058 63.306 67.057 1.00 13.40 C ATOM 1023 CD2 LEU A 918 1.851 61.405 65.450 1.00 12.29 C ATOM 1024 H LEU A 918 4.961 60.478 68.104 1.00 0.00 H ATOM 1025 N LEU A 919 6.814 60.316 64.611 1.00 16.89 N ATOM 1026 CA LEU A 919 8.134 60.533 64.027 1.00 22.05 C ATOM 1027 C LEU A 919 8.125 61.911 63.384 1.00 19.97 C ATOM 1028 O LEU A 919 7.112 62.304 62.794 1.00 18.74 O ATOM 1029 CB LEU A 919 8.468 59.440 63.004 1.00 20.22 C ATOM 1030 CG LEU A 919 8.679 58.059 63.645 1.00 22.85 C ATOM 1031 CD1 LEU A 919 8.860 56.997 62.580 1.00 19.86 C ATOM 1032 CD2 LEU A 919 9.889 58.095 64.573 1.00 17.60 C ATOM 1033 H LEU A 919 6.260 59.482 64.329 1.00 0.00 H ATOM 1034 N PRO A 920 9.255 62.628 63.442 1.00 18.23 N ATOM 1035 CA PRO A 920 10.582 62.130 63.824 1.00 22.11 C ATOM 1036 C PRO A 920 10.909 62.179 65.325 1.00 23.97 C ATOM 1037 O PRO A 920 12.049 61.898 65.677 1.00 21.43 O ATOM 1038 CB PRO A 920 11.523 63.062 63.045 1.00 25.49 C ATOM 1039 CG PRO A 920 10.797 64.370 63.055 1.00 23.18 C ATOM 1040 CD PRO A 920 9.314 64.013 62.938 1.00 21.20 C ATOM 1041 N SER A 921 9.952 62.506 66.191 1.00 20.65 N ATOM 1042 CA SER A 921 10.198 62.451 67.637 1.00 21.26 C ATOM 1043 C SER A 921 10.324 61.008 68.120 1.00 21.56 C ATOM 1044 O SER A 921 9.635 60.116 67.610 1.00 17.53 O ATOM 1045 CB SER A 921 9.062 63.147 68.419 1.00 16.63 C ATOM 1046 OG SER A 921 9.101 64.557 68.250 1.00 19.32 O ATOM 1047 HG SER A 921 8.362 64.970 68.763 1.00 0.00 H ATOM 1048 H SER A 921 9.020 62.804 65.839 1.00 0.00 H ATOM 1049 N PHE A 922 11.194 60.793 69.106 1.00 20.77 N ATOM 1050 CA PHE A 922 11.230 59.548 69.889 1.00 22.11 C ATOM 1051 C PHE A 922 11.425 58.300 69.039 1.00 20.56 C ATOM 1052 O PHE A 922 10.630 57.356 69.085 1.00 20.66 O ATOM 1053 CB PHE A 922 9.954 59.408 70.720 1.00 17.25 C ATOM 1054 CG PHE A 922 9.597 60.663 71.482 1.00 17.11 C ATOM 1055 CD1 PHE A 922 10.563 61.352 72.194 1.00 17.95 C ATOM 1056 CD2 PHE A 922 8.304 61.177 71.442 1.00 15.97 C ATOM 1057 CE1 PHE A 922 10.249 62.516 72.878 1.00 23.36 C ATOM 1058 CE2 PHE A 922 7.982 62.344 72.126 1.00 17.18 C ATOM 1059 CZ PHE A 922 8.961 63.012 72.846 1.00 18.05 C ATOM 1060 H PHE A 922 11.880 61.541 69.333 1.00 0.00 H ATOM 1061 N LYS A 923 12.475 58.316 68.239 1.00 19.80 N ATOM 1062 CA LYS A 923 12.878 57.130 67.494 1.00 27.10 C ATOM 1063 C LYS A 923 13.399 56.067 68.459 1.00 25.55 C ATOM 1064 O LYS A 923 13.849 56.396 69.552 1.00 23.30 O ATOM 1065 CB LYS A 923 13.954 57.494 66.471 1.00 29.47 C ATOM 1066 CG LYS A 923 13.525 58.562 65.472 1.00 29.19 C ATOM 1067 CD LYS A 923 14.643 58.886 64.475 1.00 34.95 C ATOM 1068 CE LYS A 923 14.188 59.926 63.462 1.00 40.00 C ATOM 1069 NZ LYS A 923 15.247 60.244 62.458 1.00 44.85 N ATOM 1070 HZ1 LYS A 923 16.086 60.616 62.947 1.00 0.00 H ATOM 1071 HZ2 LYS A 923 15.502 59.379 61.939 1.00 0.00 H ATOM 1072 HZ3 LYS A 923 14.888 60.957 61.791 1.00 0.00 H ATOM 1073 H LYS A 923 13.026 59.193 68.138 1.00 0.00 H ATOM 1074 N GLY A 924 13.337 54.799 68.068 1.00 32.48 N ATOM 1075 CA GLY A 924 13.986 53.749 68.841 1.00 30.46 C ATOM 1076 C GLY A 924 13.022 52.787 69.517 1.00 34.20 C ATOM 1077 O GLY A 924 11.822 52.790 69.238 1.00 29.91 O ATOM 1078 H GLY A 924 12.819 54.553 67.200 1.00 0.00 H ATOM 1079 N SER A 925 13.548 51.974 70.429 1.00 30.55 N ATOM 1080 CA SER A 925 12.784 50.865 71.009 1.00 34.65 C ATOM 1081 C SER A 925 11.898 51.214 72.220 1.00 36.54 C ATOM 1082 O SER A 925 11.068 50.389 72.633 1.00 36.29 O ATOM 1083 CB SER A 925 13.745 49.764 71.428 1.00 31.39 C ATOM 1084 OG SER A 925 14.595 50.278 72.435 1.00 34.61 O ATOM 1085 HG SER A 925 15.229 49.574 72.721 1.00 0.00 H ATOM 1086 H SER A 925 14.528 52.129 70.739 1.00 0.00 H ATOM 1087 N ASN A 926 12.087 52.404 72.797 1.00 24.85 N ATOM 1088 CA ASN A 926 11.333 52.817 73.984 1.00 24.28 C ATOM 1089 C ASN A 926 10.614 54.166 73.813 1.00 21.91 C ATOM 1090 O ASN A 926 10.775 55.080 74.635 1.00 21.94 O ATOM 1091 CB ASN A 926 12.276 52.896 75.178 1.00 25.12 C ATOM 1092 CG ASN A 926 13.347 53.945 74.983 1.00 32.56 C ATOM 1093 OD1 ASN A 926 13.615 54.358 73.852 1.00 36.90 O ATOM 1094 ND2 ASN A 926 13.961 54.391 76.077 1.00 31.01 N ATOM 1095 HD22 ASN A 926 13.701 54.013 77.010 1.00 0.00 H ATOM 1096 HD21 ASN A 926 14.701 55.118 75.998 1.00 0.00 H ATOM 1097 H ASN A 926 12.789 53.056 72.392 1.00 0.00 H ATOM 1098 N ALA A 927 9.838 54.301 72.744 1.00 19.06 N ATOM 1099 CA ALA A 927 9.249 55.596 72.411 1.00 18.74 C ATOM 1100 C ALA A 927 8.390 56.153 73.557 1.00 22.27 C ATOM 1101 O ALA A 927 8.501 57.327 73.889 1.00 22.02 O ATOM 1102 CB ALA A 927 8.426 55.498 71.120 1.00 16.72 C ATOM 1103 H ALA A 927 9.648 53.477 72.138 1.00 0.00 H ATOM 1104 N HIS A 928 7.567 55.306 74.177 1.00 21.37 N ATOM 1105 CA HIS A 928 6.666 55.763 75.245 1.00 21.45 C ATOM 1106 C HIS A 928 7.441 56.315 76.447 1.00 21.62 C ATOM 1107 O HIS A 928 7.070 57.354 77.004 1.00 19.85 O ATOM 1108 CB HIS A 928 5.729 54.626 75.689 1.00 18.09 C ATOM 1109 CG HIS A 928 4.760 54.195 74.628 1.00 18.80 C ATOM 1110 ND1 HIS A 928 4.000 55.093 73.910 1.00 17.21 N ATOM 1111 CD2 HIS A 928 4.424 52.963 74.171 1.00 21.10 C ATOM 1112 CE1 HIS A 928 3.241 54.435 73.048 1.00 18.32 C ATOM 1113 NE2 HIS A 928 3.470 53.140 73.195 1.00 21.69 N ATOM 1114 H HIS A 928 7.563 54.304 73.900 1.00 0.00 H ATOM 1115 N GLU A 929 8.521 55.632 76.827 1.00 20.71 N ATOM 1116 CA GLU A 929 9.392 56.101 77.906 1.00 20.12 C ATOM 1117 C GLU A 929 9.947 57.483 77.590 1.00 24.83 C ATOM 1118 O GLU A 929 9.971 58.359 78.450 1.00 19.80 O ATOM 1119 CB GLU A 929 10.559 55.129 78.154 1.00 21.14 C ATOM 1120 CG GLU A 929 10.128 53.795 78.723 1.00 26.96 C ATOM 1121 CD GLU A 929 11.299 52.962 79.231 1.00 34.92 C ATOM 1122 OE1 GLU A 929 12.456 53.267 78.870 1.00 34.00 O ATOM 1123 OE2 GLU A 929 11.059 52.013 80.009 1.00 36.00 O ATOM 1124 H GLU A 929 8.751 54.741 76.343 1.00 0.00 H ATOM 1125 N GLN A 930 10.405 57.659 76.355 1.00 21.02 N ATOM 1126 CA GLN A 930 10.923 58.940 75.907 1.00 24.82 C ATOM 1127 C GLN A 930 9.846 60.029 75.952 1.00 23.11 C ATOM 1128 O GLN A 930 10.091 61.132 76.433 1.00 19.87 O ATOM 1129 CB GLN A 930 11.482 58.821 74.486 1.00 23.70 C ATOM 1130 CG GLN A 930 12.722 57.934 74.360 1.00 25.67 C ATOM 1131 CD GLN A 930 13.205 57.894 72.923 1.00 25.23 C ATOM 1132 OE1 GLN A 930 13.551 58.929 72.362 1.00 24.69 O ATOM 1133 NE2 GLN A 930 13.180 56.712 72.305 1.00 23.16 N ATOM 1134 HE22 GLN A 930 12.879 55.861 72.822 1.00 0.00 H ATOM 1135 HE21 GLN A 930 13.461 56.641 71.306 1.00 0.00 H ATOM 1136 H GLN A 930 10.392 56.858 75.692 1.00 0.00 H ATOM 1137 N ALA A 931 8.662 59.719 75.439 1.00 17.28 N ATOM 1138 CA ALA A 931 7.586 60.704 75.404 1.00 21.08 C ATOM 1139 C ALA A 931 7.208 61.162 76.820 1.00 20.91 C ATOM 1140 O ALA A 931 7.032 62.359 77.071 1.00 21.88 O ATOM 1141 CB ALA A 931 6.379 60.139 74.673 1.00 17.20 C ATOM 1142 H ALA A 931 8.499 58.765 75.058 1.00 0.00 H ATOM 1143 N LEU A 932 7.106 60.214 77.747 1.00 18.77 N ATOM 1144 CA LEU A 932 6.794 60.539 79.141 1.00 20.97 C ATOM 1145 C LEU A 932 7.929 61.315 79.797 1.00 18.80 C ATOM 1146 O LEU A 932 7.692 62.279 80.519 1.00 23.29 O ATOM 1147 CB LEU A 932 6.480 59.256 79.935 1.00 20.32 C ATOM 1148 CG LEU A 932 5.201 58.568 79.420 1.00 22.72 C ATOM 1149 CD1 LEU A 932 4.986 57.183 80.033 1.00 23.42 C ATOM 1150 CD2 LEU A 932 3.971 59.455 79.647 1.00 19.55 C ATOM 1151 H LEU A 932 7.251 59.220 77.476 1.00 0.00 H ATOM 1152 N GLU A 933 9.168 60.905 79.547 1.00 23.25 N ATOM 1153 CA GLU A 933 10.321 61.600 80.133 1.00 23.58 C ATOM 1154 C GLU A 933 10.386 63.049 79.646 1.00 26.86 C ATOM 1155 O GLU A 933 10.663 63.957 80.416 1.00 21.29 O ATOM 1156 CB GLU A 933 11.626 60.870 79.788 1.00 28.09 C ATOM 1157 CG GLU A 933 12.891 61.610 80.165 1.00 40.75 C ATOM 1158 CD GLU A 933 12.960 61.959 81.648 1.00 60.80 C ATOM 1159 OE1 GLU A 933 12.431 61.183 82.476 1.00 66.88 O ATOM 1160 OE2 GLU A 933 13.549 63.013 81.988 1.00 66.63 O ATOM 1161 H GLU A 933 9.323 60.083 78.929 1.00 0.00 H ATOM 1162 N THR A 934 10.110 63.251 78.361 1.00 23.67 N ATOM 1163 CA THR A 934 10.154 64.583 77.752 1.00 27.68 C ATOM 1164 C THR A 934 8.985 65.465 78.207 1.00 25.56 C ATOM 1165 O THR A 934 9.127 66.674 78.322 1.00 27.49 O ATOM 1166 CB THR A 934 10.160 64.472 76.206 1.00 26.53 C ATOM 1167 OG1 THR A 934 11.313 63.729 75.813 1.00 24.97 O ATOM 1168 CG2 THR A 934 10.194 65.864 75.521 1.00 22.25 C ATOM 1169 HG1 THR A 934 11.276 62.826 76.218 1.00 0.00 H ATOM 1170 H THR A 934 9.854 62.436 77.768 1.00 0.00 H ATOM 1171 N GLY A 935 7.835 64.856 78.472 1.00 21.43 N ATOM 1172 CA GLY A 935 6.697 65.594 78.992 1.00 22.62 C ATOM 1173 C GLY A 935 5.772 66.148 77.915 1.00 24.43 C ATOM 1174 O GLY A 935 5.067 67.140 78.147 1.00 20.75 O ATOM 1175 H GLY A 935 7.748 63.833 78.304 1.00 0.00 H ATOM 1176 N VAL A 936 5.764 65.532 76.736 1.00 23.28 N ATOM 1177 CA VAL A 936 4.821 65.967 75.701 1.00 19.80 C ATOM 1178 C VAL A 936 3.401 65.713 76.193 1.00 19.39 C ATOM 1179 O VAL A 936 3.175 64.815 77.015 1.00 16.83 O ATOM 1180 CB VAL A 936 5.029 65.246 74.343 1.00 19.94 C ATOM 1181 CG1 VAL A 936 6.370 65.607 73.732 1.00 16.14 C ATOM 1182 CG2 VAL A 936 4.847 63.720 74.488 1.00 14.98 C ATOM 1183 H VAL A 936 6.421 64.748 76.550 1.00 0.00 H ATOM 1184 N THR A 937 2.450 66.520 75.727 1.00 18.92 N ATOM 1185 CA THR A 937 1.035 66.274 76.026 1.00 20.18 C ATOM 1186 C THR A 937 0.325 65.655 74.815 1.00 15.32 C ATOM 1187 O THR A 937 -0.827 65.209 74.907 1.00 16.20 O ATOM 1188 CB THR A 937 0.312 67.567 76.429 1.00 23.73 C ATOM 1189 OG1 THR A 937 0.351 68.489 75.334 1.00 20.66 O ATOM 1190 CG2 THR A 937 0.987 68.202 77.649 1.00 23.54 C ATOM 1191 HG1 THR A 937 -0.115 69.324 75.591 1.00 0.00 H ATOM 1192 H THR A 937 2.715 67.338 75.142 1.00 0.00 H ATOM 1193 N VAL A 938 1.013 65.646 73.678 1.00 14.02 N ATOM 1194 CA VAL A 938 0.523 64.957 72.488 1.00 13.23 C ATOM 1195 C VAL A 938 1.592 63.978 71.974 1.00 16.90 C ATOM 1196 O VAL A 938 2.733 64.368 71.728 1.00 16.25 O ATOM 1197 CB VAL A 938 0.151 65.937 71.355 1.00 14.78 C ATOM 1198 CG1 VAL A 938 -0.189 65.153 70.074 1.00 16.26 C ATOM 1199 CG2 VAL A 938 -1.036 66.828 71.779 1.00 15.59 C ATOM 1200 H VAL A 938 1.925 66.143 73.635 1.00 0.00 H ATOM 1201 N THR A 939 1.236 62.706 71.851 1.00 12.48 N ATOM 1202 CA THR A 939 2.124 61.748 71.194 1.00 12.81 C ATOM 1203 C THR A 939 1.288 61.132 70.073 1.00 18.62 C ATOM 1204 O THR A 939 0.384 61.788 69.567 1.00 17.39 O ATOM 1205 CB THR A 939 2.702 60.690 72.176 1.00 18.72 C ATOM 1206 OG1 THR A 939 3.692 59.891 71.504 1.00 18.17 O ATOM 1207 CG2 THR A 939 1.592 59.801 72.783 1.00 17.32 C ATOM 1208 HG1 THR A 939 4.056 59.220 72.134 1.00 0.00 H ATOM 1209 H THR A 939 0.319 62.388 72.224 1.00 0.00 H ATOM 1210 N GLY A 940 1.573 59.902 69.670 1.00 18.03 N ATOM 1211 CA GLY A 940 0.838 59.305 68.569 1.00 13.15 C ATOM 1212 C GLY A 940 1.575 58.108 67.991 1.00 17.48 C ATOM 1213 O GLY A 940 2.416 57.530 68.653 1.00 16.90 O ATOM 1214 H GLY A 940 2.325 59.363 70.144 1.00 0.00 H ATOM 1215 N CYS A 941 1.252 57.731 66.758 1.00 14.79 N ATOM 1216 CA CYS A 941 1.908 56.601 66.120 1.00 12.71 C ATOM 1217 C CYS A 941 2.085 56.894 64.639 1.00 17.34 C ATOM 1218 O CYS A 941 1.410 57.755 64.078 1.00 17.11 O ATOM 1219 CB CYS A 941 1.112 55.304 66.327 1.00 15.86 C ATOM 1220 SG CYS A 941 -0.641 55.400 65.806 1.00 17.30 S ATOM 1221 H CYS A 941 0.517 58.254 66.240 1.00 0.00 H ATOM 1222 N THR A 942 2.998 56.163 64.017 1.00 16.67 N ATOM 1223 CA THR A 942 3.422 56.438 62.654 1.00 14.06 C ATOM 1224 C THR A 942 3.567 55.143 61.867 1.00 17.28 C ATOM 1225 O THR A 942 4.214 54.201 62.338 1.00 16.40 O ATOM 1226 CB THR A 942 4.791 57.183 62.637 1.00 13.93 C ATOM 1227 OG1 THR A 942 4.702 58.377 63.425 1.00 13.56 O ATOM 1228 CG2 THR A 942 5.240 57.540 61.186 1.00 15.41 C ATOM 1229 HG1 THR A 942 4.469 58.139 64.357 1.00 0.00 H ATOM 1230 H THR A 942 3.428 55.362 64.523 1.00 0.00 H ATOM 1231 N VAL A 943 2.979 55.093 60.672 1.00 16.03 N ATOM 1232 CA VAL A 943 3.342 54.050 59.718 1.00 15.46 C ATOM 1233 C VAL A 943 4.252 54.650 58.657 1.00 17.56 C ATOM 1234 O VAL A 943 3.917 55.667 58.049 1.00 20.33 O ATOM 1235 CB VAL A 943 2.114 53.407 59.019 1.00 17.82 C ATOM 1236 CG1 VAL A 943 2.584 52.322 58.037 1.00 16.33 C ATOM 1237 CG2 VAL A 943 1.176 52.815 60.031 1.00 16.85 C ATOM 1238 H VAL A 943 2.259 55.800 60.419 1.00 0.00 H ATOM 1239 N HIS A 944 5.393 54.009 58.419 1.00 16.23 N ATOM 1240 CA HIS A 944 6.355 54.505 57.448 1.00 21.18 C ATOM 1241 C HIS A 944 6.965 53.373 56.645 1.00 25.08 C ATOM 1242 O HIS A 944 7.011 52.226 57.104 1.00 18.98 O ATOM 1243 CB HIS A 944 7.471 55.289 58.158 1.00 20.58 C ATOM 1244 CG HIS A 944 8.275 54.463 59.117 1.00 22.42 C ATOM 1245 ND1 HIS A 944 9.473 53.872 58.768 1.00 25.16 N ATOM 1246 CD2 HIS A 944 8.054 54.129 60.414 1.00 21.27 C ATOM 1247 CE1 HIS A 944 9.955 53.210 59.806 1.00 25.97 C ATOM 1248 NE2 HIS A 944 9.118 53.353 60.820 1.00 24.19 N ATOM 1249 H HIS A 944 5.602 53.133 58.939 1.00 0.00 H ATOM 1250 N PHE A 945 7.438 53.698 55.443 1.00 22.19 N ATOM 1251 CA PHE A 945 8.293 52.783 54.711 1.00 27.00 C ATOM 1252 C PHE A 945 9.613 52.589 55.465 1.00 30.07 C ATOM 1253 O PHE A 945 10.166 53.534 56.032 1.00 30.29 O ATOM 1254 CB PHE A 945 8.557 53.299 53.294 1.00 25.55 C ATOM 1255 CG PHE A 945 7.402 53.099 52.353 1.00 26.83 C ATOM 1256 CD1 PHE A 945 7.101 51.839 51.874 1.00 27.00 C ATOM 1257 CD2 PHE A 945 6.624 54.177 51.941 1.00 21.28 C ATOM 1258 CE1 PHE A 945 6.045 51.647 50.990 1.00 25.50 C ATOM 1259 CE2 PHE A 945 5.569 53.998 51.055 1.00 24.02 C ATOM 1260 CZ PHE A 945 5.277 52.726 50.580 1.00 28.44 C ATOM 1261 H PHE A 945 7.192 54.618 55.025 1.00 0.00 H ATOM 1262 N VAL A 946 10.112 51.361 55.469 1.00 28.74 N ATOM 1263 CA VAL A 946 11.380 51.063 56.121 1.00 26.66 C ATOM 1264 C VAL A 946 12.542 51.447 55.208 1.00 31.62 C ATOM 1265 O VAL A 946 12.650 50.962 54.068 1.00 31.37 O ATOM 1266 CB VAL A 946 11.483 49.567 56.494 1.00 26.85 C ATOM 1267 CG1 VAL A 946 12.850 49.246 57.089 1.00 27.79 C ATOM 1268 CG2 VAL A 946 10.363 49.182 57.450 1.00 25.42 C ATOM 1269 H VAL A 946 9.588 50.596 54.998 1.00 0.00 H ATOM 1270 N ALA A 947 13.384 52.348 55.703 1.00 29.23 N ATOM 1271 CA ALA A 947 14.642 52.687 55.047 1.00 34.44 C ATOM 1272 C ALA A 947 15.779 52.143 55.909 1.00 35.16 C ATOM 1273 O ALA A 947 15.539 51.614 56.992 1.00 38.28 O ATOM 1274 CB ALA A 947 14.769 54.193 54.848 1.00 33.32 C ATOM 1275 H ALA A 947 13.137 52.829 56.591 1.00 0.00 H ATOM 1276 N GLU A 948 17.013 52.252 55.435 1.00 36.38 N ATOM 1277 CA GLU A 948 18.123 51.660 56.162 1.00 38.17 C ATOM 1278 C GLU A 948 18.275 52.312 57.538 1.00 40.67 C ATOM 1279 O GLU A 948 18.423 51.621 58.544 1.00 42.12 O ATOM 1280 CB GLU A 948 19.416 51.768 55.357 1.00 43.64 C ATOM 1281 CG GLU A 948 20.551 51.001 55.983 1.00 54.24 C ATOM 1282 CD GLU A 948 21.758 50.883 55.071 1.00 67.73 C ATOM 1283 OE1 GLU A 948 21.666 51.289 53.890 1.00 72.15 O ATOM 1284 OE2 GLU A 948 22.799 50.383 55.545 1.00 69.36 O ATOM 1285 H GLU A 948 17.186 52.760 54.544 1.00 0.00 H ATOM 1286 N ASP A 949 18.239 53.641 57.582 1.00 41.43 N ATOM 1287 CA ASP A 949 18.258 54.348 58.861 1.00 41.87 C ATOM 1288 C ASP A 949 16.942 54.139 59.612 1.00 37.65 C ATOM 1289 O ASP A 949 15.858 54.393 59.081 1.00 32.47 O ATOM 1290 CB ASP A 949 18.527 55.841 58.657 1.00 47.16 C ATOM 1291 CG ASP A 949 19.995 56.139 58.402 1.00 52.57 C ATOM 1292 OD1 ASP A 949 20.854 55.383 58.903 1.00 49.46 O ATOM 1293 OD2 ASP A 949 20.288 57.128 57.700 1.00 58.61 O ATOM 1294 H ASP A 949 18.197 54.183 56.696 1.00 0.00 H ATOM 1295 N VAL A 950 17.057 53.673 60.851 1.00 34.84 N ATOM 1296 CA VAL A 950 15.901 53.259 61.646 1.00 38.20 C ATOM 1297 C VAL A 950 14.908 54.402 61.914 1.00 35.15 C ATOM 1298 O VAL A 950 15.305 55.500 62.305 1.00 36.63 O ATOM 1299 CB VAL A 950 16.366 52.635 62.988 1.00 36.57 C ATOM 1300 CG1 VAL A 950 15.177 52.236 63.845 1.00 34.49 C ATOM 1301 CG2 VAL A 950 17.235 51.426 62.716 1.00 40.94 C ATOM 1302 H VAL A 950 18.005 53.600 61.272 1.00 0.00 H ATOM 1303 N ASP A 951 13.623 54.125 61.671 1.00 29.13 N ATOM 1304 CA ASP A 951 12.540 55.085 61.861 1.00 27.27 C ATOM 1305 C ASP A 951 12.753 56.402 61.104 1.00 33.39 C ATOM 1306 O ASP A 951 12.319 57.457 61.566 1.00 39.26 O ATOM 1307 CB ASP A 951 12.347 55.379 63.359 1.00 28.70 C ATOM 1308 CG ASP A 951 12.091 54.120 64.177 1.00 29.83 C ATOM 1309 OD1 ASP A 951 11.547 53.133 63.619 1.00 29.13 O ATOM 1310 OD2 ASP A 951 12.437 54.117 65.378 1.00 31.10 O ATOM 1311 H ASP A 951 13.382 53.173 61.328 1.00 0.00 H ATOM 1312 N ALA A 952 13.412 56.337 59.946 1.00 30.23 N ATOM 1313 CA ALA A 952 13.697 57.532 59.152 1.00 36.75 C ATOM 1314 C ALA A 952 13.054 57.456 57.765 1.00 32.75 C ATOM 1315 O ALA A 952 13.113 58.410 56.990 1.00 34.44 O ATOM 1316 CB ALA A 952 15.223 57.746 59.022 1.00 33.11 C ATOM 1317 H ALA A 952 13.732 55.411 59.598 1.00 0.00 H ATOM 1318 N GLY A 953 12.431 56.325 57.455 1.00 27.77 N ATOM 1319 CA GLY A 953 11.828 56.140 56.147 1.00 25.71 C ATOM 1320 C GLY A 953 10.616 57.025 55.914 1.00 27.79 C ATOM 1321 O GLY A 953 10.125 57.668 56.833 1.00 21.95 O ATOM 1322 H GLY A 953 12.374 55.561 58.159 1.00 0.00 H ATOM 1323 N GLN A 954 10.114 57.039 54.683 1.00 22.61 N ATOM 1324 CA GLN A 954 9.022 57.942 54.321 1.00 29.56 C ATOM 1325 C GLN A 954 7.696 57.606 55.014 1.00 28.74 C ATOM 1326 O GLN A 954 7.235 56.458 55.031 1.00 22.31 O ATOM 1327 CB GLN A 954 8.839 57.955 52.808 1.00 33.17 C ATOM 1328 CG GLN A 954 9.935 58.728 52.083 1.00 41.57 C ATOM 1329 CD GLN A 954 9.867 60.242 52.329 1.00 49.90 C ATOM 1330 OE1 GLN A 954 8.874 60.893 51.997 1.00 63.40 O ATOM 1331 NE2 GLN A 954 10.921 60.799 52.908 1.00 38.31 N ATOM 1332 HE22 GLN A 954 11.739 60.214 53.173 1.00 0.00 H ATOM 1333 HE21 GLN A 954 10.930 61.821 53.098 1.00 0.00 H ATOM 1334 H GLN A 954 10.505 56.396 53.965 1.00 0.00 H ATOM 1335 N ILE A 955 7.090 58.644 55.573 1.00 22.89 N ATOM 1336 CA ILE A 955 5.908 58.520 56.398 1.00 20.92 C ATOM 1337 C ILE A 955 4.652 58.355 55.545 1.00 21.60 C ATOM 1338 O ILE A 955 4.437 59.080 54.565 1.00 22.33 O ATOM 1339 CB ILE A 955 5.801 59.746 57.333 1.00 22.60 C ATOM 1340 CG1 ILE A 955 6.980 59.722 58.321 1.00 21.49 C ATOM 1341 CG2 ILE A 955 4.423 59.787 58.025 1.00 16.60 C ATOM 1342 CD1 ILE A 955 7.230 61.022 59.087 1.00 21.35 C ATOM 1343 H ILE A 955 7.483 59.593 55.411 1.00 0.00 H ATOM 1344 N ILE A 956 3.834 57.377 55.901 1.00 18.12 N ATOM 1345 CA ILE A 956 2.619 57.108 55.145 1.00 17.62 C ATOM 1346 C ILE A 956 1.414 57.699 55.860 1.00 17.38 C ATOM 1347 O ILE A 956 0.714 58.527 55.295 1.00 19.03 O ATOM 1348 CB ILE A 956 2.419 55.599 54.920 1.00 17.81 C ATOM 1349 CG1 ILE A 956 3.614 55.032 54.135 1.00 19.48 C ATOM 1350 CG2 ILE A 956 1.103 55.327 54.190 1.00 16.47 C ATOM 1351 CD1 ILE A 956 3.664 53.517 54.087 1.00 23.62 C ATOM 1352 H ILE A 956 4.062 56.793 56.731 1.00 0.00 H ATOM 1353 N LEU A 957 1.173 57.272 57.101 1.00 18.27 N ATOM 1354 CA LEU A 957 0.095 57.830 57.912 1.00 19.48 C ATOM 1355 C LEU A 957 0.579 58.080 59.337 1.00 19.58 C ATOM 1356 O LEU A 957 1.485 57.403 59.815 1.00 15.80 O ATOM 1357 CB LEU A 957 -1.119 56.893 57.948 1.00 18.00 C ATOM 1358 CG LEU A 957 -1.885 56.636 56.649 1.00 23.80 C ATOM 1359 CD1 LEU A 957 -2.945 55.560 56.875 1.00 19.87 C ATOM 1360 CD2 LEU A 957 -2.520 57.928 56.143 1.00 19.59 C ATOM 1361 H LEU A 957 1.770 56.521 57.502 1.00 0.00 H ATOM 1362 N GLN A 958 -0.037 59.042 60.013 1.00 17.94 N ATOM 1363 CA GLN A 958 0.186 59.243 61.447 1.00 17.43 C ATOM 1364 C GLN A 958 -1.136 59.522 62.134 1.00 17.13 C ATOM 1365 O GLN A 958 -2.084 59.981 61.496 1.00 14.89 O ATOM 1366 CB GLN A 958 1.149 60.405 61.702 1.00 14.10 C ATOM 1367 CG GLN A 958 2.552 60.171 61.138 1.00 12.95 C ATOM 1368 CD GLN A 958 3.484 61.339 61.382 1.00 17.06 C ATOM 1369 OE1 GLN A 958 3.281 62.436 60.851 1.00 17.38 O ATOM 1370 NE2 GLN A 958 4.505 61.115 62.209 1.00 16.61 N ATOM 1371 HE22 GLN A 958 4.635 60.174 62.632 1.00 0.00 H ATOM 1372 HE21 GLN A 958 5.172 61.881 62.431 1.00 0.00 H ATOM 1373 H GLN A 958 -0.696 59.670 59.511 1.00 0.00 H ATOM 1374 N GLU A 959 -1.212 59.247 63.434 1.00 14.58 N ATOM 1375 CA GLU A 959 -2.378 59.675 64.190 1.00 16.13 C ATOM 1376 C GLU A 959 -1.935 60.155 65.560 1.00 15.33 C ATOM 1377 O GLU A 959 -1.187 59.460 66.253 1.00 14.05 O ATOM 1378 CB GLU A 959 -3.410 58.552 64.331 1.00 15.61 C ATOM 1379 CG GLU A 959 -4.629 58.994 65.184 1.00 21.06 C ATOM 1380 CD GLU A 959 -5.759 57.965 65.216 1.00 30.20 C ATOM 1381 OE1 GLU A 959 -5.884 57.168 64.260 1.00 27.16 O ATOM 1382 OE2 GLU A 959 -6.527 57.954 66.207 1.00 34.19 O ATOM 1383 H GLU A 959 -0.443 58.730 63.906 1.00 0.00 H ATOM 1384 N ALA A 960 -2.401 61.336 65.955 1.00 11.36 N ATOM 1385 CA ALA A 960 -2.028 61.894 67.244 1.00 14.28 C ATOM 1386 C ALA A 960 -2.876 61.297 68.362 1.00 17.99 C ATOM 1387 O ALA A 960 -4.044 60.998 68.168 1.00 15.27 O ATOM 1388 CB ALA A 960 -2.175 63.418 67.226 1.00 12.55 C ATOM 1389 H ALA A 960 -3.042 61.868 65.332 1.00 0.00 H ATOM 1390 N VAL A 961 -2.282 61.169 69.541 1.00 12.54 N ATOM 1391 CA VAL A 961 -2.921 60.596 70.711 1.00 14.94 C ATOM 1392 C VAL A 961 -2.526 61.429 71.926 1.00 16.74 C ATOM 1393 O VAL A 961 -1.341 61.700 72.121 1.00 18.32 O ATOM 1394 CB VAL A 961 -2.478 59.123 70.934 1.00 16.36 C ATOM 1395 CG1 VAL A 961 -3.072 58.589 72.209 1.00 12.81 C ATOM 1396 CG2 VAL A 961 -2.880 58.243 69.746 1.00 16.22 C ATOM 1397 H VAL A 961 -1.300 61.499 69.632 1.00 0.00 H ATOM 1398 N PRO A 962 -3.501 61.853 72.737 1.00 17.87 N ATOM 1399 CA PRO A 962 -3.132 62.701 73.880 1.00 17.44 C ATOM 1400 C PRO A 962 -2.390 61.935 74.979 1.00 19.95 C ATOM 1401 O PRO A 962 -2.633 60.749 75.174 1.00 18.45 O ATOM 1402 CB PRO A 962 -4.490 63.203 74.408 1.00 22.77 C ATOM 1403 CG PRO A 962 -5.470 62.112 73.993 1.00 24.92 C ATOM 1404 CD PRO A 962 -4.961 61.660 72.624 1.00 18.20 C ATOM 1405 N VAL A 963 -1.502 62.617 75.693 1.00 18.31 N ATOM 1406 CA VAL A 963 -0.931 62.057 76.913 1.00 20.50 C ATOM 1407 C VAL A 963 -1.744 62.598 78.090 1.00 24.46 C ATOM 1408 O VAL A 963 -1.954 63.808 78.182 1.00 21.16 O ATOM 1409 CB VAL A 963 0.554 62.429 77.076 1.00 19.24 C ATOM 1410 CG1 VAL A 963 1.109 61.895 78.410 1.00 18.06 C ATOM 1411 CG2 VAL A 963 1.362 61.915 75.899 1.00 19.84 C ATOM 1412 H VAL A 963 -1.209 63.564 75.378 1.00 0.00 H ATOM 1413 N LYS A 964 -2.226 61.714 78.963 1.00 20.35 N ATOM 1414 CA LYS A 964 -2.947 62.155 80.165 1.00 21.89 C ATOM 1415 C LYS A 964 -1.972 62.317 81.331 1.00 19.60 C ATOM 1416 O LYS A 964 -0.997 61.580 81.437 1.00 26.83 O ATOM 1417 CB LYS A 964 -4.043 61.160 80.565 1.00 31.84 C ATOM 1418 CG LYS A 964 -5.054 60.806 79.486 1.00 40.45 C ATOM 1419 CD LYS A 964 -5.897 61.977 79.055 1.00 49.25 C ATOM 1420 CE LYS A 964 -6.958 61.525 78.060 1.00 52.51 C ATOM 1421 NZ LYS A 964 -7.636 62.680 77.398 1.00 57.92 N ATOM 1422 HZ1 LYS A 964 -8.098 63.269 78.120 1.00 0.00 H ATOM 1423 HZ2 LYS A 964 -6.931 63.247 76.885 1.00 0.00 H ATOM 1424 HZ3 LYS A 964 -8.350 62.325 76.730 1.00 0.00 H ATOM 1425 H LYS A 964 -2.090 60.697 78.791 1.00 0.00 H ATOM 1426 N ARG A 965 -2.220 63.283 82.201 1.00 23.47 N ATOM 1427 CA ARG A 965 -1.392 63.425 83.384 1.00 28.53 C ATOM 1428 C ARG A 965 -1.481 62.144 84.216 1.00 26.88 C ATOM 1429 O ARG A 965 -2.558 61.587 84.405 1.00 24.77 O ATOM 1430 CB ARG A 965 -1.818 64.660 84.176 1.00 33.87 C ATOM 1431 CG ARG A 965 -1.683 65.929 83.335 1.00 35.91 C ATOM 1432 CD ARG A 965 -2.069 67.197 84.074 1.00 37.53 C ATOM 1433 NE ARG A 965 -3.504 67.379 84.291 1.00 36.61 N ATOM 1434 CZ ARG A 965 -4.376 67.743 83.353 1.00 35.90 C ATOM 1435 NH1 ARG A 965 -3.983 67.916 82.088 1.00 19.78 N ATOM 1436 NH2 ARG A 965 -5.656 67.903 83.683 1.00 30.00 N ATOM 1437 HE ARG A 965 -3.871 67.212 85.250 1.00 0.00 H ATOM 1438 HH12 ARG A 965 -4.673 68.200 81.363 1.00 0.00 H ATOM 1439 HH11 ARG A 965 -2.987 67.766 81.828 1.00 0.00 H ATOM 1440 HH22 ARG A 965 -6.348 68.187 82.960 1.00 0.00 H ATOM 1441 HH21 ARG A 965 -5.964 67.744 84.664 1.00 0.00 H ATOM 1442 H ARG A 965 -3.009 63.941 82.037 1.00 0.00 H ATOM 1443 N GLY A 966 -0.330 61.668 84.674 1.00 25.73 N ATOM 1444 CA GLY A 966 -0.281 60.436 85.436 1.00 25.77 C ATOM 1445 C GLY A 966 -0.163 59.213 84.539 1.00 23.46 C ATOM 1446 O GLY A 966 -0.160 58.090 85.037 1.00 24.95 O ATOM 1447 H GLY A 966 0.551 62.187 84.483 1.00 0.00 H ATOM 1448 N ASP A 967 -0.080 59.416 83.223 1.00 18.01 N ATOM 1449 CA ASP A 967 0.121 58.300 82.296 1.00 16.21 C ATOM 1450 C ASP A 967 1.385 57.514 82.622 1.00 24.62 C ATOM 1451 O ASP A 967 2.394 58.078 83.016 1.00 19.61 O ATOM 1452 CB ASP A 967 0.217 58.783 80.833 1.00 17.27 C ATOM 1453 CG ASP A 967 -1.088 58.591 80.050 1.00 18.81 C ATOM 1454 OD1 ASP A 967 -1.988 57.851 80.514 1.00 18.20 O ATOM 1455 OD2 ASP A 967 -1.205 59.173 78.954 1.00 18.37 O ATOM 1456 H ASP A 967 -0.159 60.383 82.849 1.00 0.00 H ATOM 1457 N THR A 968 1.324 56.208 82.432 1.00 22.17 N ATOM 1458 CA THR A 968 2.509 55.365 82.492 1.00 21.51 C ATOM 1459 C THR A 968 2.687 54.747 81.122 1.00 22.48 C ATOM 1460 O THR A 968 1.828 54.921 80.261 1.00 20.52 O ATOM 1461 CB THR A 968 2.372 54.249 83.517 1.00 24.47 C ATOM 1462 OG1 THR A 968 1.331 53.356 83.083 1.00 24.37 O ATOM 1463 CG2 THR A 968 2.053 54.816 84.911 1.00 21.98 C ATOM 1464 HG1 THR A 968 1.230 52.624 83.741 1.00 0.00 H ATOM 1465 H THR A 968 0.402 55.769 82.234 1.00 0.00 H ATOM 1466 N VAL A 969 3.777 54.011 80.917 1.00 22.45 N ATOM 1467 CA VAL A 969 3.935 53.246 79.686 1.00 17.71 C ATOM 1468 C VAL A 969 2.705 52.345 79.468 1.00 21.22 C ATOM 1469 O VAL A 969 2.220 52.212 78.344 1.00 21.38 O ATOM 1470 CB VAL A 969 5.245 52.411 79.710 1.00 27.48 C ATOM 1471 CG1 VAL A 969 5.252 51.325 78.613 1.00 21.52 C ATOM 1472 CG2 VAL A 969 6.472 53.348 79.577 1.00 24.68 C ATOM 1473 H VAL A 969 4.523 53.981 81.641 1.00 0.00 H ATOM 1474 N ALA A 970 2.186 51.746 80.542 1.00 22.82 N ATOM 1475 CA ALA A 970 1.044 50.826 80.427 1.00 18.13 C ATOM 1476 C ALA A 970 -0.188 51.531 79.860 1.00 21.54 C ATOM 1477 O ALA A 970 -0.771 51.076 78.879 1.00 21.05 O ATOM 1478 CB ALA A 970 0.709 50.205 81.766 1.00 19.03 C ATOM 1479 H ALA A 970 2.597 51.933 81.479 1.00 0.00 H ATOM 1480 N THR A 971 -0.572 52.648 80.470 1.00 20.08 N ATOM 1481 CA THR A 971 -1.787 53.359 80.060 1.00 15.97 C ATOM 1482 C THR A 971 -1.605 54.113 78.740 1.00 17.79 C ATOM 1483 O THR A 971 -2.509 54.139 77.899 1.00 16.52 O ATOM 1484 CB THR A 971 -2.259 54.357 81.151 1.00 21.02 C ATOM 1485 OG1 THR A 971 -1.248 55.352 81.365 1.00 21.02 O ATOM 1486 CG2 THR A 971 -2.543 53.627 82.462 1.00 20.10 C ATOM 1487 HG1 THR A 971 -1.084 55.841 80.520 1.00 0.00 H ATOM 1488 H THR A 971 0.000 53.025 81.253 1.00 0.00 H ATOM 1489 N LEU A 972 -0.437 54.708 78.536 1.00 19.45 N ATOM 1490 CA LEU A 972 -0.191 55.412 77.276 1.00 17.26 C ATOM 1491 C LEU A 972 -0.118 54.463 76.074 1.00 17.10 C ATOM 1492 O LEU A 972 -0.691 54.754 75.013 1.00 16.05 O ATOM 1493 CB LEU A 972 1.090 56.241 77.371 1.00 18.70 C ATOM 1494 CG LEU A 972 1.391 57.098 76.138 1.00 22.13 C ATOM 1495 CD1 LEU A 972 0.223 58.031 75.839 1.00 16.09 C ATOM 1496 CD2 LEU A 972 2.704 57.888 76.317 1.00 14.44 C ATOM 1497 H LEU A 972 0.301 54.675 79.268 1.00 0.00 H ATOM 1498 N SER A 973 0.565 53.326 76.221 1.00 17.66 N ATOM 1499 CA SER A 973 0.692 52.396 75.103 1.00 18.73 C ATOM 1500 C SER A 973 -0.665 51.782 74.734 1.00 20.59 C ATOM 1501 O SER A 973 -0.920 51.501 73.566 1.00 21.87 O ATOM 1502 CB SER A 973 1.702 51.283 75.407 1.00 19.80 C ATOM 1503 OG SER A 973 1.240 50.447 76.444 1.00 27.29 O ATOM 1504 HG SER A 973 1.104 50.985 77.264 1.00 0.00 H ATOM 1505 H SER A 973 1.008 53.102 77.135 1.00 0.00 H ATOM 1506 N GLU A 974 -1.526 51.597 75.730 1.00 19.53 N ATOM 1507 CA GLU A 974 -2.883 51.102 75.507 1.00 21.36 C ATOM 1508 C GLU A 974 -3.659 52.090 74.633 1.00 21.16 C ATOM 1509 O GLU A 974 -4.303 51.706 73.664 1.00 19.61 O ATOM 1510 CB GLU A 974 -3.587 50.880 76.851 1.00 24.26 C ATOM 1511 CG GLU A 974 -4.971 50.253 76.795 1.00 30.53 C ATOM 1512 CD GLU A 974 -5.610 50.105 78.179 1.00 25.77 C ATOM 1513 OE1 GLU A 974 -5.614 51.084 78.969 1.00 28.17 O ATOM 1514 OE2 GLU A 974 -6.102 48.998 78.484 1.00 31.65 O ATOM 1515 H GLU A 974 -1.223 51.812 76.702 1.00 0.00 H ATOM 1516 N ARG A 975 -3.582 53.371 74.973 1.00 16.77 N ATOM 1517 CA ARG A 975 -4.268 54.397 74.198 1.00 17.17 C ATOM 1518 C ARG A 975 -3.697 54.500 72.775 1.00 20.43 C ATOM 1519 O ARG A 975 -4.444 54.585 71.797 1.00 20.55 O ATOM 1520 CB ARG A 975 -4.177 55.760 74.901 1.00 14.89 C ATOM 1521 CG ARG A 975 -5.198 56.789 74.392 1.00 18.24 C ATOM 1522 CD ARG A 975 -5.127 58.094 75.191 1.00 13.91 C ATOM 1523 NE ARG A 975 -5.223 57.814 76.626 1.00 13.62 N ATOM 1524 CZ ARG A 975 -4.236 58.024 77.487 1.00 17.02 C ATOM 1525 NH1 ARG A 975 -3.080 58.552 77.065 1.00 15.48 N ATOM 1526 NH2 ARG A 975 -4.405 57.707 78.763 1.00 18.75 N ATOM 1527 HE ARG A 975 -6.117 57.428 76.991 1.00 0.00 H ATOM 1528 HH12 ARG A 975 -2.306 58.717 77.740 1.00 0.00 H ATOM 1529 HH11 ARG A 975 -2.956 58.798 76.062 1.00 0.00 H ATOM 1530 HH22 ARG A 975 -3.637 57.868 79.445 1.00 0.00 H ATOM 1531 HH21 ARG A 975 -5.306 57.297 79.082 1.00 0.00 H ATOM 1532 H ARG A 975 -3.023 53.647 75.806 1.00 0.00 H ATOM 1533 N VAL A 976 -2.376 54.485 72.657 1.00 17.73 N ATOM 1534 CA VAL A 976 -1.749 54.642 71.350 1.00 17.49 C ATOM 1535 C VAL A 976 -2.020 53.402 70.470 1.00 17.93 C ATOM 1536 O VAL A 976 -2.218 53.528 69.270 1.00 18.70 O ATOM 1537 CB VAL A 976 -0.231 54.911 71.483 1.00 14.53 C ATOM 1538 CG1 VAL A 976 0.456 54.821 70.127 1.00 12.00 C ATOM 1539 CG2 VAL A 976 0.014 56.309 72.105 1.00 14.11 C ATOM 1540 H VAL A 976 -1.783 54.360 73.502 1.00 0.00 H ATOM 1541 N LYS A 977 -2.076 52.215 71.070 1.00 17.82 N ATOM 1542 CA LYS A 977 -2.388 51.010 70.301 1.00 17.69 C ATOM 1543 C LYS A 977 -3.751 51.091 69.602 1.00 19.95 C ATOM 1544 O LYS A 977 -3.909 50.563 68.505 1.00 20.78 O ATOM 1545 CB LYS A 977 -2.329 49.766 71.191 1.00 18.90 C ATOM 1546 CG LYS A 977 -0.931 49.176 71.279 1.00 24.50 C ATOM 1547 CD LYS A 977 -0.909 47.845 72.021 1.00 32.26 C ATOM 1548 CE LYS A 977 0.527 47.289 72.146 1.00 33.55 C ATOM 1549 NZ LYS A 977 0.562 45.930 72.797 1.00 43.59 N ATOM 1550 HZ1 LYS A 977 0.157 45.994 73.753 1.00 0.00 H ATOM 1551 HZ2 LYS A 977 0.006 45.260 72.228 1.00 0.00 H ATOM 1552 HZ3 LYS A 977 1.547 45.601 72.857 1.00 0.00 H ATOM 1553 H LYS A 977 -1.897 52.144 72.092 1.00 0.00 H ATOM 1554 N LEU A 978 -4.730 51.755 70.211 1.00 16.50 N ATOM 1555 CA LEU A 978 -6.029 51.903 69.545 1.00 22.46 C ATOM 1556 C LEU A 978 -5.869 52.687 68.239 1.00 20.89 C ATOM 1557 O LEU A 978 -6.548 52.416 67.249 1.00 20.97 O ATOM 1558 CB LEU A 978 -7.054 52.590 70.455 1.00 21.32 C ATOM 1559 CG LEU A 978 -7.429 51.853 71.749 1.00 26.31 C ATOM 1560 CD1 LEU A 978 -8.395 52.690 72.578 1.00 26.47 C ATOM 1561 CD2 LEU A 978 -8.013 50.471 71.470 1.00 26.12 C ATOM 1562 H LEU A 978 -4.575 52.167 71.153 1.00 0.00 H ATOM 1563 N ALA A 979 -4.954 53.646 68.229 1.00 15.87 N ATOM 1564 CA ALA A 979 -4.671 54.401 67.006 1.00 13.51 C ATOM 1565 C ALA A 979 -3.859 53.574 66.010 1.00 16.23 C ATOM 1566 O ALA A 979 -4.100 53.619 64.797 1.00 21.50 O ATOM 1567 CB ALA A 979 -3.931 55.697 67.340 1.00 12.15 C ATOM 1568 H ALA A 979 -4.430 53.865 69.100 1.00 0.00 H ATOM 1569 N GLU A 980 -2.895 52.820 66.523 1.00 15.63 N ATOM 1570 CA GLU A 980 -2.103 51.929 65.678 1.00 18.41 C ATOM 1571 C GLU A 980 -2.976 50.983 64.869 1.00 20.31 C ATOM 1572 O GLU A 980 -2.728 50.754 63.675 1.00 17.93 O ATOM 1573 CB GLU A 980 -1.134 51.120 66.525 1.00 16.24 C ATOM 1574 CG GLU A 980 -0.081 51.959 67.264 1.00 17.07 C ATOM 1575 CD GLU A 980 0.905 51.071 68.038 1.00 23.12 C ATOM 1576 OE1 GLU A 980 1.326 51.452 69.150 1.00 26.15 O ATOM 1577 OE2 GLU A 980 1.258 49.984 67.528 1.00 23.91 O ATOM 1578 H GLU A 980 -2.700 52.864 67.544 1.00 0.00 H ATOM 1579 N HIS A 981 -3.997 50.440 65.529 1.00 16.75 N ATOM 1580 CA HIS A 981 -4.881 49.451 64.924 1.00 19.56 C ATOM 1581 C HIS A 981 -5.781 50.076 63.866 1.00 22.03 C ATOM 1582 O HIS A 981 -6.456 49.366 63.124 1.00 20.94 O ATOM 1583 CB HIS A 981 -5.748 48.780 65.990 1.00 17.98 C ATOM 1584 CG HIS A 981 -4.964 48.042 67.026 1.00 22.19 C ATOM 1585 ND1 HIS A 981 -5.489 47.700 68.252 1.00 21.90 N ATOM 1586 CD2 HIS A 981 -3.696 47.559 67.009 1.00 20.57 C ATOM 1587 CE1 HIS A 981 -4.580 47.042 68.950 1.00 20.93 C ATOM 1588 NE2 HIS A 981 -3.484 46.941 68.218 1.00 22.62 N ATOM 1589 H HIS A 981 -4.170 50.732 66.512 1.00 0.00 H ATOM 1590 N LYS A 982 -5.809 51.404 63.827 1.00 18.21 N ATOM 1591 CA LYS A 982 -6.512 52.127 62.779 1.00 19.87 C ATOM 1592 C LYS A 982 -5.594 52.448 61.594 1.00 21.76 C ATOM 1593 O LYS A 982 -5.909 52.126 60.449 1.00 20.47 O ATOM 1594 CB LYS A 982 -7.116 53.418 63.337 1.00 19.46 C ATOM 1595 CG LYS A 982 -8.402 53.202 64.147 1.00 26.93 C ATOM 1596 CD LYS A 982 -8.728 54.427 65.003 1.00 37.92 C ATOM 1597 CE LYS A 982 -8.830 55.694 64.156 1.00 46.87 C ATOM 1598 NZ LYS A 982 -9.060 56.917 64.987 1.00 49.24 N ATOM 1599 HZ1 LYS A 982 -9.948 56.812 65.518 1.00 0.00 H ATOM 1600 HZ2 LYS A 982 -8.269 57.037 65.652 1.00 0.00 H ATOM 1601 HZ3 LYS A 982 -9.122 57.749 64.367 1.00 0.00 H ATOM 1602 H LYS A 982 -5.314 51.942 64.567 1.00 0.00 H ATOM 1603 N ILE A 983 -4.457 53.080 61.850 1.00 14.42 N ATOM 1604 CA ILE A 983 -3.658 53.546 60.723 1.00 19.17 C ATOM 1605 C ILE A 983 -2.824 52.448 60.046 1.00 18.88 C ATOM 1606 O ILE A 983 -2.555 52.546 58.863 1.00 22.14 O ATOM 1607 CB ILE A 983 -2.730 54.724 61.122 1.00 22.70 C ATOM 1608 CG1 ILE A 983 -1.639 54.292 62.107 1.00 19.80 C ATOM 1609 CG2 ILE A 983 -3.569 55.912 61.619 1.00 21.06 C ATOM 1610 CD1 ILE A 983 -0.512 55.354 62.265 1.00 21.45 C ATOM 1611 H ILE A 983 -4.143 53.239 62.829 1.00 0.00 H ATOM 1612 N PHE A 984 -2.432 51.397 60.757 1.00 16.51 N ATOM 1613 CA PHE A 984 -1.660 50.346 60.089 1.00 16.79 C ATOM 1614 C PHE A 984 -2.526 49.628 59.047 1.00 16.86 C ATOM 1615 O PHE A 984 -2.097 49.517 57.913 1.00 19.11 O ATOM 1616 CB PHE A 984 -1.002 49.419 61.140 1.00 15.70 C ATOM 1617 CG PHE A 984 0.220 48.666 60.640 1.00 20.28 C ATOM 1618 CD1 PHE A 984 0.810 48.971 59.416 1.00 18.91 C ATOM 1619 CD2 PHE A 984 0.930 47.854 61.517 1.00 20.36 C ATOM 1620 CE1 PHE A 984 1.975 48.295 58.986 1.00 18.76 C ATOM 1621 CE2 PHE A 984 2.105 47.206 61.124 1.00 20.02 C ATOM 1622 CZ PHE A 984 2.637 47.437 59.857 1.00 17.37 C ATOM 1623 H PHE A 984 -2.668 51.322 61.767 1.00 0.00 H ATOM 1624 N PRO A 985 -3.756 49.197 59.390 1.00 21.37 N ATOM 1625 CA PRO A 985 -4.591 48.681 58.288 1.00 21.53 C ATOM 1626 C PRO A 985 -4.868 49.697 57.172 1.00 20.66 C ATOM 1627 O PRO A 985 -4.922 49.320 55.996 1.00 19.64 O ATOM 1628 CB PRO A 985 -5.901 48.302 58.985 1.00 18.12 C ATOM 1629 CG PRO A 985 -5.497 47.998 60.396 1.00 21.98 C ATOM 1630 CD PRO A 985 -4.399 49.004 60.703 1.00 19.53 C ATOM 1631 N ALA A 986 -5.065 50.963 57.525 1.00 18.07 N ATOM 1632 CA ALA A 986 -5.351 51.954 56.492 1.00 21.12 C ATOM 1633 C ALA A 986 -4.135 52.118 55.568 1.00 23.47 C ATOM 1634 O ALA A 986 -4.290 52.210 54.343 1.00 20.07 O ATOM 1635 CB ALA A 986 -5.743 53.278 57.110 1.00 17.72 C ATOM 1636 H ALA A 986 -5.016 51.244 58.525 1.00 0.00 H ATOM 1637 N ALA A 987 -2.937 52.129 56.156 1.00 20.89 N ATOM 1638 CA ALA A 987 -1.695 52.299 55.399 1.00 23.99 C ATOM 1639 C ALA A 987 -1.394 51.084 54.536 1.00 22.67 C ATOM 1640 O ALA A 987 -0.940 51.228 53.406 1.00 21.53 O ATOM 1641 CB ALA A 987 -0.525 52.571 56.333 1.00 13.73 C ATOM 1642 H ALA A 987 -2.884 52.013 57.188 1.00 0.00 H ATOM 1643 N LEU A 988 -1.629 49.885 55.065 1.00 19.16 N ATOM 1644 CA LEU A 988 -1.429 48.683 54.259 1.00 20.24 C ATOM 1645 C LEU A 988 -2.350 48.714 53.040 1.00 21.91 C ATOM 1646 O LEU A 988 -1.936 48.377 51.926 1.00 19.28 O ATOM 1647 CB LEU A 988 -1.682 47.411 55.077 1.00 18.03 C ATOM 1648 CG LEU A 988 -1.599 46.118 54.264 1.00 20.53 C ATOM 1649 CD1 LEU A 988 -0.236 45.995 53.589 1.00 27.53 C ATOM 1650 CD2 LEU A 988 -1.861 44.893 55.132 1.00 19.35 C ATOM 1651 H LEU A 988 -1.954 49.804 56.050 1.00 0.00 H ATOM 1652 N GLN A 989 -3.600 49.125 53.249 1.00 20.30 N ATOM 1653 CA GLN A 989 -4.557 49.183 52.138 1.00 21.45 C ATOM 1654 C GLN A 989 -4.121 50.221 51.084 1.00 23.77 C ATOM 1655 O GLN A 989 -4.221 49.966 49.891 1.00 22.69 O ATOM 1656 CB GLN A 989 -5.973 49.482 52.662 1.00 19.43 C ATOM 1657 CG GLN A 989 -7.038 49.689 51.565 1.00 22.22 C ATOM 1658 CD GLN A 989 -7.267 48.456 50.687 1.00 27.69 C ATOM 1659 OE1 GLN A 989 -6.913 47.329 51.053 1.00 23.90 O ATOM 1660 NE2 GLN A 989 -7.873 48.670 49.523 1.00 29.39 N ATOM 1661 HE22 GLN A 989 -8.155 49.634 49.253 1.00 0.00 H ATOM 1662 HE21 GLN A 989 -8.065 47.873 48.883 1.00 0.00 H ATOM 1663 H GLN A 989 -3.899 49.406 54.205 1.00 0.00 H ATOM 1664 N LEU A 990 -3.612 51.371 51.519 1.00 21.84 N ATOM 1665 CA LEU A 990 -3.115 52.377 50.566 1.00 22.30 C ATOM 1666 C LEU A 990 -1.988 51.834 49.686 1.00 26.33 C ATOM 1667 O LEU A 990 -1.961 52.078 48.481 1.00 27.98 O ATOM 1668 CB LEU A 990 -2.622 53.623 51.304 1.00 17.11 C ATOM 1669 CG LEU A 990 -3.712 54.507 51.914 1.00 23.59 C ATOM 1670 CD1 LEU A 990 -3.109 55.537 52.874 1.00 22.94 C ATOM 1671 CD2 LEU A 990 -4.510 55.183 50.790 1.00 20.12 C ATOM 1672 H LEU A 990 -3.565 51.561 52.540 1.00 0.00 H ATOM 1673 N VAL A 991 -1.059 51.101 50.298 1.00 22.56 N ATOM 1674 CA VAL A 991 0.095 50.594 49.578 1.00 22.46 C ATOM 1675 C VAL A 991 -0.313 49.412 48.721 1.00 25.95 C ATOM 1676 O VAL A 991 0.063 49.340 47.553 1.00 23.83 O ATOM 1677 CB VAL A 991 1.239 50.185 50.527 1.00 23.56 C ATOM 1678 CG1 VAL A 991 2.373 49.495 49.739 1.00 25.39 C ATOM 1679 CG2 VAL A 991 1.760 51.411 51.289 1.00 22.47 C ATOM 1680 H VAL A 991 -1.163 50.888 51.311 1.00 0.00 H ATOM 1681 N ALA A 992 -1.112 48.502 49.278 1.00 25.02 N ATOM 1682 CA ALA A 992 -1.521 47.316 48.520 1.00 26.72 C ATOM 1683 C ALA A 992 -2.422 47.657 47.335 1.00 22.89 C ATOM 1684 O ALA A 992 -2.452 46.917 46.372 1.00 26.01 O ATOM 1685 CB ALA A 992 -2.222 46.306 49.421 1.00 23.48 C ATOM 1686 H ALA A 992 -1.446 48.634 50.254 1.00 0.00 H ATOM 1687 N SER A 993 -3.173 48.754 47.411 1.00 23.85 N ATOM 1688 CA SER A 993 -4.054 49.111 46.304 1.00 29.20 C ATOM 1689 C SER A 993 -3.293 49.942 45.260 1.00 36.30 C ATOM 1690 O SER A 993 -3.844 50.304 44.225 1.00 30.66 O ATOM 1691 CB SER A 993 -5.283 49.873 46.817 1.00 29.40 C ATOM 1692 OG SER A 993 -4.902 51.082 47.455 1.00 29.87 O ATOM 1693 HG SER A 993 -4.312 50.877 48.223 1.00 0.00 H ATOM 1694 H SER A 993 -3.132 49.356 48.258 1.00 0.00 H ATOM 1695 N GLY A 994 -2.026 50.244 45.538 1.00 29.74 N ATOM 1696 CA GLY A 994 -1.226 51.055 44.636 1.00 35.06 C ATOM 1697 C GLY A 994 -1.569 52.535 44.701 1.00 36.30 C ATOM 1698 O GLY A 994 -1.157 53.313 43.843 1.00 32.72 O ATOM 1699 H GLY A 994 -1.600 49.892 46.419 1.00 0.00 H ATOM 1700 N THR A 995 -2.328 52.926 45.721 1.00 27.82 N ATOM 1701 CA THR A 995 -2.728 54.320 45.891 1.00 29.41 C ATOM 1702 C THR A 995 -1.537 55.172 46.318 1.00 31.32 C ATOM 1703 O THR A 995 -1.386 56.321 45.906 1.00 29.85 O ATOM 1704 CB THR A 995 -3.858 54.448 46.931 1.00 29.47 C ATOM 1705 OG1 THR A 995 -4.973 53.665 46.496 1.00 28.38 O ATOM 1706 CG2 THR A 995 -4.294 55.892 47.086 1.00 29.34 C ATOM 1707 HG1 THR A 995 -4.697 52.718 46.413 1.00 0.00 H ATOM 1708 H THR A 995 -2.645 52.220 46.416 1.00 0.00 H ATOM 1709 N VAL A 996 -0.686 54.580 47.141 1.00 26.17 N ATOM 1710 CA VAL A 996 0.504 55.231 47.649 1.00 28.44 C ATOM 1711 C VAL A 996 1.721 54.397 47.276 1.00 28.26 C ATOM 1712 O VAL A 996 1.669 53.171 47.355 1.00 27.78 O ATOM 1713 CB VAL A 996 0.426 55.408 49.183 1.00 28.68 C ATOM 1714 CG1 VAL A 996 1.803 55.682 49.767 1.00 30.66 C ATOM 1715 CG2 VAL A 996 -0.564 56.524 49.540 1.00 26.61 C ATOM 1716 H VAL A 996 -0.881 53.602 47.437 1.00 0.00 H ATOM 1717 N GLN A 997 2.805 55.049 46.861 1.00 29.43 N ATOM 1718 CA GLN A 997 4.053 54.345 46.602 1.00 30.72 C ATOM 1719 C GLN A 997 5.240 55.222 46.986 1.00 35.03 C ATOM 1720 O GLN A 997 5.107 56.439 47.137 1.00 37.57 O ATOM 1721 CB GLN A 997 4.148 53.926 45.126 1.00 33.54 C ATOM 1722 CG GLN A 997 4.471 55.060 44.173 1.00 49.79 C ATOM 1723 CD GLN A 997 4.571 54.598 42.721 1.00 57.49 C ATOM 1724 OE1 GLN A 997 3.602 54.104 42.148 1.00 60.39 O ATOM 1725 NE2 GLN A 997 5.745 54.761 42.126 1.00 55.63 N ATOM 1726 HE22 GLN A 997 6.539 55.184 42.649 1.00 0.00 H ATOM 1727 HE21 GLN A 997 5.872 54.466 41.137 1.00 0.00 H ATOM 1728 H GLN A 997 2.760 56.078 46.719 1.00 0.00 H ATOM 1729 N LEU A 998 6.401 54.597 47.133 1.00 37.96 N ATOM 1730 CA LEU A 998 7.612 55.299 47.532 1.00 47.87 C ATOM 1731 C LEU A 998 8.099 56.330 46.495 1.00 59.52 C ATOM 1732 O LEU A 998 8.687 57.344 46.862 1.00 68.72 O ATOM 1733 CB LEU A 998 8.717 54.287 47.823 1.00 48.31 C ATOM 1734 CG LEU A 998 9.879 54.820 48.651 1.00 49.21 C ATOM 1735 CD1 LEU A 998 9.335 55.417 49.928 1.00 50.05 C ATOM 1736 CD2 LEU A 998 10.854 53.719 48.961 1.00 50.07 C ATOM 1737 H LEU A 998 6.447 53.573 46.958 1.00 0.00 H ATOM 1738 N GLY A 999 7.867 56.082 45.209 1.00 57.48 N ATOM 1739 CA GLY A 999 8.205 57.063 44.185 1.00 66.72 C ATOM 1740 C GLY A 999 9.694 57.260 43.897 1.00 76.38 C ATOM 1741 O GLY A 999 10.546 57.049 44.767 1.00 77.55 O ATOM 1742 H GLY A 999 7.439 55.176 44.930 1.00 0.00 H ATOM 1743 N GLU A1000 9.995 57.696 42.671 1.00 77.93 N ATOM 1744 CA GLU A1000 11.367 57.789 42.153 1.00 76.41 C ATOM 1745 C GLU A1000 12.314 58.651 42.999 1.00 81.80 C ATOM 1746 O GLU A1000 13.449 58.255 43.269 1.00 82.39 O ATOM 1747 CB GLU A1000 11.336 58.313 40.718 1.00 70.26 C ATOM 1748 H GLU A1000 9.214 57.986 42.048 1.00 0.00 H ATOM 1749 N ASN A1001 11.848 59.829 43.408 1.00 83.24 N ATOM 1750 CA ASN A1001 12.664 60.752 44.197 1.00 81.01 C ATOM 1751 C ASN A1001 12.731 60.375 45.676 1.00 77.61 C ATOM 1752 O ASN A1001 13.333 61.087 46.482 1.00 74.92 O ATOM 1753 CB ASN A1001 12.132 62.181 44.061 1.00 74.86 C ATOM 1754 CG ASN A1001 10.688 62.314 44.519 1.00 68.96 C ATOM 1755 OD1 ASN A1001 10.062 61.343 44.960 1.00 63.45 O ATOM 1756 ND2 ASN A1001 10.154 63.525 44.423 1.00 67.49 N ATOM 1757 HD22 ASN A1001 10.718 64.313 44.046 1.00 0.00 H ATOM 1758 HD21 ASN A1001 9.172 63.686 44.725 1.00 0.00 H ATOM 1759 H ASN A1001 10.875 60.101 43.159 1.00 0.00 H ATOM 1760 N GLY A1002 12.091 59.267 46.034 1.00 78.88 N ATOM 1761 CA GLY A1002 12.153 58.770 47.394 1.00 76.76 C ATOM 1762 C GLY A1002 11.012 59.199 48.295 1.00 75.01 C ATOM 1763 O GLY A1002 10.630 58.447 49.188 1.00 74.83 O ATOM 1764 H GLY A1002 11.535 58.747 45.325 1.00 0.00 H ATOM 1765 N LYS A1003 10.472 60.399 48.074 1.00 75.32 N ATOM 1766 CA LYS A1003 9.357 60.913 48.881 1.00 68.67 C ATOM 1767 C LYS A1003 8.023 60.258 48.499 1.00 57.19 C ATOM 1768 O LYS A1003 7.864 59.784 47.373 1.00 57.52 O ATOM 1769 CB LYS A1003 9.243 62.437 48.749 1.00 71.66 C ATOM 1770 CG LYS A1003 10.157 63.245 49.674 1.00 72.97 C ATOM 1771 CD LYS A1003 11.597 63.299 49.185 1.00 72.03 C ATOM 1772 CE LYS A1003 12.449 64.160 50.109 1.00 75.72 C ATOM 1773 NZ LYS A1003 13.828 64.364 49.573 1.00 84.00 N ATOM 1774 HZ1 LYS A1003 14.297 63.442 49.465 1.00 0.00 H ATOM 1775 HZ2 LYS A1003 13.773 64.837 48.648 1.00 0.00 H ATOM 1776 HZ3 LYS A1003 14.372 64.955 50.234 1.00 0.00 H ATOM 1777 H LYS A1003 10.852 60.989 47.307 1.00 0.00 H ATOM 1778 N ILE A1004 7.071 60.245 49.433 1.00 49.82 N ATOM 1779 CA ILE A1004 5.792 59.558 49.221 1.00 43.57 C ATOM 1780 C ILE A1004 5.078 60.111 47.987 1.00 40.23 C ATOM 1781 O ILE A1004 5.069 61.322 47.745 1.00 40.90 O ATOM 1782 CB ILE A1004 4.854 59.664 50.468 1.00 50.11 C ATOM 1783 CG1 ILE A1004 4.373 58.282 50.885 1.00 47.67 C ATOM 1784 CG2 ILE A1004 3.622 60.503 50.206 1.00 54.01 C ATOM 1785 CD1 ILE A1004 5.486 57.416 51.362 1.00 43.69 C ATOM 1786 H ILE A1004 7.240 60.735 50.335 1.00 0.00 H ATOM 1787 N CYS A1005 4.516 59.205 47.195 1.00 34.32 N ATOM 1788 CA CYS A1005 3.771 59.569 46.000 1.00 36.04 C ATOM 1789 C CYS A1005 2.346 59.020 46.091 1.00 38.99 C ATOM 1790 O CYS A1005 2.144 57.808 46.180 1.00 34.97 O ATOM 1791 CB CYS A1005 4.486 59.039 44.740 1.00 40.73 C ATOM 1792 SG CYS A1005 3.707 59.490 43.154 1.00 54.63 S ATOM 1793 H CYS A1005 4.612 58.198 47.438 1.00 0.00 H ATOM 1794 N TRP A1006 1.363 59.911 46.097 1.00 34.45 N ATOM 1795 CA TRP A1006 -0.031 59.495 46.021 1.00 34.64 C ATOM 1796 C TRP A1006 -0.444 59.396 44.555 1.00 44.01 C ATOM 1797 O TRP A1006 -0.796 60.400 43.935 1.00 43.94 O ATOM 1798 CB TRP A1006 -0.947 60.466 46.780 1.00 34.07 C ATOM 1799 CG TRP A1006 -0.912 60.278 48.277 1.00 35.48 C ATOM 1800 CD1 TRP A1006 0.121 60.586 49.115 1.00 33.87 C ATOM 1801 CD2 TRP A1006 -1.960 59.756 49.109 1.00 34.95 C ATOM 1802 NE1 TRP A1006 -0.216 60.280 50.417 1.00 35.96 N ATOM 1803 CE2 TRP A1006 -1.487 59.772 50.439 1.00 37.12 C ATOM 1804 CE3 TRP A1006 -3.250 59.277 48.859 1.00 37.04 C ATOM 1805 CZ2 TRP A1006 -2.256 59.323 51.513 1.00 36.93 C ATOM 1806 CZ3 TRP A1006 -4.014 58.835 49.930 1.00 31.16 C ATOM 1807 CH2 TRP A1006 -3.514 58.859 51.237 1.00 29.13 C ATOM 1808 HE1 TRP A1006 0.396 60.414 51.247 1.00 0.00 H ATOM 1809 H TRP A1006 1.592 60.924 46.157 1.00 0.00 H ATOM 1810 N VAL A1007 -0.390 58.176 44.020 1.00 50.09 N ATOM 1811 CA VAL A1007 -0.674 57.887 42.611 1.00 61.67 C ATOM 1812 C VAL A1007 -2.133 58.166 42.214 1.00 70.69 C ATOM 1813 O VAL A1007 -2.441 58.349 41.035 1.00 75.39 O ATOM 1814 CB VAL A1007 -0.311 56.412 42.287 1.00 58.67 C ATOM 1815 CG1 VAL A1007 -0.446 56.114 40.804 1.00 69.80 C ATOM 1816 CG2 VAL A1007 1.111 56.125 42.734 1.00 49.85 C ATOM 1817 H VAL A1007 -0.131 57.382 44.639 1.00 0.00 H ATOM 1818 N LYS A1008 -3.027 58.219 43.194 1.00 77.30 N ATOM 1819 CA LYS A1008 -4.415 58.572 42.917 1.00 84.23 C ATOM 1820 C LYS A1008 -4.867 59.783 43.735 1.00 88.32 C ATOM 1821 O LYS A1008 -4.805 60.922 43.260 1.00 88.84 O ATOM 1822 CB LYS A1008 -5.326 57.372 43.178 1.00 80.14 C ATOM 1823 CG LYS A1008 -5.178 56.279 42.128 1.00 80.30 C ATOM 1824 CD LYS A1008 -4.901 54.914 42.741 1.00 75.68 C ATOM 1825 CE LYS A1008 -4.711 53.857 41.653 1.00 73.86 C ATOM 1826 NZ LYS A1008 -4.493 52.490 42.204 1.00 68.13 N ATOM 1827 HZ1 LYS A1008 -3.640 52.489 42.799 1.00 0.00 H ATOM 1828 HZ2 LYS A1008 -5.316 52.213 42.776 1.00 0.00 H ATOM 1829 HZ3 LYS A1008 -4.371 51.817 41.420 1.00 0.00 H ATOM 1830 H LYS A1008 -2.735 58.007 44.169 1.00 0.00 H TER 1831 LYS A1008 HETATM 1832 O HOH 1 10.129 51.530 65.123 1.00 23.82 O HETATM 1833 O HOH 2 -8.670 48.528 62.826 1.00 36.94 O HETATM 1834 O HOH 3 1.897 50.986 46.177 1.00 37.88 O HETATM 1835 O HOH 4 13.329 53.654 58.302 1.00 26.60 O HETATM 1836 O HOH 5 -8.211 51.420 59.605 1.00 24.41 O HETATM 1837 O HOH 6 15.158 59.358 70.417 1.00 40.52 O HETATM 1838 O HOH 7 -0.361 31.345 52.929 1.00 39.53 O HETATM 1839 O HOH 8 -6.633 46.025 53.240 1.00 38.81 O HETATM 1840 O HOH 9 8.963 50.571 80.345 1.00 31.41 O HETATM 1841 O HOH 10 -6.737 35.308 65.320 1.00 34.98 O HETATM 1842 O HOH 11 3.819 38.244 44.128 1.00 43.36 O HETATM 1843 O HOH 12 12.014 52.644 52.173 1.00 34.25 O HETATM 1844 O HOH 13 17.227 53.069 52.961 1.00 43.64 O HETATM 1845 O HOH 14 1.473 51.737 71.748 1.00 20.20 O HETATM 1846 O HOH 15 -7.491 39.335 51.644 1.00 26.33 O HETATM 1847 O HOH 16 4.657 62.994 78.228 1.00 24.05 O HETATM 1848 O HOH 17 4.552 57.592 72.490 1.00 19.07 O HETATM 1849 O HOH 18 10.026 57.791 81.035 1.00 24.96 O HETATM 1850 O HOH 19 -8.774 46.012 61.748 1.00 29.33 O HETATM 1851 O HOH 20 0.629 39.283 43.854 1.00 36.56 O HETATM 1852 O HOH 21 11.983 46.860 46.193 1.00 39.08 O HETATM 1853 O HOH 22 -3.531 65.747 77.254 1.00 35.88 O HETATM 1854 O HOH 23 6.580 65.417 68.487 1.00 16.34 O HETATM 1855 O HOH 24 3.885 49.904 72.470 1.00 28.99 O HETATM 1856 O HOH 25 -5.430 46.504 55.605 1.00 19.31 O HETATM 1857 O HOH 26 12.543 48.662 52.676 1.00 33.70 O HETATM 1858 O HOH 27 -0.617 65.519 79.777 1.00 28.42 O HETATM 1859 O HOH 28 -6.266 59.532 68.592 1.00 32.06 O HETATM 1860 O HOH 29 0.801 57.479 87.481 1.00 40.03 O HETATM 1861 O HOH 30 6.242 47.855 65.377 1.00 27.27 O HETATM 1862 O HOH 31 -6.508 56.115 70.969 1.00 26.82 O HETATM 1863 O HOH 32 5.293 68.668 80.361 1.00 29.28 O HETATM 1864 O HOH 33 1.566 42.742 66.001 1.00 19.59 O HETATM 1865 O HOH 34 -5.161 53.693 78.426 1.00 19.61 O HETATM 1866 O HOH 35 18.135 55.153 55.326 1.00 45.80 O HETATM 1867 O HOH 36 -8.729 50.798 67.409 1.00 27.86 O HETATM 1868 O HOH 37 8.296 46.575 64.085 1.00 27.45 O HETATM 1869 O HOH 38 -8.169 48.216 68.414 1.00 30.21 O HETATM 1870 O HOH 39 17.413 41.461 61.644 1.00 42.02 O HETATM 1871 O HOH 40 4.357 42.976 71.534 1.00 32.38 O HETATM 1872 O HOH 41 -6.103 43.931 67.587 1.00 27.67 O HETATM 1873 O HOH 42 -6.732 53.136 53.465 1.00 25.33 O HETATM 1874 O HOH 43 -5.289 49.137 73.467 1.00 27.94 O HETATM 1875 O HOH 44 -2.180 69.510 75.745 1.00 19.49 O HETATM 1876 O HOH 45 5.313 61.215 69.638 1.00 13.51 O HETATM 1877 O HOH 46 -2.508 47.145 63.037 1.00 22.46 O HETATM 1878 O HOH 47 -7.870 57.290 77.259 1.00 39.64 O HETATM 1879 O HOH 48 -3.701 35.594 71.603 1.00 37.96 O HETATM 1880 O HOH 49 6.731 43.333 70.202 1.00 28.14 O HETATM 1881 O HOH 50 -3.054 66.871 74.687 1.00 26.86 O HETATM 1882 O HOH 51 10.262 49.763 52.130 1.00 31.05 O HETATM 1883 O HOH 52 14.039 61.276 73.798 1.00 30.13 O HETATM 1884 O HOH 53 9.372 52.223 70.521 1.00 24.65 O HETATM 1885 O HOH 54 6.324 51.789 46.875 1.00 35.85 O HETATM 1886 O HOH 55 4.535 41.613 67.743 1.00 33.72 O HETATM 1887 O HOH 56 -6.318 55.884 79.765 1.00 33.11 O HETATM 1888 O HOH 57 2.365 65.270 79.686 1.00 27.50 O HETATM 1889 O HOH 58 -3.198 39.342 46.236 1.00 31.11 O HETATM 1890 O HOH 59 -5.573 37.953 54.891 1.00 28.71 O HETATM 1891 O HOH 60 17.305 57.789 62.276 1.00 45.05 O HETATM 1892 O HOH 61 -14.978 45.787 52.331 1.00 22.22 O HETATM 1893 O HOH 62 8.093 41.000 45.843 1.00 36.82 O HETATM 1894 O HOH 63 5.162 63.880 70.323 1.00 20.89 O HETATM 1895 O HOH 64 14.190 60.929 57.835 1.00 40.20 O HETATM 1896 O HOH 65 13.056 62.822 69.919 1.00 24.80 O HETATM 1897 O HOH 66 7.861 52.227 73.043 1.00 40.27 O HETATM 1898 O HOH 67 13.610 61.476 60.430 1.00 34.49 O HETATM 1899 O HOH 68 -4.171 62.927 64.305 1.00 17.15 O HETATM 1900 O HOH 69 -4.486 61.600 61.742 1.00 38.37 O HETATM 1901 O HOH 70 -6.347 46.296 44.425 1.00 40.20 O HETATM 1902 O HOH 71 13.137 41.220 69.312 1.00 36.54 O HETATM 1903 O HOH 72 0.792 60.686 53.299 1.00 28.30 O HETATM 1904 O HOH 73 -0.258 47.990 75.826 1.00 38.16 O HETATM 1905 O HOH 74 -7.712 51.526 48.827 1.00 47.00 O HETATM 1906 O HOH 75 14.401 60.534 68.463 1.00 34.67 O HETATM 1907 O HOH 76 11.547 55.257 52.823 1.00 30.17 O HETATM 1908 O HOH 77 -9.430 46.705 54.479 1.00 41.85 O HETATM 1909 O HOH 78 -4.714 64.781 81.607 1.00 32.66 O HETATM 1910 O HOH 79 -3.609 47.545 77.669 1.00 30.64 O HETATM 1911 O HOH 80 11.267 60.179 60.824 1.00 32.45 O HETATM 1912 O HOH 81 -7.495 55.994 68.313 1.00 34.55 O HETATM 1913 O HOH 82 9.985 59.448 82.995 1.00 32.03 O HETATM 1914 O HOH 83 2.490 27.053 60.441 1.00 53.90 O HETATM 1915 O HOH 84 3.344 37.276 73.859 1.00 41.84 O HETATM 1916 O HOH 85 13.302 61.437 76.191 1.00 39.19 O HETATM 1917 O HOH 86 -3.791 58.112 83.044 1.00 41.67 O HETATM 1918 O HOH 87 -1.411 68.134 80.317 1.00 26.82 O HETATM 1919 O HOH 88 24.919 32.178 59.391 1.00 48.44 O HETATM 1920 O HOH 89 8.460 52.584 75.856 1.00 20.66 O HETATM 1921 O HOH 90 8.292 61.099 83.525 1.00 38.10 O HETATM 1922 O HOH 91 -5.464 43.371 45.007 1.00 34.66 O HETATM 1923 O HOH 92 11.760 41.664 71.365 1.00 47.24 O HETATM 1924 O HOH 93 -5.707 34.421 51.918 1.00 46.71 O HETATM 1925 O HOH 94 -6.974 53.466 76.147 1.00 29.76 O HETATM 1926 O HOH 95 -8.534 50.124 56.760 1.00 39.30 O HETATM 1927 O HOH 96 -4.233 64.734 70.541 1.00 26.04 O HETATM 1928 O HOH 97 2.803 67.645 81.061 1.00 26.12 O HETATM 1929 O HOH 98 5.788 61.185 83.570 1.00 35.50 O HETATM 1930 O HOH 99 -5.495 33.919 69.861 1.00 42.36 O HETATM 1931 O HOH 100 -5.708 56.306 82.108 1.00 45.33 O HETATM 1932 O HOH 101 -4.081 41.590 71.973 1.00 46.26 O HETATM 1933 O HOH 102 -8.250 51.046 75.983 1.00 36.11 O HETATM 1934 O HOH 103 -7.651 49.241 74.895 1.00 43.45 O HETATM 1935 O HOH 104 -7.595 36.911 52.706 1.00 32.62 O HETATM 1936 O HOH 105 3.864 63.199 80.914 1.00 43.62 O HETATM 1937 O HOH 106 8.597 42.379 71.930 1.00 39.43 O HETATM 1938 O HOH 107 -2.839 68.647 78.217 1.00 27.61 O HETATM 1939 O HOH 108 -3.027 47.734 75.368 1.00 42.33 O HETATM 1940 O HOH 109 -8.566 55.460 75.659 1.00 38.54 O HETATM 1941 O HOH 110 13.701 63.563 72.325 1.00 32.08 O HETATM 1942 O HOH 111 14.143 59.074 77.859 1.00 43.68 O HETATM 1943 O HOH 112 8.246 51.350 44.927 1.00 44.72 O HETATM 1944 O HOH 113 -7.433 53.204 50.916 1.00 35.05 O HETATM 1945 O HOH 114 -8.581 51.724 54.847 1.00 37.65 O HETATM 1946 O HOH 115 -10.621 51.928 68.705 1.00 39.36 O HETATM 1947 O HOH 116 -7.321 39.742 69.733 1.00 46.99 O HETATM 1948 O HOH 117 -6.412 58.673 71.323 1.00 37.15 O HETATM 1949 O HOH 118 -5.678 41.431 69.759 1.00 41.05 O HETATM 1950 O HOH 119 -8.054 59.780 73.131 1.00 41.28 O HETATM 1951 N1 G A 71 15.260 48.260 60.604 1.00 -0.29 N HETATM 1952 C2 G A 71 15.682 49.163 59.713 1.00 0.23 C HETATM 1953 N3 G A 71 14.991 50.297 59.517 1.00 -0.19 N HETATM 1954 C4 G A 71 13.861 50.577 60.198 1.00 0.20 C HETATM 1955 C8 G A 71 13.394 49.643 61.133 1.00 0.02 C HETATM 1956 C7 G A 71 12.308 49.546 62.015 1.00 -0.08 C HETATM 1957 C6 G A 71 12.445 48.325 62.689 1.00 0.03 C HETATM 1958 N5 G A 71 13.548 47.715 62.235 1.00 -0.28 N HETATM 1959 C9 G A 71 14.141 48.469 61.315 1.00 0.08 C HETATM 1960 H2 G A 71 13.887 46.796 62.553 1.00 0.23 H HETATM 1961 C29 G A 71 11.536 47.787 63.743 1.00 -0.00 C HETATM 1962 C30 G A 71 12.207 47.786 65.088 1.00 -0.04 C HETATM 1963 C31 G A 71 12.689 49.148 65.487 1.00 -0.04 C HETATM 1964 C32 G A 71 12.807 49.277 66.981 1.00 -0.00 C HETATM 1965 C16 G A 71 14.129 48.754 67.437 1.00 0.02 C HETATM 1966 S12 G A 71 14.489 47.155 67.828 1.00 -0.02 S HETATM 1967 C13 G A 71 16.108 47.320 68.228 1.00 0.09 C HETATM 1968 C14 G A 71 16.402 48.686 68.052 1.00 -0.07 C HETATM 1969 C15 G A 71 15.306 49.499 67.614 1.00 -0.07 C HETATM 1970 H7 G A 71 15.378 50.571 67.439 1.00 0.03 H HETATM 1971 H6 G A 71 17.394 49.096 68.236 1.00 0.05 H HETATM 1972 C17 G A 71 17.037 46.224 68.645 1.00 0.20 C HETATM 1973 O18 G A 71 18.204 46.486 68.889 1.00 -0.40 O HETATM 1974 N19 G A 71 16.567 44.868 68.707 1.00 -0.27 N HETATM 1975 C20 G A 71 17.426 43.777 69.061 1.00 0.09 C HETATM 1976 C21 G A 71 16.595 42.592 69.440 1.00 -0.01 C HETATM 1977 C22 G A 71 17.004 42.049 70.769 1.00 0.00 C HETATM 1978 C23 G A 71 15.831 41.451 71.481 1.00 0.04 C HETATM 1979 O24 G A 71 15.669 40.203 71.516 1.00 -0.57 O HETATM 1980 O25 G A 71 14.998 42.197 72.061 1.00 -0.57 O HETATM 1981 H12 G A 71 17.419 42.864 71.380 1.00 0.04 H HETATM 1982 H13 G A 71 17.770 41.274 70.622 1.00 0.04 H HETATM 1983 H10 G A 71 16.719 41.808 68.678 1.00 0.03 H HETATM 1984 H11 G A 71 15.538 42.895 69.486 1.00 0.03 H HETATM 1985 C26 G A 71 18.274 43.433 67.869 1.00 0.06 C HETATM 1986 O27 G A 71 19.204 42.587 67.971 1.00 -0.57 O HETATM 1987 O28 G A 71 18.071 43.982 66.747 1.00 -0.57 O HETATM 1988 H9 G A 71 18.068 44.065 69.906 1.00 0.07 H HETATM 1989 H8 G A 71 15.608 44.679 68.496 1.00 0.19 H HETATM 1990 H20 G A 71 12.718 50.336 67.263 1.00 0.05 H HETATM 1991 H21 G A 71 12.002 48.701 67.461 1.00 0.05 H HETATM 1992 H18 G A 71 11.977 49.901 65.119 1.00 0.03 H HETATM 1993 H19 G A 71 13.676 49.324 65.034 1.00 0.03 H HETATM 1994 H16 G A 71 13.068 47.103 65.053 1.00 0.03 H HETATM 1995 H17 G A 71 11.488 47.431 65.841 1.00 0.03 H HETATM 1996 H14 G A 71 11.254 46.757 63.482 1.00 0.04 H HETATM 1997 H15 G A 71 10.633 48.413 63.793 1.00 0.04 H HETATM 1998 H3 G A 71 11.513 50.278 62.150 1.00 0.02 H HETATM 1999 O10 G A 71 13.208 51.768 59.948 1.00 -0.41 O HETATM 2000 H1 G A 71 15.335 50.976 58.823 1.00 0.25 H HETATM 2001 N11 G A 71 16.874 48.920 58.967 1.00 -0.28 N HETATM 2002 H4 G A 71 17.406 48.051 59.115 1.00 0.19 H HETATM 2003 H5 G A 71 17.202 49.614 58.280 1.00 0.19 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1951 1952 1959 CONECT 1952 1951 1953 2001 CONECT 1953 1952 1954 2000 CONECT 1954 1953 1955 1999 CONECT 1955 1954 1956 1959 CONECT 1956 1955 1957 1998 CONECT 1957 1956 1958 1961 CONECT 1958 1957 1959 1960 CONECT 1959 1951 1955 1958 CONECT 1960 1958 CONECT 1961 1957 1962 1996 1997 CONECT 1962 1961 1963 1994 1995 CONECT 1963 1962 1964 1992 1993 CONECT 1964 1963 1965 1990 1991 CONECT 1965 1964 1966 1969 CONECT 1966 1965 1967 CONECT 1967 1966 1968 1972 CONECT 1968 1967 1969 1971 CONECT 1969 1965 1968 1970 CONECT 1970 1969 CONECT 1971 1968 CONECT 1972 1967 1973 1974 CONECT 1973 1972 CONECT 1974 1972 1975 1989 CONECT 1975 1974 1976 1985 1988 CONECT 1976 1975 1977 1983 1984 CONECT 1977 1976 1978 1981 1982 CONECT 1978 1977 1979 1980 CONECT 1979 1978 CONECT 1980 1978 CONECT 1981 1977 CONECT 1982 1977 CONECT 1983 1976 CONECT 1984 1976 CONECT 1985 1975 1986 1987 CONECT 1986 1985 CONECT 1987 1985 CONECT 1988 1975 CONECT 1989 1974 CONECT 1990 1964 CONECT 1991 1964 CONECT 1992 1963 CONECT 1993 1963 CONECT 1994 1962 CONECT 1995 1962 CONECT 1996 1961 CONECT 1997 1961 CONECT 1998 1956 CONECT 1999 1954 CONECT 2000 1953 CONECT 2001 1952 2002 2003 CONECT 2002 2001 CONECT 2003 2001 MASTER 0 0 0 0 0 0 0 0 2002 1 57 16 END
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Related entries of code: 4zyv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1njs
RCSB PDB
PDBbind
209aa, >1NJS_1|Chains... at 100%
4ew2
RCSB PDB
PDBbind
209aa, >4EW2_1|Chain... at 100%
4ew3
RCSB PDB
PDBbind
209aa, >4EW3_1|Chain... at 100%
4zyt
RCSB PDB
PDBbind
210aa, >4ZYT_1|Chain... *
4zyu
RCSB PDB
PDBbind
210aa, >4ZYU_1|Chain... at 100%
4zyw
RCSB PDB
PDBbind
210aa, >4ZYW_1|Chain... at 100%
4zyx
RCSB PDB
PDBbind
210aa, >4ZYX_1|Chain... at 100%
4zyy
RCSB PDB
PDBbind
210aa, >4ZYY_1|Chain... at 100%
4zyz
RCSB PDB
PDBbind
210aa, >4ZYZ_1|Chain... at 100%
4zz0
RCSB PDB
PDBbind
210aa, >4ZZ0_1|Chain... at 100%
4zz1
RCSB PDB
PDBbind
210aa, >4ZZ1_1|Chain... at 100%
4zz2
RCSB PDB
PDBbind
210aa, >4ZZ2_1|Chain... at 100%
4zz3
RCSB PDB
PDBbind
210aa, >4ZZ3_1|Chain... at 100%
5j9f
RCSB PDB
PDBbind
210aa, >5J9F_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4zyv
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
glycinamide ribonucleotide (GAR) formyltransferase
Ligand Name
G71
EC.Number
E.C.-.-.-.-
Resolution
2.05(Å)
Affinity (Kd/Ki/IC50)
Ki=22nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Biochemistry Vol. 55: pp. 4574-4582
Ligand Properties
Formula
C
2
0
H
2
3
N
5
O
6
S
Molecular Weight
461.492
Exact Mass
461.137
No. of atoms
55
No. of bonds
57
Polar Surface Area
219.5
LOGP Value
3.35 (
Computed with XLOGP3
)
2.48 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 3
Canonical SMILES
OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(s1)CCCCc1[nH]c2c(c1)c(=O)[nH]c(n2)N
InChI String
InChI=1S/C20H23N5O6S/c21-20-24-16-12(17(28)25-20)9-10(22-16)3-1-2-4-11-5-7-14(32-11)18(29)23-13(19(30)31)6-8-15(26)27/h5,7,9,13H,1-4,6,8H2,(H,23,29)(H,26,27)(H,30,31)(H4,21,22,24,25,28)/t13-/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):
P22102
Entrez Gene ID
NCBI Entrez Gene ID:
2618
ASD
Information of known allosteric effects of PDB entries
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