USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 804 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 107 HIS : no HE2:sc= -4.23! X(o=-7!,f=-7.3) USER MOD Set 1.2: A 111 ASN : amide:sc= -2.59! C(o=-7!,f=-7.3!) USER MOD Set 1.3: B 34 MET CE :methyl 157:sc= -0.171 (180deg=0) USER MOD Set 2.1: A 101 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 135 GLN : amide:sc= -3.18! K(o=-3.2!,f=-2.2) USER MOD Single : A 76 MET CE :methyl -156:sc= -0.153 (180deg=-0.857) USER MOD Single : A 77 LYS NZ :NH3+ 134:sc= -0.0614 (180deg=-0.559) USER MOD Single : A 79 THR OG1 : rot -65:sc= 1 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -149:sc= 0.479 (180deg=0.116) USER MOD Single : A 97 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.9!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -154:sc= -0.117 (180deg=-0.133) USER MOD Single : A 110 THR OG1 : rot -95:sc= 1.3 USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= -0.065 (180deg=-0.515) USER MOD Single : A 117 THR OG1 : rot -85:sc= 0.355 USER MOD Single : A 124 MET CE :methyl -122:sc= -0.0919 (180deg=-0.358) USER MOD Single : A 137 ASN : amide:sc= -1.77! C(o=-1.8!,f=-8.1!) USER MOD Single : A 138 TYR OH : rot 154:sc= -0.453 USER MOD Single : A 143 GLN : amide:sc= -0.177 X(o=-0.18,f=-0.18) USER MOD Single : A 144 MET CE :methyl 176:sc= -1.04 (180deg=-1.1) USER MOD Single : A 145 MET CE :methyl -131:sc= -0.0278 (180deg=-2.22!) USER MOD Single : A 146 THR OG1 : rot -62:sc= -0.383 USER MOD Single : A 148 LYS NZ :NH3+ -166:sc=-0.00794 (180deg=-0.23) USER MOD Single : B 39 THR OG1 : rot 125:sc= 0.751 USER MOD Single : B 47 GLN : amide:sc= -5.68! C(o=-5.7!,f=-16!) USER MOD Single : B 48 SER OG : rot 61:sc= 1.28 USER MOD Single : B 49 GLN : amide:sc= -2.33! K(o=-2.3!,f=-1.7) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN : amide:sc= -0.258 X(o=-0.26,f=-0.5) USER MOD Single : B 55 LYS NZ :NH3+ -160:sc= -0.0537 (180deg=-0.485) USER MOD Single : B 56 LYS NZ :NH3+ 151:sc= 0.194 (180deg=-0.598) USER MOD Single : B 57 LYS NZ :NH3+ -157:sc= -0.088 (180deg=-0.66) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 SER OG : rot -12:sc= -0.0521 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 76 12.087 -15.584 -16.980 1.00 0.00 N ATOM 2 CA MET A 76 12.471 -14.573 -15.956 1.00 0.00 C ATOM 3 C MET A 76 12.047 -13.187 -16.434 1.00 0.00 C ATOM 4 O MET A 76 11.784 -12.295 -15.628 1.00 0.00 O ATOM 5 CB MET A 76 13.986 -14.616 -15.745 1.00 0.00 C ATOM 6 CG MET A 76 14.378 -13.649 -14.625 1.00 0.00 C ATOM 7 SD MET A 76 16.171 -13.708 -14.372 1.00 0.00 S ATOM 8 CE MET A 76 16.265 -15.359 -13.630 1.00 0.00 C ATOM 0 HA MET A 76 11.974 -14.793 -15.011 1.00 0.00 H new ATOM 0 HB2 MET A 76 14.299 -15.629 -15.491 1.00 0.00 H new ATOM 0 HB3 MET A 76 14.499 -14.346 -16.668 1.00 0.00 H new ATOM 0 HG2 MET A 76 14.070 -12.635 -14.881 1.00 0.00 H new ATOM 0 HG3 MET A 76 13.861 -13.916 -13.703 1.00 0.00 H new ATOM 0 HE1 MET A 76 17.167 -15.434 -13.023 1.00 0.00 H new ATOM 0 HE2 MET A 76 15.390 -15.526 -13.002 1.00 0.00 H new ATOM 0 HE3 MET A 76 16.295 -16.111 -14.418 1.00 0.00 H new ATOM 20 N LYS A 77 11.981 -13.017 -17.750 1.00 0.00 N ATOM 21 CA LYS A 77 11.585 -11.738 -18.327 1.00 0.00 C ATOM 22 C LYS A 77 10.094 -11.496 -18.116 1.00 0.00 C ATOM 23 O LYS A 77 9.308 -12.440 -18.042 1.00 0.00 O ATOM 24 CB LYS A 77 11.902 -11.718 -19.825 1.00 0.00 C ATOM 25 CG LYS A 77 13.418 -11.754 -20.026 1.00 0.00 C ATOM 26 CD LYS A 77 13.735 -11.730 -21.522 1.00 0.00 C ATOM 27 CE LYS A 77 15.251 -11.721 -21.721 1.00 0.00 C ATOM 28 NZ LYS A 77 15.833 -12.974 -21.164 1.00 0.00 N ATOM 0 H LYS A 77 12.195 -13.744 -18.433 1.00 0.00 H new ATOM 0 HA LYS A 77 12.145 -10.946 -17.829 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.439 -12.573 -20.317 1.00 0.00 H new ATOM 0 HB3 LYS A 77 11.485 -10.822 -20.284 1.00 0.00 H new ATOM 0 HG2 LYS A 77 13.881 -10.900 -19.532 1.00 0.00 H new ATOM 0 HG3 LYS A 77 13.835 -12.652 -19.569 1.00 0.00 H new ATOM 0 HD2 LYS A 77 13.298 -12.601 -22.011 1.00 0.00 H new ATOM 0 HD3 LYS A 77 13.291 -10.848 -21.985 1.00 0.00 H new ATOM 0 HE2 LYS A 77 15.489 -11.637 -22.781 1.00 0.00 H new ATOM 0 HE3 LYS A 77 15.688 -10.853 -21.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 16.510 -13.374 -21.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 16.323 -12.762 -20.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 15.073 -13.661 -20.987 1.00 0.00 H new ATOM 42 N ASP A 78 9.716 -10.225 -18.008 1.00 0.00 N ATOM 43 CA ASP A 78 8.318 -9.868 -17.792 1.00 0.00 C ATOM 44 C ASP A 78 7.789 -10.534 -16.527 1.00 0.00 C ATOM 45 O ASP A 78 6.659 -11.019 -16.492 1.00 0.00 O ATOM 46 CB ASP A 78 7.470 -10.291 -18.995 1.00 0.00 C ATOM 47 CG ASP A 78 7.978 -9.605 -20.258 1.00 0.00 C ATOM 48 OD1 ASP A 78 8.221 -8.411 -20.202 1.00 0.00 O ATOM 49 OD2 ASP A 78 8.117 -10.283 -21.262 1.00 0.00 O ATOM 0 H ASP A 78 10.353 -9.431 -18.066 1.00 0.00 H new ATOM 0 HA ASP A 78 8.253 -8.786 -17.675 1.00 0.00 H new ATOM 0 HB2 ASP A 78 7.512 -11.373 -19.117 1.00 0.00 H new ATOM 0 HB3 ASP A 78 6.426 -10.030 -18.824 1.00 0.00 H new ATOM 54 N THR A 79 8.621 -10.547 -15.490 1.00 0.00 N ATOM 55 CA THR A 79 8.240 -11.150 -14.218 1.00 0.00 C ATOM 56 C THR A 79 7.206 -10.279 -13.510 1.00 0.00 C ATOM 57 O THR A 79 7.435 -9.827 -12.388 1.00 0.00 O ATOM 58 CB THR A 79 9.470 -11.317 -13.324 1.00 0.00 C ATOM 59 OG1 THR A 79 9.061 -11.760 -12.037 1.00 0.00 O ATOM 60 CG2 THR A 79 10.199 -9.978 -13.198 1.00 0.00 C ATOM 0 H THR A 79 9.560 -10.148 -15.505 1.00 0.00 H new ATOM 0 HA THR A 79 7.806 -12.130 -14.415 1.00 0.00 H new ATOM 0 HB THR A 79 10.143 -12.053 -13.765 1.00 0.00 H new ATOM 0 HG1 THR A 79 8.526 -11.061 -11.605 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.075 -10.099 -12.561 1.00 0.00 H new ATOM 0 HG22 THR A 79 10.513 -9.640 -14.186 1.00 0.00 H new ATOM 0 HG23 THR A 79 9.529 -9.239 -12.758 1.00 0.00 H new ATOM 68 N ASP A 80 6.089 -10.033 -14.200 1.00 0.00 N ATOM 69 CA ASP A 80 5.002 -9.194 -13.683 1.00 0.00 C ATOM 70 C ASP A 80 5.022 -9.108 -12.160 1.00 0.00 C ATOM 71 O ASP A 80 4.655 -10.050 -11.463 1.00 0.00 O ATOM 72 CB ASP A 80 3.653 -9.756 -14.138 1.00 0.00 C ATOM 73 CG ASP A 80 3.458 -9.512 -15.631 1.00 0.00 C ATOM 74 OD1 ASP A 80 4.219 -8.739 -16.190 1.00 0.00 O ATOM 75 OD2 ASP A 80 2.551 -10.103 -16.194 1.00 0.00 O ATOM 0 H ASP A 80 5.912 -10.409 -15.132 1.00 0.00 H new ATOM 0 HA ASP A 80 5.147 -8.189 -14.080 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.606 -10.824 -13.927 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.846 -9.285 -13.577 1.00 0.00 H new ATOM 80 N SER A 81 5.464 -7.960 -11.659 1.00 0.00 N ATOM 81 CA SER A 81 5.540 -7.720 -10.223 1.00 0.00 C ATOM 82 C SER A 81 4.195 -7.271 -9.672 1.00 0.00 C ATOM 83 O SER A 81 4.040 -7.094 -8.463 1.00 0.00 O ATOM 84 CB SER A 81 6.600 -6.665 -9.914 1.00 0.00 C ATOM 85 OG SER A 81 7.875 -7.145 -10.323 1.00 0.00 O ATOM 0 H SER A 81 5.777 -7.176 -12.231 1.00 0.00 H new ATOM 0 HA SER A 81 5.817 -8.658 -9.743 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.366 -5.735 -10.432 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.608 -6.442 -8.847 1.00 0.00 H new ATOM 0 HG SER A 81 8.557 -6.469 -10.127 1.00 0.00 H new ATOM 91 N GLU A 82 3.225 -7.071 -10.556 1.00 0.00 N ATOM 92 CA GLU A 82 1.911 -6.624 -10.119 1.00 0.00 C ATOM 93 C GLU A 82 1.343 -7.609 -9.115 1.00 0.00 C ATOM 94 O GLU A 82 0.735 -7.222 -8.119 1.00 0.00 O ATOM 95 CB GLU A 82 0.964 -6.522 -11.314 1.00 0.00 C ATOM 96 CG GLU A 82 1.373 -5.344 -12.178 1.00 0.00 C ATOM 97 CD GLU A 82 0.572 -5.343 -13.476 1.00 0.00 C ATOM 98 OE1 GLU A 82 -0.046 -6.353 -13.769 1.00 0.00 O ATOM 99 OE2 GLU A 82 0.590 -4.332 -14.160 1.00 0.00 O ATOM 0 H GLU A 82 3.321 -7.209 -11.562 1.00 0.00 H new ATOM 0 HA GLU A 82 2.012 -5.643 -9.655 1.00 0.00 H new ATOM 0 HB2 GLU A 82 0.994 -7.443 -11.896 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -0.062 -6.396 -10.970 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.206 -4.412 -11.638 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.439 -5.398 -12.399 1.00 0.00 H new ATOM 106 N GLU A 83 1.565 -8.882 -9.376 1.00 0.00 N ATOM 107 CA GLU A 83 1.092 -9.929 -8.484 1.00 0.00 C ATOM 108 C GLU A 83 1.781 -9.834 -7.127 1.00 0.00 C ATOM 109 O GLU A 83 1.155 -10.041 -6.088 1.00 0.00 O ATOM 110 CB GLU A 83 1.381 -11.295 -9.104 1.00 0.00 C ATOM 111 CG GLU A 83 2.713 -11.233 -9.856 1.00 0.00 C ATOM 112 CD GLU A 83 3.248 -12.642 -10.088 1.00 0.00 C ATOM 113 OE1 GLU A 83 3.588 -13.294 -9.115 1.00 0.00 O ATOM 114 OE2 GLU A 83 3.310 -13.050 -11.237 1.00 0.00 O ATOM 0 H GLU A 83 2.069 -9.219 -10.196 1.00 0.00 H new ATOM 0 HA GLU A 83 0.019 -9.805 -8.340 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.423 -12.059 -8.328 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.578 -11.576 -9.785 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.577 -10.725 -10.811 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.436 -10.650 -9.285 1.00 0.00 H new ATOM 121 N GLU A 84 3.075 -9.528 -7.144 1.00 0.00 N ATOM 122 CA GLU A 84 3.835 -9.419 -5.905 1.00 0.00 C ATOM 123 C GLU A 84 3.299 -8.291 -5.026 1.00 0.00 C ATOM 124 O GLU A 84 3.130 -8.463 -3.817 1.00 0.00 O ATOM 125 CB GLU A 84 5.309 -9.157 -6.228 1.00 0.00 C ATOM 126 CG GLU A 84 5.931 -10.416 -6.834 1.00 0.00 C ATOM 127 CD GLU A 84 7.341 -10.113 -7.331 1.00 0.00 C ATOM 128 OE1 GLU A 84 7.683 -8.944 -7.408 1.00 0.00 O ATOM 129 OE2 GLU A 84 8.059 -11.054 -7.627 1.00 0.00 O ATOM 0 H GLU A 84 3.614 -9.353 -7.992 1.00 0.00 H new ATOM 0 HA GLU A 84 3.734 -10.357 -5.360 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.397 -8.324 -6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.846 -8.873 -5.323 1.00 0.00 H new ATOM 0 HG2 GLU A 84 5.962 -11.211 -6.089 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.315 -10.775 -7.658 1.00 0.00 H new ATOM 136 N ILE A 85 3.033 -7.141 -5.635 1.00 0.00 N ATOM 137 CA ILE A 85 2.519 -5.999 -4.888 1.00 0.00 C ATOM 138 C ILE A 85 1.108 -6.282 -4.381 1.00 0.00 C ATOM 139 O ILE A 85 0.777 -5.977 -3.237 1.00 0.00 O ATOM 140 CB ILE A 85 2.504 -4.748 -5.774 1.00 0.00 C ATOM 141 CG1 ILE A 85 3.937 -4.355 -6.159 1.00 0.00 C ATOM 142 CG2 ILE A 85 1.861 -3.594 -5.001 1.00 0.00 C ATOM 143 CD1 ILE A 85 4.565 -3.481 -5.066 1.00 0.00 C ATOM 0 H ILE A 85 3.163 -6.975 -6.633 1.00 0.00 H new ATOM 0 HA ILE A 85 3.175 -5.827 -4.034 1.00 0.00 H new ATOM 0 HB ILE A 85 1.935 -4.959 -6.679 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.539 -5.251 -6.307 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.931 -3.815 -7.106 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.847 -2.701 -5.626 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.840 -3.862 -4.729 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.437 -3.396 -4.097 1.00 0.00 H new ATOM 0 HD11 ILE A 85 5.581 -3.211 -5.355 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.972 -2.576 -4.938 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.590 -4.034 -4.127 1.00 0.00 H new ATOM 155 N ARG A 86 0.284 -6.870 -5.246 1.00 0.00 N ATOM 156 CA ARG A 86 -1.095 -7.193 -4.891 1.00 0.00 C ATOM 157 C ARG A 86 -1.143 -8.155 -3.712 1.00 0.00 C ATOM 158 O ARG A 86 -2.023 -8.055 -2.860 1.00 0.00 O ATOM 159 CB ARG A 86 -1.823 -7.803 -6.090 1.00 0.00 C ATOM 160 CG ARG A 86 -2.096 -6.713 -7.130 1.00 0.00 C ATOM 161 CD ARG A 86 -2.616 -7.353 -8.418 1.00 0.00 C ATOM 162 NE ARG A 86 -2.982 -6.321 -9.381 1.00 0.00 N ATOM 163 CZ ARG A 86 -3.302 -6.630 -10.634 1.00 0.00 C ATOM 164 NH1 ARG A 86 -3.282 -7.876 -11.023 1.00 0.00 N ATOM 165 NH2 ARG A 86 -3.633 -5.688 -11.474 1.00 0.00 N ATOM 0 H ARG A 86 0.547 -7.132 -6.196 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.594 -6.268 -4.602 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.220 -8.597 -6.530 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.761 -8.256 -5.768 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.827 -6.003 -6.744 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.183 -6.153 -7.333 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.852 -8.003 -8.844 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.481 -7.979 -8.198 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.993 -5.344 -9.088 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.021 -8.611 -10.366 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.527 -8.114 -11.984 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.646 -4.715 -11.169 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.878 -5.925 -12.435 1.00 0.00 H new ATOM 179 N GLU A 87 -0.193 -9.081 -3.659 1.00 0.00 N ATOM 180 CA GLU A 87 -0.162 -10.041 -2.565 1.00 0.00 C ATOM 181 C GLU A 87 -0.144 -9.287 -1.244 1.00 0.00 C ATOM 182 O GLU A 87 -0.824 -9.666 -0.289 1.00 0.00 O ATOM 183 CB GLU A 87 1.083 -10.927 -2.678 1.00 0.00 C ATOM 184 CG GLU A 87 1.075 -11.972 -1.558 1.00 0.00 C ATOM 185 CD GLU A 87 2.278 -12.896 -1.702 1.00 0.00 C ATOM 186 OE1 GLU A 87 3.046 -12.699 -2.630 1.00 0.00 O ATOM 187 OE2 GLU A 87 2.416 -13.790 -0.883 1.00 0.00 O ATOM 0 H GLU A 87 0.553 -9.187 -4.347 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.046 -10.676 -2.613 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.103 -11.421 -3.649 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.983 -10.316 -2.612 1.00 0.00 H new ATOM 0 HG2 GLU A 87 1.100 -11.477 -0.587 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.153 -12.552 -1.597 1.00 0.00 H new ATOM 194 N ALA A 88 0.632 -8.213 -1.200 1.00 0.00 N ATOM 195 CA ALA A 88 0.732 -7.398 0.002 1.00 0.00 C ATOM 196 C ALA A 88 -0.637 -6.842 0.395 1.00 0.00 C ATOM 197 O ALA A 88 -0.953 -6.743 1.580 1.00 0.00 O ATOM 198 CB ALA A 88 1.708 -6.243 -0.227 1.00 0.00 C ATOM 0 H ALA A 88 1.200 -7.886 -1.981 1.00 0.00 H new ATOM 0 HA ALA A 88 1.099 -8.028 0.812 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.776 -5.639 0.678 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.692 -6.642 -0.472 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.352 -5.624 -1.050 1.00 0.00 H new ATOM 204 N PHE A 89 -1.458 -6.503 -0.598 1.00 0.00 N ATOM 205 CA PHE A 89 -2.796 -5.991 -0.316 1.00 0.00 C ATOM 206 C PHE A 89 -3.749 -7.142 0.001 1.00 0.00 C ATOM 207 O PHE A 89 -4.586 -7.036 0.897 1.00 0.00 O ATOM 208 CB PHE A 89 -3.317 -5.181 -1.505 1.00 0.00 C ATOM 209 CG PHE A 89 -2.551 -3.882 -1.588 1.00 0.00 C ATOM 210 CD1 PHE A 89 -2.969 -2.777 -0.837 1.00 0.00 C ATOM 211 CD2 PHE A 89 -1.422 -3.784 -2.409 1.00 0.00 C ATOM 212 CE1 PHE A 89 -2.256 -1.574 -0.906 1.00 0.00 C ATOM 213 CE2 PHE A 89 -0.708 -2.580 -2.480 1.00 0.00 C ATOM 214 CZ PHE A 89 -1.126 -1.475 -1.727 1.00 0.00 C ATOM 0 H PHE A 89 -1.225 -6.572 -1.589 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.741 -5.336 0.553 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.198 -5.748 -2.428 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.382 -4.983 -1.388 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.841 -2.852 -0.205 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.101 -4.637 -2.988 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.578 -0.722 -0.326 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.163 -2.504 -3.114 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.577 -0.547 -1.780 1.00 0.00 H new ATOM 224 N ARG A 90 -3.630 -8.231 -0.756 1.00 0.00 N ATOM 225 CA ARG A 90 -4.506 -9.380 -0.553 1.00 0.00 C ATOM 226 C ARG A 90 -4.537 -9.772 0.919 1.00 0.00 C ATOM 227 O ARG A 90 -5.529 -10.317 1.404 1.00 0.00 O ATOM 228 CB ARG A 90 -4.057 -10.570 -1.408 1.00 0.00 C ATOM 229 CG ARG A 90 -4.398 -10.297 -2.876 1.00 0.00 C ATOM 230 CD ARG A 90 -3.961 -11.482 -3.740 1.00 0.00 C ATOM 231 NE ARG A 90 -4.291 -11.234 -5.140 1.00 0.00 N ATOM 232 CZ ARG A 90 -4.015 -12.131 -6.082 1.00 0.00 C ATOM 233 NH1 ARG A 90 -3.439 -13.258 -5.762 1.00 0.00 N ATOM 234 NH2 ARG A 90 -4.321 -11.885 -7.327 1.00 0.00 N ATOM 0 H ARG A 90 -2.946 -8.341 -1.505 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.512 -9.096 -0.863 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.985 -10.729 -1.296 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.551 -11.481 -1.071 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -5.470 -10.132 -2.985 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -3.900 -9.388 -3.211 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -2.888 -11.642 -3.635 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.454 -12.392 -3.398 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.741 -10.357 -5.400 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -3.201 -13.451 -4.789 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.227 -13.946 -6.485 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.772 -11.005 -7.577 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -4.109 -12.573 -8.050 1.00 0.00 H new ATOM 248 N VAL A 91 -3.462 -9.468 1.635 1.00 0.00 N ATOM 249 CA VAL A 91 -3.399 -9.769 3.060 1.00 0.00 C ATOM 250 C VAL A 91 -4.492 -9.010 3.804 1.00 0.00 C ATOM 251 O VAL A 91 -5.118 -9.544 4.720 1.00 0.00 O ATOM 252 CB VAL A 91 -2.031 -9.383 3.628 1.00 0.00 C ATOM 253 CG1 VAL A 91 -2.069 -9.477 5.157 1.00 0.00 C ATOM 254 CG2 VAL A 91 -0.970 -10.343 3.087 1.00 0.00 C ATOM 0 H VAL A 91 -2.629 -9.017 1.257 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.549 -10.841 3.193 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.787 -8.363 3.332 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.095 -9.202 5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.828 -8.798 5.545 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.310 -10.498 5.453 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.006 -10.071 3.489 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.215 -11.362 3.386 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.944 -10.281 1.999 1.00 0.00 H new ATOM 264 N PHE A 92 -4.710 -7.760 3.408 1.00 0.00 N ATOM 265 CA PHE A 92 -5.726 -6.933 4.049 1.00 0.00 C ATOM 266 C PHE A 92 -7.105 -7.206 3.446 1.00 0.00 C ATOM 267 O PHE A 92 -8.125 -7.013 4.106 1.00 0.00 O ATOM 268 CB PHE A 92 -5.376 -5.451 3.882 1.00 0.00 C ATOM 269 CG PHE A 92 -3.909 -5.221 4.192 1.00 0.00 C ATOM 270 CD1 PHE A 92 -3.340 -5.721 5.372 1.00 0.00 C ATOM 271 CD2 PHE A 92 -3.113 -4.507 3.289 1.00 0.00 C ATOM 272 CE1 PHE A 92 -1.987 -5.508 5.647 1.00 0.00 C ATOM 273 CE2 PHE A 92 -1.758 -4.295 3.566 1.00 0.00 C ATOM 274 CZ PHE A 92 -1.195 -4.796 4.744 1.00 0.00 C ATOM 0 H PHE A 92 -4.201 -7.300 2.653 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.753 -7.183 5.110 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.594 -5.131 2.863 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.995 -4.847 4.546 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -3.950 -6.273 6.071 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.545 -4.120 2.378 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -1.554 -5.894 6.558 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -1.145 -3.743 2.868 1.00 0.00 H new ATOM 0 HZ PHE A 92 -0.149 -4.632 4.955 1.00 0.00 H new ATOM 284 N ASP A 93 -7.130 -7.680 2.202 1.00 0.00 N ATOM 285 CA ASP A 93 -8.399 -8.001 1.552 1.00 0.00 C ATOM 286 C ASP A 93 -8.739 -9.465 1.801 1.00 0.00 C ATOM 287 O ASP A 93 -8.433 -10.333 0.984 1.00 0.00 O ATOM 288 CB ASP A 93 -8.327 -7.734 0.046 1.00 0.00 C ATOM 289 CG ASP A 93 -9.701 -7.945 -0.583 1.00 0.00 C ATOM 290 OD1 ASP A 93 -10.577 -8.439 0.108 1.00 0.00 O ATOM 291 OD2 ASP A 93 -9.856 -7.609 -1.745 1.00 0.00 O ATOM 0 H ASP A 93 -6.301 -7.848 1.632 1.00 0.00 H new ATOM 0 HA ASP A 93 -9.177 -7.364 1.974 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.986 -6.715 -0.136 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.599 -8.401 -0.416 1.00 0.00 H new ATOM 296 N LYS A 94 -9.358 -9.730 2.944 1.00 0.00 N ATOM 297 CA LYS A 94 -9.723 -11.084 3.313 1.00 0.00 C ATOM 298 C LYS A 94 -11.084 -11.453 2.728 1.00 0.00 C ATOM 299 O LYS A 94 -11.423 -12.630 2.606 1.00 0.00 O ATOM 300 CB LYS A 94 -9.723 -11.188 4.845 1.00 0.00 C ATOM 301 CG LYS A 94 -10.822 -12.133 5.325 1.00 0.00 C ATOM 302 CD LYS A 94 -10.636 -12.423 6.820 1.00 0.00 C ATOM 303 CE LYS A 94 -9.687 -13.612 7.009 1.00 0.00 C ATOM 304 NZ LYS A 94 -9.568 -13.925 8.462 1.00 0.00 N ATOM 0 H LYS A 94 -9.617 -9.021 3.630 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.999 -11.790 2.906 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -8.753 -11.547 5.190 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.871 -10.200 5.281 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.801 -11.687 5.150 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -10.789 -13.063 4.757 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.234 -11.543 7.322 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.600 -12.640 7.280 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -10.063 -14.481 6.468 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -8.706 -13.378 6.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.622 -14.309 8.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -9.711 -13.057 9.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -10.288 -14.627 8.726 1.00 0.00 H new ATOM 318 N ASP A 95 -11.854 -10.443 2.340 1.00 0.00 N ATOM 319 CA ASP A 95 -13.162 -10.689 1.750 1.00 0.00 C ATOM 320 C ASP A 95 -13.014 -11.023 0.270 1.00 0.00 C ATOM 321 O ASP A 95 -13.860 -11.704 -0.311 1.00 0.00 O ATOM 322 CB ASP A 95 -14.051 -9.456 1.913 1.00 0.00 C ATOM 323 CG ASP A 95 -14.246 -9.146 3.394 1.00 0.00 C ATOM 324 OD1 ASP A 95 -14.422 -10.081 4.156 1.00 0.00 O ATOM 325 OD2 ASP A 95 -14.215 -7.977 3.743 1.00 0.00 O ATOM 0 H ASP A 95 -11.599 -9.459 2.422 1.00 0.00 H new ATOM 0 HA ASP A 95 -13.624 -11.533 2.262 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -13.598 -8.601 1.411 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -15.017 -9.629 1.439 1.00 0.00 H new ATOM 330 N GLY A 96 -11.934 -10.537 -0.334 1.00 0.00 N ATOM 331 CA GLY A 96 -11.684 -10.788 -1.749 1.00 0.00 C ATOM 332 C GLY A 96 -12.669 -10.016 -2.619 1.00 0.00 C ATOM 333 O GLY A 96 -13.015 -10.450 -3.718 1.00 0.00 O ATOM 0 H GLY A 96 -11.223 -9.972 0.130 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.664 -10.496 -2.000 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.770 -11.855 -1.954 1.00 0.00 H new ATOM 337 N ASN A 97 -13.118 -8.870 -2.118 1.00 0.00 N ATOM 338 CA ASN A 97 -14.066 -8.044 -2.857 1.00 0.00 C ATOM 339 C ASN A 97 -13.337 -6.998 -3.697 1.00 0.00 C ATOM 340 O ASN A 97 -13.958 -6.278 -4.479 1.00 0.00 O ATOM 341 CB ASN A 97 -15.017 -7.348 -1.881 1.00 0.00 C ATOM 342 CG ASN A 97 -16.334 -7.023 -2.576 1.00 0.00 C ATOM 343 OD1 ASN A 97 -16.448 -7.167 -3.793 1.00 0.00 O ATOM 344 ND2 ASN A 97 -17.344 -6.590 -1.870 1.00 0.00 N ATOM 0 H ASN A 97 -12.843 -8.494 -1.210 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.635 -8.689 -3.526 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -15.200 -7.990 -1.019 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.559 -6.433 -1.505 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -18.229 -6.371 -2.327 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -17.248 -6.471 -0.862 1.00 0.00 H new ATOM 351 N GLY A 98 -12.018 -6.920 -3.535 1.00 0.00 N ATOM 352 CA GLY A 98 -11.224 -5.954 -4.289 1.00 0.00 C ATOM 353 C GLY A 98 -11.017 -4.664 -3.495 1.00 0.00 C ATOM 354 O GLY A 98 -10.529 -3.669 -4.030 1.00 0.00 O ATOM 0 H GLY A 98 -11.482 -7.507 -2.896 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.256 -6.390 -4.537 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.722 -5.727 -5.232 1.00 0.00 H new ATOM 358 N TYR A 99 -11.399 -4.690 -2.221 1.00 0.00 N ATOM 359 CA TYR A 99 -11.252 -3.506 -1.374 1.00 0.00 C ATOM 360 C TYR A 99 -10.732 -3.861 0.016 1.00 0.00 C ATOM 361 O TYR A 99 -10.885 -4.990 0.484 1.00 0.00 O ATOM 362 CB TYR A 99 -12.593 -2.788 -1.238 1.00 0.00 C ATOM 363 CG TYR A 99 -13.122 -2.433 -2.604 1.00 0.00 C ATOM 364 CD1 TYR A 99 -13.677 -3.429 -3.411 1.00 0.00 C ATOM 365 CD2 TYR A 99 -13.071 -1.110 -3.058 1.00 0.00 C ATOM 366 CE1 TYR A 99 -14.179 -3.109 -4.676 1.00 0.00 C ATOM 367 CE2 TYR A 99 -13.575 -0.786 -4.325 1.00 0.00 C ATOM 368 CZ TYR A 99 -14.128 -1.788 -5.134 1.00 0.00 C ATOM 369 OH TYR A 99 -14.621 -1.470 -6.384 1.00 0.00 O ATOM 0 H TYR A 99 -11.806 -5.502 -1.757 1.00 0.00 H new ATOM 0 HA TYR A 99 -10.524 -2.853 -1.855 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -13.306 -3.426 -0.716 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -12.474 -1.886 -0.638 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -13.718 -4.448 -3.057 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -12.644 -0.340 -2.433 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -14.606 -3.881 -5.299 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -13.537 0.234 -4.677 1.00 0.00 H new ATOM 0 HH TYR A 99 -14.509 -0.510 -6.545 1.00 0.00 H new ATOM 379 N ILE A 100 -10.151 -2.864 0.682 1.00 0.00 N ATOM 380 CA ILE A 100 -9.640 -3.030 2.039 1.00 0.00 C ATOM 381 C ILE A 100 -10.194 -1.884 2.881 1.00 0.00 C ATOM 382 O ILE A 100 -10.368 -0.779 2.371 1.00 0.00 O ATOM 383 CB ILE A 100 -8.092 -2.999 2.052 1.00 0.00 C ATOM 384 CG1 ILE A 100 -7.568 -1.560 2.036 1.00 0.00 C ATOM 385 CG2 ILE A 100 -7.546 -3.680 0.801 1.00 0.00 C ATOM 386 CD1 ILE A 100 -6.041 -1.585 1.932 1.00 0.00 C ATOM 0 H ILE A 100 -10.023 -1.927 0.299 1.00 0.00 H new ATOM 0 HA ILE A 100 -9.952 -3.994 2.442 1.00 0.00 H new ATOM 0 HB ILE A 100 -7.768 -3.510 2.959 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.993 -1.014 1.194 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.875 -1.038 2.942 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.456 -3.654 0.818 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.883 -4.716 0.774 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -7.907 -3.158 -0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.660 -0.564 1.920 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.627 -2.117 2.789 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.747 -2.092 1.013 1.00 0.00 H new ATOM 398 N SER A 101 -10.484 -2.125 4.154 1.00 0.00 N ATOM 399 CA SER A 101 -11.025 -1.057 4.990 1.00 0.00 C ATOM 400 C SER A 101 -10.008 0.074 5.147 1.00 0.00 C ATOM 401 O SER A 101 -8.825 -0.169 5.356 1.00 0.00 O ATOM 402 CB SER A 101 -11.399 -1.606 6.366 1.00 0.00 C ATOM 403 OG SER A 101 -12.434 -2.570 6.223 1.00 0.00 O ATOM 0 H SER A 101 -10.359 -3.023 4.621 1.00 0.00 H new ATOM 0 HA SER A 101 -11.917 -0.661 4.504 1.00 0.00 H new ATOM 0 HB2 SER A 101 -10.527 -2.059 6.838 1.00 0.00 H new ATOM 0 HB3 SER A 101 -11.729 -0.796 7.016 1.00 0.00 H new ATOM 0 HG SER A 101 -12.674 -2.925 7.104 1.00 0.00 H new ATOM 409 N ALA A 102 -10.480 1.311 5.036 1.00 0.00 N ATOM 410 CA ALA A 102 -9.605 2.476 5.163 1.00 0.00 C ATOM 411 C ALA A 102 -9.002 2.588 6.564 1.00 0.00 C ATOM 412 O ALA A 102 -7.853 2.994 6.726 1.00 0.00 O ATOM 413 CB ALA A 102 -10.384 3.752 4.845 1.00 0.00 C ATOM 0 H ALA A 102 -11.459 1.535 4.859 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.788 2.348 4.452 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.725 4.615 4.942 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.766 3.700 3.826 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -11.217 3.852 5.540 1.00 0.00 H new ATOM 419 N ALA A 103 -9.802 2.268 7.574 1.00 0.00 N ATOM 420 CA ALA A 103 -9.352 2.379 8.962 1.00 0.00 C ATOM 421 C ALA A 103 -8.127 1.504 9.238 1.00 0.00 C ATOM 422 O ALA A 103 -7.213 1.920 9.949 1.00 0.00 O ATOM 423 CB ALA A 103 -10.483 1.977 9.909 1.00 0.00 C ATOM 0 H ALA A 103 -10.759 1.932 7.463 1.00 0.00 H new ATOM 0 HA ALA A 103 -9.070 3.418 9.132 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.141 2.062 10.941 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.338 2.635 9.755 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.777 0.947 9.708 1.00 0.00 H new ATOM 429 N GLU A 104 -8.115 0.295 8.690 1.00 0.00 N ATOM 430 CA GLU A 104 -6.990 -0.610 8.917 1.00 0.00 C ATOM 431 C GLU A 104 -5.746 -0.108 8.191 1.00 0.00 C ATOM 432 O GLU A 104 -4.621 -0.374 8.613 1.00 0.00 O ATOM 433 CB GLU A 104 -7.340 -2.024 8.440 1.00 0.00 C ATOM 434 CG GLU A 104 -6.909 -2.224 6.986 1.00 0.00 C ATOM 435 CD GLU A 104 -7.609 -3.447 6.405 1.00 0.00 C ATOM 436 OE1 GLU A 104 -7.726 -4.431 7.117 1.00 0.00 O ATOM 437 OE2 GLU A 104 -8.020 -3.382 5.259 1.00 0.00 O ATOM 0 H GLU A 104 -8.855 -0.079 8.096 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.783 -0.639 9.987 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.848 -2.760 9.075 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.413 -2.190 8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.155 -1.339 6.399 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -5.828 -2.352 6.932 1.00 0.00 H new ATOM 444 N LEU A 105 -5.956 0.618 7.098 1.00 0.00 N ATOM 445 CA LEU A 105 -4.832 1.149 6.326 1.00 0.00 C ATOM 446 C LEU A 105 -4.013 2.094 7.204 1.00 0.00 C ATOM 447 O LEU A 105 -2.793 1.971 7.294 1.00 0.00 O ATOM 448 CB LEU A 105 -5.365 1.912 5.101 1.00 0.00 C ATOM 449 CG LEU A 105 -4.211 2.372 4.194 1.00 0.00 C ATOM 450 CD1 LEU A 105 -3.614 1.181 3.435 1.00 0.00 C ATOM 451 CD2 LEU A 105 -4.742 3.394 3.187 1.00 0.00 C ATOM 0 H LEU A 105 -6.878 0.851 6.729 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.199 0.327 5.991 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.043 1.272 4.536 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.941 2.777 5.429 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.434 2.820 4.813 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.799 1.526 2.799 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.233 0.450 4.148 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -4.385 0.719 2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.929 3.724 2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.524 2.936 2.581 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -5.152 4.251 3.721 1.00 0.00 H new ATOM 463 N ARG A 106 -4.698 3.039 7.849 1.00 0.00 N ATOM 464 CA ARG A 106 -4.025 4.004 8.717 1.00 0.00 C ATOM 465 C ARG A 106 -3.205 3.275 9.779 1.00 0.00 C ATOM 466 O ARG A 106 -2.020 3.551 9.955 1.00 0.00 O ATOM 467 CB ARG A 106 -5.088 4.924 9.361 1.00 0.00 C ATOM 468 CG ARG A 106 -4.620 5.533 10.701 1.00 0.00 C ATOM 469 CD ARG A 106 -3.384 6.414 10.529 1.00 0.00 C ATOM 470 NE ARG A 106 -3.767 7.706 9.966 1.00 0.00 N ATOM 471 CZ ARG A 106 -2.942 8.749 10.011 1.00 0.00 C ATOM 472 NH1 ARG A 106 -1.782 8.639 10.596 1.00 0.00 N ATOM 473 NH2 ARG A 106 -3.301 9.890 9.485 1.00 0.00 N ATOM 0 H ARG A 106 -5.709 3.156 7.788 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.337 4.615 8.133 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -5.334 5.728 8.668 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -6.003 4.355 9.526 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -5.428 6.123 11.133 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -4.399 4.731 11.406 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.893 6.558 11.491 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.664 5.922 9.875 1.00 0.00 H new ATOM 0 HE ARG A 106 -4.683 7.811 9.530 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.506 7.753 11.020 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -1.150 9.439 10.630 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.214 9.981 9.040 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -2.668 10.689 9.520 1.00 0.00 H new ATOM 487 N HIS A 107 -3.836 2.340 10.482 1.00 0.00 N ATOM 488 CA HIS A 107 -3.145 1.577 11.520 1.00 0.00 C ATOM 489 C HIS A 107 -1.989 0.763 10.944 1.00 0.00 C ATOM 490 O HIS A 107 -0.886 0.752 11.489 1.00 0.00 O ATOM 491 CB HIS A 107 -4.141 0.637 12.201 1.00 0.00 C ATOM 492 CG HIS A 107 -3.417 -0.260 13.164 1.00 0.00 C ATOM 493 ND1 HIS A 107 -2.903 0.202 14.366 1.00 0.00 N ATOM 494 CD2 HIS A 107 -3.118 -1.597 13.116 1.00 0.00 C ATOM 495 CE1 HIS A 107 -2.328 -0.843 14.988 1.00 0.00 C ATOM 496 NE2 HIS A 107 -2.430 -1.965 14.268 1.00 0.00 N ATOM 0 H HIS A 107 -4.817 2.092 10.355 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.732 2.281 12.242 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.899 1.216 12.729 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -4.660 0.039 11.453 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -2.952 1.159 14.715 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.377 -2.264 12.307 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.843 -0.783 15.951 1.00 0.00 H new ATOM 505 N VAL A 108 -2.266 0.069 9.850 1.00 0.00 N ATOM 506 CA VAL A 108 -1.275 -0.780 9.190 1.00 0.00 C ATOM 507 C VAL A 108 -0.076 0.024 8.680 1.00 0.00 C ATOM 508 O VAL A 108 1.067 -0.424 8.770 1.00 0.00 O ATOM 509 CB VAL A 108 -1.943 -1.506 8.022 1.00 0.00 C ATOM 510 CG1 VAL A 108 -0.887 -2.213 7.172 1.00 0.00 C ATOM 511 CG2 VAL A 108 -2.928 -2.540 8.568 1.00 0.00 C ATOM 0 H VAL A 108 -3.178 0.076 9.394 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.899 -1.495 9.922 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.472 -0.780 7.404 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.372 -2.727 6.343 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -0.183 -1.478 6.781 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -0.352 -2.938 7.785 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.407 -3.060 7.738 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.393 -3.260 9.188 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.687 -2.038 9.168 1.00 0.00 H new ATOM 521 N MET A 109 -0.350 1.202 8.140 1.00 0.00 N ATOM 522 CA MET A 109 0.706 2.062 7.606 1.00 0.00 C ATOM 523 C MET A 109 1.497 2.737 8.718 1.00 0.00 C ATOM 524 O MET A 109 2.648 3.123 8.513 1.00 0.00 O ATOM 525 CB MET A 109 0.098 3.134 6.699 1.00 0.00 C ATOM 526 CG MET A 109 0.089 2.649 5.248 1.00 0.00 C ATOM 527 SD MET A 109 -0.390 0.902 5.180 1.00 0.00 S ATOM 528 CE MET A 109 0.069 0.610 3.456 1.00 0.00 C ATOM 0 H MET A 109 -1.291 1.587 8.058 1.00 0.00 H new ATOM 0 HA MET A 109 1.387 1.431 7.035 1.00 0.00 H new ATOM 0 HB2 MET A 109 -0.918 3.361 7.021 1.00 0.00 H new ATOM 0 HB3 MET A 109 0.672 4.057 6.779 1.00 0.00 H new ATOM 0 HG2 MET A 109 -0.606 3.248 4.660 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.076 2.781 4.806 1.00 0.00 H new ATOM 0 HE1 MET A 109 -0.528 -0.208 3.054 1.00 0.00 H new ATOM 0 HE2 MET A 109 -0.113 1.513 2.873 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.126 0.349 3.400 1.00 0.00 H new ATOM 538 N THR A 110 0.875 2.902 9.880 1.00 0.00 N ATOM 539 CA THR A 110 1.543 3.565 10.994 1.00 0.00 C ATOM 540 C THR A 110 1.964 2.573 12.076 1.00 0.00 C ATOM 541 O THR A 110 2.775 2.908 12.937 1.00 0.00 O ATOM 542 CB THR A 110 0.609 4.617 11.588 1.00 0.00 C ATOM 543 OG1 THR A 110 -0.542 3.982 12.126 1.00 0.00 O ATOM 544 CG2 THR A 110 0.194 5.582 10.488 1.00 0.00 C ATOM 0 H THR A 110 -0.077 2.591 10.074 1.00 0.00 H new ATOM 0 HA THR A 110 2.448 4.038 10.614 1.00 0.00 H new ATOM 0 HB THR A 110 1.120 5.160 12.383 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.261 3.989 11.460 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.474 6.338 10.900 1.00 0.00 H new ATOM 0 HG22 THR A 110 1.079 6.066 10.075 1.00 0.00 H new ATOM 0 HG23 THR A 110 -0.321 5.034 9.699 1.00 0.00 H new ATOM 552 N ASN A 111 1.391 1.369 12.051 1.00 0.00 N ATOM 553 CA ASN A 111 1.713 0.362 13.065 1.00 0.00 C ATOM 554 C ASN A 111 2.595 -0.763 12.511 1.00 0.00 C ATOM 555 O ASN A 111 3.463 -1.272 13.219 1.00 0.00 O ATOM 556 CB ASN A 111 0.425 -0.243 13.622 1.00 0.00 C ATOM 557 CG ASN A 111 0.710 -0.921 14.958 1.00 0.00 C ATOM 558 OD1 ASN A 111 1.514 -0.426 15.746 1.00 0.00 O ATOM 559 ND2 ASN A 111 0.095 -2.033 15.260 1.00 0.00 N ATOM 0 H ASN A 111 0.712 1.069 11.352 1.00 0.00 H new ATOM 0 HA ASN A 111 2.271 0.868 13.853 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.327 0.535 13.752 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.017 -0.966 12.916 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.281 -2.493 16.151 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -0.571 -2.441 14.605 1.00 0.00 H new ATOM 566 N LEU A 112 2.358 -1.164 11.260 1.00 0.00 N ATOM 567 CA LEU A 112 3.134 -2.253 10.659 1.00 0.00 C ATOM 568 C LEU A 112 4.092 -1.738 9.587 1.00 0.00 C ATOM 569 O LEU A 112 3.746 -0.858 8.798 1.00 0.00 O ATOM 570 CB LEU A 112 2.191 -3.279 10.026 1.00 0.00 C ATOM 571 CG LEU A 112 1.217 -3.824 11.076 1.00 0.00 C ATOM 572 CD1 LEU A 112 0.266 -4.825 10.415 1.00 0.00 C ATOM 573 CD2 LEU A 112 1.994 -4.529 12.193 1.00 0.00 C ATOM 0 H LEU A 112 1.647 -0.759 10.651 1.00 0.00 H new ATOM 0 HA LEU A 112 3.718 -2.715 11.455 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.636 -2.818 9.210 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.769 -4.097 9.596 1.00 0.00 H new ATOM 0 HG LEU A 112 0.648 -2.996 11.500 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.428 -5.214 11.160 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.294 -4.327 9.623 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.841 -5.648 9.990 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.295 -4.914 12.936 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.567 -5.355 11.772 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.673 -3.820 12.667 1.00 0.00 H new ATOM 585 N GLY A 113 5.295 -2.315 9.559 1.00 0.00 N ATOM 586 CA GLY A 113 6.309 -1.938 8.577 1.00 0.00 C ATOM 587 C GLY A 113 6.625 -0.449 8.645 1.00 0.00 C ATOM 588 O GLY A 113 5.720 0.374 8.516 1.00 0.00 O ATOM 0 H GLY A 113 5.589 -3.046 10.207 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.219 -2.513 8.753 1.00 0.00 H new ATOM 0 HA3 GLY A 113 5.960 -2.192 7.576 1.00 0.00 H new ATOM 592 N GLU A 114 7.915 -0.125 8.839 1.00 0.00 N ATOM 593 CA GLU A 114 8.379 1.270 8.916 1.00 0.00 C ATOM 594 C GLU A 114 7.207 2.223 9.099 1.00 0.00 C ATOM 595 O GLU A 114 6.618 2.682 8.125 1.00 0.00 O ATOM 596 CB GLU A 114 9.137 1.641 7.638 1.00 0.00 C ATOM 597 CG GLU A 114 10.327 0.693 7.454 1.00 0.00 C ATOM 598 CD GLU A 114 9.902 -0.545 6.668 1.00 0.00 C ATOM 599 OE1 GLU A 114 8.710 -0.736 6.496 1.00 0.00 O ATOM 600 OE2 GLU A 114 10.778 -1.286 6.252 1.00 0.00 O ATOM 0 H GLU A 114 8.658 -0.815 8.946 1.00 0.00 H new ATOM 0 HA GLU A 114 9.042 1.359 9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.472 1.578 6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.486 2.672 7.696 1.00 0.00 H new ATOM 0 HG2 GLU A 114 11.132 1.207 6.929 1.00 0.00 H new ATOM 0 HG3 GLU A 114 10.719 0.397 8.427 1.00 0.00 H new ATOM 607 N LYS A 115 6.836 2.470 10.344 1.00 0.00 N ATOM 608 CA LYS A 115 5.689 3.320 10.633 1.00 0.00 C ATOM 609 C LYS A 115 5.728 4.613 9.817 1.00 0.00 C ATOM 610 O LYS A 115 6.745 5.307 9.777 1.00 0.00 O ATOM 611 CB LYS A 115 5.683 3.664 12.122 1.00 0.00 C ATOM 612 CG LYS A 115 5.623 2.372 12.942 1.00 0.00 C ATOM 613 CD LYS A 115 5.526 2.715 14.430 1.00 0.00 C ATOM 614 CE LYS A 115 5.455 1.426 15.248 1.00 0.00 C ATOM 615 NZ LYS A 115 6.721 0.656 15.076 1.00 0.00 N ATOM 0 H LYS A 115 7.308 2.097 11.168 1.00 0.00 H new ATOM 0 HA LYS A 115 4.784 2.776 10.362 1.00 0.00 H new ATOM 0 HB2 LYS A 115 6.578 4.230 12.379 1.00 0.00 H new ATOM 0 HB3 LYS A 115 4.827 4.297 12.357 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.762 1.776 12.639 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.511 1.768 12.754 1.00 0.00 H new ATOM 0 HD2 LYS A 115 6.391 3.304 14.735 1.00 0.00 H new ATOM 0 HD3 LYS A 115 4.642 3.325 14.616 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.299 1.659 16.301 1.00 0.00 H new ATOM 0 HE3 LYS A 115 4.605 0.825 14.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.826 -0.019 15.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.693 0.138 14.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.528 1.312 15.073 1.00 0.00 H new ATOM 629 N LEU A 116 4.599 4.939 9.184 1.00 0.00 N ATOM 630 CA LEU A 116 4.495 6.162 8.390 1.00 0.00 C ATOM 631 C LEU A 116 4.020 7.303 9.287 1.00 0.00 C ATOM 632 O LEU A 116 3.386 7.064 10.314 1.00 0.00 O ATOM 633 CB LEU A 116 3.481 5.982 7.242 1.00 0.00 C ATOM 634 CG LEU A 116 4.162 5.484 5.955 1.00 0.00 C ATOM 635 CD1 LEU A 116 5.147 6.532 5.436 1.00 0.00 C ATOM 636 CD2 LEU A 116 4.911 4.185 6.244 1.00 0.00 C ATOM 0 H LEU A 116 3.749 4.376 9.206 1.00 0.00 H new ATOM 0 HA LEU A 116 5.475 6.387 7.968 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.711 5.272 7.544 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.981 6.930 7.046 1.00 0.00 H new ATOM 0 HG LEU A 116 3.398 5.309 5.198 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.621 6.166 4.525 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.613 7.458 5.221 1.00 0.00 H new ATOM 0 HD13 LEU A 116 5.910 6.720 6.192 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.393 3.832 5.332 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.667 4.363 7.009 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.208 3.431 6.598 1.00 0.00 H new ATOM 648 N THR A 117 4.308 8.543 8.898 1.00 0.00 N ATOM 649 CA THR A 117 3.875 9.692 9.685 1.00 0.00 C ATOM 650 C THR A 117 2.477 10.120 9.252 1.00 0.00 C ATOM 651 O THR A 117 1.978 9.675 8.218 1.00 0.00 O ATOM 652 CB THR A 117 4.853 10.854 9.501 1.00 0.00 C ATOM 653 OG1 THR A 117 4.849 11.263 8.140 1.00 0.00 O ATOM 654 CG2 THR A 117 6.262 10.410 9.899 1.00 0.00 C ATOM 0 H THR A 117 4.832 8.775 8.054 1.00 0.00 H new ATOM 0 HA THR A 117 3.853 9.410 10.738 1.00 0.00 H new ATOM 0 HB THR A 117 4.548 11.688 10.133 1.00 0.00 H new ATOM 0 HG1 THR A 117 5.467 10.701 7.628 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.956 11.240 9.767 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.264 10.098 10.944 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.571 9.575 9.271 1.00 0.00 H new ATOM 662 N ASP A 118 1.841 10.974 10.046 1.00 0.00 N ATOM 663 CA ASP A 118 0.496 11.433 9.721 1.00 0.00 C ATOM 664 C ASP A 118 0.481 12.146 8.373 1.00 0.00 C ATOM 665 O ASP A 118 -0.449 11.977 7.584 1.00 0.00 O ATOM 666 CB ASP A 118 -0.003 12.389 10.808 1.00 0.00 C ATOM 667 CG ASP A 118 -0.300 11.616 12.088 1.00 0.00 C ATOM 668 OD1 ASP A 118 -0.358 10.400 12.023 1.00 0.00 O ATOM 669 OD2 ASP A 118 -0.465 12.253 13.117 1.00 0.00 O ATOM 0 H ASP A 118 2.228 11.358 10.908 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.160 10.564 9.666 1.00 0.00 H new ATOM 0 HB2 ASP A 118 0.748 13.155 11.002 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -0.902 12.903 10.467 1.00 0.00 H new ATOM 674 N GLU A 119 1.514 12.939 8.108 1.00 0.00 N ATOM 675 CA GLU A 119 1.595 13.661 6.843 1.00 0.00 C ATOM 676 C GLU A 119 1.680 12.674 5.683 1.00 0.00 C ATOM 677 O GLU A 119 1.038 12.857 4.649 1.00 0.00 O ATOM 678 CB GLU A 119 2.832 14.569 6.830 1.00 0.00 C ATOM 679 CG GLU A 119 2.654 15.730 7.816 1.00 0.00 C ATOM 680 CD GLU A 119 1.468 16.604 7.414 1.00 0.00 C ATOM 681 OE1 GLU A 119 1.393 16.968 6.252 1.00 0.00 O ATOM 682 OE2 GLU A 119 0.653 16.893 8.274 1.00 0.00 O ATOM 0 H GLU A 119 2.297 13.097 8.742 1.00 0.00 H new ATOM 0 HA GLU A 119 0.699 14.272 6.734 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.718 13.991 7.095 1.00 0.00 H new ATOM 0 HB3 GLU A 119 2.994 14.959 5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 119 2.499 15.339 8.822 1.00 0.00 H new ATOM 0 HG3 GLU A 119 3.562 16.332 7.844 1.00 0.00 H new ATOM 689 N GLU A 120 2.460 11.617 5.876 1.00 0.00 N ATOM 690 CA GLU A 120 2.609 10.592 4.852 1.00 0.00 C ATOM 691 C GLU A 120 1.313 9.798 4.706 1.00 0.00 C ATOM 692 O GLU A 120 0.892 9.476 3.596 1.00 0.00 O ATOM 693 CB GLU A 120 3.777 9.673 5.213 1.00 0.00 C ATOM 694 CG GLU A 120 5.082 10.462 5.048 1.00 0.00 C ATOM 695 CD GLU A 120 6.284 9.608 5.438 1.00 0.00 C ATOM 696 OE1 GLU A 120 6.381 9.253 6.602 1.00 0.00 O ATOM 697 OE2 GLU A 120 7.088 9.319 4.567 1.00 0.00 O ATOM 0 H GLU A 120 2.996 11.448 6.727 1.00 0.00 H new ATOM 0 HA GLU A 120 2.822 11.066 3.894 1.00 0.00 H new ATOM 0 HB2 GLU A 120 3.676 9.316 6.238 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.781 8.794 4.569 1.00 0.00 H new ATOM 0 HG2 GLU A 120 5.185 10.792 4.014 1.00 0.00 H new ATOM 0 HG3 GLU A 120 5.051 11.359 5.667 1.00 0.00 H new ATOM 704 N VAL A 121 0.674 9.508 5.838 1.00 0.00 N ATOM 705 CA VAL A 121 -0.589 8.772 5.826 1.00 0.00 C ATOM 706 C VAL A 121 -1.654 9.585 5.095 1.00 0.00 C ATOM 707 O VAL A 121 -2.445 9.046 4.327 1.00 0.00 O ATOM 708 CB VAL A 121 -1.068 8.494 7.255 1.00 0.00 C ATOM 709 CG1 VAL A 121 -2.491 7.934 7.210 1.00 0.00 C ATOM 710 CG2 VAL A 121 -0.152 7.472 7.927 1.00 0.00 C ATOM 0 H VAL A 121 1.006 9.768 6.767 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.427 7.824 5.314 1.00 0.00 H new ATOM 0 HB VAL A 121 -1.048 9.424 7.824 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.836 7.735 8.225 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.153 8.660 6.738 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.499 7.008 6.635 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -0.502 7.282 8.942 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.165 6.542 7.358 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.865 7.862 7.961 1.00 0.00 H new ATOM 720 N ASP A 122 -1.682 10.884 5.353 1.00 0.00 N ATOM 721 CA ASP A 122 -2.670 11.743 4.718 1.00 0.00 C ATOM 722 C ASP A 122 -2.523 11.687 3.200 1.00 0.00 C ATOM 723 O ASP A 122 -3.516 11.602 2.477 1.00 0.00 O ATOM 724 CB ASP A 122 -2.505 13.185 5.203 1.00 0.00 C ATOM 725 CG ASP A 122 -3.588 14.067 4.592 1.00 0.00 C ATOM 726 OD1 ASP A 122 -4.308 13.579 3.736 1.00 0.00 O ATOM 727 OD2 ASP A 122 -3.681 15.217 4.987 1.00 0.00 O ATOM 0 H ASP A 122 -1.042 11.361 5.988 1.00 0.00 H new ATOM 0 HA ASP A 122 -3.664 11.388 4.990 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -2.566 13.221 6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -1.520 13.560 4.926 1.00 0.00 H new ATOM 732 N GLU A 123 -1.281 11.718 2.722 1.00 0.00 N ATOM 733 CA GLU A 123 -1.034 11.651 1.285 1.00 0.00 C ATOM 734 C GLU A 123 -1.554 10.330 0.743 1.00 0.00 C ATOM 735 O GLU A 123 -2.139 10.265 -0.338 1.00 0.00 O ATOM 736 CB GLU A 123 0.468 11.733 1.002 1.00 0.00 C ATOM 737 CG GLU A 123 0.998 13.120 1.360 1.00 0.00 C ATOM 738 CD GLU A 123 0.442 14.159 0.393 1.00 0.00 C ATOM 739 OE1 GLU A 123 0.006 13.770 -0.678 1.00 0.00 O ATOM 740 OE2 GLU A 123 0.462 15.330 0.737 1.00 0.00 O ATOM 0 H GLU A 123 -0.443 11.788 3.299 1.00 0.00 H new ATOM 0 HA GLU A 123 -1.544 12.486 0.804 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.996 10.974 1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 123 0.659 11.523 -0.050 1.00 0.00 H new ATOM 0 HG2 GLU A 123 0.714 13.374 2.381 1.00 0.00 H new ATOM 0 HG3 GLU A 123 2.087 13.123 1.322 1.00 0.00 H new ATOM 747 N MET A 124 -1.332 9.279 1.519 1.00 0.00 N ATOM 748 CA MET A 124 -1.767 7.943 1.148 1.00 0.00 C ATOM 749 C MET A 124 -3.293 7.890 1.092 1.00 0.00 C ATOM 750 O MET A 124 -3.871 7.287 0.189 1.00 0.00 O ATOM 751 CB MET A 124 -1.257 6.963 2.203 1.00 0.00 C ATOM 752 CG MET A 124 0.274 6.928 2.166 1.00 0.00 C ATOM 753 SD MET A 124 0.829 5.707 0.958 1.00 0.00 S ATOM 754 CE MET A 124 0.551 4.248 1.993 1.00 0.00 C ATOM 0 H MET A 124 -0.849 9.328 2.416 1.00 0.00 H new ATOM 0 HA MET A 124 -1.372 7.681 0.166 1.00 0.00 H new ATOM 0 HB2 MET A 124 -1.601 7.265 3.192 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.659 5.967 2.015 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.663 7.913 1.907 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.665 6.681 3.153 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.486 3.699 2.107 1.00 0.00 H new ATOM 0 HE2 MET A 124 0.192 4.561 2.974 1.00 0.00 H new ATOM 0 HE3 MET A 124 -0.193 3.605 1.523 1.00 0.00 H new ATOM 764 N ILE A 125 -3.938 8.537 2.063 1.00 0.00 N ATOM 765 CA ILE A 125 -5.399 8.561 2.121 1.00 0.00 C ATOM 766 C ILE A 125 -5.971 9.319 0.923 1.00 0.00 C ATOM 767 O ILE A 125 -7.010 8.947 0.379 1.00 0.00 O ATOM 768 CB ILE A 125 -5.860 9.205 3.448 1.00 0.00 C ATOM 769 CG1 ILE A 125 -6.343 8.133 4.446 1.00 0.00 C ATOM 770 CG2 ILE A 125 -6.990 10.219 3.216 1.00 0.00 C ATOM 771 CD1 ILE A 125 -5.137 7.498 5.143 1.00 0.00 C ATOM 0 H ILE A 125 -3.476 9.048 2.815 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.772 7.538 2.081 1.00 0.00 H new ATOM 0 HB ILE A 125 -4.997 9.724 3.865 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -7.007 8.582 5.184 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.918 7.368 3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.291 10.653 4.170 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.639 11.009 2.552 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.843 9.715 2.762 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -5.481 6.741 5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.490 7.034 4.399 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -4.580 8.267 5.679 1.00 0.00 H new ATOM 783 N ARG A 126 -5.285 10.382 0.524 1.00 0.00 N ATOM 784 CA ARG A 126 -5.726 11.193 -0.606 1.00 0.00 C ATOM 785 C ARG A 126 -5.790 10.344 -1.874 1.00 0.00 C ATOM 786 O ARG A 126 -6.651 10.546 -2.731 1.00 0.00 O ATOM 787 CB ARG A 126 -4.753 12.360 -0.818 1.00 0.00 C ATOM 788 CG ARG A 126 -5.350 13.375 -1.799 1.00 0.00 C ATOM 789 CD ARG A 126 -6.200 14.396 -1.037 1.00 0.00 C ATOM 790 NE ARG A 126 -5.347 15.246 -0.213 1.00 0.00 N ATOM 791 CZ ARG A 126 -5.866 16.085 0.676 1.00 0.00 C ATOM 792 NH1 ARG A 126 -7.160 16.156 0.828 1.00 0.00 N ATOM 793 NH2 ARG A 126 -5.081 16.837 1.399 1.00 0.00 N ATOM 0 H ARG A 126 -4.423 10.703 0.964 1.00 0.00 H new ATOM 0 HA ARG A 126 -6.721 11.583 -0.390 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -4.542 12.845 0.135 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -3.804 11.987 -1.202 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -4.552 13.884 -2.340 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -5.961 12.861 -2.541 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -6.765 15.008 -1.741 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -6.926 13.880 -0.409 1.00 0.00 H new ATOM 0 HE ARG A 126 -4.334 15.195 -0.322 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -7.773 15.567 0.264 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -7.559 16.800 1.511 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -4.069 16.780 1.281 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -5.479 17.482 2.082 1.00 0.00 H new ATOM 807 N GLU A 127 -4.872 9.391 -1.976 1.00 0.00 N ATOM 808 CA GLU A 127 -4.821 8.502 -3.132 1.00 0.00 C ATOM 809 C GLU A 127 -5.547 7.187 -2.842 1.00 0.00 C ATOM 810 O GLU A 127 -5.646 6.319 -3.710 1.00 0.00 O ATOM 811 CB GLU A 127 -3.363 8.218 -3.495 1.00 0.00 C ATOM 812 CG GLU A 127 -2.663 9.534 -3.846 1.00 0.00 C ATOM 813 CD GLU A 127 -1.213 9.267 -4.233 1.00 0.00 C ATOM 814 OE1 GLU A 127 -0.546 8.559 -3.498 1.00 0.00 O ATOM 815 OE2 GLU A 127 -0.791 9.773 -5.260 1.00 0.00 O ATOM 0 H GLU A 127 -4.154 9.213 -1.274 1.00 0.00 H new ATOM 0 HA GLU A 127 -5.320 8.992 -3.968 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.856 7.735 -2.660 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -3.314 7.530 -4.339 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.183 10.024 -4.669 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -2.701 10.214 -2.995 1.00 0.00 H new ATOM 822 N ALA A 128 -6.038 7.039 -1.615 1.00 0.00 N ATOM 823 CA ALA A 128 -6.733 5.814 -1.222 1.00 0.00 C ATOM 824 C ALA A 128 -8.220 5.861 -1.578 1.00 0.00 C ATOM 825 O ALA A 128 -8.637 5.268 -2.570 1.00 0.00 O ATOM 826 CB ALA A 128 -6.589 5.595 0.284 1.00 0.00 C ATOM 0 H ALA A 128 -5.970 7.744 -0.881 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.276 4.991 -1.771 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.109 4.681 0.570 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.533 5.507 0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.022 6.441 0.818 1.00 0.00 H new ATOM 832 N ASP A 129 -9.001 6.578 -0.759 1.00 0.00 N ATOM 833 CA ASP A 129 -10.448 6.704 -0.975 1.00 0.00 C ATOM 834 C ASP A 129 -11.107 7.495 0.159 1.00 0.00 C ATOM 835 O ASP A 129 -10.871 8.691 0.324 1.00 0.00 O ATOM 836 CB ASP A 129 -11.100 5.313 -1.036 1.00 0.00 C ATOM 837 CG ASP A 129 -12.605 5.441 -1.253 1.00 0.00 C ATOM 838 OD1 ASP A 129 -13.088 6.561 -1.278 1.00 0.00 O ATOM 839 OD2 ASP A 129 -13.252 4.416 -1.389 1.00 0.00 O ATOM 0 H ASP A 129 -8.655 7.079 0.059 1.00 0.00 H new ATOM 0 HA ASP A 129 -10.594 7.231 -1.918 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -10.657 4.732 -1.845 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -10.904 4.771 -0.111 1.00 0.00 H new ATOM 844 N ILE A 130 -11.945 6.795 0.922 1.00 0.00 N ATOM 845 CA ILE A 130 -12.675 7.374 2.040 1.00 0.00 C ATOM 846 C ILE A 130 -13.667 8.430 1.565 1.00 0.00 C ATOM 847 O ILE A 130 -14.576 8.129 0.794 1.00 0.00 O ATOM 848 CB ILE A 130 -11.723 7.980 3.074 1.00 0.00 C ATOM 849 CG1 ILE A 130 -10.727 6.913 3.524 1.00 0.00 C ATOM 850 CG2 ILE A 130 -12.533 8.439 4.291 1.00 0.00 C ATOM 851 CD1 ILE A 130 -9.651 7.551 4.406 1.00 0.00 C ATOM 0 H ILE A 130 -12.135 5.803 0.778 1.00 0.00 H new ATOM 0 HA ILE A 130 -13.230 6.564 2.514 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.193 8.825 2.635 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -11.245 6.128 4.075 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -10.267 6.442 2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -11.862 8.872 5.033 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -13.263 9.187 3.981 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -13.052 7.585 4.726 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -8.942 6.787 4.725 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.125 8.320 3.840 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -10.118 8.001 5.282 1.00 0.00 H new ATOM 863 N ASP A 131 -13.501 9.653 2.063 1.00 0.00 N ATOM 864 CA ASP A 131 -14.396 10.763 1.730 1.00 0.00 C ATOM 865 C ASP A 131 -15.790 10.508 2.307 1.00 0.00 C ATOM 866 O ASP A 131 -16.501 11.443 2.672 1.00 0.00 O ATOM 867 CB ASP A 131 -14.487 10.966 0.212 1.00 0.00 C ATOM 868 CG ASP A 131 -13.090 11.118 -0.378 1.00 0.00 C ATOM 869 OD1 ASP A 131 -12.328 11.912 0.148 1.00 0.00 O ATOM 870 OD2 ASP A 131 -12.801 10.436 -1.348 1.00 0.00 O ATOM 0 H ASP A 131 -12.748 9.904 2.704 1.00 0.00 H new ATOM 0 HA ASP A 131 -13.985 11.671 2.171 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -14.994 10.117 -0.247 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -15.083 11.851 -0.010 1.00 0.00 H new ATOM 875 N GLY A 132 -16.171 9.234 2.384 1.00 0.00 N ATOM 876 CA GLY A 132 -17.475 8.862 2.915 1.00 0.00 C ATOM 877 C GLY A 132 -17.766 7.387 2.655 1.00 0.00 C ATOM 878 O GLY A 132 -18.819 6.878 3.042 1.00 0.00 O ATOM 0 H GLY A 132 -15.595 8.447 2.086 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -17.506 9.060 3.986 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -18.249 9.476 2.455 1.00 0.00 H new ATOM 882 N ASP A 133 -16.830 6.700 2.004 1.00 0.00 N ATOM 883 CA ASP A 133 -17.011 5.282 1.710 1.00 0.00 C ATOM 884 C ASP A 133 -16.587 4.421 2.894 1.00 0.00 C ATOM 885 O ASP A 133 -17.252 3.442 3.233 1.00 0.00 O ATOM 886 CB ASP A 133 -16.189 4.885 0.483 1.00 0.00 C ATOM 887 CG ASP A 133 -16.782 5.517 -0.771 1.00 0.00 C ATOM 888 OD1 ASP A 133 -17.906 5.987 -0.699 1.00 0.00 O ATOM 889 OD2 ASP A 133 -16.104 5.522 -1.786 1.00 0.00 O ATOM 0 H ASP A 133 -15.950 7.096 1.674 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.070 5.116 1.512 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -15.155 5.207 0.608 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -16.174 3.800 0.381 1.00 0.00 H new ATOM 894 N GLY A 134 -15.476 4.792 3.517 1.00 0.00 N ATOM 895 CA GLY A 134 -14.966 4.048 4.661 1.00 0.00 C ATOM 896 C GLY A 134 -14.101 2.875 4.209 1.00 0.00 C ATOM 897 O GLY A 134 -13.481 2.202 5.034 1.00 0.00 O ATOM 0 H GLY A 134 -14.913 5.600 3.251 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.382 4.711 5.299 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -15.799 3.681 5.261 1.00 0.00 H new ATOM 901 N GLN A 135 -14.065 2.633 2.898 1.00 0.00 N ATOM 902 CA GLN A 135 -13.272 1.531 2.353 1.00 0.00 C ATOM 903 C GLN A 135 -12.181 2.066 1.435 1.00 0.00 C ATOM 904 O GLN A 135 -12.207 3.230 1.044 1.00 0.00 O ATOM 905 CB GLN A 135 -14.160 0.571 1.564 1.00 0.00 C ATOM 906 CG GLN A 135 -15.532 0.471 2.234 1.00 0.00 C ATOM 907 CD GLN A 135 -15.368 0.139 3.714 1.00 0.00 C ATOM 908 OE1 GLN A 135 -14.667 -0.809 4.065 1.00 0.00 O ATOM 909 NE2 GLN A 135 -15.981 0.867 4.607 1.00 0.00 N ATOM 0 H GLN A 135 -14.570 3.179 2.200 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.817 0.999 3.188 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.270 0.922 0.538 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -13.695 -0.414 1.516 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -16.070 1.412 2.122 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -16.130 -0.298 1.745 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -16.562 1.653 4.313 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.879 0.650 5.599 1.00 0.00 H new ATOM 918 N VAL A 136 -11.225 1.206 1.091 1.00 0.00 N ATOM 919 CA VAL A 136 -10.126 1.595 0.213 1.00 0.00 C ATOM 920 C VAL A 136 -9.867 0.538 -0.853 1.00 0.00 C ATOM 921 O VAL A 136 -9.759 -0.646 -0.549 1.00 0.00 O ATOM 922 CB VAL A 136 -8.864 1.812 1.044 1.00 0.00 C ATOM 923 CG1 VAL A 136 -7.636 1.838 0.128 1.00 0.00 C ATOM 924 CG2 VAL A 136 -8.984 3.150 1.769 1.00 0.00 C ATOM 0 H VAL A 136 -11.190 0.237 1.407 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.402 2.521 -0.292 1.00 0.00 H new ATOM 0 HB VAL A 136 -8.752 1.001 1.764 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.739 1.993 0.727 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.558 0.889 -0.403 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.736 2.650 -0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -8.090 3.321 2.368 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -9.090 3.952 1.038 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.859 3.134 2.419 1.00 0.00 H new ATOM 934 N ASN A 137 -9.749 0.974 -2.101 1.00 0.00 N ATOM 935 CA ASN A 137 -9.483 0.046 -3.192 1.00 0.00 C ATOM 936 C ASN A 137 -7.981 -0.002 -3.488 1.00 0.00 C ATOM 937 O ASN A 137 -7.407 0.973 -3.969 1.00 0.00 O ATOM 938 CB ASN A 137 -10.243 0.478 -4.447 1.00 0.00 C ATOM 939 CG ASN A 137 -9.689 1.800 -4.970 1.00 0.00 C ATOM 940 OD1 ASN A 137 -9.112 2.577 -4.209 1.00 0.00 O ATOM 941 ND2 ASN A 137 -9.831 2.103 -6.231 1.00 0.00 N ATOM 0 H ASN A 137 -9.832 1.951 -2.380 1.00 0.00 H new ATOM 0 HA ASN A 137 -9.820 -0.947 -2.896 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -10.157 -0.290 -5.216 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -11.304 0.584 -4.220 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.464 2.985 -6.588 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -10.309 1.458 -6.860 1.00 0.00 H new ATOM 948 N TYR A 138 -7.345 -1.127 -3.175 1.00 0.00 N ATOM 949 CA TYR A 138 -5.906 -1.260 -3.394 1.00 0.00 C ATOM 950 C TYR A 138 -5.536 -1.131 -4.870 1.00 0.00 C ATOM 951 O TYR A 138 -4.355 -1.049 -5.212 1.00 0.00 O ATOM 952 CB TYR A 138 -5.393 -2.601 -2.857 1.00 0.00 C ATOM 953 CG TYR A 138 -6.121 -3.755 -3.513 1.00 0.00 C ATOM 954 CD1 TYR A 138 -5.737 -4.203 -4.783 1.00 0.00 C ATOM 955 CD2 TYR A 138 -7.171 -4.389 -2.840 1.00 0.00 C ATOM 956 CE1 TYR A 138 -6.407 -5.280 -5.376 1.00 0.00 C ATOM 957 CE2 TYR A 138 -7.837 -5.465 -3.428 1.00 0.00 C ATOM 958 CZ TYR A 138 -7.457 -5.913 -4.698 1.00 0.00 C ATOM 959 OH TYR A 138 -8.114 -6.978 -5.280 1.00 0.00 O ATOM 0 H TYR A 138 -7.795 -1.950 -2.774 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.430 -0.444 -2.850 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -4.322 -2.687 -3.043 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -5.533 -2.643 -1.777 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -4.925 -3.718 -5.305 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -7.468 -4.044 -1.861 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -6.114 -5.623 -6.357 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.646 -5.952 -2.903 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.495 -7.549 -4.581 1.00 0.00 H new ATOM 969 N GLU A 139 -6.534 -1.131 -5.744 1.00 0.00 N ATOM 970 CA GLU A 139 -6.252 -1.032 -7.175 1.00 0.00 C ATOM 971 C GLU A 139 -5.498 0.262 -7.487 1.00 0.00 C ATOM 972 O GLU A 139 -4.484 0.238 -8.186 1.00 0.00 O ATOM 973 CB GLU A 139 -7.558 -1.072 -7.971 1.00 0.00 C ATOM 974 CG GLU A 139 -8.156 -2.478 -7.900 1.00 0.00 C ATOM 975 CD GLU A 139 -9.534 -2.491 -8.551 1.00 0.00 C ATOM 976 OE1 GLU A 139 -10.052 -1.419 -8.817 1.00 0.00 O ATOM 977 OE2 GLU A 139 -10.051 -3.573 -8.777 1.00 0.00 O ATOM 0 H GLU A 139 -7.522 -1.196 -5.500 1.00 0.00 H new ATOM 0 HA GLU A 139 -5.629 -1.879 -7.462 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.263 -0.345 -7.569 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -7.372 -0.796 -9.009 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -7.500 -3.187 -8.404 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -8.232 -2.798 -6.861 1.00 0.00 H new ATOM 984 N GLU A 140 -5.997 1.388 -6.985 1.00 0.00 N ATOM 985 CA GLU A 140 -5.356 2.677 -7.240 1.00 0.00 C ATOM 986 C GLU A 140 -3.927 2.693 -6.702 1.00 0.00 C ATOM 987 O GLU A 140 -3.016 3.201 -7.355 1.00 0.00 O ATOM 988 CB GLU A 140 -6.169 3.798 -6.586 1.00 0.00 C ATOM 989 CG GLU A 140 -5.534 5.156 -6.906 1.00 0.00 C ATOM 990 CD GLU A 140 -6.383 6.277 -6.318 1.00 0.00 C ATOM 991 OE1 GLU A 140 -7.395 5.971 -5.708 1.00 0.00 O ATOM 992 OE2 GLU A 140 -6.010 7.426 -6.486 1.00 0.00 O ATOM 0 H GLU A 140 -6.835 1.436 -6.405 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.318 2.834 -8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -7.197 3.773 -6.948 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -6.207 3.650 -5.507 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.524 5.200 -6.498 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -5.447 5.281 -7.985 1.00 0.00 H new ATOM 999 N PHE A 141 -3.734 2.128 -5.518 1.00 0.00 N ATOM 1000 CA PHE A 141 -2.402 2.084 -4.925 1.00 0.00 C ATOM 1001 C PHE A 141 -1.456 1.308 -5.822 1.00 0.00 C ATOM 1002 O PHE A 141 -0.336 1.741 -6.081 1.00 0.00 O ATOM 1003 CB PHE A 141 -2.452 1.413 -3.553 1.00 0.00 C ATOM 1004 CG PHE A 141 -2.668 2.446 -2.477 1.00 0.00 C ATOM 1005 CD1 PHE A 141 -1.615 3.291 -2.107 1.00 0.00 C ATOM 1006 CD2 PHE A 141 -3.906 2.549 -1.833 1.00 0.00 C ATOM 1007 CE1 PHE A 141 -1.801 4.240 -1.099 1.00 0.00 C ATOM 1008 CE2 PHE A 141 -4.089 3.495 -0.821 1.00 0.00 C ATOM 1009 CZ PHE A 141 -3.037 4.341 -0.454 1.00 0.00 C ATOM 0 H PHE A 141 -4.469 1.700 -4.956 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.044 3.107 -4.814 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -3.256 0.678 -3.529 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -1.522 0.874 -3.369 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.658 3.209 -2.601 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.719 1.898 -2.118 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -0.990 4.896 -0.818 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -5.043 3.573 -0.322 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.180 5.072 0.328 1.00 0.00 H new ATOM 1019 N VAL A 142 -1.916 0.166 -6.304 1.00 0.00 N ATOM 1020 CA VAL A 142 -1.102 -0.651 -7.184 1.00 0.00 C ATOM 1021 C VAL A 142 -0.826 0.076 -8.488 1.00 0.00 C ATOM 1022 O VAL A 142 0.288 0.022 -9.000 1.00 0.00 O ATOM 1023 CB VAL A 142 -1.783 -1.992 -7.448 1.00 0.00 C ATOM 1024 CG1 VAL A 142 -1.033 -2.737 -8.555 1.00 0.00 C ATOM 1025 CG2 VAL A 142 -1.750 -2.831 -6.168 1.00 0.00 C ATOM 0 H VAL A 142 -2.841 -0.213 -6.102 1.00 0.00 H new ATOM 0 HA VAL A 142 -0.148 -0.840 -6.692 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.815 -1.823 -7.756 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.519 -3.694 -8.743 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.043 -2.140 -9.467 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.002 -2.908 -8.244 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -2.235 -3.790 -6.349 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.715 -2.998 -5.869 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -2.277 -2.303 -5.373 1.00 0.00 H new ATOM 1035 N GLN A 143 -1.835 0.761 -9.026 1.00 0.00 N ATOM 1036 CA GLN A 143 -1.647 1.482 -10.276 1.00 0.00 C ATOM 1037 C GLN A 143 -0.519 2.492 -10.114 1.00 0.00 C ATOM 1038 O GLN A 143 0.336 2.624 -10.988 1.00 0.00 O ATOM 1039 CB GLN A 143 -2.942 2.203 -10.666 1.00 0.00 C ATOM 1040 CG GLN A 143 -2.790 2.838 -12.052 1.00 0.00 C ATOM 1041 CD GLN A 143 -2.604 1.756 -13.112 1.00 0.00 C ATOM 1042 OE1 GLN A 143 -1.550 1.679 -13.744 1.00 0.00 O ATOM 1043 NE2 GLN A 143 -3.569 0.909 -13.343 1.00 0.00 N ATOM 0 H GLN A 143 -2.770 0.829 -8.624 1.00 0.00 H new ATOM 0 HA GLN A 143 -1.388 0.775 -11.064 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.774 1.498 -10.669 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -3.177 2.971 -9.929 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -3.671 3.437 -12.284 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -1.935 3.514 -12.058 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -4.441 0.974 -12.818 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -3.451 0.181 -14.048 1.00 0.00 H new ATOM 1052 N MET A 144 -0.516 3.200 -8.988 1.00 0.00 N ATOM 1053 CA MET A 144 0.530 4.182 -8.742 1.00 0.00 C ATOM 1054 C MET A 144 1.887 3.488 -8.746 1.00 0.00 C ATOM 1055 O MET A 144 2.868 4.019 -9.266 1.00 0.00 O ATOM 1056 CB MET A 144 0.322 4.882 -7.387 1.00 0.00 C ATOM 1057 CG MET A 144 -0.895 5.813 -7.449 1.00 0.00 C ATOM 1058 SD MET A 144 -0.882 6.947 -6.027 1.00 0.00 S ATOM 1059 CE MET A 144 -1.376 5.789 -4.724 1.00 0.00 C ATOM 0 H MET A 144 -1.211 3.114 -8.247 1.00 0.00 H new ATOM 0 HA MET A 144 0.489 4.933 -9.531 1.00 0.00 H new ATOM 0 HB2 MET A 144 0.179 4.138 -6.604 1.00 0.00 H new ATOM 0 HB3 MET A 144 1.212 5.454 -7.125 1.00 0.00 H new ATOM 0 HG2 MET A 144 -0.881 6.382 -8.379 1.00 0.00 H new ATOM 0 HG3 MET A 144 -1.813 5.226 -7.448 1.00 0.00 H new ATOM 0 HE1 MET A 144 -1.353 6.296 -3.759 1.00 0.00 H new ATOM 0 HE2 MET A 144 -2.386 5.429 -4.921 1.00 0.00 H new ATOM 0 HE3 MET A 144 -0.687 4.945 -4.707 1.00 0.00 H new ATOM 1069 N MET A 145 1.932 2.300 -8.154 1.00 0.00 N ATOM 1070 CA MET A 145 3.168 1.529 -8.079 1.00 0.00 C ATOM 1071 C MET A 145 3.555 0.934 -9.435 1.00 0.00 C ATOM 1072 O MET A 145 4.707 0.554 -9.642 1.00 0.00 O ATOM 1073 CB MET A 145 3.007 0.416 -7.043 1.00 0.00 C ATOM 1074 CG MET A 145 2.831 1.055 -5.668 1.00 0.00 C ATOM 1075 SD MET A 145 2.621 -0.232 -4.419 1.00 0.00 S ATOM 1076 CE MET A 145 2.200 0.864 -3.045 1.00 0.00 C ATOM 0 H MET A 145 1.127 1.849 -7.719 1.00 0.00 H new ATOM 0 HA MET A 145 3.971 2.204 -7.781 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.144 -0.205 -7.285 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.881 -0.236 -7.049 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.699 1.669 -5.428 1.00 0.00 H new ATOM 0 HG3 MET A 145 1.964 1.716 -5.672 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.806 0.608 -2.176 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.395 1.898 -3.331 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.145 0.749 -2.798 1.00 0.00 H new ATOM 1086 N THR A 146 2.598 0.859 -10.356 1.00 0.00 N ATOM 1087 CA THR A 146 2.872 0.311 -11.684 1.00 0.00 C ATOM 1088 C THR A 146 3.143 1.435 -12.683 1.00 0.00 C ATOM 1089 O THR A 146 2.979 1.260 -13.891 1.00 0.00 O ATOM 1090 CB THR A 146 1.685 -0.538 -12.170 1.00 0.00 C ATOM 1091 OG1 THR A 146 0.611 -0.414 -11.256 1.00 0.00 O ATOM 1092 CG2 THR A 146 2.086 -2.013 -12.287 1.00 0.00 C ATOM 0 H THR A 146 1.636 1.166 -10.212 1.00 0.00 H new ATOM 0 HA THR A 146 3.757 -0.321 -11.614 1.00 0.00 H new ATOM 0 HB THR A 146 1.380 -0.180 -13.153 1.00 0.00 H new ATOM 0 HG1 THR A 146 0.888 -0.751 -10.378 1.00 0.00 H new ATOM 0 HG21 THR A 146 1.232 -2.596 -12.632 1.00 0.00 H new ATOM 0 HG22 THR A 146 2.905 -2.112 -13.000 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.407 -2.381 -11.312 1.00 0.00 H new ATOM 1100 N ALA A 147 3.573 2.587 -12.176 1.00 0.00 N ATOM 1101 CA ALA A 147 3.872 3.726 -13.036 1.00 0.00 C ATOM 1102 C ALA A 147 5.215 4.336 -12.657 1.00 0.00 C ATOM 1103 O ALA A 147 6.268 3.758 -12.926 1.00 0.00 O ATOM 1104 CB ALA A 147 2.773 4.781 -12.904 1.00 0.00 C ATOM 0 H ALA A 147 3.721 2.755 -11.181 1.00 0.00 H new ATOM 0 HA ALA A 147 3.919 3.381 -14.069 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.003 5.629 -13.549 1.00 0.00 H new ATOM 0 HB2 ALA A 147 1.817 4.349 -13.199 1.00 0.00 H new ATOM 0 HB3 ALA A 147 2.715 5.118 -11.869 1.00 0.00 H new ATOM 1110 N LYS A 148 5.165 5.505 -12.031 1.00 0.00 N ATOM 1111 CA LYS A 148 6.382 6.195 -11.611 1.00 0.00 C ATOM 1112 C LYS A 148 7.401 5.198 -11.068 1.00 0.00 C ATOM 1113 O LYS A 148 7.026 4.395 -10.230 1.00 0.00 O ATOM 1114 CB LYS A 148 6.054 7.225 -10.525 1.00 0.00 C ATOM 1115 CG LYS A 148 4.994 8.216 -11.028 1.00 0.00 C ATOM 1116 CD LYS A 148 5.644 9.288 -11.911 1.00 0.00 C ATOM 1117 CE LYS A 148 4.603 10.348 -12.270 1.00 0.00 C ATOM 1118 NZ LYS A 148 3.562 9.745 -13.150 1.00 0.00 N ATOM 1119 OXT LYS A 148 8.541 5.253 -11.498 1.00 0.00 O ATOM 0 H LYS A 148 4.300 5.995 -11.803 1.00 0.00 H new ATOM 0 HA LYS A 148 6.805 6.701 -12.478 1.00 0.00 H new ATOM 0 HB2 LYS A 148 5.691 6.717 -9.631 1.00 0.00 H new ATOM 0 HB3 LYS A 148 6.958 7.763 -10.241 1.00 0.00 H new ATOM 0 HG2 LYS A 148 4.229 7.684 -11.594 1.00 0.00 H new ATOM 0 HG3 LYS A 148 4.495 8.687 -10.181 1.00 0.00 H new ATOM 0 HD2 LYS A 148 6.482 9.748 -11.387 1.00 0.00 H new ATOM 0 HD3 LYS A 148 6.045 8.834 -12.817 1.00 0.00 H new ATOM 0 HE2 LYS A 148 4.144 10.743 -11.364 1.00 0.00 H new ATOM 0 HE3 LYS A 148 5.082 11.186 -12.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 2.994 10.501 -13.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 4.021 9.184 -13.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 2.944 9.129 -12.584 1.00 0.00 H new TER 1133 LYS A 148 ATOM 1134 N PHE B 30 -9.516 -4.820 11.720 1.00 0.00 N ATOM 1135 CA PHE B 30 -8.431 -5.132 10.748 1.00 0.00 C ATOM 1136 C PHE B 30 -8.655 -6.529 10.177 1.00 0.00 C ATOM 1137 O PHE B 30 -8.606 -6.730 8.964 1.00 0.00 O ATOM 1138 CB PHE B 30 -7.079 -5.067 11.461 1.00 0.00 C ATOM 1139 CG PHE B 30 -7.136 -4.020 12.549 1.00 0.00 C ATOM 1140 CD1 PHE B 30 -7.481 -2.700 12.233 1.00 0.00 C ATOM 1141 CD2 PHE B 30 -6.848 -4.368 13.875 1.00 0.00 C ATOM 1142 CE1 PHE B 30 -7.537 -1.730 13.240 1.00 0.00 C ATOM 1143 CE2 PHE B 30 -6.904 -3.397 14.882 1.00 0.00 C ATOM 1144 CZ PHE B 30 -7.248 -2.077 14.565 1.00 0.00 C ATOM 0 HA PHE B 30 -8.440 -4.407 9.935 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -6.834 -6.039 11.889 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -6.291 -4.824 10.748 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -7.704 -2.430 11.211 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -6.583 -5.386 14.121 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -7.803 -0.713 12.995 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -6.682 -3.666 15.904 1.00 0.00 H new ATOM 0 HZ PHE B 30 -7.290 -1.328 15.342 1.00 0.00 H new ATOM 1154 N ASP B 31 -8.908 -7.488 11.062 1.00 0.00 N ATOM 1155 CA ASP B 31 -9.146 -8.863 10.640 1.00 0.00 C ATOM 1156 C ASP B 31 -7.994 -9.384 9.786 1.00 0.00 C ATOM 1157 O ASP B 31 -8.215 -9.970 8.726 1.00 0.00 O ATOM 1158 CB ASP B 31 -10.448 -8.942 9.841 1.00 0.00 C ATOM 1159 CG ASP B 31 -10.846 -10.400 9.633 1.00 0.00 C ATOM 1160 OD1 ASP B 31 -10.020 -11.261 9.887 1.00 0.00 O ATOM 1161 OD2 ASP B 31 -11.972 -10.633 9.224 1.00 0.00 O ATOM 0 H ASP B 31 -8.953 -7.339 12.070 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.222 -9.483 11.533 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -11.241 -8.412 10.369 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -10.323 -8.450 8.877 1.00 0.00 H new ATOM 1166 N ILE B 32 -6.765 -9.173 10.255 1.00 0.00 N ATOM 1167 CA ILE B 32 -5.588 -9.633 9.524 1.00 0.00 C ATOM 1168 C ILE B 32 -4.661 -10.396 10.458 1.00 0.00 C ATOM 1169 O ILE B 32 -4.778 -10.297 11.680 1.00 0.00 O ATOM 1170 CB ILE B 32 -4.843 -8.438 8.913 1.00 0.00 C ATOM 1171 CG1 ILE B 32 -3.922 -7.790 9.951 1.00 0.00 C ATOM 1172 CG2 ILE B 32 -5.862 -7.403 8.454 1.00 0.00 C ATOM 1173 CD1 ILE B 32 -3.418 -6.449 9.415 1.00 0.00 C ATOM 0 H ILE B 32 -6.560 -8.691 11.130 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.911 -10.296 8.721 1.00 0.00 H new ATOM 0 HB ILE B 32 -4.243 -8.789 8.073 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -4.459 -7.641 10.888 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -3.080 -8.447 10.167 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -5.343 -6.550 8.018 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -6.521 -7.847 7.707 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -6.453 -7.071 9.308 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -2.762 -5.986 10.152 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -2.866 -6.611 8.489 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.266 -5.793 9.221 1.00 0.00 H new ATOM 1185 N ASP B 33 -3.736 -11.151 9.883 1.00 0.00 N ATOM 1186 CA ASP B 33 -2.792 -11.913 10.686 1.00 0.00 C ATOM 1187 C ASP B 33 -1.542 -11.083 10.959 1.00 0.00 C ATOM 1188 O ASP B 33 -0.513 -11.262 10.309 1.00 0.00 O ATOM 1189 CB ASP B 33 -2.408 -13.204 9.961 1.00 0.00 C ATOM 1190 CG ASP B 33 -3.656 -14.035 9.683 1.00 0.00 C ATOM 1191 OD1 ASP B 33 -4.451 -14.193 10.594 1.00 0.00 O ATOM 1192 OD2 ASP B 33 -3.796 -14.501 8.564 1.00 0.00 O ATOM 0 H ASP B 33 -3.620 -11.252 8.875 1.00 0.00 H new ATOM 0 HA ASP B 33 -3.265 -12.164 11.635 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -1.901 -12.969 9.025 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -1.707 -13.777 10.568 1.00 0.00 H new ATOM 1197 N MET B 34 -1.636 -10.177 11.928 1.00 0.00 N ATOM 1198 CA MET B 34 -0.503 -9.328 12.276 1.00 0.00 C ATOM 1199 C MET B 34 0.666 -10.173 12.770 1.00 0.00 C ATOM 1200 O MET B 34 1.825 -9.879 12.481 1.00 0.00 O ATOM 1201 CB MET B 34 -0.894 -8.325 13.363 1.00 0.00 C ATOM 1202 CG MET B 34 -1.833 -7.273 12.775 1.00 0.00 C ATOM 1203 SD MET B 34 -2.287 -6.086 14.062 1.00 0.00 S ATOM 1204 CE MET B 34 -3.118 -4.894 12.985 1.00 0.00 C ATOM 0 H MET B 34 -2.477 -10.013 12.481 1.00 0.00 H new ATOM 0 HA MET B 34 -0.203 -8.786 11.379 1.00 0.00 H new ATOM 0 HB2 MET B 34 -1.382 -8.841 14.190 1.00 0.00 H new ATOM 0 HB3 MET B 34 -0.003 -7.846 13.768 1.00 0.00 H new ATOM 0 HG2 MET B 34 -1.347 -6.759 11.946 1.00 0.00 H new ATOM 0 HG3 MET B 34 -2.727 -7.751 12.374 1.00 0.00 H new ATOM 0 HE1 MET B 34 -3.818 -4.299 13.572 1.00 0.00 H new ATOM 0 HE2 MET B 34 -2.377 -4.237 12.529 1.00 0.00 H new ATOM 0 HE3 MET B 34 -3.661 -5.426 12.204 1.00 0.00 H new ATOM 1214 N ASP B 35 0.346 -11.216 13.524 1.00 0.00 N ATOM 1215 CA ASP B 35 1.370 -12.100 14.067 1.00 0.00 C ATOM 1216 C ASP B 35 2.165 -12.759 12.946 1.00 0.00 C ATOM 1217 O ASP B 35 3.379 -12.933 13.057 1.00 0.00 O ATOM 1218 CB ASP B 35 0.722 -13.179 14.937 1.00 0.00 C ATOM 1219 CG ASP B 35 1.800 -14.028 15.601 1.00 0.00 C ATOM 1220 OD1 ASP B 35 2.522 -13.495 16.427 1.00 0.00 O ATOM 1221 OD2 ASP B 35 1.887 -15.201 15.274 1.00 0.00 O ATOM 0 H ASP B 35 -0.610 -11.470 13.773 1.00 0.00 H new ATOM 0 HA ASP B 35 2.050 -11.502 14.674 1.00 0.00 H new ATOM 0 HB2 ASP B 35 0.092 -12.716 15.697 1.00 0.00 H new ATOM 0 HB3 ASP B 35 0.075 -13.809 14.327 1.00 0.00 H new ATOM 1226 N ALA B 36 1.480 -13.131 11.871 1.00 0.00 N ATOM 1227 CA ALA B 36 2.150 -13.777 10.750 1.00 0.00 C ATOM 1228 C ALA B 36 3.236 -12.852 10.169 1.00 0.00 C ATOM 1229 O ALA B 36 2.926 -11.733 9.761 1.00 0.00 O ATOM 1230 CB ALA B 36 1.126 -14.088 9.656 1.00 0.00 C ATOM 0 H ALA B 36 0.476 -12.999 11.752 1.00 0.00 H new ATOM 0 HA ALA B 36 2.614 -14.698 11.103 1.00 0.00 H new ATOM 0 HB1 ALA B 36 1.626 -14.571 8.817 1.00 0.00 H new ATOM 0 HB2 ALA B 36 0.359 -14.753 10.054 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.662 -13.161 9.318 1.00 0.00 H new ATOM 1236 N PRO B 37 4.490 -13.277 10.098 1.00 0.00 N ATOM 1237 CA PRO B 37 5.583 -12.425 9.524 1.00 0.00 C ATOM 1238 C PRO B 37 5.238 -11.876 8.141 1.00 0.00 C ATOM 1239 O PRO B 37 5.697 -10.799 7.762 1.00 0.00 O ATOM 1240 CB PRO B 37 6.769 -13.384 9.419 1.00 0.00 C ATOM 1241 CG PRO B 37 6.536 -14.397 10.479 1.00 0.00 C ATOM 1242 CD PRO B 37 5.024 -14.579 10.561 1.00 0.00 C ATOM 0 HA PRO B 37 5.770 -11.548 10.144 1.00 0.00 H new ATOM 0 HB2 PRO B 37 6.817 -13.847 8.433 1.00 0.00 H new ATOM 0 HB3 PRO B 37 7.714 -12.862 9.572 1.00 0.00 H new ATOM 0 HG2 PRO B 37 7.030 -15.338 10.235 1.00 0.00 H new ATOM 0 HG3 PRO B 37 6.941 -14.063 11.434 1.00 0.00 H new ATOM 0 HD2 PRO B 37 4.684 -15.399 9.929 1.00 0.00 H new ATOM 0 HD3 PRO B 37 4.702 -14.806 11.577 1.00 0.00 H new ATOM 1250 N GLU B 38 4.449 -12.631 7.386 1.00 0.00 N ATOM 1251 CA GLU B 38 4.077 -12.215 6.038 1.00 0.00 C ATOM 1252 C GLU B 38 3.317 -10.891 6.060 1.00 0.00 C ATOM 1253 O GLU B 38 3.531 -10.036 5.203 1.00 0.00 O ATOM 1254 CB GLU B 38 3.207 -13.289 5.383 1.00 0.00 C ATOM 1255 CG GLU B 38 4.047 -14.541 5.120 1.00 0.00 C ATOM 1256 CD GLU B 38 5.066 -14.265 4.020 1.00 0.00 C ATOM 1257 OE1 GLU B 38 4.889 -13.293 3.305 1.00 0.00 O ATOM 1258 OE2 GLU B 38 6.010 -15.031 3.908 1.00 0.00 O ATOM 0 H GLU B 38 4.057 -13.526 7.680 1.00 0.00 H new ATOM 0 HA GLU B 38 4.993 -12.079 5.462 1.00 0.00 H new ATOM 0 HB2 GLU B 38 2.365 -13.533 6.030 1.00 0.00 H new ATOM 0 HB3 GLU B 38 2.792 -12.914 4.447 1.00 0.00 H new ATOM 0 HG2 GLU B 38 4.559 -14.844 6.033 1.00 0.00 H new ATOM 0 HG3 GLU B 38 3.400 -15.368 4.828 1.00 0.00 H new ATOM 1265 N THR B 39 2.432 -10.724 7.038 1.00 0.00 N ATOM 1266 CA THR B 39 1.661 -9.490 7.134 1.00 0.00 C ATOM 1267 C THR B 39 2.586 -8.297 7.348 1.00 0.00 C ATOM 1268 O THR B 39 2.446 -7.266 6.689 1.00 0.00 O ATOM 1269 CB THR B 39 0.661 -9.577 8.289 1.00 0.00 C ATOM 1270 OG1 THR B 39 -0.239 -10.650 8.051 1.00 0.00 O ATOM 1271 CG2 THR B 39 -0.121 -8.266 8.390 1.00 0.00 C ATOM 0 H THR B 39 2.233 -11.414 7.763 1.00 0.00 H new ATOM 0 HA THR B 39 1.118 -9.354 6.199 1.00 0.00 H new ATOM 0 HB THR B 39 1.197 -9.750 9.223 1.00 0.00 H new ATOM 0 HG1 THR B 39 -0.230 -11.261 8.817 1.00 0.00 H new ATOM 0 HG21 THR B 39 -0.833 -8.329 9.213 1.00 0.00 H new ATOM 0 HG22 THR B 39 0.570 -7.443 8.571 1.00 0.00 H new ATOM 0 HG23 THR B 39 -0.658 -8.090 7.458 1.00 0.00 H new ATOM 1279 N GLU B 40 3.533 -8.442 8.269 1.00 0.00 N ATOM 1280 CA GLU B 40 4.475 -7.366 8.551 1.00 0.00 C ATOM 1281 C GLU B 40 5.329 -7.076 7.321 1.00 0.00 C ATOM 1282 O GLU B 40 5.585 -5.919 6.988 1.00 0.00 O ATOM 1283 CB GLU B 40 5.378 -7.757 9.722 1.00 0.00 C ATOM 1284 CG GLU B 40 4.563 -7.768 11.015 1.00 0.00 C ATOM 1285 CD GLU B 40 5.401 -8.334 12.156 1.00 0.00 C ATOM 1286 OE1 GLU B 40 6.441 -8.906 11.874 1.00 0.00 O ATOM 1287 OE2 GLU B 40 4.991 -8.188 13.295 1.00 0.00 O ATOM 0 H GLU B 40 3.668 -9.285 8.827 1.00 0.00 H new ATOM 0 HA GLU B 40 3.913 -6.470 8.812 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.814 -8.741 9.546 1.00 0.00 H new ATOM 0 HB3 GLU B 40 6.205 -7.053 9.808 1.00 0.00 H new ATOM 0 HG2 GLU B 40 4.239 -6.756 11.258 1.00 0.00 H new ATOM 0 HG3 GLU B 40 3.663 -8.368 10.882 1.00 0.00 H new ATOM 1294 N ARG B 41 5.761 -8.138 6.648 1.00 0.00 N ATOM 1295 CA ARG B 41 6.580 -7.993 5.450 1.00 0.00 C ATOM 1296 C ARG B 41 5.779 -7.322 4.339 1.00 0.00 C ATOM 1297 O ARG B 41 6.306 -6.500 3.590 1.00 0.00 O ATOM 1298 CB ARG B 41 7.069 -9.368 4.979 1.00 0.00 C ATOM 1299 CG ARG B 41 8.056 -9.961 5.997 1.00 0.00 C ATOM 1300 CD ARG B 41 9.466 -9.400 5.766 1.00 0.00 C ATOM 1301 NE ARG B 41 10.405 -10.004 6.706 1.00 0.00 N ATOM 1302 CZ ARG B 41 11.687 -9.655 6.717 1.00 0.00 C ATOM 1303 NH1 ARG B 41 12.125 -8.758 5.876 1.00 0.00 N ATOM 1304 NH2 ARG B 41 12.508 -10.207 7.569 1.00 0.00 N ATOM 0 H ARG B 41 5.559 -9.103 6.910 1.00 0.00 H new ATOM 0 HA ARG B 41 7.441 -7.369 5.690 1.00 0.00 H new ATOM 0 HB2 ARG B 41 6.220 -10.040 4.852 1.00 0.00 H new ATOM 0 HB3 ARG B 41 7.551 -9.276 4.006 1.00 0.00 H new ATOM 0 HG2 ARG B 41 7.727 -9.729 7.010 1.00 0.00 H new ATOM 0 HG3 ARG B 41 8.071 -11.047 5.908 1.00 0.00 H new ATOM 0 HD2 ARG B 41 9.783 -9.601 4.743 1.00 0.00 H new ATOM 0 HD3 ARG B 41 9.460 -8.317 5.891 1.00 0.00 H new ATOM 0 HE ARG B 41 10.071 -10.706 7.366 1.00 0.00 H new ATOM 0 HH11 ARG B 41 11.483 -8.326 5.211 1.00 0.00 H new ATOM 0 HH12 ARG B 41 13.109 -8.489 5.884 1.00 0.00 H new ATOM 0 HH21 ARG B 41 12.165 -10.907 8.227 1.00 0.00 H new ATOM 0 HH22 ARG B 41 13.492 -9.938 7.576 1.00 0.00 H new ATOM 1318 N ALA B 42 4.503 -7.681 4.239 1.00 0.00 N ATOM 1319 CA ALA B 42 3.639 -7.108 3.215 1.00 0.00 C ATOM 1320 C ALA B 42 3.540 -5.598 3.393 1.00 0.00 C ATOM 1321 O ALA B 42 3.562 -4.844 2.420 1.00 0.00 O ATOM 1322 CB ALA B 42 2.244 -7.727 3.309 1.00 0.00 C ATOM 0 H ALA B 42 4.048 -8.360 4.849 1.00 0.00 H new ATOM 0 HA ALA B 42 4.066 -7.323 2.235 1.00 0.00 H new ATOM 0 HB1 ALA B 42 1.602 -7.295 2.541 1.00 0.00 H new ATOM 0 HB2 ALA B 42 2.313 -8.805 3.160 1.00 0.00 H new ATOM 0 HB3 ALA B 42 1.821 -7.523 4.293 1.00 0.00 H new ATOM 1328 N ALA B 43 3.437 -5.165 4.644 1.00 0.00 N ATOM 1329 CA ALA B 43 3.342 -3.743 4.945 1.00 0.00 C ATOM 1330 C ALA B 43 4.599 -3.020 4.472 1.00 0.00 C ATOM 1331 O ALA B 43 4.532 -1.907 3.953 1.00 0.00 O ATOM 1332 CB ALA B 43 3.172 -3.539 6.454 1.00 0.00 C ATOM 0 H ALA B 43 3.417 -5.775 5.462 1.00 0.00 H new ATOM 0 HA ALA B 43 2.477 -3.333 4.425 1.00 0.00 H new ATOM 0 HB1 ALA B 43 3.102 -2.473 6.671 1.00 0.00 H new ATOM 0 HB2 ALA B 43 2.263 -4.038 6.789 1.00 0.00 H new ATOM 0 HB3 ALA B 43 4.031 -3.960 6.977 1.00 0.00 H new ATOM 1338 N VAL B 44 5.746 -3.660 4.668 1.00 0.00 N ATOM 1339 CA VAL B 44 7.022 -3.074 4.275 1.00 0.00 C ATOM 1340 C VAL B 44 7.090 -2.833 2.766 1.00 0.00 C ATOM 1341 O VAL B 44 7.529 -1.773 2.323 1.00 0.00 O ATOM 1342 CB VAL B 44 8.163 -4.003 4.690 1.00 0.00 C ATOM 1343 CG1 VAL B 44 9.477 -3.497 4.095 1.00 0.00 C ATOM 1344 CG2 VAL B 44 8.269 -4.034 6.216 1.00 0.00 C ATOM 0 H VAL B 44 5.819 -4.583 5.096 1.00 0.00 H new ATOM 0 HA VAL B 44 7.117 -2.112 4.778 1.00 0.00 H new ATOM 0 HB VAL B 44 7.963 -5.009 4.321 1.00 0.00 H new ATOM 0 HG11 VAL B 44 10.290 -4.160 4.391 1.00 0.00 H new ATOM 0 HG12 VAL B 44 9.401 -3.479 3.008 1.00 0.00 H new ATOM 0 HG13 VAL B 44 9.678 -2.490 4.461 1.00 0.00 H new ATOM 0 HG21 VAL B 44 9.083 -4.697 6.511 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.467 -3.029 6.587 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.333 -4.399 6.638 1.00 0.00 H new ATOM 1354 N ALA B 45 6.672 -3.824 1.981 1.00 0.00 N ATOM 1355 CA ALA B 45 6.719 -3.696 0.526 1.00 0.00 C ATOM 1356 C ALA B 45 5.855 -2.536 0.042 1.00 0.00 C ATOM 1357 O ALA B 45 6.292 -1.729 -0.778 1.00 0.00 O ATOM 1358 CB ALA B 45 6.236 -4.994 -0.124 1.00 0.00 C ATOM 0 H ALA B 45 6.302 -4.712 2.321 1.00 0.00 H new ATOM 0 HA ALA B 45 7.752 -3.498 0.240 1.00 0.00 H new ATOM 0 HB1 ALA B 45 6.273 -4.893 -1.209 1.00 0.00 H new ATOM 0 HB2 ALA B 45 6.879 -5.818 0.186 1.00 0.00 H new ATOM 0 HB3 ALA B 45 5.211 -5.197 0.187 1.00 0.00 H new ATOM 1364 N ILE B 46 4.635 -2.446 0.552 1.00 0.00 N ATOM 1365 CA ILE B 46 3.741 -1.367 0.154 1.00 0.00 C ATOM 1366 C ILE B 46 4.305 -0.019 0.585 1.00 0.00 C ATOM 1367 O ILE B 46 4.327 0.937 -0.191 1.00 0.00 O ATOM 1368 CB ILE B 46 2.361 -1.588 0.770 1.00 0.00 C ATOM 1369 CG1 ILE B 46 1.718 -2.809 0.109 1.00 0.00 C ATOM 1370 CG2 ILE B 46 1.480 -0.358 0.537 1.00 0.00 C ATOM 1371 CD1 ILE B 46 0.482 -3.222 0.900 1.00 0.00 C ATOM 0 H ILE B 46 4.245 -3.097 1.233 1.00 0.00 H new ATOM 0 HA ILE B 46 3.650 -1.366 -0.932 1.00 0.00 H new ATOM 0 HB ILE B 46 2.461 -1.751 1.843 1.00 0.00 H new ATOM 0 HG12 ILE B 46 1.444 -2.577 -0.920 1.00 0.00 H new ATOM 0 HG13 ILE B 46 2.431 -3.633 0.071 1.00 0.00 H new ATOM 0 HG21 ILE B 46 0.498 -0.525 0.980 1.00 0.00 H new ATOM 0 HG22 ILE B 46 1.943 0.514 0.999 1.00 0.00 H new ATOM 0 HG23 ILE B 46 1.371 -0.186 -0.534 1.00 0.00 H new ATOM 0 HD11 ILE B 46 0.023 -4.092 0.430 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.770 -3.471 1.921 1.00 0.00 H new ATOM 0 HD13 ILE B 46 -0.232 -2.399 0.915 1.00 0.00 H new ATOM 1383 N GLN B 47 4.760 0.045 1.830 1.00 0.00 N ATOM 1384 CA GLN B 47 5.327 1.274 2.371 1.00 0.00 C ATOM 1385 C GLN B 47 6.607 1.656 1.637 1.00 0.00 C ATOM 1386 O GLN B 47 6.838 2.829 1.345 1.00 0.00 O ATOM 1387 CB GLN B 47 5.632 1.073 3.852 1.00 0.00 C ATOM 1388 CG GLN B 47 4.324 0.978 4.635 1.00 0.00 C ATOM 1389 CD GLN B 47 4.616 0.530 6.058 1.00 0.00 C ATOM 1390 OE1 GLN B 47 5.533 -0.261 6.278 1.00 0.00 O ATOM 1391 NE2 GLN B 47 3.899 0.998 7.043 1.00 0.00 N ATOM 0 H GLN B 47 4.748 -0.738 2.483 1.00 0.00 H new ATOM 0 HA GLN B 47 4.604 2.079 2.240 1.00 0.00 H new ATOM 0 HB2 GLN B 47 6.219 0.165 3.993 1.00 0.00 H new ATOM 0 HB3 GLN B 47 6.232 1.902 4.226 1.00 0.00 H new ATOM 0 HG2 GLN B 47 3.822 1.945 4.643 1.00 0.00 H new ATOM 0 HG3 GLN B 47 3.649 0.272 4.151 1.00 0.00 H new ATOM 0 HE21 GLN B 47 3.140 1.653 6.855 1.00 0.00 H new ATOM 0 HE22 GLN B 47 4.097 0.709 8.001 1.00 0.00 H new ATOM 1400 N SER B 48 7.437 0.660 1.343 1.00 0.00 N ATOM 1401 CA SER B 48 8.691 0.912 0.645 1.00 0.00 C ATOM 1402 C SER B 48 8.421 1.487 -0.737 1.00 0.00 C ATOM 1403 O SER B 48 9.087 2.424 -1.174 1.00 0.00 O ATOM 1404 CB SER B 48 9.486 -0.387 0.515 1.00 0.00 C ATOM 1405 OG SER B 48 9.874 -0.832 1.808 1.00 0.00 O ATOM 0 H SER B 48 7.266 -0.319 1.575 1.00 0.00 H new ATOM 0 HA SER B 48 9.271 1.633 1.221 1.00 0.00 H new ATOM 0 HB2 SER B 48 8.882 -1.149 0.022 1.00 0.00 H new ATOM 0 HB3 SER B 48 10.367 -0.227 -0.107 1.00 0.00 H new ATOM 0 HG SER B 48 9.075 -1.004 2.348 1.00 0.00 H new ATOM 1411 N GLN B 49 7.431 0.923 -1.417 1.00 0.00 N ATOM 1412 CA GLN B 49 7.069 1.388 -2.747 1.00 0.00 C ATOM 1413 C GLN B 49 6.458 2.786 -2.690 1.00 0.00 C ATOM 1414 O GLN B 49 6.699 3.612 -3.571 1.00 0.00 O ATOM 1415 CB GLN B 49 6.083 0.412 -3.390 1.00 0.00 C ATOM 1416 CG GLN B 49 6.839 -0.538 -4.322 1.00 0.00 C ATOM 1417 CD GLN B 49 7.925 -1.285 -3.553 1.00 0.00 C ATOM 1418 OE1 GLN B 49 9.111 -0.995 -3.714 1.00 0.00 O ATOM 1419 NE2 GLN B 49 7.591 -2.240 -2.731 1.00 0.00 N ATOM 0 H GLN B 49 6.868 0.147 -1.070 1.00 0.00 H new ATOM 0 HA GLN B 49 7.975 1.436 -3.351 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.562 -0.156 -2.619 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.325 0.960 -3.949 1.00 0.00 H new ATOM 0 HG2 GLN B 49 6.144 -1.250 -4.767 1.00 0.00 H new ATOM 0 HG3 GLN B 49 7.286 0.025 -5.141 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.608 -2.479 -2.599 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.312 -2.748 -2.220 1.00 0.00 H new ATOM 1428 N PHE B 50 5.665 3.047 -1.653 1.00 0.00 N ATOM 1429 CA PHE B 50 5.029 4.353 -1.504 1.00 0.00 C ATOM 1430 C PHE B 50 6.069 5.464 -1.413 1.00 0.00 C ATOM 1431 O PHE B 50 5.958 6.482 -2.095 1.00 0.00 O ATOM 1432 CB PHE B 50 4.120 4.378 -0.268 1.00 0.00 C ATOM 1433 CG PHE B 50 3.616 5.788 -0.036 1.00 0.00 C ATOM 1434 CD1 PHE B 50 2.872 6.441 -1.030 1.00 0.00 C ATOM 1435 CD2 PHE B 50 3.911 6.454 1.165 1.00 0.00 C ATOM 1436 CE1 PHE B 50 2.420 7.751 -0.823 1.00 0.00 C ATOM 1437 CE2 PHE B 50 3.460 7.766 1.367 1.00 0.00 C ATOM 1438 CZ PHE B 50 2.716 8.414 0.374 1.00 0.00 C ATOM 0 H PHE B 50 5.449 2.380 -0.912 1.00 0.00 H new ATOM 0 HA PHE B 50 4.419 4.526 -2.390 1.00 0.00 H new ATOM 0 HB2 PHE B 50 3.279 3.699 -0.409 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.669 4.029 0.607 1.00 0.00 H new ATOM 0 HD1 PHE B 50 2.647 5.933 -1.956 1.00 0.00 H new ATOM 0 HD2 PHE B 50 4.485 5.956 1.932 1.00 0.00 H new ATOM 0 HE1 PHE B 50 1.843 8.250 -1.588 1.00 0.00 H new ATOM 0 HE2 PHE B 50 3.687 8.278 2.291 1.00 0.00 H new ATOM 0 HZ PHE B 50 2.370 9.425 0.531 1.00 0.00 H new ATOM 1448 N ARG B 51 7.078 5.274 -0.567 1.00 0.00 N ATOM 1449 CA ARG B 51 8.115 6.287 -0.413 1.00 0.00 C ATOM 1450 C ARG B 51 8.850 6.505 -1.734 1.00 0.00 C ATOM 1451 O ARG B 51 9.146 7.639 -2.106 1.00 0.00 O ATOM 1452 CB ARG B 51 9.114 5.864 0.665 1.00 0.00 C ATOM 1453 CG ARG B 51 8.442 5.921 2.038 1.00 0.00 C ATOM 1454 CD ARG B 51 9.404 5.386 3.101 1.00 0.00 C ATOM 1455 NE ARG B 51 9.632 3.959 2.909 1.00 0.00 N ATOM 1456 CZ ARG B 51 10.511 3.299 3.658 1.00 0.00 C ATOM 1457 NH1 ARG B 51 11.192 3.932 4.574 1.00 0.00 N ATOM 1458 NH2 ARG B 51 10.696 2.020 3.476 1.00 0.00 N ATOM 0 H ARG B 51 7.198 4.443 0.012 1.00 0.00 H new ATOM 0 HA ARG B 51 7.638 7.220 -0.114 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.473 4.854 0.466 1.00 0.00 H new ATOM 0 HB3 ARG B 51 9.984 6.521 0.647 1.00 0.00 H new ATOM 0 HG2 ARG B 51 8.158 6.947 2.273 1.00 0.00 H new ATOM 0 HG3 ARG B 51 7.526 5.330 2.031 1.00 0.00 H new ATOM 0 HD2 ARG B 51 10.351 5.923 3.046 1.00 0.00 H new ATOM 0 HD3 ARG B 51 8.993 5.565 4.095 1.00 0.00 H new ATOM 0 HE ARG B 51 9.110 3.459 2.189 1.00 0.00 H new ATOM 0 HH11 ARG B 51 11.050 4.932 4.715 1.00 0.00 H new ATOM 0 HH12 ARG B 51 11.866 3.427 5.149 1.00 0.00 H new ATOM 0 HH21 ARG B 51 10.166 1.525 2.759 1.00 0.00 H new ATOM 0 HH22 ARG B 51 11.370 1.515 4.051 1.00 0.00 H new ATOM 1472 N LYS B 52 9.126 5.416 -2.445 1.00 0.00 N ATOM 1473 CA LYS B 52 9.812 5.511 -3.730 1.00 0.00 C ATOM 1474 C LYS B 52 8.963 6.295 -4.723 1.00 0.00 C ATOM 1475 O LYS B 52 9.479 7.081 -5.518 1.00 0.00 O ATOM 1476 CB LYS B 52 10.092 4.114 -4.286 1.00 0.00 C ATOM 1477 CG LYS B 52 11.171 3.433 -3.441 1.00 0.00 C ATOM 1478 CD LYS B 52 11.441 2.031 -3.990 1.00 0.00 C ATOM 1479 CE LYS B 52 12.520 1.351 -3.149 1.00 0.00 C ATOM 1480 NZ LYS B 52 12.777 -0.017 -3.680 1.00 0.00 N ATOM 0 H LYS B 52 8.888 4.467 -2.158 1.00 0.00 H new ATOM 0 HA LYS B 52 10.758 6.031 -3.579 1.00 0.00 H new ATOM 0 HB2 LYS B 52 9.179 3.518 -4.278 1.00 0.00 H new ATOM 0 HB3 LYS B 52 10.418 4.183 -5.324 1.00 0.00 H new ATOM 0 HG2 LYS B 52 12.087 4.024 -3.457 1.00 0.00 H new ATOM 0 HG3 LYS B 52 10.849 3.372 -2.401 1.00 0.00 H new ATOM 0 HD2 LYS B 52 10.525 1.440 -3.972 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.761 2.092 -5.030 1.00 0.00 H new ATOM 0 HE2 LYS B 52 13.437 1.939 -3.171 1.00 0.00 H new ATOM 0 HE3 LYS B 52 12.202 1.295 -2.108 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 13.512 -0.479 -3.107 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 11.901 -0.576 -3.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 13.098 0.048 -4.667 1.00 0.00 H new ATOM 1494 N PHE B 53 7.656 6.067 -4.672 1.00 0.00 N ATOM 1495 CA PHE B 53 6.731 6.746 -5.570 1.00 0.00 C ATOM 1496 C PHE B 53 6.826 8.258 -5.389 1.00 0.00 C ATOM 1497 O PHE B 53 6.912 9.006 -6.363 1.00 0.00 O ATOM 1498 CB PHE B 53 5.301 6.285 -5.285 1.00 0.00 C ATOM 1499 CG PHE B 53 4.347 6.985 -6.220 1.00 0.00 C ATOM 1500 CD1 PHE B 53 4.156 6.494 -7.517 1.00 0.00 C ATOM 1501 CD2 PHE B 53 3.650 8.122 -5.793 1.00 0.00 C ATOM 1502 CE1 PHE B 53 3.271 7.139 -8.388 1.00 0.00 C ATOM 1503 CE2 PHE B 53 2.764 8.768 -6.664 1.00 0.00 C ATOM 1504 CZ PHE B 53 2.575 8.277 -7.961 1.00 0.00 C ATOM 0 H PHE B 53 7.214 5.419 -4.020 1.00 0.00 H new ATOM 0 HA PHE B 53 6.996 6.497 -6.597 1.00 0.00 H new ATOM 0 HB2 PHE B 53 5.224 5.205 -5.413 1.00 0.00 H new ATOM 0 HB3 PHE B 53 5.037 6.503 -4.250 1.00 0.00 H new ATOM 0 HD1 PHE B 53 4.692 5.616 -7.846 1.00 0.00 H new ATOM 0 HD2 PHE B 53 3.796 8.501 -4.792 1.00 0.00 H new ATOM 0 HE1 PHE B 53 3.125 6.760 -9.389 1.00 0.00 H new ATOM 0 HE2 PHE B 53 2.227 9.645 -6.335 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.892 8.776 -8.633 1.00 0.00 H new ATOM 1514 N GLN B 54 6.804 8.703 -4.136 1.00 0.00 N ATOM 1515 CA GLN B 54 6.881 10.130 -3.840 1.00 0.00 C ATOM 1516 C GLN B 54 8.210 10.707 -4.326 1.00 0.00 C ATOM 1517 O GLN B 54 8.256 11.810 -4.870 1.00 0.00 O ATOM 1518 CB GLN B 54 6.757 10.354 -2.328 1.00 0.00 C ATOM 1519 CG GLN B 54 5.340 10.003 -1.854 1.00 0.00 C ATOM 1520 CD GLN B 54 4.314 10.934 -2.494 1.00 0.00 C ATOM 1521 OE1 GLN B 54 4.505 12.150 -2.514 1.00 0.00 O ATOM 1522 NE2 GLN B 54 3.230 10.433 -3.018 1.00 0.00 N ATOM 0 H GLN B 54 6.734 8.102 -3.315 1.00 0.00 H new ATOM 0 HA GLN B 54 6.064 10.634 -4.356 1.00 0.00 H new ATOM 0 HB2 GLN B 54 7.487 9.740 -1.801 1.00 0.00 H new ATOM 0 HB3 GLN B 54 6.982 11.393 -2.087 1.00 0.00 H new ATOM 0 HG2 GLN B 54 5.111 8.969 -2.111 1.00 0.00 H new ATOM 0 HG3 GLN B 54 5.284 10.082 -0.768 1.00 0.00 H new ATOM 0 HE21 GLN B 54 3.074 9.425 -3.000 1.00 0.00 H new ATOM 0 HE22 GLN B 54 2.538 11.049 -3.446 1.00 0.00 H new ATOM 1531 N LYS B 55 9.288 9.953 -4.127 1.00 0.00 N ATOM 1532 CA LYS B 55 10.609 10.400 -4.552 1.00 0.00 C ATOM 1533 C LYS B 55 10.660 10.570 -6.067 1.00 0.00 C ATOM 1534 O LYS B 55 11.269 11.511 -6.576 1.00 0.00 O ATOM 1535 CB LYS B 55 11.672 9.391 -4.114 1.00 0.00 C ATOM 1536 CG LYS B 55 11.829 9.442 -2.592 1.00 0.00 C ATOM 1537 CD LYS B 55 12.880 8.419 -2.154 1.00 0.00 C ATOM 1538 CE LYS B 55 13.019 8.447 -0.631 1.00 0.00 C ATOM 1539 NZ LYS B 55 13.511 9.787 -0.201 1.00 0.00 N ATOM 0 H LYS B 55 9.273 9.037 -3.678 1.00 0.00 H new ATOM 0 HA LYS B 55 10.809 11.364 -4.084 1.00 0.00 H new ATOM 0 HB2 LYS B 55 11.386 8.387 -4.427 1.00 0.00 H new ATOM 0 HB3 LYS B 55 12.623 9.617 -4.596 1.00 0.00 H new ATOM 0 HG2 LYS B 55 12.127 10.443 -2.280 1.00 0.00 H new ATOM 0 HG3 LYS B 55 10.875 9.229 -2.110 1.00 0.00 H new ATOM 0 HD2 LYS B 55 12.591 7.421 -2.485 1.00 0.00 H new ATOM 0 HD3 LYS B 55 13.839 8.645 -2.621 1.00 0.00 H new ATOM 0 HE2 LYS B 55 12.058 8.234 -0.164 1.00 0.00 H new ATOM 0 HE3 LYS B 55 13.712 7.671 -0.304 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 13.923 9.716 0.751 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 14.235 10.121 -0.868 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 12.718 10.460 -0.186 1.00 0.00 H new ATOM 1553 N LYS B 56 10.020 9.651 -6.783 1.00 0.00 N ATOM 1554 CA LYS B 56 10.003 9.708 -8.240 1.00 0.00 C ATOM 1555 C LYS B 56 9.321 10.988 -8.716 1.00 0.00 C ATOM 1556 O LYS B 56 9.763 11.617 -9.677 1.00 0.00 O ATOM 1557 CB LYS B 56 9.259 8.491 -8.801 1.00 0.00 C ATOM 1558 CG LYS B 56 10.083 7.218 -8.569 1.00 0.00 C ATOM 1559 CD LYS B 56 11.088 7.022 -9.711 1.00 0.00 C ATOM 1560 CE LYS B 56 11.853 5.713 -9.495 1.00 0.00 C ATOM 1561 NZ LYS B 56 10.900 4.568 -9.536 1.00 0.00 N ATOM 0 H LYS B 56 9.510 8.864 -6.382 1.00 0.00 H new ATOM 0 HA LYS B 56 11.032 9.702 -8.599 1.00 0.00 H new ATOM 0 HB2 LYS B 56 8.285 8.396 -8.320 1.00 0.00 H new ATOM 0 HB3 LYS B 56 9.076 8.626 -9.867 1.00 0.00 H new ATOM 0 HG2 LYS B 56 10.611 7.286 -7.618 1.00 0.00 H new ATOM 0 HG3 LYS B 56 9.421 6.354 -8.505 1.00 0.00 H new ATOM 0 HD2 LYS B 56 10.567 6.998 -10.668 1.00 0.00 H new ATOM 0 HD3 LYS B 56 11.783 7.861 -9.747 1.00 0.00 H new ATOM 0 HE2 LYS B 56 12.615 5.593 -10.265 1.00 0.00 H new ATOM 0 HE3 LYS B 56 12.370 5.736 -8.536 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 11.393 3.718 -9.878 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 10.528 4.392 -8.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 10.113 4.794 -10.178 1.00 0.00 H new ATOM 1575 N LYS B 57 8.245 11.368 -8.036 1.00 0.00 N ATOM 1576 CA LYS B 57 7.513 12.578 -8.398 1.00 0.00 C ATOM 1577 C LYS B 57 8.429 13.792 -8.263 1.00 0.00 C ATOM 1578 O LYS B 57 8.436 14.678 -9.118 1.00 0.00 O ATOM 1579 CB LYS B 57 6.294 12.737 -7.478 1.00 0.00 C ATOM 1580 CG LYS B 57 5.407 13.902 -7.945 1.00 0.00 C ATOM 1581 CD LYS B 57 4.453 13.428 -9.048 1.00 0.00 C ATOM 1582 CE LYS B 57 3.520 14.575 -9.440 1.00 0.00 C ATOM 1583 NZ LYS B 57 2.671 14.946 -8.273 1.00 0.00 N ATOM 0 H LYS B 57 7.862 10.861 -7.238 1.00 0.00 H new ATOM 0 HA LYS B 57 7.174 12.501 -9.431 1.00 0.00 H new ATOM 0 HB2 LYS B 57 5.715 11.813 -7.471 1.00 0.00 H new ATOM 0 HB3 LYS B 57 6.625 12.914 -6.455 1.00 0.00 H new ATOM 0 HG2 LYS B 57 4.836 14.295 -7.104 1.00 0.00 H new ATOM 0 HG3 LYS B 57 6.029 14.717 -8.316 1.00 0.00 H new ATOM 0 HD2 LYS B 57 5.021 13.093 -9.916 1.00 0.00 H new ATOM 0 HD3 LYS B 57 3.872 12.575 -8.699 1.00 0.00 H new ATOM 0 HE2 LYS B 57 4.103 15.436 -9.768 1.00 0.00 H new ATOM 0 HE3 LYS B 57 2.892 14.277 -10.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 1.807 15.417 -8.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 2.415 14.088 -7.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 3.198 15.592 -7.651 1.00 0.00 H new ATOM 1597 N ALA B 58 9.203 13.818 -7.183 1.00 0.00 N ATOM 1598 CA ALA B 58 10.129 14.916 -6.933 1.00 0.00 C ATOM 1599 C ALA B 58 11.174 15.003 -8.040 1.00 0.00 C ATOM 1600 O ALA B 58 11.685 16.081 -8.342 1.00 0.00 O ATOM 1601 CB ALA B 58 10.822 14.716 -5.585 1.00 0.00 C ATOM 0 H ALA B 58 9.207 13.091 -6.467 1.00 0.00 H new ATOM 0 HA ALA B 58 9.562 15.847 -6.915 1.00 0.00 H new ATOM 0 HB1 ALA B 58 11.512 15.540 -5.405 1.00 0.00 H new ATOM 0 HB2 ALA B 58 10.075 14.689 -4.792 1.00 0.00 H new ATOM 0 HB3 ALA B 58 11.374 13.776 -5.596 1.00 0.00 H new ATOM 1607 N GLY B 59 11.496 13.858 -8.635 1.00 0.00 N ATOM 1608 CA GLY B 59 12.492 13.814 -9.699 1.00 0.00 C ATOM 1609 C GLY B 59 12.086 14.706 -10.867 1.00 0.00 C ATOM 1610 O GLY B 59 10.900 14.930 -11.109 1.00 0.00 O ATOM 0 H GLY B 59 11.085 12.955 -8.400 1.00 0.00 H new ATOM 0 HA2 GLY B 59 13.458 14.135 -9.310 1.00 0.00 H new ATOM 0 HA3 GLY B 59 12.613 12.788 -10.046 1.00 0.00 H new ATOM 1614 N SER B 60 13.083 15.220 -11.583 1.00 0.00 N ATOM 1615 CA SER B 60 12.827 16.099 -12.718 1.00 0.00 C ATOM 1616 C SER B 60 12.215 15.323 -13.880 1.00 0.00 C ATOM 1617 O SER B 60 12.322 14.098 -13.949 1.00 0.00 O ATOM 1618 CB SER B 60 14.133 16.751 -13.173 1.00 0.00 C ATOM 1619 OG SER B 60 14.973 15.762 -13.755 1.00 0.00 O ATOM 0 H SER B 60 14.070 15.044 -11.398 1.00 0.00 H new ATOM 0 HA SER B 60 12.122 16.868 -12.403 1.00 0.00 H new ATOM 0 HB2 SER B 60 13.926 17.540 -13.896 1.00 0.00 H new ATOM 0 HB3 SER B 60 14.635 17.218 -12.325 1.00 0.00 H new ATOM 0 HG SER B 60 15.811 16.176 -14.050 1.00 0.00 H new ATOM 1625 N GLN B 61 11.572 16.049 -14.790 1.00 0.00 N ATOM 1626 CA GLN B 61 10.943 15.427 -15.949 1.00 0.00 C ATOM 1627 C GLN B 61 10.875 16.410 -17.114 1.00 0.00 C ATOM 1628 O GLN B 61 9.969 16.340 -17.945 1.00 0.00 O ATOM 1629 CB GLN B 61 9.531 14.962 -15.585 1.00 0.00 C ATOM 1630 CG GLN B 61 8.705 16.159 -15.112 1.00 0.00 C ATOM 1631 CD GLN B 61 7.328 15.693 -14.653 1.00 0.00 C ATOM 1632 OE1 GLN B 61 6.580 15.102 -15.432 1.00 0.00 O ATOM 1633 NE2 GLN B 61 6.948 15.923 -13.426 1.00 0.00 N ATOM 0 H GLN B 61 11.473 17.063 -14.747 1.00 0.00 H new ATOM 0 HA GLN B 61 11.543 14.568 -16.250 1.00 0.00 H new ATOM 0 HB2 GLN B 61 9.056 14.497 -16.449 1.00 0.00 H new ATOM 0 HB3 GLN B 61 9.577 14.206 -14.801 1.00 0.00 H new ATOM 0 HG2 GLN B 61 9.218 16.665 -14.294 1.00 0.00 H new ATOM 0 HG3 GLN B 61 8.602 16.883 -15.920 1.00 0.00 H new ATOM 0 HE21 GLN B 61 7.570 16.413 -12.783 1.00 0.00 H new ATOM 0 HE22 GLN B 61 6.029 15.613 -13.110 1.00 0.00 H new ATOM 1642 N SER B 62 11.837 17.326 -17.165 1.00 0.00 N ATOM 1643 CA SER B 62 11.876 18.321 -18.233 1.00 0.00 C ATOM 1644 C SER B 62 10.552 19.073 -18.314 1.00 0.00 C ATOM 1645 O SER B 62 10.029 19.194 -19.409 1.00 0.00 O ATOM 1646 CB SER B 62 12.164 17.643 -19.572 1.00 0.00 C ATOM 1647 OG SER B 62 11.015 16.917 -19.988 1.00 0.00 O ATOM 1648 OXT SER B 62 10.081 19.516 -17.279 1.00 0.00 O ATOM 0 H SER B 62 12.594 17.401 -16.486 1.00 0.00 H new ATOM 0 HA SER B 62 12.671 19.032 -18.010 1.00 0.00 H new ATOM 0 HB2 SER B 62 12.428 18.389 -20.321 1.00 0.00 H new ATOM 0 HB3 SER B 62 13.018 16.972 -19.477 1.00 0.00 H new ATOM 0 HG SER B 62 10.376 16.864 -19.247 1.00 0.00 H new TER 1654 SER B 62