USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1287 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 80 THR OG1 : rot -111:sc= -0.226 USER MOD Set 1.2: A 109 HIS : +bothHN:sc= -1.41 K(o=-1.6,f=-4.4!) USER MOD Set 2.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 THR N :NH3+ 163:sc= -2.15 (180deg=-2.98!) USER MOD Single : A 1 THR OG1 : rot 101:sc= 0.866 USER MOD Single : A 4 SER OG : rot -105:sc= 0.237 USER MOD Single : A 7 LYS NZ :NH3+ -176:sc= 0.846 (180deg=0.834) USER MOD Single : A 13 SER OG : rot 64:sc= 0.229 USER MOD Single : A 15 SER OG : rot 180:sc= -0.41 USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 0.52 (180deg=0.482) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-0.87) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0538 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 85:sc= 0.166 USER MOD Single : A 64 TYR OH : rot 35:sc= 0.167 USER MOD Single : A 65 MET CE :methyl -139:sc= -0.119 (180deg=-0.548) USER MOD Single : A 71 THR OG1 : rot 87:sc= 0.544 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.198 X(o=-0.2,f=-0.34) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HE2:sc= 0.154 K(o=0.15,f=-2.5) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 144:sc= -0.441 USER MOD Single : A 111 THR OG1 : rot 70:sc= 0.0232 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 121 THR OG1 : rot 1:sc= 0.497 USER MOD Single : A 123 MET CE :methyl 134:sc= -0.918 (180deg=-2.2) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= -1.72! USER MOD Single : A 131 SER OG : rot -175:sc= 0.0428 USER MOD Single : A 134 GLN : amide:sc= 0.119 K(o=0.12,f=-3.7!) USER MOD Single : A 135 MET CE :methyl -155:sc= -0.0417 (180deg=-1.41) USER MOD Single : A 136 GLN : amide:sc= -0.467 X(o=-0.47,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 147:sc= 0.313 (180deg=0.035) USER MOD Single : A 138 MET CE :methyl -128:sc= -0.374 (180deg=-1.83!) USER MOD Single : A 141 MET CE :methyl -163:sc= -0.0754 (180deg=-0.435) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 MET CE :methyl 180:sc= -0.114 (180deg=-0.114) USER MOD Single : A 153 GLN :FLIP amide:sc= -0.0024 F(o=-0.72,f=-0.0024) USER MOD Single : A 159 SER OG : rot -40:sc= 0.164 USER MOD Single : A 163 ASN : amide:sc= 0.0259 X(o=0.026,f=-0.29) USER MOD Single : A 167 HIS : +bothHN:sc= 0.359 K(o=0.36,f=-2.1) USER MOD Single : A 168 HIS : no HE2:sc= -1.54 K(o=-1.5,f=-4.1!) USER MOD Single : A 169 HIS : no HD1:sc= -0.136 K(o=-0.14,f=-0.76) USER MOD Single : A 170 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 171 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 172 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.572 2.172 -6.216 1.00 52.50 N ATOM 2 CA THR A 1 -11.751 2.069 -7.683 1.00 72.15 C ATOM 3 C THR A 1 -11.084 0.795 -8.248 1.00 22.23 C ATOM 4 O THR A 1 -11.770 -0.199 -8.495 1.00 11.31 O ATOM 5 CB THR A 1 -11.237 3.351 -8.409 1.00 23.13 C ATOM 6 OG1 THR A 1 -11.788 4.513 -7.767 1.00 75.34 O ATOM 7 CG2 THR A 1 -11.620 3.357 -9.898 1.00 70.44 C ATOM 0 H1 THR A 1 -11.766 3.147 -5.910 1.00 52.50 H new ATOM 0 H2 THR A 1 -12.230 1.522 -5.740 1.00 52.50 H new ATOM 0 H3 THR A 1 -10.594 1.919 -5.967 1.00 52.50 H new ATOM 0 HA THR A 1 -12.821 1.988 -7.876 1.00 72.15 H new ATOM 0 HB THR A 1 -10.149 3.361 -8.345 1.00 23.13 H new ATOM 0 HG1 THR A 1 -11.118 4.906 -7.170 1.00 75.34 H new ATOM 0 HG21 THR A 1 -11.244 4.266 -10.367 1.00 70.44 H new ATOM 0 HG22 THR A 1 -11.183 2.488 -10.390 1.00 70.44 H new ATOM 0 HG23 THR A 1 -12.705 3.321 -9.995 1.00 70.44 H new ATOM 17 N VAL A 2 -9.738 0.835 -8.414 1.00 0.34 N ATOM 18 CA VAL A 2 -8.947 -0.237 -9.081 1.00 53.25 C ATOM 19 C VAL A 2 -9.432 -0.471 -10.539 1.00 54.35 C ATOM 20 O VAL A 2 -10.376 -1.225 -10.794 1.00 54.22 O ATOM 21 CB VAL A 2 -8.901 -1.594 -8.273 1.00 22.44 C ATOM 22 CG1 VAL A 2 -8.046 -2.659 -9.012 1.00 2.52 C ATOM 23 CG2 VAL A 2 -8.371 -1.367 -6.840 1.00 2.04 C ATOM 0 H VAL A 2 -9.166 1.614 -8.088 1.00 0.34 H new ATOM 0 HA VAL A 2 -7.920 0.129 -9.108 1.00 53.25 H new ATOM 0 HB VAL A 2 -9.921 -1.972 -8.203 1.00 22.44 H new ATOM 0 HG11 VAL A 2 -8.033 -3.582 -8.432 1.00 2.52 H new ATOM 0 HG12 VAL A 2 -8.477 -2.854 -9.994 1.00 2.52 H new ATOM 0 HG13 VAL A 2 -7.027 -2.290 -9.130 1.00 2.52 H new ATOM 0 HG21 VAL A 2 -8.349 -2.317 -6.305 1.00 2.04 H new ATOM 0 HG22 VAL A 2 -7.364 -0.953 -6.886 1.00 2.04 H new ATOM 0 HG23 VAL A 2 -9.026 -0.670 -6.316 1.00 2.04 H new ATOM 33 N VAL A 3 -8.790 0.227 -11.482 1.00 21.11 N ATOM 34 CA VAL A 3 -9.119 0.156 -12.929 1.00 50.33 C ATOM 35 C VAL A 3 -8.239 -0.874 -13.682 1.00 14.43 C ATOM 36 O VAL A 3 -8.619 -1.346 -14.761 1.00 22.24 O ATOM 37 CB VAL A 3 -8.998 1.581 -13.602 1.00 41.54 C ATOM 38 CG1 VAL A 3 -10.205 2.483 -13.229 1.00 40.02 C ATOM 39 CG2 VAL A 3 -7.664 2.268 -13.207 1.00 32.01 C ATOM 0 H VAL A 3 -8.021 0.864 -11.272 1.00 21.11 H new ATOM 0 HA VAL A 3 -10.152 -0.184 -13.003 1.00 50.33 H new ATOM 0 HB VAL A 3 -9.005 1.438 -14.682 1.00 41.54 H new ATOM 0 HG11 VAL A 3 -10.093 3.456 -13.707 1.00 40.02 H new ATOM 0 HG12 VAL A 3 -11.128 2.015 -13.571 1.00 40.02 H new ATOM 0 HG13 VAL A 3 -10.242 2.612 -12.147 1.00 40.02 H new ATOM 0 HG21 VAL A 3 -7.604 3.247 -13.683 1.00 32.01 H new ATOM 0 HG22 VAL A 3 -7.623 2.387 -12.124 1.00 32.01 H new ATOM 0 HG23 VAL A 3 -6.827 1.653 -13.536 1.00 32.01 H new ATOM 49 N SER A 4 -7.070 -1.219 -13.110 1.00 44.21 N ATOM 50 CA SER A 4 -6.129 -2.201 -13.709 1.00 61.50 C ATOM 51 C SER A 4 -5.237 -2.838 -12.621 1.00 40.33 C ATOM 52 O SER A 4 -4.893 -2.186 -11.635 1.00 12.12 O ATOM 53 CB SER A 4 -5.241 -1.515 -14.775 1.00 53.44 C ATOM 54 OG SER A 4 -4.319 -2.418 -15.363 1.00 63.00 O ATOM 0 H SER A 4 -6.747 -0.830 -12.224 1.00 44.21 H new ATOM 0 HA SER A 4 -6.717 -2.986 -14.184 1.00 61.50 H new ATOM 0 HB2 SER A 4 -5.874 -1.087 -15.552 1.00 53.44 H new ATOM 0 HB3 SER A 4 -4.697 -0.690 -14.316 1.00 53.44 H new ATOM 0 HG SER A 4 -3.421 -2.245 -15.011 1.00 63.00 H new ATOM 60 N VAL A 5 -4.893 -4.131 -12.798 1.00 34.22 N ATOM 61 CA VAL A 5 -3.913 -4.849 -11.938 1.00 71.12 C ATOM 62 C VAL A 5 -2.878 -5.575 -12.835 1.00 73.04 C ATOM 63 O VAL A 5 -3.189 -6.602 -13.450 1.00 41.33 O ATOM 64 CB VAL A 5 -4.600 -5.898 -10.968 1.00 45.14 C ATOM 65 CG1 VAL A 5 -3.554 -6.595 -10.043 1.00 21.44 C ATOM 66 CG2 VAL A 5 -5.715 -5.243 -10.121 1.00 34.44 C ATOM 0 H VAL A 5 -5.284 -4.712 -13.540 1.00 34.22 H new ATOM 0 HA VAL A 5 -3.425 -4.103 -11.311 1.00 71.12 H new ATOM 0 HB VAL A 5 -5.056 -6.661 -11.599 1.00 45.14 H new ATOM 0 HG11 VAL A 5 -4.061 -7.307 -9.392 1.00 21.44 H new ATOM 0 HG12 VAL A 5 -2.821 -7.121 -10.655 1.00 21.44 H new ATOM 0 HG13 VAL A 5 -3.048 -5.844 -9.435 1.00 21.44 H new ATOM 0 HG21 VAL A 5 -6.163 -5.992 -9.468 1.00 34.44 H new ATOM 0 HG22 VAL A 5 -5.290 -4.442 -9.516 1.00 34.44 H new ATOM 0 HG23 VAL A 5 -6.479 -4.832 -10.781 1.00 34.44 H new ATOM 76 N ASP A 6 -1.676 -5.001 -12.947 1.00 75.02 N ATOM 77 CA ASP A 6 -0.547 -5.605 -13.691 1.00 10.54 C ATOM 78 C ASP A 6 0.394 -6.341 -12.716 1.00 4.14 C ATOM 79 O ASP A 6 0.745 -5.807 -11.674 1.00 14.32 O ATOM 80 CB ASP A 6 0.222 -4.507 -14.459 1.00 54.45 C ATOM 81 CG ASP A 6 -0.669 -3.804 -15.492 1.00 61.23 C ATOM 82 OD1 ASP A 6 -1.377 -2.840 -15.124 1.00 10.21 O ATOM 83 OD2 ASP A 6 -0.692 -4.234 -16.662 1.00 22.34 O ATOM 0 H ASP A 6 -1.450 -4.100 -12.525 1.00 75.02 H new ATOM 0 HA ASP A 6 -0.936 -6.327 -14.409 1.00 10.54 H new ATOM 0 HB2 ASP A 6 0.609 -3.772 -13.753 1.00 54.45 H new ATOM 0 HB3 ASP A 6 1.082 -4.949 -14.962 1.00 54.45 H new ATOM 88 N LYS A 7 0.789 -7.575 -13.057 1.00 53.43 N ATOM 89 CA LYS A 7 1.636 -8.418 -12.181 1.00 63.11 C ATOM 90 C LYS A 7 2.777 -9.085 -12.985 1.00 71.42 C ATOM 91 O LYS A 7 2.537 -9.888 -13.889 1.00 74.31 O ATOM 92 CB LYS A 7 0.741 -9.471 -11.495 1.00 52.30 C ATOM 93 CG LYS A 7 1.465 -10.424 -10.520 1.00 32.34 C ATOM 94 CD LYS A 7 0.492 -11.475 -9.954 1.00 31.15 C ATOM 95 CE LYS A 7 1.161 -12.489 -9.032 1.00 21.31 C ATOM 96 NZ LYS A 7 0.219 -13.565 -8.641 1.00 73.25 N ATOM 0 H LYS A 7 0.537 -8.021 -13.939 1.00 53.43 H new ATOM 0 HA LYS A 7 2.109 -7.796 -11.421 1.00 63.11 H new ATOM 0 HB2 LYS A 7 -0.048 -8.953 -10.950 1.00 52.30 H new ATOM 0 HB3 LYS A 7 0.256 -10.069 -12.267 1.00 52.30 H new ATOM 0 HG2 LYS A 7 2.286 -10.923 -11.035 1.00 32.34 H new ATOM 0 HG3 LYS A 7 1.903 -9.851 -9.703 1.00 32.34 H new ATOM 0 HD2 LYS A 7 -0.302 -10.966 -9.407 1.00 31.15 H new ATOM 0 HD3 LYS A 7 0.020 -12.004 -10.782 1.00 31.15 H new ATOM 0 HE2 LYS A 7 2.026 -12.924 -9.533 1.00 21.31 H new ATOM 0 HE3 LYS A 7 1.530 -11.984 -8.139 1.00 21.31 H new ATOM 0 HZ1 LYS A 7 0.682 -14.201 -7.961 1.00 73.25 H new ATOM 0 HZ2 LYS A 7 -0.625 -13.145 -8.203 1.00 73.25 H new ATOM 0 HZ3 LYS A 7 -0.061 -14.105 -9.485 1.00 73.25 H new ATOM 110 N ASP A 8 4.015 -8.735 -12.629 1.00 71.04 N ATOM 111 CA ASP A 8 5.239 -9.194 -13.313 1.00 10.24 C ATOM 112 C ASP A 8 5.978 -10.232 -12.438 1.00 52.24 C ATOM 113 O ASP A 8 6.735 -9.875 -11.535 1.00 44.21 O ATOM 114 CB ASP A 8 6.152 -7.973 -13.603 1.00 74.30 C ATOM 115 CG ASP A 8 5.388 -6.802 -14.245 1.00 74.14 C ATOM 116 OD1 ASP A 8 5.235 -6.780 -15.483 1.00 1.14 O ATOM 117 OD2 ASP A 8 4.923 -5.902 -13.505 1.00 75.25 O ATOM 0 H ASP A 8 4.205 -8.113 -11.843 1.00 71.04 H new ATOM 0 HA ASP A 8 4.974 -9.671 -14.256 1.00 10.24 H new ATOM 0 HB2 ASP A 8 6.609 -7.637 -12.672 1.00 74.30 H new ATOM 0 HB3 ASP A 8 6.963 -8.279 -14.264 1.00 74.30 H new ATOM 122 N VAL A 9 5.719 -11.521 -12.697 1.00 72.44 N ATOM 123 CA VAL A 9 6.260 -12.649 -11.896 1.00 63.25 C ATOM 124 C VAL A 9 7.754 -12.918 -12.223 1.00 20.04 C ATOM 125 O VAL A 9 8.544 -13.244 -11.334 1.00 0.32 O ATOM 126 CB VAL A 9 5.382 -13.940 -12.124 1.00 64.01 C ATOM 127 CG1 VAL A 9 5.877 -15.143 -11.277 1.00 14.51 C ATOM 128 CG2 VAL A 9 3.878 -13.643 -11.849 1.00 71.14 C ATOM 0 H VAL A 9 5.126 -11.821 -13.471 1.00 72.44 H new ATOM 0 HA VAL A 9 6.211 -12.375 -10.842 1.00 63.25 H new ATOM 0 HB VAL A 9 5.491 -14.223 -13.171 1.00 64.01 H new ATOM 0 HG11 VAL A 9 5.242 -16.008 -11.468 1.00 14.51 H new ATOM 0 HG12 VAL A 9 6.905 -15.381 -11.549 1.00 14.51 H new ATOM 0 HG13 VAL A 9 5.832 -14.886 -10.219 1.00 14.51 H new ATOM 0 HG21 VAL A 9 3.293 -14.548 -12.013 1.00 71.14 H new ATOM 0 HG22 VAL A 9 3.755 -13.313 -10.817 1.00 71.14 H new ATOM 0 HG23 VAL A 9 3.532 -12.860 -12.524 1.00 71.14 H new ATOM 138 N GLU A 10 8.129 -12.747 -13.500 1.00 71.51 N ATOM 139 CA GLU A 10 9.541 -12.868 -13.960 1.00 10.13 C ATOM 140 C GLU A 10 10.378 -11.611 -13.597 1.00 43.14 C ATOM 141 O GLU A 10 11.563 -11.713 -13.257 1.00 24.32 O ATOM 142 CB GLU A 10 9.619 -13.184 -15.499 1.00 11.34 C ATOM 143 CG GLU A 10 8.466 -12.644 -16.380 1.00 2.01 C ATOM 144 CD GLU A 10 8.326 -11.110 -16.383 1.00 61.55 C ATOM 145 OE1 GLU A 10 9.110 -10.433 -17.072 1.00 1.55 O ATOM 146 OE2 GLU A 10 7.439 -10.575 -15.678 1.00 41.43 O ATOM 0 H GLU A 10 7.473 -12.522 -14.248 1.00 71.51 H new ATOM 0 HA GLU A 10 9.980 -13.711 -13.427 1.00 10.13 H new ATOM 0 HB2 GLU A 10 10.557 -12.781 -15.882 1.00 11.34 H new ATOM 0 HB3 GLU A 10 9.663 -14.266 -15.622 1.00 11.34 H new ATOM 0 HG2 GLU A 10 8.619 -12.984 -17.404 1.00 2.01 H new ATOM 0 HG3 GLU A 10 7.528 -13.081 -16.036 1.00 2.01 H new ATOM 153 N ALA A 11 9.738 -10.434 -13.656 1.00 74.45 N ATOM 154 CA ALA A 11 10.389 -9.131 -13.378 1.00 35.00 C ATOM 155 C ALA A 11 10.227 -8.691 -11.898 1.00 63.43 C ATOM 156 O ALA A 11 10.714 -7.623 -11.516 1.00 14.14 O ATOM 157 CB ALA A 11 9.829 -8.070 -14.335 1.00 43.33 C ATOM 0 H ALA A 11 8.751 -10.351 -13.898 1.00 74.45 H new ATOM 0 HA ALA A 11 11.460 -9.244 -13.546 1.00 35.00 H new ATOM 0 HB1 ALA A 11 10.305 -7.111 -14.133 1.00 43.33 H new ATOM 0 HB2 ALA A 11 10.030 -8.366 -15.365 1.00 43.33 H new ATOM 0 HB3 ALA A 11 8.753 -7.979 -14.188 1.00 43.33 H new ATOM 163 N LEU A 12 9.544 -9.533 -11.089 1.00 10.43 N ATOM 164 CA LEU A 12 9.357 -9.347 -9.622 1.00 31.23 C ATOM 165 C LEU A 12 8.789 -7.960 -9.230 1.00 5.25 C ATOM 166 O LEU A 12 9.261 -7.339 -8.290 1.00 43.12 O ATOM 167 CB LEU A 12 10.691 -9.644 -8.869 1.00 44.55 C ATOM 168 CG LEU A 12 11.294 -11.060 -9.092 1.00 13.44 C ATOM 169 CD1 LEU A 12 12.568 -11.269 -8.246 1.00 41.01 C ATOM 170 CD2 LEU A 12 10.244 -12.152 -8.811 1.00 24.11 C ATOM 0 H LEU A 12 9.096 -10.380 -11.440 1.00 10.43 H new ATOM 0 HA LEU A 12 8.597 -10.065 -9.314 1.00 31.23 H new ATOM 0 HB2 LEU A 12 11.430 -8.903 -9.173 1.00 44.55 H new ATOM 0 HB3 LEU A 12 10.522 -9.506 -7.801 1.00 44.55 H new ATOM 0 HG LEU A 12 11.586 -11.140 -10.139 1.00 13.44 H new ATOM 0 HD11 LEU A 12 12.964 -12.269 -8.425 1.00 41.01 H new ATOM 0 HD12 LEU A 12 13.316 -10.527 -8.525 1.00 41.01 H new ATOM 0 HD13 LEU A 12 12.325 -11.159 -7.189 1.00 41.01 H new ATOM 0 HD21 LEU A 12 10.688 -13.134 -8.973 1.00 24.11 H new ATOM 0 HD22 LEU A 12 9.905 -12.073 -7.778 1.00 24.11 H new ATOM 0 HD23 LEU A 12 9.395 -12.022 -9.482 1.00 24.11 H new ATOM 182 N SER A 13 7.780 -7.479 -9.954 1.00 55.41 N ATOM 183 CA SER A 13 7.090 -6.208 -9.625 1.00 3.32 C ATOM 184 C SER A 13 5.564 -6.375 -9.720 1.00 43.23 C ATOM 185 O SER A 13 5.065 -6.943 -10.674 1.00 62.21 O ATOM 186 CB SER A 13 7.588 -5.073 -10.549 1.00 11.52 C ATOM 187 OG SER A 13 7.428 -5.395 -11.922 1.00 53.11 O ATOM 0 H SER A 13 7.411 -7.947 -10.782 1.00 55.41 H new ATOM 0 HA SER A 13 7.329 -5.938 -8.596 1.00 3.32 H new ATOM 0 HB2 SER A 13 7.041 -4.157 -10.325 1.00 11.52 H new ATOM 0 HB3 SER A 13 8.640 -4.874 -10.344 1.00 11.52 H new ATOM 0 HG SER A 13 6.474 -5.483 -12.128 1.00 53.11 H new ATOM 193 N PHE A 14 4.831 -5.884 -8.713 1.00 40.24 N ATOM 194 CA PHE A 14 3.356 -6.023 -8.625 1.00 70.54 C ATOM 195 C PHE A 14 2.687 -4.625 -8.619 1.00 72.31 C ATOM 196 O PHE A 14 2.686 -3.926 -7.611 1.00 33.22 O ATOM 197 CB PHE A 14 3.026 -6.847 -7.348 1.00 55.04 C ATOM 198 CG PHE A 14 1.546 -6.964 -6.981 1.00 63.03 C ATOM 199 CD1 PHE A 14 0.602 -7.436 -7.901 1.00 32.13 C ATOM 200 CD2 PHE A 14 1.106 -6.619 -5.702 1.00 72.13 C ATOM 201 CE1 PHE A 14 -0.730 -7.549 -7.544 1.00 54.33 C ATOM 202 CE2 PHE A 14 -0.220 -6.732 -5.353 1.00 21.23 C ATOM 203 CZ PHE A 14 -1.138 -7.197 -6.268 1.00 54.42 C ATOM 0 H PHE A 14 5.238 -5.375 -7.928 1.00 40.24 H new ATOM 0 HA PHE A 14 2.960 -6.551 -9.492 1.00 70.54 H new ATOM 0 HB2 PHE A 14 3.427 -7.852 -7.476 1.00 55.04 H new ATOM 0 HB3 PHE A 14 3.553 -6.399 -6.506 1.00 55.04 H new ATOM 0 HD1 PHE A 14 0.916 -7.714 -8.896 1.00 32.13 H new ATOM 0 HD2 PHE A 14 1.818 -6.258 -4.975 1.00 72.13 H new ATOM 0 HE1 PHE A 14 -1.452 -7.912 -8.261 1.00 54.33 H new ATOM 0 HE2 PHE A 14 -0.541 -6.456 -4.360 1.00 21.23 H new ATOM 0 HZ PHE A 14 -2.178 -7.287 -5.990 1.00 54.42 H new ATOM 213 N SER A 15 2.095 -4.255 -9.759 1.00 55.52 N ATOM 214 CA SER A 15 1.562 -2.893 -10.026 1.00 4.42 C ATOM 215 C SER A 15 0.014 -2.850 -9.962 1.00 33.43 C ATOM 216 O SER A 15 -0.656 -3.504 -10.756 1.00 64.42 O ATOM 217 CB SER A 15 2.035 -2.432 -11.423 1.00 25.33 C ATOM 218 OG SER A 15 3.450 -2.467 -11.533 1.00 13.32 O ATOM 0 H SER A 15 1.965 -4.896 -10.542 1.00 55.52 H new ATOM 0 HA SER A 15 1.940 -2.225 -9.252 1.00 4.42 H new ATOM 0 HB2 SER A 15 1.594 -3.072 -12.187 1.00 25.33 H new ATOM 0 HB3 SER A 15 1.680 -1.419 -11.612 1.00 25.33 H new ATOM 0 HG SER A 15 3.716 -2.171 -12.429 1.00 13.32 H new ATOM 224 N ILE A 16 -0.554 -2.077 -9.015 1.00 75.54 N ATOM 225 CA ILE A 16 -2.020 -1.848 -8.933 1.00 23.11 C ATOM 226 C ILE A 16 -2.349 -0.392 -9.336 1.00 34.41 C ATOM 227 O ILE A 16 -1.926 0.556 -8.669 1.00 44.45 O ATOM 228 CB ILE A 16 -2.581 -2.145 -7.491 1.00 41.40 C ATOM 229 CG1 ILE A 16 -2.201 -3.595 -7.050 1.00 31.53 C ATOM 230 CG2 ILE A 16 -4.124 -1.927 -7.432 1.00 21.50 C ATOM 231 CD1 ILE A 16 -2.572 -3.940 -5.620 1.00 51.31 C ATOM 0 H ILE A 16 -0.021 -1.596 -8.290 1.00 75.54 H new ATOM 0 HA ILE A 16 -2.502 -2.539 -9.625 1.00 23.11 H new ATOM 0 HB ILE A 16 -2.124 -1.443 -6.794 1.00 41.40 H new ATOM 0 HG12 ILE A 16 -2.690 -4.303 -7.719 1.00 31.53 H new ATOM 0 HG13 ILE A 16 -1.126 -3.728 -7.175 1.00 31.53 H new ATOM 0 HG21 ILE A 16 -4.483 -2.139 -6.425 1.00 21.50 H new ATOM 0 HG22 ILE A 16 -4.356 -0.893 -7.689 1.00 21.50 H new ATOM 0 HG23 ILE A 16 -4.613 -2.596 -8.140 1.00 21.50 H new ATOM 0 HD11 ILE A 16 -2.271 -4.965 -5.403 1.00 51.31 H new ATOM 0 HD12 ILE A 16 -2.062 -3.260 -4.938 1.00 51.31 H new ATOM 0 HD13 ILE A 16 -3.650 -3.844 -5.490 1.00 51.31 H new ATOM 243 N VAL A 17 -3.111 -0.245 -10.430 1.00 11.21 N ATOM 244 CA VAL A 17 -3.520 1.060 -10.987 1.00 63.54 C ATOM 245 C VAL A 17 -4.983 1.369 -10.579 1.00 54.51 C ATOM 246 O VAL A 17 -5.893 0.572 -10.846 1.00 12.11 O ATOM 247 CB VAL A 17 -3.388 1.065 -12.559 1.00 42.04 C ATOM 248 CG1 VAL A 17 -3.769 2.442 -13.165 1.00 70.44 C ATOM 249 CG2 VAL A 17 -1.965 0.629 -12.998 1.00 25.31 C ATOM 0 H VAL A 17 -3.467 -1.039 -10.963 1.00 11.21 H new ATOM 0 HA VAL A 17 -2.861 1.830 -10.585 1.00 63.54 H new ATOM 0 HB VAL A 17 -4.098 0.336 -12.949 1.00 42.04 H new ATOM 0 HG11 VAL A 17 -3.665 2.404 -14.249 1.00 70.44 H new ATOM 0 HG12 VAL A 17 -4.801 2.680 -12.908 1.00 70.44 H new ATOM 0 HG13 VAL A 17 -3.109 3.211 -12.764 1.00 70.44 H new ATOM 0 HG21 VAL A 17 -1.900 0.641 -14.086 1.00 25.31 H new ATOM 0 HG22 VAL A 17 -1.229 1.318 -12.583 1.00 25.31 H new ATOM 0 HG23 VAL A 17 -1.765 -0.379 -12.634 1.00 25.31 H new ATOM 259 N ALA A 18 -5.203 2.527 -9.933 1.00 32.11 N ATOM 260 CA ALA A 18 -6.536 2.949 -9.454 1.00 13.22 C ATOM 261 C ALA A 18 -6.719 4.476 -9.581 1.00 22.43 C ATOM 262 O ALA A 18 -5.900 5.242 -9.081 1.00 21.10 O ATOM 263 CB ALA A 18 -6.713 2.500 -7.999 1.00 72.02 C ATOM 0 H ALA A 18 -4.464 3.199 -9.727 1.00 32.11 H new ATOM 0 HA ALA A 18 -7.299 2.479 -10.074 1.00 13.22 H new ATOM 0 HB1 ALA A 18 -7.695 2.809 -7.640 1.00 72.02 H new ATOM 0 HB2 ALA A 18 -6.630 1.415 -7.940 1.00 72.02 H new ATOM 0 HB3 ALA A 18 -5.940 2.957 -7.381 1.00 72.02 H new ATOM 269 N GLU A 19 -7.822 4.906 -10.218 1.00 45.23 N ATOM 270 CA GLU A 19 -8.085 6.339 -10.518 1.00 61.44 C ATOM 271 C GLU A 19 -9.252 6.882 -9.674 1.00 31.20 C ATOM 272 O GLU A 19 -10.341 6.311 -9.668 1.00 32.03 O ATOM 273 CB GLU A 19 -8.377 6.490 -12.029 1.00 62.22 C ATOM 274 CG GLU A 19 -7.190 6.070 -12.928 1.00 53.51 C ATOM 275 CD GLU A 19 -7.503 6.098 -14.429 1.00 61.44 C ATOM 276 OE1 GLU A 19 -7.995 7.129 -14.917 1.00 70.12 O ATOM 277 OE2 GLU A 19 -7.228 5.105 -15.131 1.00 60.15 O ATOM 0 H GLU A 19 -8.558 4.279 -10.542 1.00 45.23 H new ATOM 0 HA GLU A 19 -7.204 6.926 -10.258 1.00 61.44 H new ATOM 0 HB2 GLU A 19 -9.248 5.888 -12.285 1.00 62.22 H new ATOM 0 HB3 GLU A 19 -8.634 7.528 -12.240 1.00 62.22 H new ATOM 0 HG2 GLU A 19 -6.347 6.732 -12.731 1.00 53.51 H new ATOM 0 HG3 GLU A 19 -6.877 5.063 -12.651 1.00 53.51 H new ATOM 284 N PHE A 20 -9.013 8.005 -8.975 1.00 51.13 N ATOM 285 CA PHE A 20 -9.964 8.573 -7.988 1.00 51.12 C ATOM 286 C PHE A 20 -10.375 10.001 -8.373 1.00 70.42 C ATOM 287 O PHE A 20 -9.540 10.784 -8.833 1.00 44.25 O ATOM 288 CB PHE A 20 -9.325 8.553 -6.572 1.00 24.32 C ATOM 289 CG PHE A 20 -8.783 7.182 -6.180 1.00 33.12 C ATOM 290 CD1 PHE A 20 -9.652 6.115 -5.948 1.00 65.21 C ATOM 291 CD2 PHE A 20 -7.411 6.947 -6.081 1.00 0.41 C ATOM 292 CE1 PHE A 20 -9.168 4.866 -5.634 1.00 14.24 C ATOM 293 CE2 PHE A 20 -6.929 5.696 -5.758 1.00 54.11 C ATOM 294 CZ PHE A 20 -7.808 4.658 -5.538 1.00 73.55 C ATOM 0 H PHE A 20 -8.156 8.549 -9.074 1.00 51.13 H new ATOM 0 HA PHE A 20 -10.865 7.959 -7.983 1.00 51.12 H new ATOM 0 HB2 PHE A 20 -8.515 9.282 -6.535 1.00 24.32 H new ATOM 0 HB3 PHE A 20 -10.069 8.866 -5.840 1.00 24.32 H new ATOM 0 HD1 PHE A 20 -10.718 6.272 -6.016 1.00 65.21 H new ATOM 0 HD2 PHE A 20 -6.718 7.755 -6.260 1.00 0.41 H new ATOM 0 HE1 PHE A 20 -9.853 4.049 -5.463 1.00 14.24 H new ATOM 0 HE2 PHE A 20 -5.865 5.530 -5.678 1.00 54.11 H new ATOM 0 HZ PHE A 20 -7.430 3.677 -5.289 1.00 73.55 H new ATOM 304 N ASP A 21 -11.668 10.326 -8.169 1.00 32.33 N ATOM 305 CA ASP A 21 -12.230 11.662 -8.459 1.00 41.21 C ATOM 306 C ASP A 21 -11.714 12.705 -7.431 1.00 10.22 C ATOM 307 O ASP A 21 -12.352 12.959 -6.400 1.00 1.24 O ATOM 308 CB ASP A 21 -13.777 11.586 -8.459 1.00 60.33 C ATOM 309 CG ASP A 21 -14.318 10.575 -9.480 1.00 13.22 C ATOM 310 OD1 ASP A 21 -14.424 10.920 -10.679 1.00 2.14 O ATOM 311 OD2 ASP A 21 -14.610 9.423 -9.098 1.00 54.30 O ATOM 0 H ASP A 21 -12.354 9.668 -7.798 1.00 32.33 H new ATOM 0 HA ASP A 21 -11.901 11.985 -9.446 1.00 41.21 H new ATOM 0 HB2 ASP A 21 -14.124 11.312 -7.463 1.00 60.33 H new ATOM 0 HB3 ASP A 21 -14.186 12.572 -8.678 1.00 60.33 H new ATOM 316 N ALA A 22 -10.534 13.275 -7.734 1.00 61.11 N ATOM 317 CA ALA A 22 -9.764 14.130 -6.800 1.00 12.14 C ATOM 318 C ALA A 22 -8.545 14.775 -7.509 1.00 23.32 C ATOM 319 O ALA A 22 -8.261 14.469 -8.664 1.00 23.04 O ATOM 320 CB ALA A 22 -9.285 13.260 -5.625 1.00 22.04 C ATOM 0 H ALA A 22 -10.081 13.157 -8.640 1.00 61.11 H new ATOM 0 HA ALA A 22 -10.405 14.935 -6.441 1.00 12.14 H new ATOM 0 HB1 ALA A 22 -8.716 13.873 -4.927 1.00 22.04 H new ATOM 0 HB2 ALA A 22 -10.147 12.833 -5.113 1.00 22.04 H new ATOM 0 HB3 ALA A 22 -8.652 12.457 -6.002 1.00 22.04 H new ATOM 326 N ASP A 23 -7.815 15.670 -6.811 1.00 43.45 N ATOM 327 CA ASP A 23 -6.487 16.145 -7.292 1.00 43.40 C ATOM 328 C ASP A 23 -5.365 15.306 -6.646 1.00 71.10 C ATOM 329 O ASP A 23 -5.626 14.492 -5.750 1.00 2.40 O ATOM 330 CB ASP A 23 -6.265 17.661 -7.021 1.00 34.11 C ATOM 331 CG ASP A 23 -6.311 18.034 -5.536 1.00 73.51 C ATOM 332 OD1 ASP A 23 -7.409 18.315 -5.016 1.00 31.55 O ATOM 333 OD2 ASP A 23 -5.249 18.033 -4.874 1.00 71.34 O ATOM 0 H ASP A 23 -8.111 16.077 -5.924 1.00 43.45 H new ATOM 0 HA ASP A 23 -6.462 16.013 -8.374 1.00 43.40 H new ATOM 0 HB2 ASP A 23 -5.299 17.957 -7.431 1.00 34.11 H new ATOM 0 HB3 ASP A 23 -7.026 18.232 -7.554 1.00 34.11 H new ATOM 338 N VAL A 24 -4.123 15.536 -7.099 1.00 23.50 N ATOM 339 CA VAL A 24 -2.937 14.761 -6.671 1.00 10.31 C ATOM 340 C VAL A 24 -2.689 14.853 -5.145 1.00 20.20 C ATOM 341 O VAL A 24 -2.442 13.839 -4.504 1.00 23.21 O ATOM 342 CB VAL A 24 -1.669 15.223 -7.468 1.00 1.24 C ATOM 343 CG1 VAL A 24 -0.396 14.457 -7.044 1.00 34.31 C ATOM 344 CG2 VAL A 24 -1.893 15.073 -8.984 1.00 73.33 C ATOM 0 H VAL A 24 -3.907 16.268 -7.776 1.00 23.50 H new ATOM 0 HA VAL A 24 -3.137 13.713 -6.895 1.00 10.31 H new ATOM 0 HB VAL A 24 -1.514 16.275 -7.229 1.00 1.24 H new ATOM 0 HG11 VAL A 24 0.454 14.814 -7.625 1.00 34.31 H new ATOM 0 HG12 VAL A 24 -0.207 14.625 -5.984 1.00 34.31 H new ATOM 0 HG13 VAL A 24 -0.536 13.391 -7.223 1.00 34.31 H new ATOM 0 HG21 VAL A 24 -1.000 15.399 -9.518 1.00 73.33 H new ATOM 0 HG22 VAL A 24 -2.095 14.028 -9.220 1.00 73.33 H new ATOM 0 HG23 VAL A 24 -2.742 15.685 -9.289 1.00 73.33 H new ATOM 354 N LYS A 25 -2.797 16.067 -4.574 1.00 1.21 N ATOM 355 CA LYS A 25 -2.618 16.298 -3.117 1.00 21.43 C ATOM 356 C LYS A 25 -3.789 15.720 -2.278 1.00 65.32 C ATOM 357 O LYS A 25 -3.588 15.291 -1.135 1.00 20.11 O ATOM 358 CB LYS A 25 -2.419 17.821 -2.822 1.00 3.34 C ATOM 359 CG LYS A 25 -0.953 18.340 -2.970 1.00 2.23 C ATOM 360 CD LYS A 25 -0.209 18.510 -1.608 1.00 72.35 C ATOM 361 CE LYS A 25 -0.157 17.219 -0.761 1.00 71.42 C ATOM 362 NZ LYS A 25 0.518 17.422 0.539 1.00 44.45 N ATOM 0 H LYS A 25 -3.009 16.914 -5.100 1.00 1.21 H new ATOM 0 HA LYS A 25 -1.719 15.762 -2.815 1.00 21.43 H new ATOM 0 HB2 LYS A 25 -3.059 18.392 -3.494 1.00 3.34 H new ATOM 0 HB3 LYS A 25 -2.759 18.026 -1.807 1.00 3.34 H new ATOM 0 HG2 LYS A 25 -0.392 17.646 -3.596 1.00 2.23 H new ATOM 0 HG3 LYS A 25 -0.967 19.298 -3.489 1.00 2.23 H new ATOM 0 HD2 LYS A 25 0.809 18.848 -1.800 1.00 72.35 H new ATOM 0 HD3 LYS A 25 -0.701 19.293 -1.031 1.00 72.35 H new ATOM 0 HE2 LYS A 25 -1.172 16.861 -0.588 1.00 71.42 H new ATOM 0 HE3 LYS A 25 0.364 16.442 -1.320 1.00 71.42 H new ATOM 0 HZ1 LYS A 25 0.366 16.589 1.143 1.00 44.45 H new ATOM 0 HZ2 LYS A 25 1.538 17.555 0.384 1.00 44.45 H new ATOM 0 HZ3 LYS A 25 0.126 18.265 1.006 1.00 44.45 H new ATOM 376 N ARG A 26 -4.998 15.716 -2.863 1.00 15.53 N ATOM 377 CA ARG A 26 -6.208 15.142 -2.226 1.00 41.32 C ATOM 378 C ARG A 26 -6.064 13.609 -2.051 1.00 45.44 C ATOM 379 O ARG A 26 -6.368 13.066 -0.980 1.00 24.52 O ATOM 380 CB ARG A 26 -7.457 15.504 -3.070 1.00 70.02 C ATOM 381 CG ARG A 26 -8.801 14.904 -2.596 1.00 3.23 C ATOM 382 CD ARG A 26 -9.248 15.364 -1.205 1.00 62.22 C ATOM 383 NE ARG A 26 -10.585 14.825 -0.887 1.00 51.50 N ATOM 384 CZ ARG A 26 -10.961 14.321 0.266 1.00 0.22 C ATOM 385 NH1 ARG A 26 -10.144 14.245 1.271 1.00 75.32 N ATOM 386 NH2 ARG A 26 -12.164 13.886 0.408 1.00 42.01 N ATOM 0 H ARG A 26 -5.170 16.108 -3.789 1.00 15.53 H new ATOM 0 HA ARG A 26 -6.327 15.568 -1.230 1.00 41.32 H new ATOM 0 HB2 ARG A 26 -7.554 16.589 -3.089 1.00 70.02 H new ATOM 0 HB3 ARG A 26 -7.282 15.182 -4.096 1.00 70.02 H new ATOM 0 HG2 ARG A 26 -9.575 15.165 -3.317 1.00 3.23 H new ATOM 0 HG3 ARG A 26 -8.719 13.817 -2.596 1.00 3.23 H new ATOM 0 HD2 ARG A 26 -8.528 15.032 -0.457 1.00 62.22 H new ATOM 0 HD3 ARG A 26 -9.270 16.453 -1.165 1.00 62.22 H new ATOM 0 HE ARG A 26 -11.281 14.846 -1.632 1.00 51.50 H new ATOM 0 HH11 ARG A 26 -9.186 14.581 1.176 1.00 75.32 H new ATOM 0 HH12 ARG A 26 -10.460 13.849 2.156 1.00 75.32 H new ATOM 0 HH21 ARG A 26 -12.819 13.934 -0.372 1.00 42.01 H new ATOM 0 HH22 ARG A 26 -12.462 13.493 1.301 1.00 42.01 H new ATOM 400 N VAL A 27 -5.572 12.933 -3.109 1.00 32.23 N ATOM 401 CA VAL A 27 -5.271 11.485 -3.069 1.00 50.53 C ATOM 402 C VAL A 27 -4.017 11.207 -2.197 1.00 40.05 C ATOM 403 O VAL A 27 -4.004 10.276 -1.423 1.00 0.03 O ATOM 404 CB VAL A 27 -5.060 10.883 -4.514 1.00 5.42 C ATOM 405 CG1 VAL A 27 -4.861 9.340 -4.465 1.00 53.03 C ATOM 406 CG2 VAL A 27 -6.232 11.255 -5.455 1.00 23.03 C ATOM 0 H VAL A 27 -5.373 13.370 -4.009 1.00 32.23 H new ATOM 0 HA VAL A 27 -6.136 10.994 -2.623 1.00 50.53 H new ATOM 0 HB VAL A 27 -4.149 11.325 -4.918 1.00 5.42 H new ATOM 0 HG11 VAL A 27 -4.719 8.959 -5.476 1.00 53.03 H new ATOM 0 HG12 VAL A 27 -3.984 9.105 -3.862 1.00 53.03 H new ATOM 0 HG13 VAL A 27 -5.741 8.874 -4.022 1.00 53.03 H new ATOM 0 HG21 VAL A 27 -6.057 10.826 -6.442 1.00 23.03 H new ATOM 0 HG22 VAL A 27 -7.164 10.862 -5.049 1.00 23.03 H new ATOM 0 HG23 VAL A 27 -6.302 12.340 -5.538 1.00 23.03 H new ATOM 416 N TRP A 28 -2.995 12.071 -2.305 1.00 74.54 N ATOM 417 CA TRP A 28 -1.704 11.936 -1.564 1.00 2.45 C ATOM 418 C TRP A 28 -1.888 11.928 -0.029 1.00 75.51 C ATOM 419 O TRP A 28 -1.074 11.341 0.689 1.00 51.41 O ATOM 420 CB TRP A 28 -0.753 13.081 -1.986 1.00 70.12 C ATOM 421 CG TRP A 28 0.618 13.073 -1.344 1.00 61.22 C ATOM 422 CD1 TRP A 28 1.063 13.891 -0.345 1.00 45.12 C ATOM 423 CD2 TRP A 28 1.720 12.212 -1.668 1.00 44.22 C ATOM 424 NE1 TRP A 28 2.368 13.613 -0.055 1.00 72.22 N ATOM 425 CE2 TRP A 28 2.794 12.588 -0.848 1.00 75.52 C ATOM 426 CE3 TRP A 28 1.904 11.166 -2.578 1.00 71.10 C ATOM 427 CZ2 TRP A 28 4.029 11.966 -0.912 1.00 31.41 C ATOM 428 CZ3 TRP A 28 3.131 10.551 -2.642 1.00 10.02 C ATOM 429 CH2 TRP A 28 4.182 10.956 -1.813 1.00 31.41 C ATOM 0 H TRP A 28 -3.029 12.892 -2.909 1.00 74.54 H new ATOM 0 HA TRP A 28 -1.273 10.970 -1.827 1.00 2.45 H new ATOM 0 HB2 TRP A 28 -0.626 13.042 -3.068 1.00 70.12 H new ATOM 0 HB3 TRP A 28 -1.235 14.031 -1.756 1.00 70.12 H new ATOM 0 HD1 TRP A 28 0.469 14.648 0.145 1.00 45.12 H new ATOM 0 HE1 TRP A 28 2.934 14.095 0.643 1.00 72.22 H new ATOM 0 HE3 TRP A 28 1.096 10.847 -3.219 1.00 71.10 H new ATOM 0 HZ2 TRP A 28 4.842 12.271 -0.270 1.00 31.41 H new ATOM 0 HZ3 TRP A 28 3.286 9.744 -3.342 1.00 10.02 H new ATOM 0 HH2 TRP A 28 5.137 10.457 -1.889 1.00 31.41 H new ATOM 440 N ALA A 29 -2.962 12.578 0.454 1.00 32.13 N ATOM 441 CA ALA A 29 -3.301 12.638 1.896 1.00 21.32 C ATOM 442 C ALA A 29 -3.501 11.239 2.528 1.00 73.42 C ATOM 443 O ALA A 29 -3.225 11.049 3.710 1.00 35.23 O ATOM 444 CB ALA A 29 -4.552 13.493 2.094 1.00 75.30 C ATOM 0 H ALA A 29 -3.623 13.078 -0.141 1.00 32.13 H new ATOM 0 HA ALA A 29 -2.453 13.092 2.409 1.00 21.32 H new ATOM 0 HB1 ALA A 29 -4.799 13.536 3.155 1.00 75.30 H new ATOM 0 HB2 ALA A 29 -4.366 14.501 1.724 1.00 75.30 H new ATOM 0 HB3 ALA A 29 -5.384 13.053 1.545 1.00 75.30 H new ATOM 450 N ILE A 30 -3.959 10.256 1.723 1.00 62.24 N ATOM 451 CA ILE A 30 -4.176 8.858 2.193 1.00 41.43 C ATOM 452 C ILE A 30 -2.838 8.123 2.465 1.00 43.43 C ATOM 453 O ILE A 30 -2.831 7.008 2.967 1.00 42.22 O ATOM 454 CB ILE A 30 -5.042 8.028 1.176 1.00 51.15 C ATOM 455 CG1 ILE A 30 -4.186 7.617 -0.067 1.00 34.13 C ATOM 456 CG2 ILE A 30 -6.319 8.816 0.782 1.00 22.45 C ATOM 457 CD1 ILE A 30 -4.924 6.973 -1.210 1.00 34.21 C ATOM 0 H ILE A 30 -4.188 10.400 0.740 1.00 62.24 H new ATOM 0 HA ILE A 30 -4.723 8.934 3.133 1.00 41.43 H new ATOM 0 HB ILE A 30 -5.370 7.106 1.656 1.00 51.15 H new ATOM 0 HG12 ILE A 30 -3.684 8.508 -0.444 1.00 34.13 H new ATOM 0 HG13 ILE A 30 -3.408 6.930 0.267 1.00 34.13 H new ATOM 0 HG21 ILE A 30 -6.907 8.227 0.078 1.00 22.45 H new ATOM 0 HG22 ILE A 30 -6.913 9.015 1.674 1.00 22.45 H new ATOM 0 HG23 ILE A 30 -6.035 9.760 0.317 1.00 22.45 H new ATOM 0 HD11 ILE A 30 -4.222 6.735 -2.009 1.00 34.21 H new ATOM 0 HD12 ILE A 30 -5.403 6.057 -0.864 1.00 34.21 H new ATOM 0 HD13 ILE A 30 -5.683 7.659 -1.586 1.00 34.21 H new ATOM 469 N TRP A 31 -1.724 8.739 2.049 1.00 74.13 N ATOM 470 CA TRP A 31 -0.360 8.252 2.325 1.00 13.20 C ATOM 471 C TRP A 31 0.332 9.131 3.377 1.00 71.52 C ATOM 472 O TRP A 31 0.953 8.622 4.311 1.00 43.13 O ATOM 473 CB TRP A 31 0.458 8.252 1.008 1.00 62.13 C ATOM 474 CG TRP A 31 -0.143 7.360 -0.052 1.00 52.34 C ATOM 475 CD1 TRP A 31 -0.817 7.735 -1.187 1.00 22.32 C ATOM 476 CD2 TRP A 31 -0.138 5.926 -0.043 1.00 1.42 C ATOM 477 NE1 TRP A 31 -1.231 6.619 -1.869 1.00 21.33 N ATOM 478 CE2 TRP A 31 -0.819 5.501 -1.191 1.00 40.15 C ATOM 479 CE3 TRP A 31 0.386 4.963 0.830 1.00 52.25 C ATOM 480 CZ2 TRP A 31 -0.993 4.158 -1.488 1.00 64.33 C ATOM 481 CZ3 TRP A 31 0.214 3.629 0.532 1.00 23.53 C ATOM 482 CH2 TRP A 31 -0.469 3.236 -0.619 1.00 54.21 C ATOM 0 H TRP A 31 -1.742 9.601 1.504 1.00 74.13 H new ATOM 0 HA TRP A 31 -0.420 7.238 2.720 1.00 13.20 H new ATOM 0 HB2 TRP A 31 0.523 9.271 0.626 1.00 62.13 H new ATOM 0 HB3 TRP A 31 1.476 7.925 1.218 1.00 62.13 H new ATOM 0 HD1 TRP A 31 -0.995 8.754 -1.496 1.00 22.32 H new ATOM 0 HE1 TRP A 31 -1.760 6.621 -2.741 1.00 21.33 H new ATOM 0 HE3 TRP A 31 0.916 5.262 1.722 1.00 52.25 H new ATOM 0 HZ2 TRP A 31 -1.524 3.848 -2.376 1.00 64.33 H new ATOM 0 HZ3 TRP A 31 0.613 2.878 1.198 1.00 23.53 H new ATOM 0 HH2 TRP A 31 -0.588 2.183 -0.830 1.00 54.21 H new ATOM 493 N GLU A 32 0.202 10.459 3.203 1.00 52.32 N ATOM 494 CA GLU A 32 0.921 11.470 4.005 1.00 21.32 C ATOM 495 C GLU A 32 0.333 11.598 5.430 1.00 13.44 C ATOM 496 O GLU A 32 1.074 11.743 6.411 1.00 13.02 O ATOM 497 CB GLU A 32 0.895 12.831 3.248 1.00 30.33 C ATOM 498 CG GLU A 32 1.752 13.946 3.881 1.00 22.32 C ATOM 499 CD GLU A 32 1.880 15.198 2.988 1.00 33.54 C ATOM 500 OE1 GLU A 32 0.948 16.026 2.972 1.00 14.53 O ATOM 501 OE2 GLU A 32 2.905 15.348 2.286 1.00 10.23 O ATOM 0 H GLU A 32 -0.410 10.866 2.496 1.00 52.32 H new ATOM 0 HA GLU A 32 1.956 11.151 4.131 1.00 21.32 H new ATOM 0 HB2 GLU A 32 1.236 12.667 2.226 1.00 30.33 H new ATOM 0 HB3 GLU A 32 -0.137 13.177 3.188 1.00 30.33 H new ATOM 0 HG2 GLU A 32 1.314 14.233 4.837 1.00 22.32 H new ATOM 0 HG3 GLU A 32 2.747 13.555 4.091 1.00 22.32 H new ATOM 508 N ASP A 33 -1.008 11.541 5.529 1.00 11.11 N ATOM 509 CA ASP A 33 -1.717 11.562 6.822 1.00 33.14 C ATOM 510 C ASP A 33 -2.056 10.110 7.280 1.00 21.52 C ATOM 511 O ASP A 33 -2.730 9.369 6.545 1.00 51.51 O ATOM 512 CB ASP A 33 -3.008 12.414 6.721 1.00 13.31 C ATOM 513 CG ASP A 33 -3.691 12.585 8.082 1.00 1.43 C ATOM 514 OD1 ASP A 33 -3.160 13.336 8.929 1.00 25.41 O ATOM 515 OD2 ASP A 33 -4.727 11.953 8.333 1.00 72.32 O ATOM 0 H ASP A 33 -1.627 11.479 4.721 1.00 11.11 H new ATOM 0 HA ASP A 33 -1.063 12.016 7.566 1.00 33.14 H new ATOM 0 HB2 ASP A 33 -2.764 13.395 6.312 1.00 13.31 H new ATOM 0 HB3 ASP A 33 -3.701 11.941 6.025 1.00 13.31 H new ATOM 520 N PRO A 34 -1.600 9.685 8.510 1.00 10.53 N ATOM 521 CA PRO A 34 -1.860 8.315 9.053 1.00 60.35 C ATOM 522 C PRO A 34 -3.361 7.979 9.246 1.00 5.01 C ATOM 523 O PRO A 34 -3.755 6.810 9.154 1.00 1.34 O ATOM 524 CB PRO A 34 -1.123 8.322 10.420 1.00 72.04 C ATOM 525 CG PRO A 34 -0.969 9.771 10.767 1.00 61.31 C ATOM 526 CD PRO A 34 -0.766 10.479 9.450 1.00 24.33 C ATOM 0 HA PRO A 34 -1.513 7.552 8.356 1.00 60.35 H new ATOM 0 HB2 PRO A 34 -1.696 7.792 11.181 1.00 72.04 H new ATOM 0 HB3 PRO A 34 -0.154 7.828 10.349 1.00 72.04 H new ATOM 0 HG2 PRO A 34 -1.852 10.147 11.283 1.00 61.31 H new ATOM 0 HG3 PRO A 34 -0.120 9.928 11.432 1.00 61.31 H new ATOM 0 HD2 PRO A 34 -1.090 11.519 9.497 1.00 24.33 H new ATOM 0 HD3 PRO A 34 0.283 10.485 9.153 1.00 24.33 H new ATOM 534 N ARG A 35 -4.182 9.011 9.530 1.00 61.55 N ATOM 535 CA ARG A 35 -5.627 8.829 9.782 1.00 13.03 C ATOM 536 C ARG A 35 -6.373 8.515 8.470 1.00 70.55 C ATOM 537 O ARG A 35 -7.198 7.608 8.434 1.00 63.24 O ATOM 538 CB ARG A 35 -6.229 10.080 10.471 1.00 44.42 C ATOM 539 CG ARG A 35 -5.459 10.582 11.719 1.00 71.20 C ATOM 540 CD ARG A 35 -5.590 9.674 12.962 1.00 61.42 C ATOM 541 NE ARG A 35 -4.961 8.350 12.811 1.00 10.21 N ATOM 542 CZ ARG A 35 -3.718 8.049 13.122 1.00 1.04 C ATOM 543 NH1 ARG A 35 -2.878 8.953 13.522 1.00 42.20 N ATOM 544 NH2 ARG A 35 -3.311 6.831 13.009 1.00 3.33 N ATOM 0 H ARG A 35 -3.869 9.980 9.591 1.00 61.55 H new ATOM 0 HA ARG A 35 -5.750 7.981 10.456 1.00 13.03 H new ATOM 0 HB2 ARG A 35 -6.275 10.889 9.742 1.00 44.42 H new ATOM 0 HB3 ARG A 35 -7.255 9.856 10.763 1.00 44.42 H new ATOM 0 HG2 ARG A 35 -4.403 10.678 11.465 1.00 71.20 H new ATOM 0 HG3 ARG A 35 -5.817 11.579 11.974 1.00 71.20 H new ATOM 0 HD2 ARG A 35 -5.143 10.181 13.817 1.00 61.42 H new ATOM 0 HD3 ARG A 35 -6.647 9.538 13.189 1.00 61.42 H new ATOM 0 HE ARG A 35 -5.540 7.601 12.432 1.00 10.21 H new ATOM 0 HH11 ARG A 35 -3.175 9.925 13.602 1.00 42.20 H new ATOM 0 HH12 ARG A 35 -1.920 8.691 13.756 1.00 42.20 H new ATOM 0 HH21 ARG A 35 -3.951 6.108 12.680 1.00 3.33 H new ATOM 0 HH22 ARG A 35 -2.349 6.590 13.248 1.00 3.33 H new ATOM 558 N GLN A 36 -6.033 9.253 7.388 1.00 21.31 N ATOM 559 CA GLN A 36 -6.579 8.993 6.026 1.00 43.53 C ATOM 560 C GLN A 36 -6.182 7.583 5.531 1.00 54.11 C ATOM 561 O GLN A 36 -6.959 6.909 4.863 1.00 64.42 O ATOM 562 CB GLN A 36 -6.064 10.040 5.003 1.00 40.14 C ATOM 563 CG GLN A 36 -6.303 11.510 5.373 1.00 61.33 C ATOM 564 CD GLN A 36 -7.770 11.896 5.524 1.00 33.25 C ATOM 565 OE1 GLN A 36 -8.659 11.354 4.872 1.00 31.45 O ATOM 566 NE2 GLN A 36 -8.029 12.836 6.401 1.00 51.12 N ATOM 0 H GLN A 36 -5.381 10.037 7.427 1.00 21.31 H new ATOM 0 HA GLN A 36 -7.664 9.064 6.100 1.00 43.53 H new ATOM 0 HB2 GLN A 36 -4.993 9.889 4.865 1.00 40.14 H new ATOM 0 HB3 GLN A 36 -6.540 9.845 4.042 1.00 40.14 H new ATOM 0 HG2 GLN A 36 -5.786 11.724 6.309 1.00 61.33 H new ATOM 0 HG3 GLN A 36 -5.852 12.142 4.608 1.00 61.33 H new ATOM 0 HE21 GLN A 36 -7.268 13.267 6.927 1.00 51.12 H new ATOM 0 HE22 GLN A 36 -8.991 13.136 6.557 1.00 51.12 H new ATOM 575 N LEU A 37 -4.951 7.172 5.884 1.00 55.43 N ATOM 576 CA LEU A 37 -4.375 5.868 5.498 1.00 1.22 C ATOM 577 C LEU A 37 -5.138 4.676 6.124 1.00 13.23 C ATOM 578 O LEU A 37 -5.566 3.769 5.412 1.00 45.50 O ATOM 579 CB LEU A 37 -2.881 5.852 5.905 1.00 74.32 C ATOM 580 CG LEU A 37 -2.079 4.535 5.658 1.00 4.44 C ATOM 581 CD1 LEU A 37 -2.114 4.071 4.184 1.00 53.15 C ATOM 582 CD2 LEU A 37 -0.635 4.709 6.140 1.00 52.22 C ATOM 0 H LEU A 37 -4.321 7.740 6.451 1.00 55.43 H new ATOM 0 HA LEU A 37 -4.470 5.749 4.419 1.00 1.22 H new ATOM 0 HB2 LEU A 37 -2.378 6.657 5.369 1.00 74.32 H new ATOM 0 HB3 LEU A 37 -2.819 6.089 6.967 1.00 74.32 H new ATOM 0 HG LEU A 37 -2.566 3.748 6.234 1.00 4.44 H new ATOM 0 HD11 LEU A 37 -1.539 3.151 4.078 1.00 53.15 H new ATOM 0 HD12 LEU A 37 -3.146 3.890 3.884 1.00 53.15 H new ATOM 0 HD13 LEU A 37 -1.682 4.844 3.549 1.00 53.15 H new ATOM 0 HD21 LEU A 37 -0.080 3.787 5.966 1.00 52.22 H new ATOM 0 HD22 LEU A 37 -0.164 5.525 5.592 1.00 52.22 H new ATOM 0 HD23 LEU A 37 -0.632 4.938 7.206 1.00 52.22 H new ATOM 594 N GLU A 38 -5.351 4.719 7.452 1.00 33.20 N ATOM 595 CA GLU A 38 -6.013 3.614 8.201 1.00 50.34 C ATOM 596 C GLU A 38 -7.526 3.468 7.860 1.00 3.23 C ATOM 597 O GLU A 38 -8.153 2.477 8.259 1.00 23.00 O ATOM 598 CB GLU A 38 -5.819 3.813 9.724 1.00 0.10 C ATOM 599 CG GLU A 38 -6.464 5.096 10.283 1.00 13.53 C ATOM 600 CD GLU A 38 -6.264 5.325 11.789 1.00 44.34 C ATOM 601 OE1 GLU A 38 -5.318 4.762 12.389 1.00 23.43 O ATOM 602 OE2 GLU A 38 -7.046 6.106 12.377 1.00 45.40 O ATOM 0 H GLU A 38 -5.076 5.507 8.038 1.00 33.20 H new ATOM 0 HA GLU A 38 -5.533 2.687 7.888 1.00 50.34 H new ATOM 0 HB2 GLU A 38 -6.237 2.953 10.247 1.00 0.10 H new ATOM 0 HB3 GLU A 38 -4.751 3.832 9.943 1.00 0.10 H new ATOM 0 HG2 GLU A 38 -6.058 5.952 9.744 1.00 13.53 H new ATOM 0 HG3 GLU A 38 -7.534 5.066 10.075 1.00 13.53 H new ATOM 609 N ARG A 39 -8.096 4.451 7.120 1.00 12.31 N ATOM 610 CA ARG A 39 -9.504 4.399 6.651 1.00 22.41 C ATOM 611 C ARG A 39 -9.745 3.225 5.684 1.00 64.32 C ATOM 612 O ARG A 39 -10.794 2.583 5.717 1.00 31.22 O ATOM 613 CB ARG A 39 -9.905 5.713 5.923 1.00 72.42 C ATOM 614 CG ARG A 39 -9.777 6.997 6.758 1.00 53.33 C ATOM 615 CD ARG A 39 -10.561 6.931 8.073 1.00 45.41 C ATOM 616 NE ARG A 39 -10.520 8.212 8.797 1.00 25.42 N ATOM 617 CZ ARG A 39 -9.927 8.438 9.946 1.00 50.40 C ATOM 618 NH1 ARG A 39 -9.241 7.516 10.560 1.00 34.13 N ATOM 619 NH2 ARG A 39 -10.004 9.615 10.463 1.00 43.52 N ATOM 0 H ARG A 39 -7.599 5.294 6.834 1.00 12.31 H new ATOM 0 HA ARG A 39 -10.115 4.264 7.544 1.00 22.41 H new ATOM 0 HB2 ARG A 39 -9.287 5.817 5.031 1.00 72.42 H new ATOM 0 HB3 ARG A 39 -10.938 5.621 5.586 1.00 72.42 H new ATOM 0 HG2 ARG A 39 -8.725 7.179 6.976 1.00 53.33 H new ATOM 0 HG3 ARG A 39 -10.132 7.844 6.171 1.00 53.33 H new ATOM 0 HD2 ARG A 39 -11.597 6.663 7.866 1.00 45.41 H new ATOM 0 HD3 ARG A 39 -10.148 6.143 8.703 1.00 45.41 H new ATOM 0 HE ARG A 39 -10.999 9.001 8.363 1.00 25.42 H new ATOM 0 HH11 ARG A 39 -9.153 6.587 10.149 1.00 34.13 H new ATOM 0 HH12 ARG A 39 -8.792 7.723 11.452 1.00 34.13 H new ATOM 0 HH21 ARG A 39 -10.519 10.351 9.980 1.00 43.52 H new ATOM 0 HH22 ARG A 39 -9.550 9.811 11.355 1.00 43.52 H new ATOM 633 N TRP A 40 -8.749 2.968 4.829 1.00 0.33 N ATOM 634 CA TRP A 40 -8.866 2.024 3.698 1.00 53.14 C ATOM 635 C TRP A 40 -7.818 0.895 3.762 1.00 43.35 C ATOM 636 O TRP A 40 -8.049 -0.164 3.197 1.00 54.00 O ATOM 637 CB TRP A 40 -8.708 2.808 2.372 1.00 34.13 C ATOM 638 CG TRP A 40 -7.372 3.514 2.230 1.00 74.32 C ATOM 639 CD1 TRP A 40 -7.037 4.751 2.700 1.00 1.15 C ATOM 640 CD2 TRP A 40 -6.197 3.010 1.574 1.00 62.35 C ATOM 641 NE1 TRP A 40 -5.736 5.037 2.381 1.00 12.51 N ATOM 642 CE2 TRP A 40 -5.206 3.994 1.677 1.00 22.22 C ATOM 643 CE3 TRP A 40 -5.899 1.820 0.905 1.00 33.22 C ATOM 644 CZ2 TRP A 40 -3.940 3.826 1.132 1.00 35.13 C ATOM 645 CZ3 TRP A 40 -4.649 1.652 0.363 1.00 20.54 C ATOM 646 CH2 TRP A 40 -3.682 2.652 0.480 1.00 64.22 C ATOM 0 H TRP A 40 -7.832 3.409 4.898 1.00 0.33 H new ATOM 0 HA TRP A 40 -9.848 1.553 3.754 1.00 53.14 H new ATOM 0 HB2 TRP A 40 -8.834 2.119 1.537 1.00 34.13 H new ATOM 0 HB3 TRP A 40 -9.507 3.546 2.300 1.00 34.13 H new ATOM 0 HD1 TRP A 40 -7.700 5.408 3.243 1.00 1.15 H new ATOM 0 HE1 TRP A 40 -5.241 5.894 2.630 1.00 12.51 H new ATOM 0 HE3 TRP A 40 -6.643 1.042 0.815 1.00 33.22 H new ATOM 0 HZ2 TRP A 40 -3.186 4.595 1.220 1.00 35.13 H new ATOM 0 HZ3 TRP A 40 -4.411 0.737 -0.159 1.00 20.54 H new ATOM 0 HH2 TRP A 40 -2.706 2.495 0.045 1.00 64.22 H new ATOM 657 N TRP A 41 -6.668 1.156 4.444 1.00 4.01 N ATOM 658 CA TRP A 41 -5.453 0.275 4.434 1.00 74.22 C ATOM 659 C TRP A 41 -5.771 -1.206 4.740 1.00 63.42 C ATOM 660 O TRP A 41 -5.155 -2.123 4.179 1.00 1.14 O ATOM 661 CB TRP A 41 -4.401 0.817 5.439 1.00 12.41 C ATOM 662 CG TRP A 41 -3.061 0.118 5.380 1.00 45.12 C ATOM 663 CD1 TRP A 41 -2.455 -0.626 6.358 1.00 52.54 C ATOM 664 CD2 TRP A 41 -2.180 0.077 4.249 1.00 2.41 C ATOM 665 NE1 TRP A 41 -1.238 -1.073 5.919 1.00 0.32 N ATOM 666 CE2 TRP A 41 -1.055 -0.669 4.623 1.00 24.32 C ATOM 667 CE3 TRP A 41 -2.237 0.607 2.957 1.00 41.22 C ATOM 668 CZ2 TRP A 41 0.005 -0.890 3.756 1.00 31.54 C ATOM 669 CZ3 TRP A 41 -1.191 0.382 2.092 1.00 21.12 C ATOM 670 CH2 TRP A 41 -0.081 -0.364 2.492 1.00 11.44 C ATOM 0 H TRP A 41 -6.552 1.988 5.022 1.00 4.01 H new ATOM 0 HA TRP A 41 -5.051 0.301 3.421 1.00 74.22 H new ATOM 0 HB2 TRP A 41 -4.251 1.880 5.251 1.00 12.41 H new ATOM 0 HB3 TRP A 41 -4.801 0.725 6.449 1.00 12.41 H new ATOM 0 HD1 TRP A 41 -2.876 -0.830 7.332 1.00 52.54 H new ATOM 0 HE1 TRP A 41 -0.574 -1.619 6.468 1.00 0.32 H new ATOM 0 HE3 TRP A 41 -3.092 1.186 2.641 1.00 41.22 H new ATOM 0 HZ2 TRP A 41 0.870 -1.458 4.066 1.00 31.54 H new ATOM 0 HZ3 TRP A 41 -1.229 0.787 1.092 1.00 21.12 H new ATOM 0 HH2 TRP A 41 0.725 -0.530 1.793 1.00 11.44 H new ATOM 681 N GLY A 42 -6.732 -1.416 5.643 1.00 31.44 N ATOM 682 CA GLY A 42 -7.278 -2.745 5.908 1.00 25.11 C ATOM 683 C GLY A 42 -8.578 -3.006 5.124 1.00 2.43 C ATOM 684 O GLY A 42 -9.349 -2.062 4.892 1.00 54.13 O ATOM 0 H GLY A 42 -7.149 -0.675 6.206 1.00 31.44 H new ATOM 0 HA2 GLY A 42 -6.538 -3.500 5.643 1.00 25.11 H new ATOM 0 HA3 GLY A 42 -7.472 -2.850 6.975 1.00 25.11 H new ATOM 688 N PRO A 43 -8.872 -4.292 4.719 1.00 1.02 N ATOM 689 CA PRO A 43 -10.110 -4.637 3.955 1.00 31.55 C ATOM 690 C PRO A 43 -11.423 -4.350 4.766 1.00 61.23 C ATOM 691 O PRO A 43 -11.360 -4.174 5.989 1.00 14.12 O ATOM 692 CB PRO A 43 -9.923 -6.159 3.655 1.00 52.41 C ATOM 693 CG PRO A 43 -8.993 -6.644 4.725 1.00 22.24 C ATOM 694 CD PRO A 43 -8.036 -5.495 4.978 1.00 74.10 C ATOM 0 HA PRO A 43 -10.230 -4.034 3.055 1.00 31.55 H new ATOM 0 HB2 PRO A 43 -10.875 -6.689 3.687 1.00 52.41 H new ATOM 0 HB3 PRO A 43 -9.502 -6.319 2.662 1.00 52.41 H new ATOM 0 HG2 PRO A 43 -9.539 -6.907 5.631 1.00 22.24 H new ATOM 0 HG3 PRO A 43 -8.458 -7.538 4.405 1.00 22.24 H new ATOM 0 HD2 PRO A 43 -7.653 -5.507 5.999 1.00 74.10 H new ATOM 0 HD3 PRO A 43 -7.173 -5.536 4.313 1.00 74.10 H new ATOM 702 N PRO A 44 -12.632 -4.289 4.090 1.00 25.45 N ATOM 703 CA PRO A 44 -13.958 -4.019 4.761 1.00 4.33 C ATOM 704 C PRO A 44 -14.248 -4.840 6.061 1.00 51.43 C ATOM 705 O PRO A 44 -15.041 -4.414 6.908 1.00 3.42 O ATOM 706 CB PRO A 44 -14.973 -4.384 3.645 1.00 23.41 C ATOM 707 CG PRO A 44 -14.255 -4.041 2.374 1.00 62.22 C ATOM 708 CD PRO A 44 -12.806 -4.429 2.606 1.00 73.42 C ATOM 0 HA PRO A 44 -14.000 -2.992 5.125 1.00 4.33 H new ATOM 0 HB2 PRO A 44 -15.241 -5.440 3.679 1.00 23.41 H new ATOM 0 HB3 PRO A 44 -15.898 -3.817 3.746 1.00 23.41 H new ATOM 0 HG2 PRO A 44 -14.675 -4.584 1.528 1.00 62.22 H new ATOM 0 HG3 PRO A 44 -14.345 -2.979 2.148 1.00 62.22 H new ATOM 0 HD2 PRO A 44 -12.606 -5.448 2.274 1.00 73.42 H new ATOM 0 HD3 PRO A 44 -12.125 -3.777 2.060 1.00 73.42 H new ATOM 716 N THR A 45 -13.600 -6.016 6.194 1.00 23.33 N ATOM 717 CA THR A 45 -13.749 -6.917 7.367 1.00 55.24 C ATOM 718 C THR A 45 -12.676 -6.660 8.467 1.00 13.52 C ATOM 719 O THR A 45 -12.944 -6.855 9.660 1.00 30.12 O ATOM 720 CB THR A 45 -13.688 -8.414 6.907 1.00 52.11 C ATOM 721 OG1 THR A 45 -12.476 -8.643 6.159 1.00 54.30 O ATOM 722 CG2 THR A 45 -14.903 -8.791 6.037 1.00 24.04 C ATOM 0 H THR A 45 -12.954 -6.373 5.490 1.00 23.33 H new ATOM 0 HA THR A 45 -14.721 -6.701 7.809 1.00 55.24 H new ATOM 0 HB THR A 45 -13.703 -9.038 7.800 1.00 52.11 H new ATOM 0 HG1 THR A 45 -12.440 -9.580 5.874 1.00 54.30 H new ATOM 0 HG21 THR A 45 -14.826 -9.836 5.737 1.00 24.04 H new ATOM 0 HG22 THR A 45 -15.819 -8.644 6.609 1.00 24.04 H new ATOM 0 HG23 THR A 45 -14.925 -8.159 5.149 1.00 24.04 H new ATOM 730 N TRP A 46 -11.462 -6.229 8.057 1.00 63.32 N ATOM 731 CA TRP A 46 -10.305 -5.993 8.977 1.00 20.53 C ATOM 732 C TRP A 46 -9.808 -4.517 8.907 1.00 74.51 C ATOM 733 O TRP A 46 -8.902 -4.215 8.130 1.00 2.54 O ATOM 734 CB TRP A 46 -9.135 -6.966 8.628 1.00 21.51 C ATOM 735 CG TRP A 46 -9.356 -8.404 9.045 1.00 15.53 C ATOM 736 CD1 TRP A 46 -10.310 -9.275 8.593 1.00 14.44 C ATOM 737 CD2 TRP A 46 -8.572 -9.138 9.990 1.00 32.32 C ATOM 738 NE1 TRP A 46 -10.194 -10.476 9.241 1.00 13.22 N ATOM 739 CE2 TRP A 46 -9.130 -10.421 10.090 1.00 41.22 C ATOM 740 CE3 TRP A 46 -7.459 -8.827 10.765 1.00 35.14 C ATOM 741 CZ2 TRP A 46 -8.619 -11.388 10.938 1.00 72.10 C ATOM 742 CZ3 TRP A 46 -6.946 -9.791 11.605 1.00 24.12 C ATOM 743 CH2 TRP A 46 -7.527 -11.059 11.687 1.00 65.43 C ATOM 0 H TRP A 46 -11.247 -6.032 7.079 1.00 63.32 H new ATOM 0 HA TRP A 46 -10.645 -6.184 9.995 1.00 20.53 H new ATOM 0 HB2 TRP A 46 -8.967 -6.937 7.551 1.00 21.51 H new ATOM 0 HB3 TRP A 46 -8.224 -6.601 9.103 1.00 21.51 H new ATOM 0 HD1 TRP A 46 -11.046 -9.048 7.836 1.00 14.44 H new ATOM 0 HE1 TRP A 46 -10.806 -11.282 9.109 1.00 13.22 H new ATOM 0 HE3 TRP A 46 -7.006 -7.848 10.709 1.00 35.14 H new ATOM 0 HZ2 TRP A 46 -9.068 -12.368 11.005 1.00 72.10 H new ATOM 0 HZ3 TRP A 46 -6.081 -9.563 12.210 1.00 24.12 H new ATOM 0 HH2 TRP A 46 -7.103 -11.793 12.356 1.00 65.43 H new ATOM 754 N PRO A 47 -10.407 -3.566 9.702 1.00 72.34 N ATOM 755 CA PRO A 47 -9.950 -2.145 9.738 1.00 32.12 C ATOM 756 C PRO A 47 -8.525 -1.973 10.355 1.00 34.23 C ATOM 757 O PRO A 47 -8.224 -2.521 11.424 1.00 72.32 O ATOM 758 CB PRO A 47 -11.040 -1.446 10.604 1.00 33.22 C ATOM 759 CG PRO A 47 -11.605 -2.545 11.461 1.00 3.31 C ATOM 760 CD PRO A 47 -11.583 -3.787 10.592 1.00 73.00 C ATOM 0 HA PRO A 47 -9.849 -1.721 8.739 1.00 32.12 H new ATOM 0 HB2 PRO A 47 -10.612 -0.649 11.212 1.00 33.22 H new ATOM 0 HB3 PRO A 47 -11.811 -0.993 9.981 1.00 33.22 H new ATOM 0 HG2 PRO A 47 -11.009 -2.686 12.362 1.00 3.31 H new ATOM 0 HG3 PRO A 47 -12.619 -2.309 11.783 1.00 3.31 H new ATOM 0 HD2 PRO A 47 -11.471 -4.693 11.188 1.00 73.00 H new ATOM 0 HD3 PRO A 47 -12.505 -3.894 10.020 1.00 73.00 H new ATOM 768 N ALA A 48 -7.659 -1.195 9.665 1.00 44.12 N ATOM 769 CA ALA A 48 -6.266 -0.943 10.106 1.00 74.43 C ATOM 770 C ALA A 48 -6.202 0.136 11.217 1.00 15.12 C ATOM 771 O ALA A 48 -7.071 1.009 11.307 1.00 55.12 O ATOM 772 CB ALA A 48 -5.400 -0.534 8.901 1.00 44.44 C ATOM 0 H ALA A 48 -7.903 -0.727 8.792 1.00 44.12 H new ATOM 0 HA ALA A 48 -5.874 -1.867 10.530 1.00 74.43 H new ATOM 0 HB1 ALA A 48 -4.378 -0.351 9.233 1.00 44.44 H new ATOM 0 HB2 ALA A 48 -5.403 -1.335 8.162 1.00 44.44 H new ATOM 0 HB3 ALA A 48 -5.805 0.374 8.454 1.00 44.44 H new ATOM 778 N THR A 49 -5.163 0.053 12.065 1.00 43.43 N ATOM 779 CA THR A 49 -4.925 0.998 13.187 1.00 31.02 C ATOM 780 C THR A 49 -3.423 1.350 13.269 1.00 54.12 C ATOM 781 O THR A 49 -2.601 0.483 13.578 1.00 14.41 O ATOM 782 CB THR A 49 -5.398 0.382 14.557 1.00 43.11 C ATOM 783 OG1 THR A 49 -6.797 0.050 14.502 1.00 22.50 O ATOM 784 CG2 THR A 49 -5.154 1.335 15.744 1.00 4.31 C ATOM 0 H THR A 49 -4.454 -0.677 11.996 1.00 43.43 H new ATOM 0 HA THR A 49 -5.504 1.902 12.997 1.00 31.02 H new ATOM 0 HB THR A 49 -4.804 -0.518 14.717 1.00 43.11 H new ATOM 0 HG1 THR A 49 -7.076 -0.333 15.360 1.00 22.50 H new ATOM 0 HG21 THR A 49 -5.497 0.864 16.665 1.00 4.31 H new ATOM 0 HG22 THR A 49 -4.089 1.553 15.823 1.00 4.31 H new ATOM 0 HG23 THR A 49 -5.703 2.263 15.585 1.00 4.31 H new ATOM 792 N PHE A 50 -3.069 2.621 12.981 1.00 13.21 N ATOM 793 CA PHE A 50 -1.662 3.101 12.991 1.00 32.14 C ATOM 794 C PHE A 50 -1.288 3.766 14.338 1.00 44.51 C ATOM 795 O PHE A 50 -1.845 4.804 14.713 1.00 30.42 O ATOM 796 CB PHE A 50 -1.401 4.066 11.791 1.00 50.43 C ATOM 797 CG PHE A 50 -1.150 3.328 10.474 1.00 44.25 C ATOM 798 CD1 PHE A 50 -2.202 2.738 9.770 1.00 73.13 C ATOM 799 CD2 PHE A 50 0.145 3.195 9.965 1.00 32.41 C ATOM 800 CE1 PHE A 50 -1.967 2.039 8.604 1.00 53.31 C ATOM 801 CE2 PHE A 50 0.378 2.499 8.795 1.00 13.45 C ATOM 802 CZ PHE A 50 -0.678 1.918 8.116 1.00 23.41 C ATOM 0 H PHE A 50 -3.745 3.344 12.735 1.00 13.21 H new ATOM 0 HA PHE A 50 -1.016 2.231 12.877 1.00 32.14 H new ATOM 0 HB2 PHE A 50 -2.258 4.729 11.672 1.00 50.43 H new ATOM 0 HB3 PHE A 50 -0.540 4.695 12.018 1.00 50.43 H new ATOM 0 HD1 PHE A 50 -3.211 2.830 10.143 1.00 73.13 H new ATOM 0 HD2 PHE A 50 0.974 3.642 10.493 1.00 32.41 H new ATOM 0 HE1 PHE A 50 -2.790 1.586 8.072 1.00 53.31 H new ATOM 0 HE2 PHE A 50 1.383 2.408 8.411 1.00 13.45 H new ATOM 0 HZ PHE A 50 -0.496 1.369 7.204 1.00 23.41 H new ATOM 812 N GLU A 51 -0.336 3.138 15.052 1.00 32.03 N ATOM 813 CA GLU A 51 0.276 3.684 16.283 1.00 0.44 C ATOM 814 C GLU A 51 1.337 4.732 15.951 1.00 15.34 C ATOM 815 O GLU A 51 1.406 5.795 16.578 1.00 31.21 O ATOM 816 CB GLU A 51 0.919 2.537 17.104 1.00 72.32 C ATOM 817 CG GLU A 51 -0.046 1.402 17.485 1.00 33.23 C ATOM 818 CD GLU A 51 -1.249 1.869 18.325 1.00 61.41 C ATOM 819 OE1 GLU A 51 -1.075 2.126 19.535 1.00 71.32 O ATOM 820 OE2 GLU A 51 -2.367 1.994 17.779 1.00 52.32 O ATOM 0 H GLU A 51 0.036 2.225 14.789 1.00 32.03 H new ATOM 0 HA GLU A 51 -0.509 4.161 16.870 1.00 0.44 H new ATOM 0 HB2 GLU A 51 1.745 2.116 16.530 1.00 72.32 H new ATOM 0 HB3 GLU A 51 1.345 2.955 18.016 1.00 72.32 H new ATOM 0 HG2 GLU A 51 -0.412 0.927 16.575 1.00 33.23 H new ATOM 0 HG3 GLU A 51 0.502 0.642 18.042 1.00 33.23 H new ATOM 827 N THR A 52 2.159 4.413 14.953 1.00 52.32 N ATOM 828 CA THR A 52 3.270 5.266 14.523 1.00 32.33 C ATOM 829 C THR A 52 3.237 5.430 12.995 1.00 22.11 C ATOM 830 O THR A 52 2.862 4.490 12.287 1.00 51.11 O ATOM 831 CB THR A 52 4.638 4.641 14.961 1.00 4.50 C ATOM 832 OG1 THR A 52 4.611 4.335 16.366 1.00 43.32 O ATOM 833 CG2 THR A 52 5.810 5.585 14.682 1.00 31.42 C ATOM 0 H THR A 52 2.074 3.550 14.415 1.00 52.32 H new ATOM 0 HA THR A 52 3.165 6.244 14.994 1.00 32.33 H new ATOM 0 HB THR A 52 4.781 3.731 14.378 1.00 4.50 H new ATOM 0 HG1 THR A 52 5.469 3.943 16.632 1.00 43.32 H new ATOM 0 HG21 THR A 52 6.740 5.114 15.000 1.00 31.42 H new ATOM 0 HG22 THR A 52 5.858 5.799 13.614 1.00 31.42 H new ATOM 0 HG23 THR A 52 5.667 6.515 15.233 1.00 31.42 H new ATOM 841 N HIS A 53 3.592 6.633 12.506 1.00 42.23 N ATOM 842 CA HIS A 53 3.670 6.932 11.061 1.00 23.22 C ATOM 843 C HIS A 53 4.473 8.237 10.835 1.00 73.31 C ATOM 844 O HIS A 53 3.922 9.337 10.920 1.00 64.45 O ATOM 845 CB HIS A 53 2.232 7.034 10.497 1.00 45.13 C ATOM 846 CG HIS A 53 2.119 7.288 9.017 1.00 30.34 C ATOM 847 ND1 HIS A 53 2.154 8.563 8.513 1.00 45.50 N ATOM 848 CD2 HIS A 53 1.909 6.420 8.001 1.00 54.24 C ATOM 849 CE1 HIS A 53 1.962 8.447 7.222 1.00 40.13 C ATOM 850 NE2 HIS A 53 1.808 7.169 6.860 1.00 64.11 N ATOM 0 H HIS A 53 3.833 7.426 13.100 1.00 42.23 H new ATOM 0 HA HIS A 53 4.193 6.135 10.533 1.00 23.22 H new ATOM 0 HB2 HIS A 53 1.706 6.107 10.728 1.00 45.13 H new ATOM 0 HB3 HIS A 53 1.713 7.835 11.023 1.00 45.13 H new ATOM 0 HD2 HIS A 53 1.835 5.345 8.076 1.00 54.24 H new ATOM 0 HE1 HIS A 53 1.932 9.280 6.536 1.00 40.13 H new ATOM 0 HE2 HIS A 53 1.646 6.820 5.915 1.00 64.11 H new ATOM 858 N GLU A 54 5.793 8.103 10.612 1.00 10.32 N ATOM 859 CA GLU A 54 6.708 9.265 10.453 1.00 11.54 C ATOM 860 C GLU A 54 6.456 10.013 9.126 1.00 52.21 C ATOM 861 O GLU A 54 6.358 11.242 9.098 1.00 54.04 O ATOM 862 CB GLU A 54 8.190 8.794 10.507 1.00 42.41 C ATOM 863 CG GLU A 54 8.588 8.041 11.789 1.00 71.22 C ATOM 864 CD GLU A 54 8.351 8.850 13.071 1.00 43.14 C ATOM 865 OE1 GLU A 54 9.138 9.776 13.351 1.00 5.40 O ATOM 866 OE2 GLU A 54 7.369 8.570 13.793 1.00 32.40 O ATOM 0 H GLU A 54 6.259 7.199 10.536 1.00 10.32 H new ATOM 0 HA GLU A 54 6.508 9.952 11.276 1.00 11.54 H new ATOM 0 HB2 GLU A 54 8.381 8.148 9.650 1.00 42.41 H new ATOM 0 HB3 GLU A 54 8.836 9.665 10.400 1.00 42.41 H new ATOM 0 HG2 GLU A 54 8.022 7.111 11.846 1.00 71.22 H new ATOM 0 HG3 GLU A 54 9.642 7.770 11.729 1.00 71.22 H new ATOM 873 N PHE A 55 6.339 9.219 8.048 1.00 14.43 N ATOM 874 CA PHE A 55 6.277 9.692 6.651 1.00 53.41 C ATOM 875 C PHE A 55 7.501 10.579 6.303 1.00 22.02 C ATOM 876 O PHE A 55 7.384 11.794 6.135 1.00 50.21 O ATOM 877 CB PHE A 55 4.923 10.394 6.330 1.00 24.42 C ATOM 878 CG PHE A 55 4.601 10.417 4.834 1.00 2.43 C ATOM 879 CD1 PHE A 55 4.155 9.260 4.202 1.00 61.12 C ATOM 880 CD2 PHE A 55 4.767 11.562 4.061 1.00 1.14 C ATOM 881 CE1 PHE A 55 3.880 9.244 2.852 1.00 64.15 C ATOM 882 CE2 PHE A 55 4.485 11.546 2.708 1.00 70.04 C ATOM 883 CZ PHE A 55 4.043 10.384 2.108 1.00 14.40 C ATOM 0 H PHE A 55 6.283 8.203 8.124 1.00 14.43 H new ATOM 0 HA PHE A 55 6.324 8.815 6.006 1.00 53.41 H new ATOM 0 HB2 PHE A 55 4.120 9.883 6.861 1.00 24.42 H new ATOM 0 HB3 PHE A 55 4.952 11.417 6.705 1.00 24.42 H new ATOM 0 HD1 PHE A 55 4.022 8.358 4.781 1.00 61.12 H new ATOM 0 HD2 PHE A 55 5.120 12.472 4.523 1.00 1.14 H new ATOM 0 HE1 PHE A 55 3.537 8.335 2.381 1.00 64.15 H new ATOM 0 HE2 PHE A 55 4.611 12.443 2.120 1.00 70.04 H new ATOM 0 HZ PHE A 55 3.825 10.373 1.050 1.00 14.40 H new ATOM 893 N THR A 56 8.682 9.937 6.249 1.00 71.31 N ATOM 894 CA THR A 56 9.971 10.601 5.924 1.00 42.35 C ATOM 895 C THR A 56 11.040 9.551 5.552 1.00 70.34 C ATOM 896 O THR A 56 10.910 8.380 5.911 1.00 2.23 O ATOM 897 CB THR A 56 10.494 11.492 7.106 1.00 65.31 C ATOM 898 OG1 THR A 56 11.743 12.113 6.751 1.00 61.42 O ATOM 899 CG2 THR A 56 10.669 10.692 8.409 1.00 52.32 C ATOM 0 H THR A 56 8.776 8.938 6.430 1.00 71.31 H new ATOM 0 HA THR A 56 9.786 11.254 5.071 1.00 42.35 H new ATOM 0 HB THR A 56 9.738 12.257 7.284 1.00 65.31 H new ATOM 0 HG1 THR A 56 12.056 12.667 7.496 1.00 61.42 H new ATOM 0 HG21 THR A 56 11.032 11.353 9.196 1.00 52.32 H new ATOM 0 HG22 THR A 56 9.710 10.267 8.706 1.00 52.32 H new ATOM 0 HG23 THR A 56 11.388 9.889 8.249 1.00 52.32 H new ATOM 907 N VAL A 57 12.105 9.986 4.856 1.00 15.14 N ATOM 908 CA VAL A 57 13.189 9.091 4.388 1.00 64.20 C ATOM 909 C VAL A 57 13.962 8.479 5.596 1.00 21.45 C ATOM 910 O VAL A 57 14.552 9.208 6.405 1.00 74.11 O ATOM 911 CB VAL A 57 14.174 9.869 3.434 1.00 34.32 C ATOM 912 CG1 VAL A 57 15.355 8.974 2.978 1.00 0.14 C ATOM 913 CG2 VAL A 57 13.410 10.462 2.212 1.00 4.23 C ATOM 0 H VAL A 57 12.243 10.964 4.600 1.00 15.14 H new ATOM 0 HA VAL A 57 12.738 8.274 3.825 1.00 64.20 H new ATOM 0 HB VAL A 57 14.598 10.697 4.002 1.00 34.32 H new ATOM 0 HG11 VAL A 57 16.012 9.545 2.322 1.00 0.14 H new ATOM 0 HG12 VAL A 57 15.916 8.639 3.851 1.00 0.14 H new ATOM 0 HG13 VAL A 57 14.969 8.108 2.440 1.00 0.14 H new ATOM 0 HG21 VAL A 57 14.110 10.994 1.568 1.00 4.23 H new ATOM 0 HG22 VAL A 57 12.941 9.655 1.649 1.00 4.23 H new ATOM 0 HG23 VAL A 57 12.643 11.153 2.563 1.00 4.23 H new ATOM 923 N GLY A 58 13.913 7.139 5.716 1.00 14.34 N ATOM 924 CA GLY A 58 14.528 6.412 6.846 1.00 4.12 C ATOM 925 C GLY A 58 13.548 6.128 7.993 1.00 72.24 C ATOM 926 O GLY A 58 13.789 5.230 8.811 1.00 41.22 O ATOM 0 H GLY A 58 13.450 6.533 5.039 1.00 14.34 H new ATOM 0 HA2 GLY A 58 14.935 5.468 6.483 1.00 4.12 H new ATOM 0 HA3 GLY A 58 15.366 6.994 7.230 1.00 4.12 H new ATOM 930 N GLY A 59 12.426 6.877 8.031 1.00 2.10 N ATOM 931 CA GLY A 59 11.421 6.749 9.098 1.00 73.33 C ATOM 932 C GLY A 59 10.438 5.610 8.849 1.00 52.14 C ATOM 933 O GLY A 59 10.234 5.198 7.707 1.00 22.35 O ATOM 0 H GLY A 59 12.196 7.580 7.329 1.00 2.10 H new ATOM 0 HA2 GLY A 59 11.927 6.585 10.050 1.00 73.33 H new ATOM 0 HA3 GLY A 59 10.870 7.685 9.187 1.00 73.33 H new ATOM 937 N LYS A 60 9.810 5.101 9.923 1.00 65.31 N ATOM 938 CA LYS A 60 8.968 3.881 9.862 1.00 62.35 C ATOM 939 C LYS A 60 7.521 4.130 10.353 1.00 3.42 C ATOM 940 O LYS A 60 7.182 5.214 10.845 1.00 22.01 O ATOM 941 CB LYS A 60 9.650 2.737 10.673 1.00 41.41 C ATOM 942 CG LYS A 60 11.001 2.267 10.078 1.00 45.34 C ATOM 943 CD LYS A 60 11.604 1.041 10.807 1.00 60.11 C ATOM 944 CE LYS A 60 12.928 0.573 10.169 1.00 31.30 C ATOM 945 NZ LYS A 60 13.529 -0.576 10.887 1.00 14.24 N ATOM 0 H LYS A 60 9.867 5.515 10.853 1.00 65.31 H new ATOM 0 HA LYS A 60 8.884 3.584 8.817 1.00 62.35 H new ATOM 0 HB2 LYS A 60 9.813 3.077 11.696 1.00 41.41 H new ATOM 0 HB3 LYS A 60 8.971 1.886 10.724 1.00 41.41 H new ATOM 0 HG2 LYS A 60 10.859 2.021 9.026 1.00 45.34 H new ATOM 0 HG3 LYS A 60 11.713 3.091 10.119 1.00 45.34 H new ATOM 0 HD2 LYS A 60 11.776 1.292 11.854 1.00 60.11 H new ATOM 0 HD3 LYS A 60 10.886 0.221 10.790 1.00 60.11 H new ATOM 0 HE2 LYS A 60 12.749 0.295 9.130 1.00 31.30 H new ATOM 0 HE3 LYS A 60 13.636 1.402 10.159 1.00 31.30 H new ATOM 0 HZ1 LYS A 60 14.416 -0.852 10.419 1.00 14.24 H new ATOM 0 HZ2 LYS A 60 13.726 -0.305 11.872 1.00 14.24 H new ATOM 0 HZ3 LYS A 60 12.867 -1.378 10.875 1.00 14.24 H new ATOM 959 N ALA A 61 6.666 3.104 10.183 1.00 25.12 N ATOM 960 CA ALA A 61 5.256 3.134 10.624 1.00 0.11 C ATOM 961 C ALA A 61 4.860 1.783 11.263 1.00 1.01 C ATOM 962 O ALA A 61 5.182 0.719 10.730 1.00 54.43 O ATOM 963 CB ALA A 61 4.319 3.493 9.453 1.00 1.35 C ATOM 0 H ALA A 61 6.933 2.228 9.735 1.00 25.12 H new ATOM 0 HA ALA A 61 5.150 3.911 11.381 1.00 0.11 H new ATOM 0 HB1 ALA A 61 3.287 3.508 9.804 1.00 1.35 H new ATOM 0 HB2 ALA A 61 4.584 4.476 9.063 1.00 1.35 H new ATOM 0 HB3 ALA A 61 4.422 2.749 8.663 1.00 1.35 H new ATOM 969 N ALA A 62 4.163 1.847 12.409 1.00 33.25 N ATOM 970 CA ALA A 62 3.722 0.657 13.170 1.00 53.44 C ATOM 971 C ALA A 62 2.188 0.569 13.145 1.00 31.21 C ATOM 972 O ALA A 62 1.507 1.550 13.471 1.00 1.24 O ATOM 973 CB ALA A 62 4.233 0.731 14.620 1.00 35.22 C ATOM 0 H ALA A 62 3.886 2.729 12.840 1.00 33.25 H new ATOM 0 HA ALA A 62 4.137 -0.238 12.707 1.00 53.44 H new ATOM 0 HB1 ALA A 62 3.901 -0.151 15.168 1.00 35.22 H new ATOM 0 HB2 ALA A 62 5.322 0.770 14.620 1.00 35.22 H new ATOM 0 HB3 ALA A 62 3.838 1.626 15.100 1.00 35.22 H new ATOM 979 N TYR A 63 1.649 -0.603 12.761 1.00 42.44 N ATOM 980 CA TYR A 63 0.191 -0.799 12.615 1.00 51.34 C ATOM 981 C TYR A 63 -0.250 -2.247 12.904 1.00 14.04 C ATOM 982 O TYR A 63 0.565 -3.168 12.998 1.00 0.33 O ATOM 983 CB TYR A 63 -0.274 -0.368 11.196 1.00 2.03 C ATOM 984 CG TYR A 63 0.375 -1.130 10.014 1.00 53.32 C ATOM 985 CD1 TYR A 63 1.608 -0.726 9.483 1.00 11.41 C ATOM 986 CD2 TYR A 63 -0.252 -2.235 9.424 1.00 74.51 C ATOM 987 CE1 TYR A 63 2.186 -1.392 8.420 1.00 65.11 C ATOM 988 CE2 TYR A 63 0.328 -2.904 8.363 1.00 14.25 C ATOM 989 CZ TYR A 63 1.545 -2.477 7.862 1.00 21.53 C ATOM 990 OH TYR A 63 2.128 -3.145 6.803 1.00 32.22 O ATOM 0 H TYR A 63 2.202 -1.432 12.545 1.00 42.44 H new ATOM 0 HA TYR A 63 -0.287 -0.167 13.363 1.00 51.34 H new ATOM 0 HB2 TYR A 63 -1.355 -0.493 11.135 1.00 2.03 H new ATOM 0 HB3 TYR A 63 -0.069 0.696 11.074 1.00 2.03 H new ATOM 0 HD1 TYR A 63 2.116 0.124 9.914 1.00 11.41 H new ATOM 0 HD2 TYR A 63 -1.205 -2.570 9.805 1.00 74.51 H new ATOM 0 HE1 TYR A 63 3.137 -1.064 8.027 1.00 65.11 H new ATOM 0 HE2 TYR A 63 -0.168 -3.758 7.926 1.00 14.25 H new ATOM 0 HH TYR A 63 2.761 -3.811 7.145 1.00 32.22 H new ATOM 1000 N TYR A 64 -1.576 -2.408 13.038 1.00 14.12 N ATOM 1001 CA TYR A 64 -2.248 -3.714 13.152 1.00 42.01 C ATOM 1002 C TYR A 64 -3.707 -3.599 12.658 1.00 14.15 C ATOM 1003 O TYR A 64 -4.368 -2.582 12.893 1.00 55.40 O ATOM 1004 CB TYR A 64 -2.195 -4.258 14.615 1.00 11.25 C ATOM 1005 CG TYR A 64 -2.703 -3.272 15.687 1.00 74.22 C ATOM 1006 CD1 TYR A 64 -1.851 -2.310 16.235 1.00 45.21 C ATOM 1007 CD2 TYR A 64 -4.027 -3.295 16.145 1.00 21.14 C ATOM 1008 CE1 TYR A 64 -2.294 -1.423 17.185 1.00 21.21 C ATOM 1009 CE2 TYR A 64 -4.472 -2.400 17.100 1.00 33.51 C ATOM 1010 CZ TYR A 64 -3.597 -1.467 17.617 1.00 2.12 C ATOM 1011 OH TYR A 64 -4.027 -0.560 18.565 1.00 1.05 O ATOM 0 H TYR A 64 -2.224 -1.621 13.071 1.00 14.12 H new ATOM 0 HA TYR A 64 -1.718 -4.429 12.523 1.00 42.01 H new ATOM 0 HB2 TYR A 64 -2.788 -5.171 14.671 1.00 11.25 H new ATOM 0 HB3 TYR A 64 -1.166 -4.531 14.850 1.00 11.25 H new ATOM 0 HD1 TYR A 64 -0.824 -2.263 15.905 1.00 45.21 H new ATOM 0 HD2 TYR A 64 -4.713 -4.026 15.744 1.00 21.14 H new ATOM 0 HE1 TYR A 64 -1.616 -0.689 17.594 1.00 21.21 H new ATOM 0 HE2 TYR A 64 -5.497 -2.431 17.439 1.00 33.51 H new ATOM 0 HH TYR A 64 -3.573 0.297 18.427 1.00 1.05 H new ATOM 1021 N MET A 65 -4.191 -4.631 11.954 1.00 60.25 N ATOM 1022 CA MET A 65 -5.600 -4.711 11.514 1.00 11.24 C ATOM 1023 C MET A 65 -6.439 -5.414 12.596 1.00 31.13 C ATOM 1024 O MET A 65 -6.291 -6.620 12.813 1.00 5.11 O ATOM 1025 CB MET A 65 -5.707 -5.461 10.162 1.00 52.44 C ATOM 1026 CG MET A 65 -4.963 -4.782 8.999 1.00 34.44 C ATOM 1027 SD MET A 65 -5.085 -5.705 7.451 1.00 74.41 S ATOM 1028 CE MET A 65 -4.303 -7.264 7.883 1.00 2.54 C ATOM 0 H MET A 65 -3.625 -5.432 11.672 1.00 60.25 H new ATOM 0 HA MET A 65 -5.986 -3.702 11.368 1.00 11.24 H new ATOM 0 HB2 MET A 65 -5.315 -6.470 10.288 1.00 52.44 H new ATOM 0 HB3 MET A 65 -6.760 -5.558 9.897 1.00 52.44 H new ATOM 0 HG2 MET A 65 -5.367 -3.780 8.852 1.00 34.44 H new ATOM 0 HG3 MET A 65 -3.912 -4.666 9.265 1.00 34.44 H new ATOM 0 HE1 MET A 65 -3.673 -7.596 7.058 1.00 2.54 H new ATOM 0 HE2 MET A 65 -3.692 -7.129 8.775 1.00 2.54 H new ATOM 0 HE3 MET A 65 -5.070 -8.014 8.078 1.00 2.54 H new ATOM 1038 N THR A 66 -7.281 -4.641 13.300 1.00 3.21 N ATOM 1039 CA THR A 66 -8.174 -5.174 14.349 1.00 10.51 C ATOM 1040 C THR A 66 -9.328 -5.956 13.692 1.00 61.10 C ATOM 1041 O THR A 66 -10.192 -5.369 13.039 1.00 65.30 O ATOM 1042 CB THR A 66 -8.743 -4.029 15.257 1.00 53.42 C ATOM 1043 OG1 THR A 66 -7.656 -3.269 15.814 1.00 40.13 O ATOM 1044 CG2 THR A 66 -9.623 -4.568 16.406 1.00 72.31 C ATOM 0 H THR A 66 -7.364 -3.634 13.162 1.00 3.21 H new ATOM 0 HA THR A 66 -7.594 -5.841 14.987 1.00 10.51 H new ATOM 0 HB THR A 66 -9.370 -3.399 14.626 1.00 53.42 H new ATOM 0 HG1 THR A 66 -8.014 -2.553 16.380 1.00 40.13 H new ATOM 0 HG21 THR A 66 -9.991 -3.734 17.004 1.00 72.31 H new ATOM 0 HG22 THR A 66 -10.468 -5.118 15.990 1.00 72.31 H new ATOM 0 HG23 THR A 66 -9.032 -5.233 17.036 1.00 72.31 H new ATOM 1052 N GLY A 67 -9.322 -7.285 13.870 1.00 54.24 N ATOM 1053 CA GLY A 67 -10.251 -8.187 13.178 1.00 65.02 C ATOM 1054 C GLY A 67 -11.707 -8.123 13.657 1.00 72.30 C ATOM 1055 O GLY A 67 -11.988 -7.522 14.701 1.00 35.02 O ATOM 0 H GLY A 67 -8.674 -7.763 14.496 1.00 54.24 H new ATOM 0 HA2 GLY A 67 -10.226 -7.959 12.112 1.00 65.02 H new ATOM 0 HA3 GLY A 67 -9.892 -9.210 13.294 1.00 65.02 H new ATOM 1059 N PRO A 68 -12.666 -8.776 12.924 1.00 53.45 N ATOM 1060 CA PRO A 68 -14.119 -8.778 13.280 1.00 64.31 C ATOM 1061 C PRO A 68 -14.422 -9.546 14.602 1.00 12.12 C ATOM 1062 O PRO A 68 -15.488 -9.388 15.203 1.00 74.21 O ATOM 1063 CB PRO A 68 -14.780 -9.456 12.046 1.00 43.34 C ATOM 1064 CG PRO A 68 -13.697 -10.324 11.466 1.00 31.24 C ATOM 1065 CD PRO A 68 -12.404 -9.571 11.690 1.00 33.35 C ATOM 0 HA PRO A 68 -14.499 -7.776 13.478 1.00 64.31 H new ATOM 0 HB2 PRO A 68 -15.649 -10.047 12.336 1.00 43.34 H new ATOM 0 HB3 PRO A 68 -15.124 -8.716 11.324 1.00 43.34 H new ATOM 0 HG2 PRO A 68 -13.672 -11.298 11.955 1.00 31.24 H new ATOM 0 HG3 PRO A 68 -13.866 -10.504 10.404 1.00 31.24 H new ATOM 0 HD2 PRO A 68 -11.563 -10.251 11.823 1.00 33.35 H new ATOM 0 HD3 PRO A 68 -12.163 -8.928 10.843 1.00 33.35 H new ATOM 1073 N ASP A 69 -13.458 -10.375 15.027 1.00 33.43 N ATOM 1074 CA ASP A 69 -13.509 -11.152 16.289 1.00 35.55 C ATOM 1075 C ASP A 69 -12.558 -10.564 17.376 1.00 55.44 C ATOM 1076 O ASP A 69 -12.573 -11.004 18.532 1.00 44.12 O ATOM 1077 CB ASP A 69 -13.167 -12.640 15.976 1.00 11.15 C ATOM 1078 CG ASP A 69 -11.984 -12.794 14.999 1.00 63.54 C ATOM 1079 OD1 ASP A 69 -10.902 -12.239 15.266 1.00 75.12 O ATOM 1080 OD2 ASP A 69 -12.144 -13.433 13.937 1.00 44.00 O ATOM 0 H ASP A 69 -12.601 -10.532 14.497 1.00 33.43 H new ATOM 0 HA ASP A 69 -14.516 -11.089 16.703 1.00 35.55 H new ATOM 0 HB2 ASP A 69 -12.932 -13.156 16.907 1.00 11.15 H new ATOM 0 HB3 ASP A 69 -14.046 -13.128 15.554 1.00 11.15 H new ATOM 1085 N GLY A 70 -11.722 -9.574 16.984 1.00 14.20 N ATOM 1086 CA GLY A 70 -10.781 -8.906 17.912 1.00 34.14 C ATOM 1087 C GLY A 70 -9.298 -9.208 17.641 1.00 43.31 C ATOM 1088 O GLY A 70 -8.424 -8.601 18.273 1.00 75.52 O ATOM 0 H GLY A 70 -11.681 -9.220 16.028 1.00 14.20 H new ATOM 0 HA2 GLY A 70 -10.936 -7.829 17.854 1.00 34.14 H new ATOM 0 HA3 GLY A 70 -11.020 -9.208 18.932 1.00 34.14 H new ATOM 1092 N THR A 71 -9.008 -10.136 16.701 1.00 74.11 N ATOM 1093 CA THR A 71 -7.609 -10.531 16.362 1.00 65.14 C ATOM 1094 C THR A 71 -6.851 -9.384 15.651 1.00 24.23 C ATOM 1095 O THR A 71 -7.179 -9.014 14.531 1.00 24.42 O ATOM 1096 CB THR A 71 -7.563 -11.822 15.468 1.00 42.51 C ATOM 1097 OG1 THR A 71 -8.195 -12.914 16.156 1.00 53.00 O ATOM 1098 CG2 THR A 71 -6.124 -12.241 15.086 1.00 15.51 C ATOM 0 H THR A 71 -9.719 -10.629 16.160 1.00 74.11 H new ATOM 0 HA THR A 71 -7.115 -10.748 17.309 1.00 65.14 H new ATOM 0 HB THR A 71 -8.094 -11.582 14.547 1.00 42.51 H new ATOM 0 HG1 THR A 71 -9.159 -12.897 15.981 1.00 53.00 H new ATOM 0 HG21 THR A 71 -6.158 -13.139 14.469 1.00 15.51 H new ATOM 0 HG22 THR A 71 -5.646 -11.435 14.529 1.00 15.51 H new ATOM 0 HG23 THR A 71 -5.552 -12.445 15.991 1.00 15.51 H new ATOM 1106 N LYS A 72 -5.847 -8.823 16.335 1.00 72.45 N ATOM 1107 CA LYS A 72 -4.966 -7.772 15.785 1.00 53.33 C ATOM 1108 C LYS A 72 -3.823 -8.401 14.953 1.00 63.43 C ATOM 1109 O LYS A 72 -2.955 -9.086 15.502 1.00 12.51 O ATOM 1110 CB LYS A 72 -4.397 -6.931 16.955 1.00 1.44 C ATOM 1111 CG LYS A 72 -5.484 -6.246 17.810 1.00 44.11 C ATOM 1112 CD LYS A 72 -4.929 -5.629 19.113 1.00 64.03 C ATOM 1113 CE LYS A 72 -6.022 -4.925 19.939 1.00 23.42 C ATOM 1114 NZ LYS A 72 -5.553 -4.578 21.306 1.00 40.13 N ATOM 0 H LYS A 72 -5.617 -9.084 17.294 1.00 72.45 H new ATOM 0 HA LYS A 72 -5.540 -7.125 15.121 1.00 53.33 H new ATOM 0 HB2 LYS A 72 -3.795 -7.576 17.596 1.00 1.44 H new ATOM 0 HB3 LYS A 72 -3.729 -6.169 16.553 1.00 1.44 H new ATOM 0 HG2 LYS A 72 -5.963 -5.465 17.220 1.00 44.11 H new ATOM 0 HG3 LYS A 72 -6.255 -6.975 18.060 1.00 44.11 H new ATOM 0 HD2 LYS A 72 -4.469 -6.412 19.716 1.00 64.03 H new ATOM 0 HD3 LYS A 72 -4.144 -4.913 18.868 1.00 64.03 H new ATOM 0 HE2 LYS A 72 -6.338 -4.018 19.423 1.00 23.42 H new ATOM 0 HE3 LYS A 72 -6.896 -5.572 20.009 1.00 23.42 H new ATOM 0 HZ1 LYS A 72 -6.320 -4.106 21.827 1.00 40.13 H new ATOM 0 HZ2 LYS A 72 -5.276 -5.445 21.808 1.00 40.13 H new ATOM 0 HZ3 LYS A 72 -4.735 -3.939 21.241 1.00 40.13 H new ATOM 1128 N ALA A 73 -3.850 -8.173 13.629 1.00 71.41 N ATOM 1129 CA ALA A 73 -2.816 -8.671 12.694 1.00 30.54 C ATOM 1130 C ALA A 73 -1.705 -7.612 12.521 1.00 64.44 C ATOM 1131 O ALA A 73 -1.898 -6.618 11.806 1.00 63.14 O ATOM 1132 CB ALA A 73 -3.446 -9.029 11.336 1.00 5.03 C ATOM 0 H ALA A 73 -4.589 -7.638 13.172 1.00 71.41 H new ATOM 0 HA ALA A 73 -2.371 -9.575 13.109 1.00 30.54 H new ATOM 0 HB1 ALA A 73 -2.672 -9.393 10.661 1.00 5.03 H new ATOM 0 HB2 ALA A 73 -4.199 -9.805 11.477 1.00 5.03 H new ATOM 0 HB3 ALA A 73 -3.914 -8.143 10.907 1.00 5.03 H new ATOM 1138 N ARG A 74 -0.554 -7.824 13.191 1.00 2.42 N ATOM 1139 CA ARG A 74 0.555 -6.839 13.218 1.00 72.11 C ATOM 1140 C ARG A 74 1.290 -6.754 11.860 1.00 60.00 C ATOM 1141 O ARG A 74 1.492 -7.759 11.170 1.00 31.21 O ATOM 1142 CB ARG A 74 1.590 -7.149 14.348 1.00 12.41 C ATOM 1143 CG ARG A 74 1.060 -7.018 15.802 1.00 2.41 C ATOM 1144 CD ARG A 74 0.263 -8.244 16.276 1.00 4.41 C ATOM 1145 NE ARG A 74 -0.318 -8.044 17.610 1.00 12.40 N ATOM 1146 CZ ARG A 74 -0.945 -8.952 18.319 1.00 73.43 C ATOM 1147 NH1 ARG A 74 -1.125 -10.156 17.874 1.00 20.41 N ATOM 1148 NH2 ARG A 74 -1.407 -8.633 19.482 1.00 63.00 N ATOM 0 H ARG A 74 -0.364 -8.672 13.724 1.00 2.42 H new ATOM 0 HA ARG A 74 0.090 -5.875 13.425 1.00 72.11 H new ATOM 0 HB2 ARG A 74 1.961 -8.164 14.206 1.00 12.41 H new ATOM 0 HB3 ARG A 74 2.441 -6.479 14.229 1.00 12.41 H new ATOM 0 HG2 ARG A 74 1.903 -6.860 16.475 1.00 2.41 H new ATOM 0 HG3 ARG A 74 0.427 -6.134 15.871 1.00 2.41 H new ATOM 0 HD2 ARG A 74 -0.533 -8.456 15.562 1.00 4.41 H new ATOM 0 HD3 ARG A 74 0.917 -9.116 16.293 1.00 4.41 H new ATOM 0 HE ARG A 74 -0.226 -7.116 18.022 1.00 12.40 H new ATOM 0 HH11 ARG A 74 -0.775 -10.416 16.952 1.00 20.41 H new ATOM 0 HH12 ARG A 74 -1.616 -10.843 18.446 1.00 20.41 H new ATOM 0 HH21 ARG A 74 -1.282 -7.685 19.838 1.00 63.00 H new ATOM 0 HH22 ARG A 74 -1.897 -9.329 20.045 1.00 63.00 H new ATOM 1162 N GLY A 75 1.663 -5.524 11.493 1.00 60.25 N ATOM 1163 CA GLY A 75 2.521 -5.259 10.341 1.00 52.54 C ATOM 1164 C GLY A 75 3.449 -4.073 10.588 1.00 35.50 C ATOM 1165 O GLY A 75 3.151 -3.199 11.417 1.00 5.35 O ATOM 0 H GLY A 75 1.375 -4.682 11.991 1.00 60.25 H new ATOM 0 HA2 GLY A 75 3.115 -6.145 10.118 1.00 52.54 H new ATOM 0 HA3 GLY A 75 1.903 -5.061 9.465 1.00 52.54 H new ATOM 1169 N TRP A 76 4.574 -4.027 9.861 1.00 54.24 N ATOM 1170 CA TRP A 76 5.542 -2.909 9.933 1.00 13.55 C ATOM 1171 C TRP A 76 5.700 -2.243 8.548 1.00 41.44 C ATOM 1172 O TRP A 76 5.381 -2.832 7.510 1.00 61.13 O ATOM 1173 CB TRP A 76 6.915 -3.396 10.480 1.00 73.41 C ATOM 1174 CG TRP A 76 7.597 -4.442 9.626 1.00 53.01 C ATOM 1175 CD1 TRP A 76 7.443 -5.796 9.704 1.00 42.41 C ATOM 1176 CD2 TRP A 76 8.540 -4.213 8.562 1.00 71.10 C ATOM 1177 NE1 TRP A 76 8.210 -6.418 8.754 1.00 41.31 N ATOM 1178 CE2 TRP A 76 8.895 -5.470 8.043 1.00 2.23 C ATOM 1179 CE3 TRP A 76 9.104 -3.064 7.994 1.00 15.14 C ATOM 1180 CZ2 TRP A 76 9.792 -5.614 6.990 1.00 65.14 C ATOM 1181 CZ3 TRP A 76 9.995 -3.206 6.951 1.00 34.21 C ATOM 1182 CH2 TRP A 76 10.329 -4.474 6.455 1.00 41.54 C ATOM 0 H TRP A 76 4.844 -4.760 9.205 1.00 54.24 H new ATOM 0 HA TRP A 76 5.155 -2.164 10.628 1.00 13.55 H new ATOM 0 HB2 TRP A 76 7.578 -2.536 10.578 1.00 73.41 H new ATOM 0 HB3 TRP A 76 6.769 -3.802 11.481 1.00 73.41 H new ATOM 0 HD1 TRP A 76 6.807 -6.305 10.413 1.00 42.41 H new ATOM 0 HE1 TRP A 76 8.262 -7.425 8.601 1.00 41.31 H new ATOM 0 HE3 TRP A 76 8.846 -2.084 8.366 1.00 15.14 H new ATOM 0 HZ2 TRP A 76 10.055 -6.589 6.608 1.00 65.14 H new ATOM 0 HZ3 TRP A 76 10.442 -2.327 6.510 1.00 34.21 H new ATOM 0 HH2 TRP A 76 11.025 -4.553 5.633 1.00 41.54 H new ATOM 1193 N TRP A 77 6.185 -1.004 8.558 1.00 22.23 N ATOM 1194 CA TRP A 77 6.380 -0.192 7.339 1.00 23.42 C ATOM 1195 C TRP A 77 7.699 0.605 7.447 1.00 51.20 C ATOM 1196 O TRP A 77 8.137 0.914 8.553 1.00 34.13 O ATOM 1197 CB TRP A 77 5.148 0.764 7.192 1.00 71.11 C ATOM 1198 CG TRP A 77 4.382 0.679 5.899 1.00 5.45 C ATOM 1199 CD1 TRP A 77 4.276 -0.383 5.044 1.00 2.25 C ATOM 1200 CD2 TRP A 77 3.566 1.715 5.356 1.00 43.30 C ATOM 1201 NE1 TRP A 77 3.463 -0.046 3.990 1.00 60.01 N ATOM 1202 CE2 TRP A 77 3.017 1.241 4.167 1.00 62.15 C ATOM 1203 CE3 TRP A 77 3.263 3.009 5.768 1.00 60.40 C ATOM 1204 CZ2 TRP A 77 2.174 2.021 3.383 1.00 10.32 C ATOM 1205 CZ3 TRP A 77 2.434 3.780 4.989 1.00 43.12 C ATOM 1206 CH2 TRP A 77 1.897 3.285 3.806 1.00 34.32 C ATOM 0 H TRP A 77 6.459 -0.523 9.415 1.00 22.23 H new ATOM 0 HA TRP A 77 6.451 -0.827 6.456 1.00 23.42 H new ATOM 0 HB2 TRP A 77 4.458 0.560 8.011 1.00 71.11 H new ATOM 0 HB3 TRP A 77 5.495 1.790 7.316 1.00 71.11 H new ATOM 0 HD1 TRP A 77 4.758 -1.340 5.177 1.00 2.25 H new ATOM 0 HE1 TRP A 77 3.229 -0.652 3.204 1.00 60.01 H new ATOM 0 HE3 TRP A 77 3.673 3.402 6.687 1.00 60.40 H new ATOM 0 HZ2 TRP A 77 1.752 1.636 2.467 1.00 10.32 H new ATOM 0 HZ3 TRP A 77 2.196 4.786 5.301 1.00 43.12 H new ATOM 0 HH2 TRP A 77 1.249 3.914 3.213 1.00 34.32 H new ATOM 1217 N GLN A 78 8.321 0.936 6.301 1.00 53.30 N ATOM 1218 CA GLN A 78 9.556 1.762 6.269 1.00 4.04 C ATOM 1219 C GLN A 78 9.602 2.661 5.012 1.00 34.54 C ATOM 1220 O GLN A 78 9.793 2.176 3.905 1.00 51.12 O ATOM 1221 CB GLN A 78 10.822 0.855 6.358 1.00 3.13 C ATOM 1222 CG GLN A 78 12.165 1.589 6.093 1.00 61.45 C ATOM 1223 CD GLN A 78 13.411 0.815 6.532 1.00 3.12 C ATOM 1224 OE1 GLN A 78 13.429 -0.410 6.567 1.00 11.23 O ATOM 1225 NE2 GLN A 78 14.473 1.536 6.850 1.00 34.02 N ATOM 0 H GLN A 78 7.993 0.647 5.380 1.00 53.30 H new ATOM 0 HA GLN A 78 9.544 2.420 7.138 1.00 4.04 H new ATOM 0 HB2 GLN A 78 10.860 0.403 7.349 1.00 3.13 H new ATOM 0 HB3 GLN A 78 10.720 0.041 5.640 1.00 3.13 H new ATOM 0 HG2 GLN A 78 12.243 1.803 5.027 1.00 61.45 H new ATOM 0 HG3 GLN A 78 12.148 2.548 6.610 1.00 61.45 H new ATOM 0 HE21 GLN A 78 14.428 2.554 6.811 1.00 34.02 H new ATOM 0 HE22 GLN A 78 15.337 1.074 7.134 1.00 34.02 H new ATOM 1234 N PHE A 79 9.446 3.982 5.217 1.00 52.52 N ATOM 1235 CA PHE A 79 9.477 4.993 4.132 1.00 73.33 C ATOM 1236 C PHE A 79 10.916 5.197 3.614 1.00 13.31 C ATOM 1237 O PHE A 79 11.803 5.617 4.360 1.00 3.33 O ATOM 1238 CB PHE A 79 8.903 6.335 4.633 1.00 31.24 C ATOM 1239 CG PHE A 79 7.505 6.208 5.210 1.00 33.33 C ATOM 1240 CD1 PHE A 79 6.394 6.165 4.374 1.00 15.32 C ATOM 1241 CD2 PHE A 79 7.304 6.111 6.588 1.00 64.12 C ATOM 1242 CE1 PHE A 79 5.130 6.039 4.898 1.00 31.15 C ATOM 1243 CE2 PHE A 79 6.039 5.982 7.109 1.00 4.25 C ATOM 1244 CZ PHE A 79 4.955 5.949 6.264 1.00 64.44 C ATOM 0 H PHE A 79 9.294 4.385 6.142 1.00 52.52 H new ATOM 0 HA PHE A 79 8.861 4.628 3.310 1.00 73.33 H new ATOM 0 HB2 PHE A 79 9.567 6.746 5.393 1.00 31.24 H new ATOM 0 HB3 PHE A 79 8.885 7.046 3.807 1.00 31.24 H new ATOM 0 HD1 PHE A 79 6.526 6.231 3.304 1.00 15.32 H new ATOM 0 HD2 PHE A 79 8.154 6.138 7.254 1.00 64.12 H new ATOM 0 HE1 PHE A 79 4.273 6.010 4.241 1.00 31.15 H new ATOM 0 HE2 PHE A 79 5.897 5.907 8.177 1.00 4.25 H new ATOM 0 HZ PHE A 79 3.960 5.852 6.672 1.00 64.44 H new ATOM 1254 N THR A 80 11.122 4.895 2.333 1.00 10.03 N ATOM 1255 CA THR A 80 12.458 4.810 1.714 1.00 25.31 C ATOM 1256 C THR A 80 12.811 6.080 0.889 1.00 50.43 C ATOM 1257 O THR A 80 13.916 6.620 1.010 1.00 41.02 O ATOM 1258 CB THR A 80 12.512 3.543 0.796 1.00 32.31 C ATOM 1259 OG1 THR A 80 11.779 2.462 1.405 1.00 51.02 O ATOM 1260 CG2 THR A 80 13.939 3.059 0.523 1.00 14.10 C ATOM 0 H THR A 80 10.361 4.699 1.682 1.00 10.03 H new ATOM 0 HA THR A 80 13.196 4.736 2.513 1.00 25.31 H new ATOM 0 HB THR A 80 12.067 3.837 -0.155 1.00 32.31 H new ATOM 0 HG1 THR A 80 12.403 1.760 1.684 1.00 51.02 H new ATOM 0 HG21 THR A 80 13.908 2.178 -0.119 1.00 14.10 H new ATOM 0 HG22 THR A 80 14.503 3.849 0.028 1.00 14.10 H new ATOM 0 HG23 THR A 80 14.423 2.804 1.466 1.00 14.10 H new ATOM 1268 N THR A 81 11.851 6.554 0.063 1.00 15.43 N ATOM 1269 CA THR A 81 12.055 7.701 -0.868 1.00 24.21 C ATOM 1270 C THR A 81 10.736 8.477 -1.068 1.00 44.52 C ATOM 1271 O THR A 81 9.793 7.963 -1.668 1.00 71.35 O ATOM 1272 CB THR A 81 12.591 7.227 -2.269 1.00 32.11 C ATOM 1273 OG1 THR A 81 13.875 6.603 -2.122 1.00 50.31 O ATOM 1274 CG2 THR A 81 12.701 8.380 -3.292 1.00 14.15 C ATOM 0 H THR A 81 10.912 6.157 0.019 1.00 15.43 H new ATOM 0 HA THR A 81 12.802 8.352 -0.414 1.00 24.21 H new ATOM 0 HB THR A 81 11.863 6.513 -2.655 1.00 32.11 H new ATOM 0 HG1 THR A 81 14.199 6.310 -2.999 1.00 50.31 H new ATOM 0 HG21 THR A 81 13.076 7.992 -4.239 1.00 14.15 H new ATOM 0 HG22 THR A 81 11.718 8.825 -3.446 1.00 14.15 H new ATOM 0 HG23 THR A 81 13.387 9.138 -2.914 1.00 14.15 H new ATOM 1282 N ILE A 82 10.678 9.723 -0.567 1.00 21.20 N ATOM 1283 CA ILE A 82 9.476 10.585 -0.668 1.00 51.42 C ATOM 1284 C ILE A 82 9.843 11.928 -1.333 1.00 73.12 C ATOM 1285 O ILE A 82 10.662 12.676 -0.798 1.00 23.41 O ATOM 1286 CB ILE A 82 8.847 10.866 0.750 1.00 42.13 C ATOM 1287 CG1 ILE A 82 8.608 9.530 1.521 1.00 31.24 C ATOM 1288 CG2 ILE A 82 7.532 11.688 0.617 1.00 73.33 C ATOM 1289 CD1 ILE A 82 7.938 9.668 2.873 1.00 51.21 C ATOM 0 H ILE A 82 11.458 10.165 -0.081 1.00 21.20 H new ATOM 0 HA ILE A 82 8.741 10.056 -1.275 1.00 51.42 H new ATOM 0 HB ILE A 82 9.553 11.462 1.328 1.00 42.13 H new ATOM 0 HG12 ILE A 82 7.999 8.875 0.898 1.00 31.24 H new ATOM 0 HG13 ILE A 82 9.569 9.034 1.660 1.00 31.24 H new ATOM 0 HG21 ILE A 82 7.115 11.870 1.607 1.00 73.33 H new ATOM 0 HG22 ILE A 82 7.746 12.641 0.132 1.00 73.33 H new ATOM 0 HG23 ILE A 82 6.813 11.129 0.018 1.00 73.33 H new ATOM 0 HD11 ILE A 82 7.819 8.682 3.323 1.00 51.21 H new ATOM 0 HD12 ILE A 82 8.553 10.291 3.522 1.00 51.21 H new ATOM 0 HD13 ILE A 82 6.959 10.130 2.748 1.00 51.21 H new ATOM 1301 N GLU A 83 9.253 12.220 -2.503 1.00 21.50 N ATOM 1302 CA GLU A 83 9.428 13.535 -3.179 1.00 61.21 C ATOM 1303 C GLU A 83 8.210 14.457 -2.955 1.00 14.54 C ATOM 1304 O GLU A 83 8.383 15.661 -2.726 1.00 12.20 O ATOM 1305 CB GLU A 83 9.693 13.351 -4.695 1.00 64.55 C ATOM 1306 CG GLU A 83 10.964 12.542 -5.023 1.00 41.12 C ATOM 1307 CD GLU A 83 11.377 12.637 -6.504 1.00 64.41 C ATOM 1308 OE1 GLU A 83 10.575 12.264 -7.379 1.00 72.23 O ATOM 1309 OE2 GLU A 83 12.507 13.080 -6.803 1.00 42.41 O ATOM 0 H GLU A 83 8.650 11.571 -3.008 1.00 21.50 H new ATOM 0 HA GLU A 83 10.298 14.014 -2.730 1.00 61.21 H new ATOM 0 HB2 GLU A 83 8.834 12.853 -5.144 1.00 64.55 H new ATOM 0 HB3 GLU A 83 9.772 14.334 -5.160 1.00 64.55 H new ATOM 0 HG2 GLU A 83 11.785 12.898 -4.400 1.00 41.12 H new ATOM 0 HG3 GLU A 83 10.798 11.496 -4.765 1.00 41.12 H new ATOM 1316 N ALA A 84 6.994 13.867 -3.046 1.00 21.05 N ATOM 1317 CA ALA A 84 5.694 14.575 -2.891 1.00 13.25 C ATOM 1318 C ALA A 84 5.404 15.587 -4.050 1.00 50.23 C ATOM 1319 O ALA A 84 6.322 16.249 -4.542 1.00 72.14 O ATOM 1320 CB ALA A 84 5.579 15.258 -1.502 1.00 31.34 C ATOM 0 H ALA A 84 6.884 12.870 -3.232 1.00 21.05 H new ATOM 0 HA ALA A 84 4.922 13.808 -2.955 1.00 13.25 H new ATOM 0 HB1 ALA A 84 4.617 15.765 -1.424 1.00 31.34 H new ATOM 0 HB2 ALA A 84 5.656 14.504 -0.718 1.00 31.34 H new ATOM 0 HB3 ALA A 84 6.383 15.985 -1.386 1.00 31.34 H new ATOM 1326 N PRO A 85 4.116 15.730 -4.523 1.00 54.20 N ATOM 1327 CA PRO A 85 2.939 14.961 -4.044 1.00 20.55 C ATOM 1328 C PRO A 85 2.612 13.724 -4.916 1.00 2.34 C ATOM 1329 O PRO A 85 1.503 13.208 -4.857 1.00 53.53 O ATOM 1330 CB PRO A 85 1.837 16.029 -4.161 1.00 33.31 C ATOM 1331 CG PRO A 85 2.175 16.754 -5.441 1.00 42.23 C ATOM 1332 CD PRO A 85 3.702 16.707 -5.569 1.00 2.43 C ATOM 0 HA PRO A 85 3.078 14.535 -3.051 1.00 20.55 H new ATOM 0 HB2 PRO A 85 0.846 15.578 -4.206 1.00 33.31 H new ATOM 0 HB3 PRO A 85 1.841 16.704 -3.305 1.00 33.31 H new ATOM 0 HG2 PRO A 85 1.698 16.276 -6.297 1.00 42.23 H new ATOM 0 HG3 PRO A 85 1.818 17.784 -5.411 1.00 42.23 H new ATOM 0 HD2 PRO A 85 4.010 16.383 -6.563 1.00 2.43 H new ATOM 0 HD3 PRO A 85 4.148 17.687 -5.400 1.00 2.43 H new ATOM 1340 N ASP A 86 3.586 13.257 -5.710 1.00 5.14 N ATOM 1341 CA ASP A 86 3.387 12.161 -6.686 1.00 20.33 C ATOM 1342 C ASP A 86 4.218 10.902 -6.327 1.00 21.02 C ATOM 1343 O ASP A 86 3.681 9.798 -6.251 1.00 62.12 O ATOM 1344 CB ASP A 86 3.719 12.685 -8.115 1.00 43.11 C ATOM 1345 CG ASP A 86 5.190 13.117 -8.315 1.00 1.10 C ATOM 1346 OD1 ASP A 86 5.701 13.925 -7.506 1.00 33.51 O ATOM 1347 OD2 ASP A 86 5.842 12.644 -9.271 1.00 33.52 O ATOM 0 H ASP A 86 4.537 13.625 -5.698 1.00 5.14 H new ATOM 0 HA ASP A 86 2.343 11.849 -6.654 1.00 20.33 H new ATOM 0 HB2 ASP A 86 3.481 11.905 -8.838 1.00 43.11 H new ATOM 0 HB3 ASP A 86 3.071 13.533 -8.337 1.00 43.11 H new ATOM 1352 N HIS A 87 5.530 11.087 -6.092 1.00 45.21 N ATOM 1353 CA HIS A 87 6.486 9.974 -5.905 1.00 73.01 C ATOM 1354 C HIS A 87 6.599 9.586 -4.406 1.00 25.32 C ATOM 1355 O HIS A 87 7.008 10.391 -3.562 1.00 74.23 O ATOM 1356 CB HIS A 87 7.872 10.379 -6.478 1.00 14.51 C ATOM 1357 CG HIS A 87 8.906 9.269 -6.594 1.00 42.14 C ATOM 1358 ND1 HIS A 87 10.059 9.408 -7.343 1.00 31.25 N ATOM 1359 CD2 HIS A 87 8.978 8.018 -6.064 1.00 20.13 C ATOM 1360 CE1 HIS A 87 10.777 8.310 -7.268 1.00 14.34 C ATOM 1361 NE2 HIS A 87 10.148 7.456 -6.500 1.00 75.12 N ATOM 0 H HIS A 87 5.959 12.010 -6.026 1.00 45.21 H new ATOM 0 HA HIS A 87 6.121 9.100 -6.444 1.00 73.01 H new ATOM 0 HB2 HIS A 87 7.720 10.809 -7.468 1.00 14.51 H new ATOM 0 HB3 HIS A 87 8.285 11.167 -5.848 1.00 14.51 H new ATOM 0 HD1 HIS A 87 10.315 10.240 -7.875 1.00 31.25 H new ATOM 0 HD2 HIS A 87 8.247 7.554 -5.418 1.00 20.13 H new ATOM 0 HE1 HIS A 87 11.725 8.141 -7.757 1.00 14.34 H new ATOM 1370 N LEU A 88 6.253 8.327 -4.126 1.00 71.23 N ATOM 1371 CA LEU A 88 6.428 7.668 -2.822 1.00 1.53 C ATOM 1372 C LEU A 88 7.069 6.283 -3.044 1.00 31.21 C ATOM 1373 O LEU A 88 6.745 5.593 -4.009 1.00 51.30 O ATOM 1374 CB LEU A 88 5.059 7.519 -2.100 1.00 74.25 C ATOM 1375 CG LEU A 88 5.051 6.741 -0.745 1.00 23.53 C ATOM 1376 CD1 LEU A 88 5.988 7.378 0.298 1.00 61.43 C ATOM 1377 CD2 LEU A 88 3.620 6.618 -0.197 1.00 62.21 C ATOM 0 H LEU A 88 5.828 7.714 -4.822 1.00 71.23 H new ATOM 0 HA LEU A 88 7.078 8.276 -2.192 1.00 1.53 H new ATOM 0 HB2 LEU A 88 4.661 8.518 -1.919 1.00 74.25 H new ATOM 0 HB3 LEU A 88 4.370 7.020 -2.781 1.00 74.25 H new ATOM 0 HG LEU A 88 5.433 5.740 -0.945 1.00 23.53 H new ATOM 0 HD11 LEU A 88 5.948 6.802 1.223 1.00 61.43 H new ATOM 0 HD12 LEU A 88 7.009 7.381 -0.084 1.00 61.43 H new ATOM 0 HD13 LEU A 88 5.671 8.402 0.495 1.00 61.43 H new ATOM 0 HD21 LEU A 88 3.637 6.073 0.747 1.00 62.21 H new ATOM 0 HD22 LEU A 88 3.206 7.613 -0.034 1.00 62.21 H new ATOM 0 HD23 LEU A 88 3.000 6.081 -0.915 1.00 62.21 H new ATOM 1389 N GLU A 89 8.018 5.919 -2.176 1.00 54.40 N ATOM 1390 CA GLU A 89 8.613 4.573 -2.118 1.00 62.41 C ATOM 1391 C GLU A 89 8.754 4.154 -0.655 1.00 4.31 C ATOM 1392 O GLU A 89 9.132 4.969 0.198 1.00 2.11 O ATOM 1393 CB GLU A 89 10.001 4.517 -2.816 1.00 63.52 C ATOM 1394 CG GLU A 89 9.961 4.685 -4.339 1.00 4.34 C ATOM 1395 CD GLU A 89 11.324 4.478 -5.012 1.00 52.11 C ATOM 1396 OE1 GLU A 89 11.677 3.323 -5.316 1.00 0.33 O ATOM 1397 OE2 GLU A 89 12.051 5.469 -5.231 1.00 32.32 O ATOM 0 H GLU A 89 8.403 6.559 -1.481 1.00 54.40 H new ATOM 0 HA GLU A 89 7.953 3.888 -2.650 1.00 62.41 H new ATOM 0 HB2 GLU A 89 10.636 5.297 -2.395 1.00 63.52 H new ATOM 0 HB3 GLU A 89 10.472 3.562 -2.582 1.00 63.52 H new ATOM 0 HG2 GLU A 89 9.247 3.975 -4.757 1.00 4.34 H new ATOM 0 HG3 GLU A 89 9.595 5.684 -4.577 1.00 4.34 H new ATOM 1404 N PHE A 90 8.432 2.891 -0.382 1.00 32.53 N ATOM 1405 CA PHE A 90 8.540 2.295 0.959 1.00 22.22 C ATOM 1406 C PHE A 90 8.687 0.767 0.859 1.00 21.32 C ATOM 1407 O PHE A 90 8.538 0.186 -0.213 1.00 30.33 O ATOM 1408 CB PHE A 90 7.318 2.687 1.845 1.00 24.32 C ATOM 1409 CG PHE A 90 5.953 2.309 1.268 1.00 35.44 C ATOM 1410 CD1 PHE A 90 5.438 1.022 1.410 1.00 52.04 C ATOM 1411 CD2 PHE A 90 5.191 3.243 0.574 1.00 75.10 C ATOM 1412 CE1 PHE A 90 4.213 0.688 0.879 1.00 51.31 C ATOM 1413 CE2 PHE A 90 3.967 2.903 0.043 1.00 62.12 C ATOM 1414 CZ PHE A 90 3.477 1.629 0.193 1.00 11.25 C ATOM 0 H PHE A 90 8.085 2.242 -1.088 1.00 32.53 H new ATOM 0 HA PHE A 90 9.435 2.691 1.439 1.00 22.22 H new ATOM 0 HB2 PHE A 90 7.428 2.212 2.820 1.00 24.32 H new ATOM 0 HB3 PHE A 90 7.340 3.764 2.011 1.00 24.32 H new ATOM 0 HD1 PHE A 90 6.008 0.276 1.944 1.00 52.04 H new ATOM 0 HD2 PHE A 90 5.565 4.249 0.450 1.00 75.10 H new ATOM 0 HE1 PHE A 90 3.828 -0.314 1.000 1.00 51.31 H new ATOM 0 HE2 PHE A 90 3.390 3.641 -0.494 1.00 62.12 H new ATOM 0 HZ PHE A 90 2.517 1.365 -0.226 1.00 11.25 H new ATOM 1424 N ASP A 91 8.982 0.142 1.995 1.00 73.35 N ATOM 1425 CA ASP A 91 9.078 -1.313 2.129 1.00 70.25 C ATOM 1426 C ASP A 91 7.848 -1.869 2.880 1.00 21.11 C ATOM 1427 O ASP A 91 7.633 -1.543 4.059 1.00 5.41 O ATOM 1428 CB ASP A 91 10.386 -1.663 2.866 1.00 34.21 C ATOM 1429 CG ASP A 91 11.623 -1.125 2.125 1.00 24.34 C ATOM 1430 OD1 ASP A 91 11.939 -1.635 1.024 1.00 74.23 O ATOM 1431 OD2 ASP A 91 12.264 -0.172 2.616 1.00 10.02 O ATOM 0 H ASP A 91 9.165 0.640 2.866 1.00 73.35 H new ATOM 0 HA ASP A 91 9.093 -1.773 1.141 1.00 70.25 H new ATOM 0 HB2 ASP A 91 10.357 -1.248 3.874 1.00 34.21 H new ATOM 0 HB3 ASP A 91 10.466 -2.745 2.969 1.00 34.21 H new ATOM 1436 N ASP A 92 7.031 -2.674 2.171 1.00 63.13 N ATOM 1437 CA ASP A 92 5.893 -3.407 2.766 1.00 25.40 C ATOM 1438 C ASP A 92 6.426 -4.517 3.706 1.00 32.14 C ATOM 1439 O ASP A 92 7.435 -5.171 3.388 1.00 72.11 O ATOM 1440 CB ASP A 92 5.014 -4.073 1.674 1.00 35.33 C ATOM 1441 CG ASP A 92 4.800 -3.205 0.430 1.00 65.21 C ATOM 1442 OD1 ASP A 92 5.670 -3.245 -0.483 1.00 40.34 O ATOM 1443 OD2 ASP A 92 3.781 -2.493 0.356 1.00 62.33 O ATOM 0 H ASP A 92 7.141 -2.835 1.170 1.00 63.13 H new ATOM 0 HA ASP A 92 5.288 -2.688 3.318 1.00 25.40 H new ATOM 0 HB2 ASP A 92 5.477 -5.013 1.373 1.00 35.33 H new ATOM 0 HB3 ASP A 92 4.043 -4.319 2.104 1.00 35.33 H new ATOM 1448 N GLY A 93 5.735 -4.748 4.832 1.00 1.41 N ATOM 1449 CA GLY A 93 6.146 -5.793 5.769 1.00 55.24 C ATOM 1450 C GLY A 93 5.054 -6.220 6.744 1.00 13.21 C ATOM 1451 O GLY A 93 4.245 -5.406 7.193 1.00 61.54 O ATOM 0 H GLY A 93 4.901 -4.231 5.110 1.00 1.41 H new ATOM 0 HA2 GLY A 93 6.474 -6.665 5.203 1.00 55.24 H new ATOM 0 HA3 GLY A 93 7.007 -5.439 6.336 1.00 55.24 H new ATOM 1455 N PHE A 94 5.047 -7.518 7.069 1.00 60.03 N ATOM 1456 CA PHE A 94 4.190 -8.100 8.115 1.00 65.42 C ATOM 1457 C PHE A 94 5.033 -8.356 9.374 1.00 72.14 C ATOM 1458 O PHE A 94 6.211 -8.725 9.275 1.00 73.11 O ATOM 1459 CB PHE A 94 3.573 -9.433 7.635 1.00 34.11 C ATOM 1460 CG PHE A 94 2.642 -9.323 6.426 1.00 32.22 C ATOM 1461 CD1 PHE A 94 3.153 -9.223 5.129 1.00 23.41 C ATOM 1462 CD2 PHE A 94 1.254 -9.347 6.587 1.00 23.10 C ATOM 1463 CE1 PHE A 94 2.308 -9.155 4.038 1.00 74.34 C ATOM 1464 CE2 PHE A 94 0.412 -9.274 5.496 1.00 23.55 C ATOM 1465 CZ PHE A 94 0.939 -9.178 4.223 1.00 40.23 C ATOM 0 H PHE A 94 5.644 -8.205 6.608 1.00 60.03 H new ATOM 0 HA PHE A 94 3.384 -7.401 8.337 1.00 65.42 H new ATOM 0 HB2 PHE A 94 4.382 -10.121 7.389 1.00 34.11 H new ATOM 0 HB3 PHE A 94 3.018 -9.876 8.462 1.00 34.11 H new ATOM 0 HD1 PHE A 94 4.222 -9.199 4.978 1.00 23.41 H new ATOM 0 HD2 PHE A 94 0.834 -9.424 7.579 1.00 23.10 H new ATOM 0 HE1 PHE A 94 2.717 -9.084 3.041 1.00 74.34 H new ATOM 0 HE2 PHE A 94 -0.659 -9.292 5.638 1.00 23.55 H new ATOM 0 HZ PHE A 94 0.279 -9.121 3.370 1.00 40.23 H new ATOM 1475 N ALA A 95 4.431 -8.157 10.546 1.00 71.43 N ATOM 1476 CA ALA A 95 5.077 -8.412 11.844 1.00 71.20 C ATOM 1477 C ALA A 95 4.358 -9.558 12.574 1.00 41.42 C ATOM 1478 O ALA A 95 3.147 -9.738 12.428 1.00 44.00 O ATOM 1479 CB ALA A 95 5.087 -7.125 12.691 1.00 22.11 C ATOM 0 H ALA A 95 3.475 -7.812 10.628 1.00 71.43 H new ATOM 0 HA ALA A 95 6.111 -8.714 11.680 1.00 71.20 H new ATOM 0 HB1 ALA A 95 5.567 -7.324 13.649 1.00 22.11 H new ATOM 0 HB2 ALA A 95 5.638 -6.347 12.164 1.00 22.11 H new ATOM 0 HB3 ALA A 95 4.063 -6.793 12.860 1.00 22.11 H new ATOM 1485 N ASP A 96 5.126 -10.336 13.345 1.00 42.40 N ATOM 1486 CA ASP A 96 4.620 -11.469 14.154 1.00 63.21 C ATOM 1487 C ASP A 96 3.666 -10.971 15.289 1.00 42.34 C ATOM 1488 O ASP A 96 3.542 -9.762 15.513 1.00 3.23 O ATOM 1489 CB ASP A 96 5.860 -12.227 14.710 1.00 35.33 C ATOM 1490 CG ASP A 96 5.524 -13.440 15.582 1.00 41.44 C ATOM 1491 OD1 ASP A 96 5.100 -14.479 15.044 1.00 12.25 O ATOM 1492 OD2 ASP A 96 5.635 -13.335 16.818 1.00 75.43 O ATOM 0 H ASP A 96 6.133 -10.200 13.431 1.00 42.40 H new ATOM 0 HA ASP A 96 4.020 -12.145 13.545 1.00 63.21 H new ATOM 0 HB2 ASP A 96 6.474 -12.557 13.872 1.00 35.33 H new ATOM 0 HB3 ASP A 96 6.463 -11.532 15.294 1.00 35.33 H new ATOM 1497 N GLU A 97 2.992 -11.903 15.997 1.00 32.01 N ATOM 1498 CA GLU A 97 2.094 -11.567 17.133 1.00 14.33 C ATOM 1499 C GLU A 97 2.835 -10.808 18.271 1.00 50.35 C ATOM 1500 O GLU A 97 2.224 -10.019 19.000 1.00 44.34 O ATOM 1501 CB GLU A 97 1.425 -12.851 17.689 1.00 44.40 C ATOM 1502 CG GLU A 97 2.393 -13.869 18.333 1.00 10.24 C ATOM 1503 CD GLU A 97 1.671 -15.106 18.888 1.00 33.23 C ATOM 1504 OE1 GLU A 97 1.195 -15.062 20.044 1.00 71.11 O ATOM 1505 OE2 GLU A 97 1.548 -16.114 18.166 1.00 31.04 O ATOM 0 H GLU A 97 3.051 -12.903 15.803 1.00 32.01 H new ATOM 0 HA GLU A 97 1.326 -10.897 16.747 1.00 14.33 H new ATOM 0 HB2 GLU A 97 0.680 -12.562 18.431 1.00 44.40 H new ATOM 0 HB3 GLU A 97 0.891 -13.345 16.877 1.00 44.40 H new ATOM 0 HG2 GLU A 97 3.127 -14.184 17.592 1.00 10.24 H new ATOM 0 HG3 GLU A 97 2.942 -13.382 19.139 1.00 10.24 H new ATOM 1512 N HIS A 98 4.155 -11.062 18.409 1.00 63.53 N ATOM 1513 CA HIS A 98 5.021 -10.364 19.396 1.00 32.23 C ATOM 1514 C HIS A 98 5.614 -9.052 18.811 1.00 33.35 C ATOM 1515 O HIS A 98 6.232 -8.266 19.537 1.00 45.31 O ATOM 1516 CB HIS A 98 6.157 -11.306 19.880 1.00 43.25 C ATOM 1517 CG HIS A 98 5.664 -12.633 20.392 1.00 44.12 C ATOM 1518 ND1 HIS A 98 4.913 -12.776 21.538 1.00 24.11 N ATOM 1519 CD2 HIS A 98 5.790 -13.879 19.881 1.00 61.12 C ATOM 1520 CE1 HIS A 98 4.600 -14.045 21.707 1.00 72.23 C ATOM 1521 NE2 HIS A 98 5.122 -14.732 20.718 1.00 23.13 N ATOM 0 H HIS A 98 4.652 -11.752 17.845 1.00 63.53 H new ATOM 0 HA HIS A 98 4.399 -10.093 20.249 1.00 32.23 H new ATOM 0 HB2 HIS A 98 6.850 -11.479 19.056 1.00 43.25 H new ATOM 0 HB3 HIS A 98 6.719 -10.808 20.670 1.00 43.25 H new ATOM 0 HD2 HIS A 98 6.319 -14.151 18.980 1.00 61.12 H new ATOM 0 HE1 HIS A 98 4.015 -14.450 22.519 1.00 72.23 H new ATOM 0 HE2 HIS A 98 5.043 -15.741 20.593 1.00 23.13 H new ATOM 1530 N GLY A 99 5.412 -8.827 17.492 1.00 61.11 N ATOM 1531 CA GLY A 99 5.867 -7.599 16.810 1.00 33.43 C ATOM 1532 C GLY A 99 7.187 -7.740 16.037 1.00 41.33 C ATOM 1533 O GLY A 99 7.685 -6.750 15.488 1.00 50.42 O ATOM 0 H GLY A 99 4.934 -9.486 16.878 1.00 61.11 H new ATOM 0 HA2 GLY A 99 5.090 -7.276 16.117 1.00 33.43 H new ATOM 0 HA3 GLY A 99 5.980 -6.809 17.553 1.00 33.43 H new ATOM 1537 N ALA A 100 7.755 -8.966 15.980 1.00 11.44 N ATOM 1538 CA ALA A 100 9.039 -9.228 15.272 1.00 54.04 C ATOM 1539 C ALA A 100 8.814 -9.425 13.741 1.00 1.52 C ATOM 1540 O ALA A 100 8.046 -10.305 13.365 1.00 71.25 O ATOM 1541 CB ALA A 100 9.730 -10.459 15.884 1.00 21.54 C ATOM 0 H ALA A 100 7.347 -9.794 16.415 1.00 11.44 H new ATOM 0 HA ALA A 100 9.684 -8.359 15.398 1.00 54.04 H new ATOM 0 HB1 ALA A 100 10.669 -10.646 15.362 1.00 21.54 H new ATOM 0 HB2 ALA A 100 9.932 -10.276 16.939 1.00 21.54 H new ATOM 0 HB3 ALA A 100 9.080 -11.328 15.784 1.00 21.54 H new ATOM 1547 N PRO A 101 9.478 -8.609 12.842 1.00 41.10 N ATOM 1548 CA PRO A 101 9.327 -8.708 11.352 1.00 5.45 C ATOM 1549 C PRO A 101 9.434 -10.155 10.777 1.00 34.30 C ATOM 1550 O PRO A 101 10.456 -10.831 10.962 1.00 33.33 O ATOM 1551 CB PRO A 101 10.489 -7.823 10.827 1.00 72.02 C ATOM 1552 CG PRO A 101 10.656 -6.784 11.892 1.00 43.13 C ATOM 1553 CD PRO A 101 10.421 -7.509 13.207 1.00 3.03 C ATOM 0 HA PRO A 101 8.331 -8.392 11.042 1.00 5.45 H new ATOM 0 HB2 PRO A 101 11.401 -8.403 10.687 1.00 72.02 H new ATOM 0 HB3 PRO A 101 10.246 -7.374 9.864 1.00 72.02 H new ATOM 0 HG2 PRO A 101 11.653 -6.345 11.859 1.00 43.13 H new ATOM 0 HG3 PRO A 101 9.944 -5.969 11.760 1.00 43.13 H new ATOM 0 HD2 PRO A 101 11.351 -7.900 13.621 1.00 3.03 H new ATOM 0 HD3 PRO A 101 9.992 -6.846 13.958 1.00 3.03 H new ATOM 1561 N VAL A 102 8.358 -10.604 10.095 1.00 43.11 N ATOM 1562 CA VAL A 102 8.265 -11.957 9.497 1.00 51.04 C ATOM 1563 C VAL A 102 9.212 -12.094 8.269 1.00 55.40 C ATOM 1564 O VAL A 102 8.933 -11.575 7.182 1.00 0.21 O ATOM 1565 CB VAL A 102 6.778 -12.304 9.097 1.00 35.32 C ATOM 1566 CG1 VAL A 102 6.661 -13.732 8.493 1.00 52.13 C ATOM 1567 CG2 VAL A 102 5.823 -12.139 10.309 1.00 40.31 C ATOM 0 H VAL A 102 7.524 -10.036 9.942 1.00 43.11 H new ATOM 0 HA VAL A 102 8.586 -12.673 10.253 1.00 51.04 H new ATOM 0 HB VAL A 102 6.477 -11.596 8.325 1.00 35.32 H new ATOM 0 HG11 VAL A 102 5.622 -13.932 8.231 1.00 52.13 H new ATOM 0 HG12 VAL A 102 7.281 -13.801 7.599 1.00 52.13 H new ATOM 0 HG13 VAL A 102 6.998 -14.466 9.225 1.00 52.13 H new ATOM 0 HG21 VAL A 102 4.805 -12.384 10.006 1.00 40.31 H new ATOM 0 HG22 VAL A 102 6.134 -12.808 11.111 1.00 40.31 H new ATOM 0 HG23 VAL A 102 5.858 -11.108 10.662 1.00 40.31 H new ATOM 1577 N ASP A 103 10.337 -12.801 8.479 1.00 71.34 N ATOM 1578 CA ASP A 103 11.406 -12.996 7.465 1.00 11.02 C ATOM 1579 C ASP A 103 10.998 -14.027 6.379 1.00 3.35 C ATOM 1580 O ASP A 103 11.578 -14.054 5.285 1.00 55.25 O ATOM 1581 CB ASP A 103 12.723 -13.417 8.175 1.00 42.25 C ATOM 1582 CG ASP A 103 12.555 -14.675 9.047 1.00 45.30 C ATOM 1583 OD1 ASP A 103 12.156 -14.550 10.227 1.00 60.42 O ATOM 1584 OD2 ASP A 103 12.790 -15.796 8.550 1.00 13.24 O ATOM 0 H ASP A 103 10.538 -13.261 9.367 1.00 71.34 H new ATOM 0 HA ASP A 103 11.565 -12.050 6.948 1.00 11.02 H new ATOM 0 HB2 ASP A 103 13.492 -13.601 7.425 1.00 42.25 H new ATOM 0 HB3 ASP A 103 13.074 -12.594 8.797 1.00 42.25 H new ATOM 1589 N GLU A 104 10.009 -14.877 6.710 1.00 24.21 N ATOM 1590 CA GLU A 104 9.406 -15.847 5.769 1.00 54.24 C ATOM 1591 C GLU A 104 8.692 -15.123 4.597 1.00 53.20 C ATOM 1592 O GLU A 104 8.828 -15.506 3.430 1.00 51.51 O ATOM 1593 CB GLU A 104 8.392 -16.738 6.532 1.00 44.40 C ATOM 1594 CG GLU A 104 7.712 -17.810 5.664 1.00 11.01 C ATOM 1595 CD GLU A 104 6.630 -18.604 6.416 1.00 42.44 C ATOM 1596 OE1 GLU A 104 6.980 -19.549 7.155 1.00 2.32 O ATOM 1597 OE2 GLU A 104 5.433 -18.277 6.278 1.00 4.12 O ATOM 0 H GLU A 104 9.601 -14.913 7.644 1.00 24.21 H new ATOM 0 HA GLU A 104 10.201 -16.463 5.350 1.00 54.24 H new ATOM 0 HB2 GLU A 104 8.907 -17.229 7.358 1.00 44.40 H new ATOM 0 HB3 GLU A 104 7.624 -16.101 6.970 1.00 44.40 H new ATOM 0 HG2 GLU A 104 7.263 -17.332 4.793 1.00 11.01 H new ATOM 0 HG3 GLU A 104 8.469 -18.501 5.293 1.00 11.01 H new ATOM 1604 N LEU A 105 7.934 -14.069 4.942 1.00 73.02 N ATOM 1605 CA LEU A 105 7.216 -13.217 3.964 1.00 10.53 C ATOM 1606 C LEU A 105 8.165 -12.224 3.254 1.00 11.24 C ATOM 1607 O LEU A 105 7.795 -11.636 2.229 1.00 14.31 O ATOM 1608 CB LEU A 105 6.065 -12.473 4.693 1.00 43.42 C ATOM 1609 CG LEU A 105 4.907 -13.400 5.200 1.00 44.55 C ATOM 1610 CD1 LEU A 105 3.945 -12.669 6.148 1.00 4.01 C ATOM 1611 CD2 LEU A 105 4.135 -14.002 4.015 1.00 62.43 C ATOM 0 H LEU A 105 7.798 -13.778 5.910 1.00 73.02 H new ATOM 0 HA LEU A 105 6.801 -13.854 3.183 1.00 10.53 H new ATOM 0 HB2 LEU A 105 6.480 -11.934 5.544 1.00 43.42 H new ATOM 0 HB3 LEU A 105 5.646 -11.727 4.017 1.00 43.42 H new ATOM 0 HG LEU A 105 5.372 -14.205 5.769 1.00 44.55 H new ATOM 0 HD11 LEU A 105 3.161 -13.354 6.471 1.00 4.01 H new ATOM 0 HD12 LEU A 105 4.494 -12.310 7.018 1.00 4.01 H new ATOM 0 HD13 LEU A 105 3.495 -11.823 5.629 1.00 4.01 H new ATOM 0 HD21 LEU A 105 3.336 -14.642 4.389 1.00 62.43 H new ATOM 0 HD22 LEU A 105 3.706 -13.200 3.415 1.00 62.43 H new ATOM 0 HD23 LEU A 105 4.815 -14.592 3.400 1.00 62.43 H new ATOM 1623 N GLY A 106 9.377 -12.042 3.823 1.00 52.24 N ATOM 1624 CA GLY A 106 10.424 -11.200 3.228 1.00 50.53 C ATOM 1625 C GLY A 106 10.134 -9.696 3.305 1.00 54.43 C ATOM 1626 O GLY A 106 9.215 -9.259 4.005 1.00 10.40 O ATOM 0 H GLY A 106 9.651 -12.476 4.705 1.00 52.24 H new ATOM 0 HA2 GLY A 106 11.369 -11.404 3.731 1.00 50.53 H new ATOM 0 HA3 GLY A 106 10.552 -11.482 2.183 1.00 50.53 H new ATOM 1630 N VAL A 107 10.946 -8.901 2.586 1.00 74.30 N ATOM 1631 CA VAL A 107 10.770 -7.436 2.478 1.00 42.05 C ATOM 1632 C VAL A 107 10.588 -7.048 0.992 1.00 14.42 C ATOM 1633 O VAL A 107 11.505 -7.200 0.181 1.00 4.33 O ATOM 1634 CB VAL A 107 12.000 -6.660 3.092 1.00 14.32 C ATOM 1635 CG1 VAL A 107 11.795 -5.122 3.015 1.00 24.12 C ATOM 1636 CG2 VAL A 107 12.279 -7.112 4.551 1.00 62.14 C ATOM 0 H VAL A 107 11.746 -9.254 2.061 1.00 74.30 H new ATOM 0 HA VAL A 107 9.883 -7.154 3.045 1.00 42.05 H new ATOM 0 HB VAL A 107 12.876 -6.908 2.492 1.00 14.32 H new ATOM 0 HG11 VAL A 107 12.660 -4.618 3.446 1.00 24.12 H new ATOM 0 HG12 VAL A 107 11.682 -4.822 1.973 1.00 24.12 H new ATOM 0 HG13 VAL A 107 10.899 -4.846 3.572 1.00 24.12 H new ATOM 0 HG21 VAL A 107 13.132 -6.560 4.946 1.00 62.14 H new ATOM 0 HG22 VAL A 107 11.402 -6.915 5.167 1.00 62.14 H new ATOM 0 HG23 VAL A 107 12.500 -8.179 4.565 1.00 62.14 H new ATOM 1646 N THR A 108 9.389 -6.564 0.650 1.00 2.22 N ATOM 1647 CA THR A 108 9.050 -6.068 -0.712 1.00 12.23 C ATOM 1648 C THR A 108 8.969 -4.530 -0.702 1.00 34.13 C ATOM 1649 O THR A 108 8.720 -3.933 0.340 1.00 41.42 O ATOM 1650 CB THR A 108 7.715 -6.693 -1.264 1.00 50.14 C ATOM 1651 OG1 THR A 108 7.240 -5.964 -2.417 1.00 45.42 O ATOM 1652 CG2 THR A 108 6.603 -6.768 -0.209 1.00 3.14 C ATOM 0 H THR A 108 8.612 -6.500 1.308 1.00 2.22 H new ATOM 0 HA THR A 108 9.845 -6.385 -1.386 1.00 12.23 H new ATOM 0 HB THR A 108 7.961 -7.715 -1.552 1.00 50.14 H new ATOM 0 HG1 THR A 108 6.830 -6.588 -3.052 1.00 45.42 H new ATOM 0 HG21 THR A 108 5.710 -7.208 -0.652 1.00 3.14 H new ATOM 0 HG22 THR A 108 6.935 -7.385 0.626 1.00 3.14 H new ATOM 0 HG23 THR A 108 6.373 -5.765 0.150 1.00 3.14 H new ATOM 1660 N HIS A 109 9.193 -3.895 -1.864 1.00 41.14 N ATOM 1661 CA HIS A 109 9.341 -2.427 -1.967 1.00 52.22 C ATOM 1662 C HIS A 109 8.281 -1.808 -2.914 1.00 73.45 C ATOM 1663 O HIS A 109 8.456 -1.802 -4.138 1.00 72.30 O ATOM 1664 CB HIS A 109 10.777 -2.108 -2.450 1.00 34.55 C ATOM 1665 CG HIS A 109 11.095 -0.646 -2.518 1.00 14.45 C ATOM 1666 ND1 HIS A 109 11.256 0.119 -1.397 1.00 14.13 N ATOM 1667 CD2 HIS A 109 11.273 0.198 -3.567 1.00 23.01 C ATOM 1668 CE1 HIS A 109 11.512 1.349 -1.743 1.00 63.15 C ATOM 1669 NE2 HIS A 109 11.531 1.429 -3.046 1.00 44.42 N ATOM 0 H HIS A 109 9.277 -4.379 -2.758 1.00 41.14 H new ATOM 0 HA HIS A 109 9.176 -1.982 -0.986 1.00 52.22 H new ATOM 0 HB2 HIS A 109 11.488 -2.592 -1.781 1.00 34.55 H new ATOM 0 HB3 HIS A 109 10.921 -2.545 -3.438 1.00 34.55 H new ATOM 0 HD1 HIS A 109 11.187 -0.220 -0.438 1.00 14.13 H new ATOM 0 HD2 HIS A 109 11.220 -0.058 -4.615 1.00 23.01 H new ATOM 0 HE1 HIS A 109 11.681 2.170 -1.062 1.00 63.15 H new ATOM 0 HE2 HIS A 109 11.710 2.276 -3.586 1.00 44.42 H new ATOM 1678 N ALA A 110 7.201 -1.260 -2.335 1.00 3.00 N ATOM 1679 CA ALA A 110 6.101 -0.645 -3.109 1.00 14.34 C ATOM 1680 C ALA A 110 6.443 0.795 -3.541 1.00 54.41 C ATOM 1681 O ALA A 110 6.948 1.598 -2.747 1.00 2.33 O ATOM 1682 CB ALA A 110 4.798 -0.662 -2.316 1.00 25.22 C ATOM 0 H ALA A 110 7.062 -1.228 -1.325 1.00 3.00 H new ATOM 0 HA ALA A 110 5.969 -1.244 -4.010 1.00 14.34 H new ATOM 0 HB1 ALA A 110 4.006 -0.204 -2.908 1.00 25.22 H new ATOM 0 HB2 ALA A 110 4.527 -1.692 -2.083 1.00 25.22 H new ATOM 0 HB3 ALA A 110 4.928 -0.102 -1.390 1.00 25.22 H new ATOM 1688 N THR A 111 6.141 1.110 -4.809 1.00 2.10 N ATOM 1689 CA THR A 111 6.393 2.439 -5.401 1.00 63.34 C ATOM 1690 C THR A 111 5.046 3.085 -5.786 1.00 40.51 C ATOM 1691 O THR A 111 4.439 2.699 -6.781 1.00 25.13 O ATOM 1692 CB THR A 111 7.301 2.308 -6.682 1.00 61.30 C ATOM 1693 OG1 THR A 111 8.388 1.397 -6.426 1.00 20.01 O ATOM 1694 CG2 THR A 111 7.882 3.664 -7.123 1.00 42.35 C ATOM 0 H THR A 111 5.713 0.450 -5.458 1.00 2.10 H new ATOM 0 HA THR A 111 6.909 3.062 -4.671 1.00 63.34 H new ATOM 0 HB THR A 111 6.668 1.930 -7.485 1.00 61.30 H new ATOM 0 HG1 THR A 111 8.040 0.483 -6.359 1.00 20.01 H new ATOM 0 HG21 THR A 111 8.501 3.524 -8.009 1.00 42.35 H new ATOM 0 HG22 THR A 111 7.068 4.351 -7.354 1.00 42.35 H new ATOM 0 HG23 THR A 111 8.489 4.079 -6.318 1.00 42.35 H new ATOM 1702 N VAL A 112 4.595 4.071 -5.002 1.00 3.23 N ATOM 1703 CA VAL A 112 3.310 4.775 -5.227 1.00 54.15 C ATOM 1704 C VAL A 112 3.543 6.043 -6.072 1.00 63.13 C ATOM 1705 O VAL A 112 4.241 6.961 -5.645 1.00 24.23 O ATOM 1706 CB VAL A 112 2.630 5.168 -3.870 1.00 64.52 C ATOM 1707 CG1 VAL A 112 1.301 5.938 -4.100 1.00 1.45 C ATOM 1708 CG2 VAL A 112 2.419 3.916 -2.984 1.00 0.02 C ATOM 0 H VAL A 112 5.107 4.411 -4.188 1.00 3.23 H new ATOM 0 HA VAL A 112 2.646 4.095 -5.760 1.00 54.15 H new ATOM 0 HB VAL A 112 3.300 5.845 -3.340 1.00 64.52 H new ATOM 0 HG11 VAL A 112 0.858 6.194 -3.138 1.00 1.45 H new ATOM 0 HG12 VAL A 112 1.502 6.850 -4.661 1.00 1.45 H new ATOM 0 HG13 VAL A 112 0.610 5.311 -4.662 1.00 1.45 H new ATOM 0 HG21 VAL A 112 1.946 4.209 -2.047 1.00 0.02 H new ATOM 0 HG22 VAL A 112 1.780 3.204 -3.506 1.00 0.02 H new ATOM 0 HG23 VAL A 112 3.383 3.452 -2.774 1.00 0.02 H new ATOM 1718 N LYS A 113 2.970 6.072 -7.281 1.00 55.10 N ATOM 1719 CA LYS A 113 3.186 7.163 -8.252 1.00 40.12 C ATOM 1720 C LYS A 113 1.833 7.741 -8.717 1.00 33.11 C ATOM 1721 O LYS A 113 1.039 7.053 -9.371 1.00 1.12 O ATOM 1722 CB LYS A 113 4.023 6.595 -9.433 1.00 14.44 C ATOM 1723 CG LYS A 113 5.412 6.042 -8.993 1.00 5.02 C ATOM 1724 CD LYS A 113 6.054 5.090 -10.020 1.00 51.40 C ATOM 1725 CE LYS A 113 6.365 5.763 -11.359 1.00 50.00 C ATOM 1726 NZ LYS A 113 7.006 4.830 -12.316 1.00 24.35 N ATOM 0 H LYS A 113 2.343 5.342 -7.618 1.00 55.10 H new ATOM 0 HA LYS A 113 3.734 7.988 -7.796 1.00 40.12 H new ATOM 0 HB2 LYS A 113 3.460 5.798 -9.919 1.00 14.44 H new ATOM 0 HB3 LYS A 113 4.170 7.379 -10.175 1.00 14.44 H new ATOM 0 HG2 LYS A 113 6.087 6.879 -8.816 1.00 5.02 H new ATOM 0 HG3 LYS A 113 5.300 5.517 -8.045 1.00 5.02 H new ATOM 0 HD2 LYS A 113 6.976 4.685 -9.602 1.00 51.40 H new ATOM 0 HD3 LYS A 113 5.384 4.247 -10.192 1.00 51.40 H new ATOM 0 HE2 LYS A 113 5.443 6.150 -11.793 1.00 50.00 H new ATOM 0 HE3 LYS A 113 7.021 6.617 -11.191 1.00 50.00 H new ATOM 0 HZ1 LYS A 113 7.199 5.327 -13.209 1.00 24.35 H new ATOM 0 HZ2 LYS A 113 7.899 4.480 -11.914 1.00 24.35 H new ATOM 0 HZ3 LYS A 113 6.370 4.027 -12.497 1.00 24.35 H new ATOM 1740 N LEU A 114 1.573 9.005 -8.336 1.00 65.14 N ATOM 1741 CA LEU A 114 0.334 9.731 -8.691 1.00 62.13 C ATOM 1742 C LEU A 114 0.491 10.523 -10.006 1.00 53.40 C ATOM 1743 O LEU A 114 1.517 11.166 -10.243 1.00 31.02 O ATOM 1744 CB LEU A 114 -0.080 10.675 -7.533 1.00 63.02 C ATOM 1745 CG LEU A 114 -0.528 9.967 -6.214 1.00 34.33 C ATOM 1746 CD1 LEU A 114 -0.790 10.979 -5.091 1.00 1.25 C ATOM 1747 CD2 LEU A 114 -1.775 9.099 -6.456 1.00 12.03 C ATOM 0 H LEU A 114 2.218 9.557 -7.770 1.00 65.14 H new ATOM 0 HA LEU A 114 -0.452 8.993 -8.849 1.00 62.13 H new ATOM 0 HB2 LEU A 114 0.760 11.331 -7.305 1.00 63.02 H new ATOM 0 HB3 LEU A 114 -0.896 11.310 -7.879 1.00 63.02 H new ATOM 0 HG LEU A 114 0.290 9.321 -5.897 1.00 34.33 H new ATOM 0 HD11 LEU A 114 -1.100 10.450 -4.190 1.00 1.25 H new ATOM 0 HD12 LEU A 114 0.122 11.541 -4.887 1.00 1.25 H new ATOM 0 HD13 LEU A 114 -1.579 11.666 -5.397 1.00 1.25 H new ATOM 0 HD21 LEU A 114 -2.069 8.616 -5.524 1.00 12.03 H new ATOM 0 HD22 LEU A 114 -2.592 9.727 -6.812 1.00 12.03 H new ATOM 0 HD23 LEU A 114 -1.549 8.338 -7.203 1.00 12.03 H new ATOM 1759 N GLU A 115 -0.547 10.457 -10.853 1.00 13.11 N ATOM 1760 CA GLU A 115 -0.587 11.141 -12.156 1.00 2.23 C ATOM 1761 C GLU A 115 -1.731 12.182 -12.183 1.00 70.21 C ATOM 1762 O GLU A 115 -2.897 11.798 -12.033 1.00 5.32 O ATOM 1763 CB GLU A 115 -0.803 10.108 -13.281 1.00 43.42 C ATOM 1764 CG GLU A 115 -0.766 10.707 -14.704 1.00 52.44 C ATOM 1765 CD GLU A 115 -1.147 9.728 -15.834 1.00 31.43 C ATOM 1766 OE1 GLU A 115 -1.103 8.497 -15.629 1.00 22.31 O ATOM 1767 OE2 GLU A 115 -1.464 10.202 -16.949 1.00 12.52 O ATOM 0 H GLU A 115 -1.392 9.922 -10.651 1.00 13.11 H new ATOM 0 HA GLU A 115 0.362 11.655 -12.310 1.00 2.23 H new ATOM 0 HB2 GLU A 115 -0.037 9.337 -13.203 1.00 43.42 H new ATOM 0 HB3 GLU A 115 -1.765 9.618 -13.130 1.00 43.42 H new ATOM 0 HG2 GLU A 115 -1.443 11.561 -14.740 1.00 52.44 H new ATOM 0 HG3 GLU A 115 0.237 11.087 -14.896 1.00 52.44 H new ATOM 1774 N PRO A 116 -1.427 13.507 -12.371 1.00 12.31 N ATOM 1775 CA PRO A 116 -2.469 14.565 -12.483 1.00 21.31 C ATOM 1776 C PRO A 116 -3.403 14.372 -13.711 1.00 52.44 C ATOM 1777 O PRO A 116 -2.971 14.506 -14.863 1.00 42.42 O ATOM 1778 CB PRO A 116 -1.641 15.878 -12.588 1.00 23.14 C ATOM 1779 CG PRO A 116 -0.283 15.444 -13.067 1.00 71.21 C ATOM 1780 CD PRO A 116 -0.053 14.080 -12.454 1.00 65.20 C ATOM 0 HA PRO A 116 -3.154 14.555 -11.635 1.00 21.31 H new ATOM 0 HB2 PRO A 116 -2.100 16.579 -13.285 1.00 23.14 H new ATOM 0 HB3 PRO A 116 -1.577 16.382 -11.624 1.00 23.14 H new ATOM 0 HG2 PRO A 116 -0.248 15.396 -14.155 1.00 71.21 H new ATOM 0 HG3 PRO A 116 0.487 16.149 -12.754 1.00 71.21 H new ATOM 0 HD2 PRO A 116 0.602 13.466 -13.072 1.00 65.20 H new ATOM 0 HD3 PRO A 116 0.413 14.154 -11.471 1.00 65.20 H new ATOM 1788 N LEU A 117 -4.675 14.023 -13.440 1.00 33.23 N ATOM 1789 CA LEU A 117 -5.728 13.878 -14.482 1.00 13.12 C ATOM 1790 C LEU A 117 -6.810 14.983 -14.323 1.00 60.23 C ATOM 1791 O LEU A 117 -7.995 14.749 -14.592 1.00 0.43 O ATOM 1792 CB LEU A 117 -6.369 12.461 -14.387 1.00 33.30 C ATOM 1793 CG LEU A 117 -5.399 11.244 -14.484 1.00 12.54 C ATOM 1794 CD1 LEU A 117 -6.159 9.909 -14.313 1.00 42.10 C ATOM 1795 CD2 LEU A 117 -4.605 11.273 -15.802 1.00 61.12 C ATOM 0 H LEU A 117 -5.009 13.832 -12.495 1.00 33.23 H new ATOM 0 HA LEU A 117 -5.272 13.993 -15.465 1.00 13.12 H new ATOM 0 HB2 LEU A 117 -6.906 12.393 -13.441 1.00 33.30 H new ATOM 0 HB3 LEU A 117 -7.110 12.369 -15.181 1.00 33.30 H new ATOM 0 HG LEU A 117 -4.683 11.321 -13.666 1.00 12.54 H new ATOM 0 HD11 LEU A 117 -5.457 9.079 -14.385 1.00 42.10 H new ATOM 0 HD12 LEU A 117 -6.645 9.889 -13.337 1.00 42.10 H new ATOM 0 HD13 LEU A 117 -6.912 9.816 -15.095 1.00 42.10 H new ATOM 0 HD21 LEU A 117 -3.937 10.413 -15.843 1.00 61.12 H new ATOM 0 HD22 LEU A 117 -5.296 11.236 -16.644 1.00 61.12 H new ATOM 0 HD23 LEU A 117 -4.019 12.191 -15.854 1.00 61.12 H new ATOM 1807 N GLU A 118 -6.354 16.190 -13.906 1.00 64.50 N ATOM 1808 CA GLU A 118 -7.200 17.402 -13.693 1.00 13.50 C ATOM 1809 C GLU A 118 -8.274 17.187 -12.590 1.00 11.11 C ATOM 1810 O GLU A 118 -8.056 17.512 -11.415 1.00 62.41 O ATOM 1811 CB GLU A 118 -7.860 17.901 -15.030 1.00 11.33 C ATOM 1812 CG GLU A 118 -6.889 18.467 -16.093 1.00 53.10 C ATOM 1813 CD GLU A 118 -5.942 17.416 -16.704 1.00 33.23 C ATOM 1814 OE1 GLU A 118 -6.352 16.697 -17.643 1.00 45.14 O ATOM 1815 OE2 GLU A 118 -4.785 17.299 -16.247 1.00 63.51 O ATOM 0 H GLU A 118 -5.368 16.357 -13.703 1.00 64.50 H new ATOM 0 HA GLU A 118 -6.527 18.184 -13.342 1.00 13.50 H new ATOM 0 HB2 GLU A 118 -8.409 17.070 -15.473 1.00 11.33 H new ATOM 0 HB3 GLU A 118 -8.591 18.672 -14.786 1.00 11.33 H new ATOM 0 HG2 GLU A 118 -7.470 18.925 -16.893 1.00 53.10 H new ATOM 0 HG3 GLU A 118 -6.292 19.258 -15.639 1.00 53.10 H new ATOM 1822 N ASN A 119 -9.421 16.619 -12.995 1.00 15.44 N ATOM 1823 CA ASN A 119 -10.571 16.341 -12.119 1.00 61.52 C ATOM 1824 C ASN A 119 -10.358 15.022 -11.338 1.00 51.22 C ATOM 1825 O ASN A 119 -10.917 14.826 -10.256 1.00 24.04 O ATOM 1826 CB ASN A 119 -11.833 16.286 -13.026 1.00 31.51 C ATOM 1827 CG ASN A 119 -13.139 15.951 -12.314 1.00 54.41 C ATOM 1828 OD1 ASN A 119 -13.350 16.293 -11.161 1.00 13.10 O ATOM 1829 ND2 ASN A 119 -14.032 15.293 -13.018 1.00 22.41 N ATOM 0 H ASN A 119 -9.578 16.334 -13.962 1.00 15.44 H new ATOM 0 HA ASN A 119 -10.691 17.121 -11.367 1.00 61.52 H new ATOM 0 HB2 ASN A 119 -11.946 17.251 -13.520 1.00 31.51 H new ATOM 0 HB3 ASN A 119 -11.665 15.545 -13.808 1.00 31.51 H new ATOM 0 HD21 ASN A 119 -14.933 15.053 -12.603 1.00 22.41 H new ATOM 0 HD22 ASN A 119 -13.825 15.022 -13.979 1.00 22.41 H new ATOM 1836 N ARG A 120 -9.542 14.115 -11.918 1.00 31.51 N ATOM 1837 CA ARG A 120 -9.175 12.825 -11.294 1.00 41.43 C ATOM 1838 C ARG A 120 -7.646 12.730 -11.089 1.00 53.41 C ATOM 1839 O ARG A 120 -6.909 13.678 -11.386 1.00 72.33 O ATOM 1840 CB ARG A 120 -9.693 11.618 -12.135 1.00 41.50 C ATOM 1841 CG ARG A 120 -11.238 11.507 -12.219 1.00 71.02 C ATOM 1842 CD ARG A 120 -11.874 12.411 -13.291 1.00 71.22 C ATOM 1843 NE ARG A 120 -11.577 11.962 -14.663 1.00 12.50 N ATOM 1844 CZ ARG A 120 -12.373 12.115 -15.702 1.00 4.20 C ATOM 1845 NH1 ARG A 120 -13.553 12.635 -15.575 1.00 4.04 N ATOM 1846 NH2 ARG A 120 -11.987 11.722 -16.869 1.00 2.24 N ATOM 0 H ARG A 120 -9.118 14.257 -12.835 1.00 31.51 H new ATOM 0 HA ARG A 120 -9.657 12.782 -10.317 1.00 41.43 H new ATOM 0 HB2 ARG A 120 -9.292 11.697 -13.145 1.00 41.50 H new ATOM 0 HB3 ARG A 120 -9.298 10.697 -11.706 1.00 41.50 H new ATOM 0 HG2 ARG A 120 -11.507 10.471 -12.426 1.00 71.02 H new ATOM 0 HG3 ARG A 120 -11.663 11.759 -11.247 1.00 71.02 H new ATOM 0 HD2 ARG A 120 -12.954 12.434 -13.147 1.00 71.22 H new ATOM 0 HD3 ARG A 120 -11.513 13.431 -13.161 1.00 71.22 H new ATOM 0 HE ARG A 120 -10.684 11.495 -14.821 1.00 12.50 H new ATOM 0 HH11 ARG A 120 -13.882 12.935 -14.657 1.00 4.04 H new ATOM 0 HH12 ARG A 120 -14.153 12.744 -16.393 1.00 4.04 H new ATOM 0 HH21 ARG A 120 -11.068 11.294 -16.985 1.00 2.24 H new ATOM 0 HH22 ARG A 120 -12.601 11.839 -17.675 1.00 2.24 H new ATOM 1860 N THR A 121 -7.184 11.598 -10.540 1.00 11.54 N ATOM 1861 CA THR A 121 -5.737 11.293 -10.383 1.00 55.40 C ATOM 1862 C THR A 121 -5.518 9.762 -10.400 1.00 2.14 C ATOM 1863 O THR A 121 -6.308 9.015 -9.820 1.00 10.13 O ATOM 1864 CB THR A 121 -5.146 11.910 -9.061 1.00 71.50 C ATOM 1865 OG1 THR A 121 -5.248 13.344 -9.103 1.00 31.20 O ATOM 1866 CG2 THR A 121 -3.673 11.525 -8.824 1.00 42.51 C ATOM 0 H THR A 121 -7.796 10.861 -10.189 1.00 11.54 H new ATOM 0 HA THR A 121 -5.209 11.748 -11.221 1.00 55.40 H new ATOM 0 HB THR A 121 -5.732 11.501 -8.238 1.00 71.50 H new ATOM 0 HG1 THR A 121 -5.683 13.617 -9.938 1.00 31.20 H new ATOM 0 HG21 THR A 121 -3.322 11.980 -7.898 1.00 42.51 H new ATOM 0 HG22 THR A 121 -3.588 10.441 -8.750 1.00 42.51 H new ATOM 0 HG23 THR A 121 -3.065 11.881 -9.656 1.00 42.51 H new ATOM 1874 N ARG A 122 -4.422 9.306 -11.040 1.00 30.42 N ATOM 1875 CA ARG A 122 -4.107 7.869 -11.210 1.00 55.30 C ATOM 1876 C ARG A 122 -2.984 7.433 -10.243 1.00 52.25 C ATOM 1877 O ARG A 122 -1.895 7.996 -10.258 1.00 14.44 O ATOM 1878 CB ARG A 122 -3.688 7.613 -12.683 1.00 40.53 C ATOM 1879 CG ARG A 122 -3.220 6.175 -12.987 1.00 24.42 C ATOM 1880 CD ARG A 122 -2.967 5.935 -14.486 1.00 73.44 C ATOM 1881 NE ARG A 122 -4.216 5.993 -15.280 1.00 61.11 N ATOM 1882 CZ ARG A 122 -4.372 6.595 -16.442 1.00 61.34 C ATOM 1883 NH1 ARG A 122 -3.438 7.329 -16.962 1.00 12.42 N ATOM 1884 NH2 ARG A 122 -5.494 6.485 -17.067 1.00 50.41 N ATOM 0 H ARG A 122 -3.726 9.925 -11.456 1.00 30.42 H new ATOM 0 HA ARG A 122 -4.992 7.278 -10.975 1.00 55.30 H new ATOM 0 HB2 ARG A 122 -4.532 7.849 -13.331 1.00 40.53 H new ATOM 0 HB3 ARG A 122 -2.885 8.303 -12.942 1.00 40.53 H new ATOM 0 HG2 ARG A 122 -2.305 5.970 -12.431 1.00 24.42 H new ATOM 0 HG3 ARG A 122 -3.972 5.470 -12.633 1.00 24.42 H new ATOM 0 HD2 ARG A 122 -2.266 6.682 -14.859 1.00 73.44 H new ATOM 0 HD3 ARG A 122 -2.497 4.961 -14.622 1.00 73.44 H new ATOM 0 HE ARG A 122 -5.033 5.522 -14.891 1.00 61.11 H new ATOM 0 HH11 ARG A 122 -2.553 7.453 -16.470 1.00 12.42 H new ATOM 0 HH12 ARG A 122 -3.588 7.782 -17.863 1.00 12.42 H new ATOM 0 HH21 ARG A 122 -6.252 5.936 -16.662 1.00 50.41 H new ATOM 0 HH22 ARG A 122 -5.624 6.947 -17.967 1.00 50.41 H new ATOM 1898 N MET A 123 -3.263 6.409 -9.420 1.00 64.51 N ATOM 1899 CA MET A 123 -2.306 5.874 -8.429 1.00 52.52 C ATOM 1900 C MET A 123 -1.812 4.482 -8.861 1.00 62.43 C ATOM 1901 O MET A 123 -2.591 3.527 -8.884 1.00 11.12 O ATOM 1902 CB MET A 123 -2.973 5.776 -7.033 1.00 45.33 C ATOM 1903 CG MET A 123 -2.005 5.389 -5.903 1.00 64.24 C ATOM 1904 SD MET A 123 -2.834 5.133 -4.327 1.00 24.54 S ATOM 1905 CE MET A 123 -3.863 3.724 -4.719 1.00 21.10 C ATOM 0 H MET A 123 -4.161 5.925 -9.421 1.00 64.51 H new ATOM 0 HA MET A 123 -1.456 6.554 -8.372 1.00 52.52 H new ATOM 0 HB2 MET A 123 -3.431 6.735 -6.792 1.00 45.33 H new ATOM 0 HB3 MET A 123 -3.777 5.041 -7.077 1.00 45.33 H new ATOM 0 HG2 MET A 123 -1.476 4.478 -6.181 1.00 64.24 H new ATOM 0 HG3 MET A 123 -1.255 6.172 -5.790 1.00 64.24 H new ATOM 0 HE1 MET A 123 -3.787 2.985 -3.921 1.00 21.10 H new ATOM 0 HE2 MET A 123 -4.900 4.047 -4.817 1.00 21.10 H new ATOM 0 HE3 MET A 123 -3.531 3.281 -5.658 1.00 21.10 H new ATOM 1915 N THR A 124 -0.524 4.378 -9.208 1.00 64.33 N ATOM 1916 CA THR A 124 0.113 3.090 -9.559 1.00 5.33 C ATOM 1917 C THR A 124 1.107 2.673 -8.450 1.00 14.20 C ATOM 1918 O THR A 124 2.120 3.341 -8.240 1.00 34.22 O ATOM 1919 CB THR A 124 0.845 3.182 -10.941 1.00 52.44 C ATOM 1920 OG1 THR A 124 -0.080 3.630 -11.949 1.00 52.42 O ATOM 1921 CG2 THR A 124 1.444 1.825 -11.376 1.00 53.23 C ATOM 0 H THR A 124 0.109 5.176 -9.255 1.00 64.33 H new ATOM 0 HA THR A 124 -0.667 2.333 -9.642 1.00 5.33 H new ATOM 0 HB THR A 124 1.665 3.892 -10.828 1.00 52.44 H new ATOM 0 HG1 THR A 124 0.380 3.689 -12.812 1.00 52.42 H new ATOM 0 HG21 THR A 124 1.941 1.939 -12.339 1.00 53.23 H new ATOM 0 HG22 THR A 124 2.167 1.491 -10.632 1.00 53.23 H new ATOM 0 HG23 THR A 124 0.647 1.087 -11.464 1.00 53.23 H new ATOM 1929 N ILE A 125 0.790 1.575 -7.729 1.00 12.33 N ATOM 1930 CA ILE A 125 1.634 1.042 -6.631 1.00 31.13 C ATOM 1931 C ILE A 125 2.398 -0.206 -7.114 1.00 65.42 C ATOM 1932 O ILE A 125 1.780 -1.237 -7.364 1.00 34.13 O ATOM 1933 CB ILE A 125 0.766 0.651 -5.381 1.00 31.22 C ATOM 1934 CG1 ILE A 125 -0.137 1.842 -4.944 1.00 41.34 C ATOM 1935 CG2 ILE A 125 1.663 0.167 -4.207 1.00 1.21 C ATOM 1936 CD1 ILE A 125 -1.044 1.537 -3.771 1.00 54.24 C ATOM 0 H ILE A 125 -0.058 1.032 -7.890 1.00 12.33 H new ATOM 0 HA ILE A 125 2.335 1.826 -6.342 1.00 31.13 H new ATOM 0 HB ILE A 125 0.117 -0.178 -5.664 1.00 31.22 H new ATOM 0 HG12 ILE A 125 0.498 2.689 -4.686 1.00 41.34 H new ATOM 0 HG13 ILE A 125 -0.749 2.149 -5.792 1.00 41.34 H new ATOM 0 HG21 ILE A 125 1.036 -0.097 -3.355 1.00 1.21 H new ATOM 0 HG22 ILE A 125 2.234 -0.706 -4.522 1.00 1.21 H new ATOM 0 HG23 ILE A 125 2.348 0.965 -3.920 1.00 1.21 H new ATOM 0 HD11 ILE A 125 -1.638 2.419 -3.532 1.00 54.24 H new ATOM 0 HD12 ILE A 125 -1.707 0.712 -4.029 1.00 54.24 H new ATOM 0 HD13 ILE A 125 -0.440 1.261 -2.907 1.00 54.24 H new ATOM 1948 N ILE A 126 3.734 -0.112 -7.224 1.00 0.11 N ATOM 1949 CA ILE A 126 4.577 -1.184 -7.808 1.00 42.00 C ATOM 1950 C ILE A 126 5.488 -1.831 -6.727 1.00 61.24 C ATOM 1951 O ILE A 126 6.516 -1.261 -6.349 1.00 61.33 O ATOM 1952 CB ILE A 126 5.467 -0.603 -8.979 1.00 45.20 C ATOM 1953 CG1 ILE A 126 4.601 0.258 -9.963 1.00 13.21 C ATOM 1954 CG2 ILE A 126 6.207 -1.737 -9.730 1.00 23.40 C ATOM 1955 CD1 ILE A 126 5.376 0.953 -11.075 1.00 42.32 C ATOM 0 H ILE A 126 4.264 0.703 -6.914 1.00 0.11 H new ATOM 0 HA ILE A 126 3.915 -1.953 -8.206 1.00 42.00 H new ATOM 0 HB ILE A 126 6.221 0.049 -8.539 1.00 45.20 H new ATOM 0 HG12 ILE A 126 3.847 -0.386 -10.416 1.00 13.21 H new ATOM 0 HG13 ILE A 126 4.069 1.014 -9.386 1.00 13.21 H new ATOM 0 HG21 ILE A 126 6.812 -1.310 -10.530 1.00 23.40 H new ATOM 0 HG22 ILE A 126 6.852 -2.273 -9.034 1.00 23.40 H new ATOM 0 HG23 ILE A 126 5.479 -2.428 -10.155 1.00 23.40 H new ATOM 0 HD11 ILE A 126 4.686 1.521 -11.699 1.00 42.32 H new ATOM 0 HD12 ILE A 126 6.111 1.629 -10.638 1.00 42.32 H new ATOM 0 HD13 ILE A 126 5.886 0.207 -11.684 1.00 42.32 H new ATOM 1967 N SER A 127 5.102 -3.026 -6.246 1.00 32.13 N ATOM 1968 CA SER A 127 5.826 -3.758 -5.171 1.00 3.33 C ATOM 1969 C SER A 127 6.911 -4.690 -5.759 1.00 24.25 C ATOM 1970 O SER A 127 6.592 -5.691 -6.399 1.00 52.23 O ATOM 1971 CB SER A 127 4.821 -4.563 -4.306 1.00 43.34 C ATOM 1972 OG SER A 127 3.862 -3.710 -3.692 1.00 23.43 O ATOM 0 H SER A 127 4.277 -3.520 -6.588 1.00 32.13 H new ATOM 0 HA SER A 127 6.329 -3.026 -4.538 1.00 3.33 H new ATOM 0 HB2 SER A 127 4.310 -5.298 -4.929 1.00 43.34 H new ATOM 0 HB3 SER A 127 5.362 -5.116 -3.538 1.00 43.34 H new ATOM 0 HG SER A 127 3.242 -4.247 -3.156 1.00 23.43 H new ATOM 1978 N THR A 128 8.197 -4.340 -5.555 1.00 2.42 N ATOM 1979 CA THR A 128 9.356 -5.097 -6.083 1.00 70.32 C ATOM 1980 C THR A 128 9.878 -6.134 -5.055 1.00 43.43 C ATOM 1981 O THR A 128 10.176 -5.798 -3.907 1.00 73.40 O ATOM 1982 CB THR A 128 10.516 -4.132 -6.512 1.00 31.02 C ATOM 1983 OG1 THR A 128 10.932 -3.329 -5.404 1.00 24.15 O ATOM 1984 CG2 THR A 128 10.102 -3.206 -7.676 1.00 41.44 C ATOM 0 H THR A 128 8.465 -3.517 -5.015 1.00 2.42 H new ATOM 0 HA THR A 128 9.009 -5.637 -6.964 1.00 70.32 H new ATOM 0 HB THR A 128 11.340 -4.760 -6.850 1.00 31.02 H new ATOM 0 HG1 THR A 128 11.657 -2.733 -5.686 1.00 24.15 H new ATOM 0 HG21 THR A 128 10.937 -2.556 -7.938 1.00 41.44 H new ATOM 0 HG22 THR A 128 9.826 -3.810 -8.541 1.00 41.44 H new ATOM 0 HG23 THR A 128 9.250 -2.598 -7.372 1.00 41.44 H new ATOM 1992 N PHE A 129 9.996 -7.400 -5.498 1.00 54.02 N ATOM 1993 CA PHE A 129 10.305 -8.562 -4.631 1.00 62.42 C ATOM 1994 C PHE A 129 11.782 -9.001 -4.739 1.00 33.43 C ATOM 1995 O PHE A 129 12.454 -8.749 -5.744 1.00 21.13 O ATOM 1996 CB PHE A 129 9.379 -9.749 -5.004 1.00 10.14 C ATOM 1997 CG PHE A 129 7.897 -9.409 -4.892 1.00 1.24 C ATOM 1998 CD1 PHE A 129 7.274 -9.372 -3.653 1.00 42.34 C ATOM 1999 CD2 PHE A 129 7.137 -9.102 -6.016 1.00 15.34 C ATOM 2000 CE1 PHE A 129 5.944 -9.043 -3.540 1.00 62.23 C ATOM 2001 CE2 PHE A 129 5.801 -8.779 -5.898 1.00 31.35 C ATOM 2002 CZ PHE A 129 5.206 -8.747 -4.660 1.00 32.12 C ATOM 0 H PHE A 129 9.879 -7.652 -6.479 1.00 54.02 H new ATOM 0 HA PHE A 129 10.131 -8.256 -3.599 1.00 62.42 H new ATOM 0 HB2 PHE A 129 9.597 -10.066 -6.024 1.00 10.14 H new ATOM 0 HB3 PHE A 129 9.602 -10.595 -4.353 1.00 10.14 H new ATOM 0 HD1 PHE A 129 7.842 -9.605 -2.764 1.00 42.34 H new ATOM 0 HD2 PHE A 129 7.598 -9.117 -6.992 1.00 15.34 H new ATOM 0 HE1 PHE A 129 5.477 -9.017 -2.566 1.00 62.23 H new ATOM 0 HE2 PHE A 129 5.222 -8.551 -6.780 1.00 31.35 H new ATOM 0 HZ PHE A 129 4.161 -8.490 -4.568 1.00 32.12 H new ATOM 2012 N GLU A 130 12.251 -9.689 -3.689 1.00 0.12 N ATOM 2013 CA GLU A 130 13.619 -10.233 -3.599 1.00 72.21 C ATOM 2014 C GLU A 130 13.768 -11.546 -4.416 1.00 24.34 C ATOM 2015 O GLU A 130 14.836 -11.828 -4.965 1.00 44.31 O ATOM 2016 CB GLU A 130 13.961 -10.496 -2.107 1.00 73.03 C ATOM 2017 CG GLU A 130 13.783 -9.269 -1.188 1.00 15.25 C ATOM 2018 CD GLU A 130 14.098 -9.570 0.290 1.00 22.33 C ATOM 2019 OE1 GLU A 130 13.237 -10.158 0.981 1.00 50.42 O ATOM 2020 OE2 GLU A 130 15.210 -9.242 0.757 1.00 22.12 O ATOM 0 H GLU A 130 11.685 -9.888 -2.864 1.00 0.12 H new ATOM 0 HA GLU A 130 14.310 -9.503 -4.021 1.00 72.21 H new ATOM 0 HB2 GLU A 130 13.330 -11.305 -1.739 1.00 73.03 H new ATOM 0 HB3 GLU A 130 14.993 -10.840 -2.038 1.00 73.03 H new ATOM 0 HG2 GLU A 130 14.432 -8.465 -1.535 1.00 15.25 H new ATOM 0 HG3 GLU A 130 12.758 -8.908 -1.269 1.00 15.25 H new ATOM 2027 N SER A 131 12.679 -12.344 -4.475 1.00 15.42 N ATOM 2028 CA SER A 131 12.652 -13.650 -5.176 1.00 13.54 C ATOM 2029 C SER A 131 11.237 -13.947 -5.721 1.00 61.30 C ATOM 2030 O SER A 131 10.242 -13.411 -5.208 1.00 42.11 O ATOM 2031 CB SER A 131 13.090 -14.781 -4.210 1.00 42.45 C ATOM 2032 OG SER A 131 13.105 -16.048 -4.854 1.00 31.15 O ATOM 0 H SER A 131 11.791 -12.101 -4.037 1.00 15.42 H new ATOM 0 HA SER A 131 13.346 -13.604 -6.015 1.00 13.54 H new ATOM 0 HB2 SER A 131 14.083 -14.560 -3.818 1.00 42.45 H new ATOM 0 HB3 SER A 131 12.411 -14.814 -3.358 1.00 42.45 H new ATOM 0 HG SER A 131 13.314 -16.746 -4.198 1.00 31.15 H new ATOM 2038 N GLU A 132 11.163 -14.805 -6.765 1.00 34.54 N ATOM 2039 CA GLU A 132 9.877 -15.308 -7.309 1.00 24.00 C ATOM 2040 C GLU A 132 9.100 -16.117 -6.246 1.00 10.02 C ATOM 2041 O GLU A 132 7.875 -16.144 -6.253 1.00 11.12 O ATOM 2042 CB GLU A 132 10.104 -16.157 -8.587 1.00 64.41 C ATOM 2043 CG GLU A 132 8.803 -16.579 -9.306 1.00 71.33 C ATOM 2044 CD GLU A 132 9.041 -17.404 -10.584 1.00 42.40 C ATOM 2045 OE1 GLU A 132 9.236 -18.636 -10.481 1.00 11.44 O ATOM 2046 OE2 GLU A 132 9.040 -16.827 -11.692 1.00 21.12 O ATOM 0 H GLU A 132 11.984 -15.166 -7.251 1.00 34.54 H new ATOM 0 HA GLU A 132 9.274 -14.442 -7.582 1.00 24.00 H new ATOM 0 HB2 GLU A 132 10.722 -15.589 -9.282 1.00 64.41 H new ATOM 0 HB3 GLU A 132 10.665 -17.052 -8.320 1.00 64.41 H new ATOM 0 HG2 GLU A 132 8.190 -17.161 -8.617 1.00 71.33 H new ATOM 0 HG3 GLU A 132 8.234 -15.685 -9.562 1.00 71.33 H new ATOM 2053 N GLU A 133 9.847 -16.738 -5.316 1.00 70.34 N ATOM 2054 CA GLU A 133 9.285 -17.460 -4.150 1.00 10.22 C ATOM 2055 C GLU A 133 8.403 -16.524 -3.278 1.00 64.41 C ATOM 2056 O GLU A 133 7.331 -16.914 -2.814 1.00 24.10 O ATOM 2057 CB GLU A 133 10.443 -18.036 -3.299 1.00 43.01 C ATOM 2058 CG GLU A 133 11.489 -18.834 -4.103 1.00 42.25 C ATOM 2059 CD GLU A 133 12.652 -19.335 -3.231 1.00 23.12 C ATOM 2060 OE1 GLU A 133 13.560 -18.529 -2.916 1.00 43.23 O ATOM 2061 OE2 GLU A 133 12.649 -20.519 -2.829 1.00 20.01 O ATOM 0 H GLU A 133 10.866 -16.756 -5.349 1.00 70.34 H new ATOM 0 HA GLU A 133 8.654 -18.270 -4.516 1.00 10.22 H new ATOM 0 HB2 GLU A 133 10.945 -17.215 -2.788 1.00 43.01 H new ATOM 0 HB3 GLU A 133 10.024 -18.683 -2.528 1.00 43.01 H new ATOM 0 HG2 GLU A 133 11.003 -19.686 -4.578 1.00 42.25 H new ATOM 0 HG3 GLU A 133 11.884 -18.206 -4.902 1.00 42.25 H new ATOM 2068 N GLN A 134 8.878 -15.272 -3.093 1.00 55.23 N ATOM 2069 CA GLN A 134 8.160 -14.224 -2.327 1.00 34.02 C ATOM 2070 C GLN A 134 6.952 -13.678 -3.128 1.00 63.42 C ATOM 2071 O GLN A 134 5.887 -13.428 -2.563 1.00 45.12 O ATOM 2072 CB GLN A 134 9.128 -13.066 -1.960 1.00 72.01 C ATOM 2073 CG GLN A 134 8.481 -11.913 -1.160 1.00 52.13 C ATOM 2074 CD GLN A 134 9.433 -10.756 -0.862 1.00 42.24 C ATOM 2075 OE1 GLN A 134 10.375 -10.511 -1.594 1.00 40.34 O ATOM 2076 NE2 GLN A 134 9.178 -10.027 0.199 1.00 75.10 N ATOM 0 H GLN A 134 9.772 -14.957 -3.471 1.00 55.23 H new ATOM 0 HA GLN A 134 7.783 -14.675 -1.409 1.00 34.02 H new ATOM 0 HB2 GLN A 134 9.956 -13.473 -1.380 1.00 72.01 H new ATOM 0 HB3 GLN A 134 9.552 -12.660 -2.878 1.00 72.01 H new ATOM 0 HG2 GLN A 134 7.625 -11.532 -1.718 1.00 52.13 H new ATOM 0 HG3 GLN A 134 8.098 -12.307 -0.219 1.00 52.13 H new ATOM 0 HE21 GLN A 134 8.382 -10.255 0.795 1.00 75.10 H new ATOM 0 HE22 GLN A 134 9.776 -9.233 0.428 1.00 75.10 H new ATOM 2085 N MET A 135 7.152 -13.488 -4.451 1.00 23.32 N ATOM 2086 CA MET A 135 6.070 -13.121 -5.405 1.00 52.00 C ATOM 2087 C MET A 135 4.871 -14.110 -5.308 1.00 72.02 C ATOM 2088 O MET A 135 3.710 -13.691 -5.198 1.00 55.14 O ATOM 2089 CB MET A 135 6.659 -13.052 -6.856 1.00 64.33 C ATOM 2090 CG MET A 135 5.643 -13.223 -7.999 1.00 11.30 C ATOM 2091 SD MET A 135 4.302 -12.007 -7.974 1.00 51.24 S ATOM 2092 CE MET A 135 5.040 -10.588 -8.778 1.00 3.24 C ATOM 0 H MET A 135 8.067 -13.584 -4.892 1.00 23.32 H new ATOM 0 HA MET A 135 5.679 -12.138 -5.144 1.00 52.00 H new ATOM 0 HB2 MET A 135 7.159 -12.091 -6.980 1.00 64.33 H new ATOM 0 HB3 MET A 135 7.423 -13.824 -6.955 1.00 64.33 H new ATOM 0 HG2 MET A 135 6.167 -13.152 -8.952 1.00 11.30 H new ATOM 0 HG3 MET A 135 5.214 -14.224 -7.945 1.00 11.30 H new ATOM 0 HE1 MET A 135 4.535 -9.680 -8.449 1.00 3.24 H new ATOM 0 HE2 MET A 135 6.097 -10.531 -8.517 1.00 3.24 H new ATOM 0 HE3 MET A 135 4.938 -10.688 -9.859 1.00 3.24 H new ATOM 2102 N GLN A 136 5.182 -15.425 -5.324 1.00 13.54 N ATOM 2103 CA GLN A 136 4.176 -16.497 -5.155 1.00 72.22 C ATOM 2104 C GLN A 136 3.526 -16.419 -3.756 1.00 14.13 C ATOM 2105 O GLN A 136 2.305 -16.438 -3.642 1.00 60.41 O ATOM 2106 CB GLN A 136 4.812 -17.897 -5.373 1.00 45.20 C ATOM 2107 CG GLN A 136 5.446 -18.142 -6.763 1.00 72.41 C ATOM 2108 CD GLN A 136 4.461 -18.056 -7.936 1.00 45.11 C ATOM 2109 OE1 GLN A 136 3.810 -19.034 -8.289 1.00 21.35 O ATOM 2110 NE2 GLN A 136 4.371 -16.902 -8.566 1.00 45.14 N ATOM 0 H GLN A 136 6.132 -15.772 -5.454 1.00 13.54 H new ATOM 0 HA GLN A 136 3.402 -16.351 -5.909 1.00 72.22 H new ATOM 0 HB2 GLN A 136 5.579 -18.049 -4.613 1.00 45.20 H new ATOM 0 HB3 GLN A 136 4.045 -18.653 -5.207 1.00 45.20 H new ATOM 0 HG2 GLN A 136 6.241 -17.413 -6.919 1.00 72.41 H new ATOM 0 HG3 GLN A 136 5.911 -19.128 -6.767 1.00 72.41 H new ATOM 0 HE21 GLN A 136 4.924 -16.105 -8.251 1.00 45.14 H new ATOM 0 HE22 GLN A 136 3.749 -16.806 -9.368 1.00 45.14 H new ATOM 2119 N LYS A 137 4.380 -16.268 -2.721 1.00 33.24 N ATOM 2120 CA LYS A 137 3.971 -16.263 -1.291 1.00 74.11 C ATOM 2121 C LYS A 137 2.896 -15.185 -0.993 1.00 23.15 C ATOM 2122 O LYS A 137 1.912 -15.468 -0.315 1.00 71.24 O ATOM 2123 CB LYS A 137 5.223 -16.042 -0.396 1.00 30.31 C ATOM 2124 CG LYS A 137 4.972 -16.107 1.130 1.00 41.21 C ATOM 2125 CD LYS A 137 4.542 -17.514 1.621 1.00 65.41 C ATOM 2126 CE LYS A 137 4.323 -17.563 3.145 1.00 43.20 C ATOM 2127 NZ LYS A 137 4.054 -18.935 3.641 1.00 35.00 N ATOM 0 H LYS A 137 5.384 -16.145 -2.851 1.00 33.24 H new ATOM 0 HA LYS A 137 3.522 -17.230 -1.066 1.00 74.11 H new ATOM 0 HB2 LYS A 137 5.970 -16.792 -0.656 1.00 30.31 H new ATOM 0 HB3 LYS A 137 5.651 -15.069 -0.635 1.00 30.31 H new ATOM 0 HG2 LYS A 137 5.880 -15.809 1.654 1.00 41.21 H new ATOM 0 HG3 LYS A 137 4.199 -15.385 1.395 1.00 41.21 H new ATOM 0 HD2 LYS A 137 3.622 -17.807 1.115 1.00 65.41 H new ATOM 0 HD3 LYS A 137 5.304 -18.242 1.343 1.00 65.41 H new ATOM 0 HE2 LYS A 137 5.205 -17.166 3.648 1.00 43.20 H new ATOM 0 HE3 LYS A 137 3.487 -16.915 3.409 1.00 43.20 H new ATOM 0 HZ1 LYS A 137 4.450 -19.043 4.597 1.00 35.00 H new ATOM 0 HZ2 LYS A 137 3.027 -19.098 3.671 1.00 35.00 H new ATOM 0 HZ3 LYS A 137 4.496 -19.628 3.003 1.00 35.00 H new ATOM 2141 N MET A 138 3.095 -13.963 -1.525 1.00 2.03 N ATOM 2142 CA MET A 138 2.137 -12.834 -1.362 1.00 14.31 C ATOM 2143 C MET A 138 0.736 -13.177 -1.915 1.00 64.44 C ATOM 2144 O MET A 138 -0.284 -12.919 -1.265 1.00 34.24 O ATOM 2145 CB MET A 138 2.681 -11.567 -2.067 1.00 10.54 C ATOM 2146 CG MET A 138 3.964 -10.966 -1.460 1.00 24.53 C ATOM 2147 SD MET A 138 3.712 -10.152 0.139 1.00 61.24 S ATOM 2148 CE MET A 138 3.959 -11.489 1.301 1.00 53.24 C ATOM 0 H MET A 138 3.918 -13.724 -2.078 1.00 2.03 H new ATOM 0 HA MET A 138 2.036 -12.647 -0.293 1.00 14.31 H new ATOM 0 HB2 MET A 138 2.874 -11.809 -3.112 1.00 10.54 H new ATOM 0 HB3 MET A 138 1.903 -10.804 -2.055 1.00 10.54 H new ATOM 0 HG2 MET A 138 4.703 -11.759 -1.340 1.00 24.53 H new ATOM 0 HG3 MET A 138 4.382 -10.244 -2.162 1.00 24.53 H new ATOM 0 HE1 MET A 138 3.110 -11.540 1.983 1.00 53.24 H new ATOM 0 HE2 MET A 138 4.046 -12.431 0.759 1.00 53.24 H new ATOM 0 HE3 MET A 138 4.871 -11.312 1.871 1.00 53.24 H new ATOM 2158 N ALA A 139 0.714 -13.770 -3.117 1.00 62.43 N ATOM 2159 CA ALA A 139 -0.533 -14.183 -3.781 1.00 33.21 C ATOM 2160 C ALA A 139 -1.239 -15.326 -2.999 1.00 20.34 C ATOM 2161 O ALA A 139 -2.463 -15.311 -2.835 1.00 54.22 O ATOM 2162 CB ALA A 139 -0.233 -14.579 -5.238 1.00 31.34 C ATOM 0 H ALA A 139 1.555 -13.977 -3.655 1.00 62.43 H new ATOM 0 HA ALA A 139 -1.227 -13.343 -3.790 1.00 33.21 H new ATOM 0 HB1 ALA A 139 -1.157 -14.885 -5.729 1.00 31.34 H new ATOM 0 HB2 ALA A 139 0.194 -13.727 -5.766 1.00 31.34 H new ATOM 0 HB3 ALA A 139 0.476 -15.407 -5.251 1.00 31.34 H new ATOM 2168 N GLU A 140 -0.435 -16.277 -2.472 1.00 11.42 N ATOM 2169 CA GLU A 140 -0.933 -17.419 -1.658 1.00 31.22 C ATOM 2170 C GLU A 140 -1.498 -16.961 -0.286 1.00 5.43 C ATOM 2171 O GLU A 140 -2.435 -17.565 0.237 1.00 50.41 O ATOM 2172 CB GLU A 140 0.201 -18.464 -1.443 1.00 15.31 C ATOM 2173 CG GLU A 140 0.794 -19.067 -2.739 1.00 13.30 C ATOM 2174 CD GLU A 140 -0.219 -19.858 -3.586 1.00 32.54 C ATOM 2175 OE1 GLU A 140 -0.422 -21.063 -3.319 1.00 64.24 O ATOM 2176 OE2 GLU A 140 -0.814 -19.286 -4.524 1.00 74.52 O ATOM 0 H GLU A 140 0.577 -16.278 -2.597 1.00 11.42 H new ATOM 0 HA GLU A 140 -1.751 -17.877 -2.214 1.00 31.22 H new ATOM 0 HB2 GLU A 140 1.006 -17.993 -0.879 1.00 15.31 H new ATOM 0 HB3 GLU A 140 -0.186 -19.276 -0.827 1.00 15.31 H new ATOM 0 HG2 GLU A 140 1.208 -18.261 -3.346 1.00 13.30 H new ATOM 0 HG3 GLU A 140 1.622 -19.725 -2.475 1.00 13.30 H new ATOM 2183 N MET A 141 -0.918 -15.884 0.280 1.00 40.32 N ATOM 2184 CA MET A 141 -1.383 -15.279 1.561 1.00 30.20 C ATOM 2185 C MET A 141 -2.674 -14.448 1.382 1.00 3.23 C ATOM 2186 O MET A 141 -3.306 -14.069 2.371 1.00 51.15 O ATOM 2187 CB MET A 141 -0.264 -14.378 2.161 1.00 21.24 C ATOM 2188 CG MET A 141 0.969 -15.140 2.675 1.00 52.03 C ATOM 2189 SD MET A 141 0.631 -16.122 4.153 1.00 52.51 S ATOM 2190 CE MET A 141 0.263 -14.857 5.376 1.00 42.30 C ATOM 0 H MET A 141 -0.116 -15.405 -0.130 1.00 40.32 H new ATOM 0 HA MET A 141 -1.609 -16.100 2.242 1.00 30.20 H new ATOM 0 HB2 MET A 141 0.057 -13.666 1.401 1.00 21.24 H new ATOM 0 HB3 MET A 141 -0.685 -13.799 2.983 1.00 21.24 H new ATOM 0 HG2 MET A 141 1.338 -15.796 1.887 1.00 52.03 H new ATOM 0 HG3 MET A 141 1.764 -14.427 2.894 1.00 52.03 H new ATOM 0 HE1 MET A 141 0.335 -15.286 6.376 1.00 42.30 H new ATOM 0 HE2 MET A 141 0.977 -14.039 5.280 1.00 42.30 H new ATOM 0 HE3 MET A 141 -0.746 -14.478 5.215 1.00 42.30 H new ATOM 2200 N GLY A 142 -3.048 -14.163 0.121 1.00 70.34 N ATOM 2201 CA GLY A 142 -4.187 -13.281 -0.176 1.00 61.41 C ATOM 2202 C GLY A 142 -3.850 -11.791 -0.038 1.00 41.22 C ATOM 2203 O GLY A 142 -4.751 -10.949 -0.029 1.00 2.14 O ATOM 0 H GLY A 142 -2.578 -14.531 -0.706 1.00 70.34 H new ATOM 0 HA2 GLY A 142 -4.534 -13.476 -1.191 1.00 61.41 H new ATOM 0 HA3 GLY A 142 -5.011 -13.524 0.495 1.00 61.41 H new ATOM 2207 N MET A 143 -2.539 -11.473 0.055 1.00 74.35 N ATOM 2208 CA MET A 143 -2.026 -10.079 0.111 1.00 42.33 C ATOM 2209 C MET A 143 -2.331 -9.326 -1.208 1.00 54.51 C ATOM 2210 O MET A 143 -2.569 -8.113 -1.204 1.00 14.53 O ATOM 2211 CB MET A 143 -0.498 -10.102 0.407 1.00 4.00 C ATOM 2212 CG MET A 143 0.189 -8.729 0.459 1.00 15.34 C ATOM 2213 SD MET A 143 -0.569 -7.615 1.661 1.00 42.42 S ATOM 2214 CE MET A 143 0.579 -6.235 1.657 1.00 10.51 C ATOM 0 H MET A 143 -1.802 -12.177 0.094 1.00 74.35 H new ATOM 0 HA MET A 143 -2.531 -9.543 0.914 1.00 42.33 H new ATOM 0 HB2 MET A 143 -0.339 -10.604 1.361 1.00 4.00 H new ATOM 0 HB3 MET A 143 -0.007 -10.705 -0.357 1.00 4.00 H new ATOM 0 HG2 MET A 143 1.242 -8.863 0.708 1.00 15.34 H new ATOM 0 HG3 MET A 143 0.151 -8.271 -0.529 1.00 15.34 H new ATOM 0 HE1 MET A 143 0.234 -5.473 2.355 1.00 10.51 H new ATOM 0 HE2 MET A 143 1.567 -6.583 1.959 1.00 10.51 H new ATOM 0 HE3 MET A 143 0.634 -5.810 0.655 1.00 10.51 H new ATOM 2224 N GLU A 144 -2.341 -10.080 -2.326 1.00 12.22 N ATOM 2225 CA GLU A 144 -2.691 -9.557 -3.663 1.00 3.54 C ATOM 2226 C GLU A 144 -4.127 -8.963 -3.686 1.00 5.24 C ATOM 2227 O GLU A 144 -4.315 -7.768 -3.944 1.00 13.11 O ATOM 2228 CB GLU A 144 -2.586 -10.700 -4.707 1.00 75.34 C ATOM 2229 CG GLU A 144 -2.968 -10.287 -6.148 1.00 3.35 C ATOM 2230 CD GLU A 144 -3.019 -11.463 -7.131 1.00 12.02 C ATOM 2231 OE1 GLU A 144 -1.948 -11.986 -7.499 1.00 71.30 O ATOM 2232 OE2 GLU A 144 -4.128 -11.859 -7.561 1.00 60.13 O ATOM 0 H GLU A 144 -2.106 -11.072 -2.327 1.00 12.22 H new ATOM 0 HA GLU A 144 -1.992 -8.757 -3.908 1.00 3.54 H new ATOM 0 HB2 GLU A 144 -1.564 -11.080 -4.710 1.00 75.34 H new ATOM 0 HB3 GLU A 144 -3.231 -11.521 -4.395 1.00 75.34 H new ATOM 0 HG2 GLU A 144 -3.941 -9.797 -6.130 1.00 3.35 H new ATOM 0 HG3 GLU A 144 -2.248 -9.553 -6.510 1.00 3.35 H new ATOM 2239 N GLU A 145 -5.122 -9.820 -3.378 1.00 14.00 N ATOM 2240 CA GLU A 145 -6.556 -9.462 -3.455 1.00 23.12 C ATOM 2241 C GLU A 145 -7.013 -8.568 -2.275 1.00 24.34 C ATOM 2242 O GLU A 145 -7.872 -7.702 -2.451 1.00 31.15 O ATOM 2243 CB GLU A 145 -7.427 -10.742 -3.539 1.00 44.33 C ATOM 2244 CG GLU A 145 -7.373 -11.660 -2.300 1.00 12.14 C ATOM 2245 CD GLU A 145 -8.354 -12.837 -2.394 1.00 61.15 C ATOM 2246 OE1 GLU A 145 -9.553 -12.655 -2.085 1.00 72.13 O ATOM 2247 OE2 GLU A 145 -7.942 -13.942 -2.808 1.00 32.32 O ATOM 0 H GLU A 145 -4.956 -10.778 -3.069 1.00 14.00 H new ATOM 0 HA GLU A 145 -6.690 -8.875 -4.364 1.00 23.12 H new ATOM 0 HB2 GLU A 145 -8.463 -10.446 -3.707 1.00 44.33 H new ATOM 0 HB3 GLU A 145 -7.115 -11.317 -4.411 1.00 44.33 H new ATOM 0 HG2 GLU A 145 -6.360 -12.045 -2.181 1.00 12.14 H new ATOM 0 HG3 GLU A 145 -7.598 -11.075 -1.409 1.00 12.14 H new ATOM 2254 N GLY A 146 -6.425 -8.799 -1.082 1.00 62.40 N ATOM 2255 CA GLY A 146 -6.769 -8.051 0.138 1.00 74.53 C ATOM 2256 C GLY A 146 -6.383 -6.577 0.060 1.00 24.23 C ATOM 2257 O GLY A 146 -7.202 -5.694 0.351 1.00 72.33 O ATOM 0 H GLY A 146 -5.703 -9.506 -0.941 1.00 62.40 H new ATOM 0 HA2 GLY A 146 -7.841 -8.132 0.317 1.00 74.53 H new ATOM 0 HA3 GLY A 146 -6.268 -8.508 0.991 1.00 74.53 H new ATOM 2261 N MET A 147 -5.125 -6.318 -0.367 1.00 53.24 N ATOM 2262 CA MET A 147 -4.616 -4.940 -0.566 1.00 40.00 C ATOM 2263 C MET A 147 -5.321 -4.258 -1.762 1.00 44.41 C ATOM 2264 O MET A 147 -5.480 -3.044 -1.769 1.00 10.44 O ATOM 2265 CB MET A 147 -3.071 -4.916 -0.776 1.00 3.42 C ATOM 2266 CG MET A 147 -2.428 -3.537 -0.516 1.00 30.54 C ATOM 2267 SD MET A 147 -0.632 -3.521 -0.730 1.00 14.24 S ATOM 2268 CE MET A 147 -0.467 -3.699 -2.507 1.00 12.40 C ATOM 0 H MET A 147 -4.443 -7.046 -0.581 1.00 53.24 H new ATOM 0 HA MET A 147 -4.841 -4.383 0.344 1.00 40.00 H new ATOM 0 HB2 MET A 147 -2.612 -5.651 -0.114 1.00 3.42 H new ATOM 0 HB3 MET A 147 -2.848 -5.224 -1.798 1.00 3.42 H new ATOM 0 HG2 MET A 147 -2.872 -2.806 -1.191 1.00 30.54 H new ATOM 0 HG3 MET A 147 -2.667 -3.220 0.499 1.00 30.54 H new ATOM 0 HE1 MET A 147 0.589 -3.704 -2.776 1.00 12.40 H new ATOM 0 HE2 MET A 147 -0.926 -4.636 -2.823 1.00 12.40 H new ATOM 0 HE3 MET A 147 -0.964 -2.866 -3.004 1.00 12.40 H new ATOM 2278 N ARG A 148 -5.744 -5.064 -2.757 1.00 33.40 N ATOM 2279 CA ARG A 148 -6.502 -4.569 -3.929 1.00 22.21 C ATOM 2280 C ARG A 148 -7.872 -3.968 -3.492 1.00 53.30 C ATOM 2281 O ARG A 148 -8.255 -2.887 -3.940 1.00 22.21 O ATOM 2282 CB ARG A 148 -6.748 -5.723 -4.937 1.00 4.24 C ATOM 2283 CG ARG A 148 -7.248 -5.272 -6.332 1.00 3.14 C ATOM 2284 CD ARG A 148 -7.993 -6.382 -7.100 1.00 3.14 C ATOM 2285 NE ARG A 148 -9.351 -6.600 -6.552 1.00 23.44 N ATOM 2286 CZ ARG A 148 -9.803 -7.699 -5.976 1.00 74.22 C ATOM 2287 NH1 ARG A 148 -9.049 -8.739 -5.797 1.00 53.52 N ATOM 2288 NH2 ARG A 148 -11.025 -7.739 -5.561 1.00 23.23 N ATOM 0 H ARG A 148 -5.573 -6.069 -2.773 1.00 33.40 H new ATOM 0 HA ARG A 148 -5.909 -3.788 -4.405 1.00 22.21 H new ATOM 0 HB2 ARG A 148 -5.820 -6.281 -5.062 1.00 4.24 H new ATOM 0 HB3 ARG A 148 -7.478 -6.410 -4.510 1.00 4.24 H new ATOM 0 HG2 ARG A 148 -7.910 -4.414 -6.213 1.00 3.14 H new ATOM 0 HG3 ARG A 148 -6.397 -4.938 -6.925 1.00 3.14 H new ATOM 0 HD2 ARG A 148 -8.063 -6.113 -8.154 1.00 3.14 H new ATOM 0 HD3 ARG A 148 -7.424 -7.310 -7.045 1.00 3.14 H new ATOM 0 HE ARG A 148 -10.005 -5.821 -6.627 1.00 23.44 H new ATOM 0 HH11 ARG A 148 -8.077 -8.723 -6.105 1.00 53.52 H new ATOM 0 HH12 ARG A 148 -9.428 -9.573 -5.349 1.00 53.52 H new ATOM 0 HH21 ARG A 148 -11.631 -6.927 -5.680 1.00 23.23 H new ATOM 0 HH22 ARG A 148 -11.385 -8.583 -5.115 1.00 23.23 H new ATOM 2302 N GLU A 149 -8.591 -4.701 -2.608 1.00 1.44 N ATOM 2303 CA GLU A 149 -9.901 -4.266 -2.036 1.00 1.15 C ATOM 2304 C GLU A 149 -9.741 -3.061 -1.079 1.00 22.51 C ATOM 2305 O GLU A 149 -10.660 -2.235 -0.939 1.00 23.23 O ATOM 2306 CB GLU A 149 -10.581 -5.452 -1.309 1.00 24.33 C ATOM 2307 CG GLU A 149 -10.968 -6.611 -2.243 1.00 30.43 C ATOM 2308 CD GLU A 149 -11.534 -7.814 -1.483 1.00 14.01 C ATOM 2309 OE1 GLU A 149 -10.737 -8.609 -0.940 1.00 23.34 O ATOM 2310 OE2 GLU A 149 -12.774 -7.967 -1.412 1.00 63.41 O ATOM 0 H GLU A 149 -8.284 -5.612 -2.267 1.00 1.44 H new ATOM 0 HA GLU A 149 -10.534 -3.940 -2.861 1.00 1.15 H new ATOM 0 HB2 GLU A 149 -9.908 -5.828 -0.538 1.00 24.33 H new ATOM 0 HB3 GLU A 149 -11.476 -5.091 -0.803 1.00 24.33 H new ATOM 0 HG2 GLU A 149 -11.707 -6.261 -2.964 1.00 30.43 H new ATOM 0 HG3 GLU A 149 -10.092 -6.924 -2.811 1.00 30.43 H new ATOM 2317 N ALA A 150 -8.572 -2.981 -0.421 1.00 3.42 N ATOM 2318 CA ALA A 150 -8.165 -1.807 0.385 1.00 12.14 C ATOM 2319 C ALA A 150 -8.062 -0.547 -0.510 1.00 43.24 C ATOM 2320 O ALA A 150 -8.653 0.499 -0.224 1.00 50.43 O ATOM 2321 CB ALA A 150 -6.819 -2.096 1.076 1.00 22.24 C ATOM 0 H ALA A 150 -7.878 -3.728 -0.430 1.00 3.42 H new ATOM 0 HA ALA A 150 -8.920 -1.618 1.149 1.00 12.14 H new ATOM 0 HB1 ALA A 150 -6.521 -1.231 1.669 1.00 22.24 H new ATOM 0 HB2 ALA A 150 -6.923 -2.964 1.727 1.00 22.24 H new ATOM 0 HB3 ALA A 150 -6.059 -2.298 0.322 1.00 22.24 H new ATOM 2327 N ILE A 151 -7.314 -0.695 -1.614 1.00 33.14 N ATOM 2328 CA ILE A 151 -7.125 0.345 -2.655 1.00 43.12 C ATOM 2329 C ILE A 151 -8.462 0.702 -3.373 1.00 21.04 C ATOM 2330 O ILE A 151 -8.662 1.826 -3.862 1.00 60.12 O ATOM 2331 CB ILE A 151 -6.031 -0.155 -3.676 1.00 64.22 C ATOM 2332 CG1 ILE A 151 -4.641 -0.258 -2.967 1.00 25.44 C ATOM 2333 CG2 ILE A 151 -5.946 0.719 -4.950 1.00 63.44 C ATOM 2334 CD1 ILE A 151 -3.576 -0.999 -3.757 1.00 70.42 C ATOM 0 H ILE A 151 -6.810 -1.558 -1.819 1.00 33.14 H new ATOM 0 HA ILE A 151 -6.785 1.266 -2.181 1.00 43.12 H new ATOM 0 HB ILE A 151 -6.335 -1.146 -4.013 1.00 64.22 H new ATOM 0 HG12 ILE A 151 -4.281 0.749 -2.755 1.00 25.44 H new ATOM 0 HG13 ILE A 151 -4.775 -0.757 -2.007 1.00 25.44 H new ATOM 0 HG21 ILE A 151 -5.176 0.323 -5.612 1.00 63.44 H new ATOM 0 HG22 ILE A 151 -6.907 0.707 -5.464 1.00 63.44 H new ATOM 0 HG23 ILE A 151 -5.695 1.743 -4.673 1.00 63.44 H new ATOM 0 HD11 ILE A 151 -2.648 -1.019 -3.186 1.00 70.42 H new ATOM 0 HD12 ILE A 151 -3.908 -2.020 -3.947 1.00 70.42 H new ATOM 0 HD13 ILE A 151 -3.407 -0.490 -4.706 1.00 70.42 H new ATOM 2346 N GLU A 152 -9.377 -0.265 -3.408 1.00 12.15 N ATOM 2347 CA GLU A 152 -10.720 -0.086 -3.986 1.00 64.34 C ATOM 2348 C GLU A 152 -11.589 0.817 -3.061 1.00 10.53 C ATOM 2349 O GLU A 152 -12.363 1.649 -3.546 1.00 13.32 O ATOM 2350 CB GLU A 152 -11.367 -1.487 -4.237 1.00 11.13 C ATOM 2351 CG GLU A 152 -12.350 -1.572 -5.427 1.00 72.31 C ATOM 2352 CD GLU A 152 -13.655 -0.780 -5.227 1.00 52.42 C ATOM 2353 OE1 GLU A 152 -14.491 -1.209 -4.418 1.00 5.23 O ATOM 2354 OE2 GLU A 152 -13.844 0.277 -5.867 1.00 74.33 O ATOM 0 H GLU A 152 -9.213 -1.201 -3.036 1.00 12.15 H new ATOM 0 HA GLU A 152 -10.650 0.424 -4.947 1.00 64.34 H new ATOM 0 HB2 GLU A 152 -10.568 -2.211 -4.398 1.00 11.13 H new ATOM 0 HB3 GLU A 152 -11.894 -1.790 -3.332 1.00 11.13 H new ATOM 0 HG2 GLU A 152 -11.850 -1.206 -6.323 1.00 72.31 H new ATOM 0 HG3 GLU A 152 -12.597 -2.619 -5.605 1.00 72.31 H new ATOM 2361 N GLN A 153 -11.380 0.699 -1.733 1.00 51.00 N ATOM 2362 CA GLN A 153 -12.159 1.446 -0.714 1.00 43.33 C ATOM 2363 C GLN A 153 -11.770 2.954 -0.662 1.00 52.23 C ATOM 2364 O GLN A 153 -12.522 3.768 -0.129 1.00 21.13 O ATOM 2365 CB GLN A 153 -11.971 0.781 0.680 1.00 60.05 C ATOM 2366 CG GLN A 153 -12.881 1.344 1.803 1.00 72.40 C ATOM 2367 CD GLN A 153 -12.750 0.616 3.146 1.00 14.52 C ATOM 2368 OE1 GLN A 153 -12.503 -0.680 3.109 1.00 12.22 O flip ATOM 2369 NE2 GLN A 153 -12.904 1.208 4.209 1.00 1.43 N flip ATOM 0 H GLN A 153 -10.669 0.086 -1.334 1.00 51.00 H new ATOM 0 HA GLN A 153 -13.210 1.402 -0.999 1.00 43.33 H new ATOM 0 HB2 GLN A 153 -12.158 -0.289 0.584 1.00 60.05 H new ATOM 0 HB3 GLN A 153 -10.931 0.897 0.984 1.00 60.05 H new ATOM 0 HG2 GLN A 153 -12.646 2.398 1.950 1.00 72.40 H new ATOM 0 HG3 GLN A 153 -13.919 1.291 1.474 1.00 72.40 H new ATOM 0 HE21 GLN A 153 -13.094 2.210 4.212 1.00 1.43 H new ATOM 0 HE22 GLN A 153 -12.842 0.698 5.090 1.00 1.43 H new ATOM 2378 N ILE A 154 -10.600 3.317 -1.239 1.00 75.22 N ATOM 2379 CA ILE A 154 -10.138 4.737 -1.338 1.00 34.24 C ATOM 2380 C ILE A 154 -11.174 5.625 -2.077 1.00 63.23 C ATOM 2381 O ILE A 154 -11.323 6.810 -1.765 1.00 53.44 O ATOM 2382 CB ILE A 154 -8.766 4.849 -2.081 1.00 73.11 C ATOM 2383 CG1 ILE A 154 -7.696 3.940 -1.428 1.00 43.14 C ATOM 2384 CG2 ILE A 154 -8.272 6.318 -2.142 1.00 72.33 C ATOM 2385 CD1 ILE A 154 -6.381 3.867 -2.180 1.00 74.55 C ATOM 0 H ILE A 154 -9.949 2.646 -1.648 1.00 75.22 H new ATOM 0 HA ILE A 154 -10.023 5.090 -0.313 1.00 34.24 H new ATOM 0 HB ILE A 154 -8.924 4.505 -3.103 1.00 73.11 H new ATOM 0 HG12 ILE A 154 -7.501 4.299 -0.418 1.00 43.14 H new ATOM 0 HG13 ILE A 154 -8.102 2.933 -1.335 1.00 43.14 H new ATOM 0 HG21 ILE A 154 -7.316 6.359 -2.665 1.00 72.33 H new ATOM 0 HG22 ILE A 154 -9.003 6.926 -2.674 1.00 72.33 H new ATOM 0 HG23 ILE A 154 -8.149 6.703 -1.130 1.00 72.33 H new ATOM 0 HD11 ILE A 154 -5.694 3.208 -1.649 1.00 74.55 H new ATOM 0 HD12 ILE A 154 -6.556 3.476 -3.182 1.00 74.55 H new ATOM 0 HD13 ILE A 154 -5.946 4.864 -2.250 1.00 74.55 H new ATOM 2397 N ASP A 155 -11.882 5.019 -3.048 1.00 22.25 N ATOM 2398 CA ASP A 155 -13.013 5.658 -3.753 1.00 50.03 C ATOM 2399 C ASP A 155 -14.084 6.132 -2.740 1.00 33.33 C ATOM 2400 O ASP A 155 -14.513 7.272 -2.774 1.00 13.40 O ATOM 2401 CB ASP A 155 -13.603 4.649 -4.775 1.00 10.12 C ATOM 2402 CG ASP A 155 -14.944 5.094 -5.392 1.00 51.41 C ATOM 2403 OD1 ASP A 155 -14.964 6.105 -6.116 1.00 62.51 O ATOM 2404 OD2 ASP A 155 -15.980 4.437 -5.146 1.00 31.11 O ATOM 0 H ASP A 155 -11.687 4.070 -3.368 1.00 22.25 H new ATOM 0 HA ASP A 155 -12.665 6.540 -4.290 1.00 50.03 H new ATOM 0 HB2 ASP A 155 -12.880 4.494 -5.576 1.00 10.12 H new ATOM 0 HB3 ASP A 155 -13.743 3.687 -4.281 1.00 10.12 H new ATOM 2409 N ALA A 156 -14.442 5.241 -1.812 1.00 2.10 N ATOM 2410 CA ALA A 156 -15.412 5.528 -0.735 1.00 71.31 C ATOM 2411 C ALA A 156 -14.872 6.560 0.293 1.00 24.44 C ATOM 2412 O ALA A 156 -15.652 7.291 0.889 1.00 31.22 O ATOM 2413 CB ALA A 156 -15.809 4.212 -0.045 1.00 54.12 C ATOM 0 H ALA A 156 -14.069 4.292 -1.781 1.00 2.10 H new ATOM 0 HA ALA A 156 -16.294 5.984 -1.186 1.00 71.31 H new ATOM 0 HB1 ALA A 156 -16.525 4.420 0.750 1.00 54.12 H new ATOM 0 HB2 ALA A 156 -16.262 3.541 -0.775 1.00 54.12 H new ATOM 0 HB3 ALA A 156 -14.922 3.741 0.379 1.00 54.12 H new ATOM 2419 N VAL A 157 -13.537 6.587 0.504 1.00 1.34 N ATOM 2420 CA VAL A 157 -12.875 7.519 1.462 1.00 1.24 C ATOM 2421 C VAL A 157 -12.854 8.983 0.919 1.00 5.40 C ATOM 2422 O VAL A 157 -13.187 9.931 1.638 1.00 53.22 O ATOM 2423 CB VAL A 157 -11.406 7.039 1.792 1.00 33.51 C ATOM 2424 CG1 VAL A 157 -10.653 8.030 2.728 1.00 3.43 C ATOM 2425 CG2 VAL A 157 -11.416 5.610 2.400 1.00 2.22 C ATOM 0 H VAL A 157 -12.885 5.969 0.021 1.00 1.34 H new ATOM 0 HA VAL A 157 -13.462 7.509 2.380 1.00 1.24 H new ATOM 0 HB VAL A 157 -10.861 7.015 0.848 1.00 33.51 H new ATOM 0 HG11 VAL A 157 -9.649 7.654 2.924 1.00 3.43 H new ATOM 0 HG12 VAL A 157 -10.588 9.006 2.247 1.00 3.43 H new ATOM 0 HG13 VAL A 157 -11.195 8.125 3.669 1.00 3.43 H new ATOM 0 HG21 VAL A 157 -10.394 5.301 2.619 1.00 2.22 H new ATOM 0 HG22 VAL A 157 -12.000 5.610 3.320 1.00 2.22 H new ATOM 0 HG23 VAL A 157 -11.861 4.915 1.688 1.00 2.22 H new ATOM 2435 N LEU A 158 -12.482 9.145 -0.368 1.00 73.15 N ATOM 2436 CA LEU A 158 -12.328 10.481 -1.008 1.00 73.45 C ATOM 2437 C LEU A 158 -13.684 11.036 -1.510 1.00 11.12 C ATOM 2438 O LEU A 158 -13.991 12.215 -1.315 1.00 44.04 O ATOM 2439 CB LEU A 158 -11.303 10.405 -2.177 1.00 63.35 C ATOM 2440 CG LEU A 158 -9.837 10.033 -1.774 1.00 63.34 C ATOM 2441 CD1 LEU A 158 -8.927 9.919 -3.014 1.00 61.44 C ATOM 2442 CD2 LEU A 158 -9.260 11.039 -0.747 1.00 42.41 C ATOM 0 H LEU A 158 -12.280 8.365 -0.993 1.00 73.15 H new ATOM 0 HA LEU A 158 -11.952 11.170 -0.251 1.00 73.45 H new ATOM 0 HB2 LEU A 158 -11.659 9.671 -2.900 1.00 63.35 H new ATOM 0 HB3 LEU A 158 -11.287 11.370 -2.684 1.00 63.35 H new ATOM 0 HG LEU A 158 -9.868 9.055 -1.295 1.00 63.34 H new ATOM 0 HD11 LEU A 158 -7.916 9.660 -2.701 1.00 61.44 H new ATOM 0 HD12 LEU A 158 -9.311 9.144 -3.677 1.00 61.44 H new ATOM 0 HD13 LEU A 158 -8.910 10.873 -3.542 1.00 61.44 H new ATOM 0 HD21 LEU A 158 -8.241 10.751 -0.489 1.00 42.41 H new ATOM 0 HD22 LEU A 158 -9.256 12.039 -1.180 1.00 42.41 H new ATOM 0 HD23 LEU A 158 -9.877 11.035 0.152 1.00 42.41 H new ATOM 2454 N SER A 159 -14.506 10.160 -2.122 1.00 44.21 N ATOM 2455 CA SER A 159 -15.841 10.535 -2.685 1.00 12.11 C ATOM 2456 C SER A 159 -16.942 10.567 -1.592 1.00 34.44 C ATOM 2457 O SER A 159 -18.107 10.820 -1.906 1.00 44.30 O ATOM 2458 CB SER A 159 -16.255 9.527 -3.795 1.00 30.33 C ATOM 2459 OG SER A 159 -17.307 10.020 -4.616 1.00 64.22 O ATOM 0 H SER A 159 -14.275 9.174 -2.245 1.00 44.21 H new ATOM 0 HA SER A 159 -15.746 11.537 -3.104 1.00 12.11 H new ATOM 0 HB2 SER A 159 -15.389 9.301 -4.417 1.00 30.33 H new ATOM 0 HB3 SER A 159 -16.568 8.591 -3.332 1.00 30.33 H new ATOM 0 HG SER A 159 -17.959 10.497 -4.061 1.00 64.22 H new ATOM 2465 N GLU A 160 -16.536 10.332 -0.318 1.00 11.45 N ATOM 2466 CA GLU A 160 -17.431 10.141 0.852 1.00 30.32 C ATOM 2467 C GLU A 160 -18.501 11.269 0.984 1.00 43.24 C ATOM 2468 O GLU A 160 -18.164 12.399 1.362 1.00 21.23 O ATOM 2469 CB GLU A 160 -16.562 10.046 2.154 1.00 30.30 C ATOM 2470 CG GLU A 160 -17.102 9.103 3.255 1.00 65.44 C ATOM 2471 CD GLU A 160 -18.469 9.521 3.817 1.00 51.43 C ATOM 2472 OE1 GLU A 160 -18.527 10.458 4.647 1.00 51.11 O ATOM 2473 OE2 GLU A 160 -19.489 8.928 3.415 1.00 4.41 O ATOM 0 H GLU A 160 -15.549 10.268 -0.070 1.00 11.45 H new ATOM 0 HA GLU A 160 -17.983 9.213 0.703 1.00 30.32 H new ATOM 0 HB2 GLU A 160 -15.561 9.715 1.877 1.00 30.30 H new ATOM 0 HB3 GLU A 160 -16.462 11.046 2.575 1.00 30.30 H new ATOM 0 HG2 GLU A 160 -17.180 8.094 2.850 1.00 65.44 H new ATOM 0 HG3 GLU A 160 -16.381 9.064 4.072 1.00 65.44 H new ATOM 2480 N PRO A 161 -19.804 10.978 0.648 1.00 13.45 N ATOM 2481 CA PRO A 161 -20.896 11.969 0.744 1.00 2.25 C ATOM 2482 C PRO A 161 -21.491 12.122 2.173 1.00 61.23 C ATOM 2483 O PRO A 161 -21.784 13.242 2.610 1.00 2.42 O ATOM 2484 CB PRO A 161 -21.940 11.412 -0.257 1.00 25.54 C ATOM 2485 CG PRO A 161 -21.769 9.919 -0.189 1.00 71.40 C ATOM 2486 CD PRO A 161 -20.299 9.677 0.108 1.00 4.43 C ATOM 0 HA PRO A 161 -20.552 12.979 0.519 1.00 2.25 H new ATOM 0 HB2 PRO A 161 -22.952 11.708 0.019 1.00 25.54 H new ATOM 0 HB3 PRO A 161 -21.762 11.786 -1.265 1.00 25.54 H new ATOM 0 HG2 PRO A 161 -22.400 9.489 0.589 1.00 71.40 H new ATOM 0 HG3 PRO A 161 -22.059 9.450 -1.129 1.00 71.40 H new ATOM 0 HD2 PRO A 161 -20.168 8.872 0.831 1.00 4.43 H new ATOM 0 HD3 PRO A 161 -19.755 9.389 -0.792 1.00 4.43 H new ATOM 2494 N ALA A 162 -21.631 10.987 2.891 1.00 52.44 N ATOM 2495 CA ALA A 162 -22.348 10.905 4.198 1.00 51.24 C ATOM 2496 C ALA A 162 -22.378 9.467 4.766 1.00 12.40 C ATOM 2497 O ALA A 162 -22.455 9.280 5.987 1.00 12.45 O ATOM 2498 CB ALA A 162 -23.797 11.434 4.079 1.00 12.41 C ATOM 0 H ALA A 162 -21.250 10.092 2.585 1.00 52.44 H new ATOM 0 HA ALA A 162 -21.786 11.534 4.889 1.00 51.24 H new ATOM 0 HB1 ALA A 162 -24.292 11.361 5.047 1.00 12.41 H new ATOM 0 HB2 ALA A 162 -23.779 12.476 3.759 1.00 12.41 H new ATOM 0 HB3 ALA A 162 -24.343 10.839 3.347 1.00 12.41 H new ATOM 2504 N ASN A 163 -22.302 8.448 3.877 1.00 22.44 N ATOM 2505 CA ASN A 163 -22.545 7.034 4.267 1.00 54.55 C ATOM 2506 C ASN A 163 -21.979 6.005 3.240 1.00 10.50 C ATOM 2507 O ASN A 163 -22.540 4.908 3.072 1.00 35.13 O ATOM 2508 CB ASN A 163 -24.075 6.851 4.468 1.00 1.00 C ATOM 2509 CG ASN A 163 -24.901 7.166 3.209 1.00 62.21 C ATOM 2510 OD1 ASN A 163 -25.322 8.298 2.986 1.00 75.04 O ATOM 2511 ND2 ASN A 163 -25.134 6.173 2.375 1.00 75.43 N ATOM 0 H ASN A 163 -22.076 8.575 2.891 1.00 22.44 H new ATOM 0 HA ASN A 163 -22.008 6.831 5.194 1.00 54.55 H new ATOM 0 HB2 ASN A 163 -24.273 5.824 4.775 1.00 1.00 H new ATOM 0 HB3 ASN A 163 -24.406 7.497 5.281 1.00 1.00 H new ATOM 0 HD21 ASN A 163 -25.673 6.337 1.525 1.00 75.43 H new ATOM 0 HD22 ASN A 163 -24.775 5.240 2.579 1.00 75.43 H new ATOM 2518 N ALA A 164 -20.832 6.331 2.610 1.00 10.34 N ATOM 2519 CA ALA A 164 -20.215 5.499 1.537 1.00 41.43 C ATOM 2520 C ALA A 164 -19.689 4.131 2.063 1.00 21.24 C ATOM 2521 O ALA A 164 -20.127 3.074 1.596 1.00 23.30 O ATOM 2522 CB ALA A 164 -19.078 6.285 0.861 1.00 61.41 C ATOM 0 H ALA A 164 -20.302 7.176 2.825 1.00 10.34 H new ATOM 0 HA ALA A 164 -20.995 5.275 0.810 1.00 41.43 H new ATOM 0 HB1 ALA A 164 -18.629 5.674 0.078 1.00 61.41 H new ATOM 0 HB2 ALA A 164 -19.478 7.200 0.424 1.00 61.41 H new ATOM 0 HB3 ALA A 164 -18.320 6.538 1.602 1.00 61.41 H new ATOM 2528 N LEU A 165 -18.761 4.193 3.043 1.00 1.23 N ATOM 2529 CA LEU A 165 -18.064 3.018 3.648 1.00 63.52 C ATOM 2530 C LEU A 165 -17.293 2.161 2.601 1.00 10.14 C ATOM 2531 O LEU A 165 -16.062 2.252 2.518 1.00 44.13 O ATOM 2532 CB LEU A 165 -19.028 2.145 4.515 1.00 51.45 C ATOM 2533 CG LEU A 165 -19.559 2.808 5.832 1.00 1.21 C ATOM 2534 CD1 LEU A 165 -20.490 1.849 6.609 1.00 2.22 C ATOM 2535 CD2 LEU A 165 -18.396 3.297 6.729 1.00 44.34 C ATOM 0 H LEU A 165 -18.463 5.079 3.451 1.00 1.23 H new ATOM 0 HA LEU A 165 -17.310 3.431 4.318 1.00 63.52 H new ATOM 0 HB2 LEU A 165 -19.885 1.866 3.901 1.00 51.45 H new ATOM 0 HB3 LEU A 165 -18.512 1.222 4.779 1.00 51.45 H new ATOM 0 HG LEU A 165 -20.144 3.681 5.542 1.00 1.21 H new ATOM 0 HD11 LEU A 165 -20.841 2.339 7.517 1.00 2.22 H new ATOM 0 HD12 LEU A 165 -21.344 1.586 5.985 1.00 2.22 H new ATOM 0 HD13 LEU A 165 -19.942 0.945 6.873 1.00 2.22 H new ATOM 0 HD21 LEU A 165 -18.800 3.751 7.633 1.00 44.34 H new ATOM 0 HD22 LEU A 165 -17.764 2.451 6.999 1.00 44.34 H new ATOM 0 HD23 LEU A 165 -17.803 4.034 6.187 1.00 44.34 H new ATOM 2547 N GLU A 166 -18.019 1.324 1.812 1.00 32.44 N ATOM 2548 CA GLU A 166 -17.399 0.488 0.749 1.00 64.44 C ATOM 2549 C GLU A 166 -18.402 0.073 -0.384 1.00 12.30 C ATOM 2550 O GLU A 166 -18.211 0.454 -1.539 1.00 11.53 O ATOM 2551 CB GLU A 166 -16.627 -0.750 1.363 1.00 34.15 C ATOM 2552 CG GLU A 166 -17.287 -1.455 2.590 1.00 44.43 C ATOM 2553 CD GLU A 166 -18.465 -2.380 2.241 1.00 33.20 C ATOM 2554 OE1 GLU A 166 -18.229 -3.426 1.598 1.00 60.11 O ATOM 2555 OE2 GLU A 166 -19.631 -2.040 2.558 1.00 53.24 O ATOM 0 H GLU A 166 -19.030 1.211 1.892 1.00 32.44 H new ATOM 0 HA GLU A 166 -16.660 1.118 0.254 1.00 64.44 H new ATOM 0 HB2 GLU A 166 -16.495 -1.492 0.576 1.00 34.15 H new ATOM 0 HB3 GLU A 166 -15.632 -0.417 1.658 1.00 34.15 H new ATOM 0 HG2 GLU A 166 -16.526 -2.038 3.110 1.00 44.43 H new ATOM 0 HG3 GLU A 166 -17.635 -0.692 3.286 1.00 44.43 H new ATOM 2562 N HIS A 167 -19.462 -0.698 -0.069 1.00 43.31 N ATOM 2563 CA HIS A 167 -20.361 -1.318 -1.090 1.00 2.00 C ATOM 2564 C HIS A 167 -21.810 -1.468 -0.559 1.00 75.00 C ATOM 2565 O HIS A 167 -22.765 -0.969 -1.173 1.00 43.11 O ATOM 2566 CB HIS A 167 -19.857 -2.731 -1.519 1.00 62.12 C ATOM 2567 CG HIS A 167 -18.474 -2.786 -2.099 1.00 43.34 C ATOM 2568 ND1 HIS A 167 -17.366 -3.147 -1.356 1.00 11.13 N ATOM 2569 CD2 HIS A 167 -18.016 -2.541 -3.350 1.00 53.22 C ATOM 2570 CE1 HIS A 167 -16.299 -3.123 -2.122 1.00 1.10 C ATOM 2571 NE2 HIS A 167 -16.663 -2.764 -3.332 1.00 44.52 N ATOM 0 H HIS A 167 -19.727 -0.914 0.892 1.00 43.31 H new ATOM 0 HA HIS A 167 -20.349 -0.646 -1.948 1.00 2.00 H new ATOM 0 HB2 HIS A 167 -19.892 -3.387 -0.649 1.00 62.12 H new ATOM 0 HB3 HIS A 167 -20.554 -3.137 -2.252 1.00 62.12 H new ATOM 0 HD1 HIS A 167 -17.375 -3.394 -0.366 1.00 11.13 H new ATOM 0 HD2 HIS A 167 -18.605 -2.229 -4.200 1.00 53.22 H new ATOM 0 HE1 HIS A 167 -15.292 -3.359 -1.810 1.00 1.10 H new ATOM 0 HE2 HIS A 167 -16.038 -2.666 -4.132 1.00 44.52 H new ATOM 2580 N HIS A 168 -21.943 -2.218 0.573 1.00 31.22 N ATOM 2581 CA HIS A 168 -23.242 -2.627 1.189 1.00 63.44 C ATOM 2582 C HIS A 168 -24.050 -3.599 0.277 1.00 42.15 C ATOM 2583 O HIS A 168 -25.263 -3.765 0.455 1.00 71.00 O ATOM 2584 CB HIS A 168 -24.107 -1.386 1.561 1.00 12.45 C ATOM 2585 CG HIS A 168 -23.428 -0.420 2.479 1.00 5.21 C ATOM 2586 ND1 HIS A 168 -22.831 0.731 2.026 1.00 24.11 N ATOM 2587 CD2 HIS A 168 -23.278 -0.410 3.820 1.00 71.44 C ATOM 2588 CE1 HIS A 168 -22.349 1.407 3.041 1.00 15.01 C ATOM 2589 NE2 HIS A 168 -22.604 0.740 4.143 1.00 22.10 N ATOM 0 H HIS A 168 -21.136 -2.562 1.093 1.00 31.22 H new ATOM 0 HA HIS A 168 -22.995 -3.166 2.104 1.00 63.44 H new ATOM 0 HB2 HIS A 168 -24.387 -0.865 0.646 1.00 12.45 H new ATOM 0 HB3 HIS A 168 -25.030 -1.727 2.029 1.00 12.45 H new ATOM 0 HD1 HIS A 168 -22.772 1.017 1.049 1.00 24.11 H new ATOM 0 HD2 HIS A 168 -23.624 -1.166 4.510 1.00 71.44 H new ATOM 0 HE1 HIS A 168 -21.830 2.352 2.981 1.00 15.01 H new ATOM 2598 N HIS A 169 -23.368 -4.270 -0.673 1.00 73.23 N ATOM 2599 CA HIS A 169 -24.032 -5.100 -1.714 1.00 60.55 C ATOM 2600 C HIS A 169 -23.810 -6.616 -1.459 1.00 44.51 C ATOM 2601 O HIS A 169 -22.866 -7.009 -0.769 1.00 70.41 O ATOM 2602 CB HIS A 169 -23.510 -4.688 -3.119 1.00 42.41 C ATOM 2603 CG HIS A 169 -24.363 -5.183 -4.262 1.00 71.30 C ATOM 2604 ND1 HIS A 169 -24.230 -6.438 -4.817 1.00 31.31 N ATOM 2605 CD2 HIS A 169 -25.387 -4.592 -4.924 1.00 10.31 C ATOM 2606 CE1 HIS A 169 -25.131 -6.597 -5.764 1.00 13.14 C ATOM 2607 NE2 HIS A 169 -25.843 -5.498 -5.850 1.00 70.04 N ATOM 0 H HIS A 169 -22.351 -4.256 -0.746 1.00 73.23 H new ATOM 0 HA HIS A 169 -25.106 -4.922 -1.668 1.00 60.55 H new ATOM 0 HB2 HIS A 169 -23.450 -3.601 -3.168 1.00 42.41 H new ATOM 0 HB3 HIS A 169 -22.496 -5.069 -3.244 1.00 42.41 H new ATOM 0 HD2 HIS A 169 -25.772 -3.597 -4.755 1.00 10.31 H new ATOM 0 HE1 HIS A 169 -25.262 -7.483 -6.368 1.00 13.14 H new ATOM 0 HE2 HIS A 169 -26.613 -5.342 -6.501 1.00 70.04 H new ATOM 2616 N HIS A 170 -24.700 -7.464 -2.034 1.00 71.31 N ATOM 2617 CA HIS A 170 -24.630 -8.941 -1.903 1.00 3.00 C ATOM 2618 C HIS A 170 -24.561 -9.640 -3.285 1.00 40.03 C ATOM 2619 O HIS A 170 -25.389 -9.387 -4.165 1.00 31.22 O ATOM 2620 CB HIS A 170 -25.844 -9.464 -1.095 1.00 22.35 C ATOM 2621 CG HIS A 170 -25.859 -9.006 0.339 1.00 55.44 C ATOM 2622 ND1 HIS A 170 -25.095 -9.605 1.314 1.00 43.34 N ATOM 2623 CD2 HIS A 170 -26.521 -7.998 0.956 1.00 33.20 C ATOM 2624 CE1 HIS A 170 -25.283 -8.994 2.461 1.00 11.31 C ATOM 2625 NE2 HIS A 170 -26.144 -8.016 2.276 1.00 61.31 N ATOM 0 H HIS A 170 -25.485 -7.143 -2.601 1.00 71.31 H new ATOM 0 HA HIS A 170 -23.712 -9.182 -1.368 1.00 3.00 H new ATOM 0 HB2 HIS A 170 -26.762 -9.135 -1.582 1.00 22.35 H new ATOM 0 HB3 HIS A 170 -25.843 -10.554 -1.119 1.00 22.35 H new ATOM 0 HD2 HIS A 170 -27.215 -7.310 0.496 1.00 33.20 H new ATOM 0 HE1 HIS A 170 -24.811 -9.251 3.398 1.00 11.31 H new ATOM 0 HE2 HIS A 170 -26.477 -7.375 2.996 1.00 61.31 H new ATOM 2634 N HIS A 171 -23.552 -10.517 -3.453 1.00 61.31 N ATOM 2635 CA HIS A 171 -23.370 -11.347 -4.665 1.00 50.00 C ATOM 2636 C HIS A 171 -22.772 -12.718 -4.264 1.00 65.40 C ATOM 2637 O HIS A 171 -21.717 -12.762 -3.623 1.00 51.03 O ATOM 2638 CB HIS A 171 -22.455 -10.620 -5.690 1.00 63.12 C ATOM 2639 CG HIS A 171 -22.227 -11.385 -6.974 1.00 61.51 C ATOM 2640 ND1 HIS A 171 -21.113 -12.165 -7.200 1.00 41.43 N ATOM 2641 CD2 HIS A 171 -22.973 -11.477 -8.107 1.00 62.34 C ATOM 2642 CE1 HIS A 171 -21.180 -12.694 -8.401 1.00 13.40 C ATOM 2643 NE2 HIS A 171 -22.291 -12.296 -8.973 1.00 4.01 N ATOM 0 H HIS A 171 -22.833 -10.672 -2.746 1.00 61.31 H new ATOM 0 HA HIS A 171 -24.337 -11.510 -5.140 1.00 50.00 H new ATOM 0 HB2 HIS A 171 -22.896 -9.653 -5.931 1.00 63.12 H new ATOM 0 HB3 HIS A 171 -21.490 -10.423 -5.222 1.00 63.12 H new ATOM 0 HD2 HIS A 171 -23.923 -10.997 -8.291 1.00 62.34 H new ATOM 0 HE1 HIS A 171 -20.443 -13.348 -8.843 1.00 13.40 H new ATOM 0 HE2 HIS A 171 -22.599 -12.553 -9.911 1.00 4.01 H new ATOM 2652 N HIS A 172 -23.457 -13.817 -4.667 1.00 14.51 N ATOM 2653 CA HIS A 172 -23.115 -15.208 -4.280 1.00 2.54 C ATOM 2654 C HIS A 172 -23.158 -15.391 -2.737 1.00 14.42 C ATOM 2655 O HIS A 172 -23.572 -16.437 -2.221 1.00 22.33 O ATOM 2656 CB HIS A 172 -21.746 -15.654 -4.882 1.00 72.12 C ATOM 2657 CG HIS A 172 -21.321 -17.053 -4.502 1.00 4.32 C ATOM 2658 ND1 HIS A 172 -22.115 -18.161 -4.711 1.00 23.34 N ATOM 2659 CD2 HIS A 172 -20.195 -17.520 -3.905 1.00 70.24 C ATOM 2660 CE1 HIS A 172 -21.505 -19.235 -4.260 1.00 35.13 C ATOM 2661 NE2 HIS A 172 -20.340 -18.879 -3.770 1.00 40.43 N ATOM 0 H HIS A 172 -24.272 -13.761 -5.277 1.00 14.51 H new ATOM 0 HA HIS A 172 -23.875 -15.864 -4.705 1.00 2.54 H new ATOM 0 HB2 HIS A 172 -21.802 -15.587 -5.969 1.00 72.12 H new ATOM 0 HB3 HIS A 172 -20.976 -14.953 -4.559 1.00 72.12 H new ATOM 0 HD2 HIS A 172 -19.344 -16.932 -3.594 1.00 70.24 H new ATOM 0 HE1 HIS A 172 -21.897 -20.241 -4.288 1.00 35.13 H new ATOM 0 HE2 HIS A 172 -19.654 -19.510 -3.356 1.00 40.43 H new TER 2670 HIS A 172