USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 938 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 62 ASN : amide:sc= 0.11 K(o=0.88,f=-6.9!) USER MOD Set 1.2: A 64 SER OG : rot 1:sc= 0.765 USER MOD Set 2.1: A 45 ASN : amide:sc= 0.742 K(o=0.6,f=-6.3!) USER MOD Set 2.2: A 50 ASN :FLIP amide:sc= -0.145 F(o=-0.18,f=0.6) USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0224 (180deg=0) USER MOD Single : A 5 SER OG : rot 56:sc= 0.795 USER MOD Single : A 7 SER OG : rot -29:sc= 0.88 USER MOD Single : A 8 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.138) USER MOD Single : A 10 CYS SG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.61! C(o=-1.6!,f=-1.9!) USER MOD Single : A 21 CYS SG : rot 180:sc= -1.02 USER MOD Single : A 22 SER OG : rot -44:sc= 0.927 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 57:sc= -0.448 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl 160:sc= -0.205 (180deg=-0.854) USER MOD Single : A 32 SER OG : rot 45:sc= 0.827 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -170:sc=-0.00242 (180deg=-0.119) USER MOD Single : A 40 THR OG1 : rot 13:sc= 0.439 USER MOD Single : A 44 ASN : amide:sc= -1.71 X(o=-1.7,f=-1.5) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 11:sc= -0.0204 USER MOD Single : A 48 CYS SG : rot -3:sc= 0.229 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.387 K(o=-0.39,f=-3.9!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -6.96! C(o=-7!,f=-12!) USER MOD Single : A 59 ASN : amide:sc= -0.368 K(o=-0.37,f=-1.2!) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -1.19 K(o=-1.2,f=-3.3!) USER MOD Single : A 68 ASN :FLIP amide:sc= -0.0352 F(o=-1.4,f=-0.035) USER MOD Single : A 70 MET CE :methyl 147:sc= -4.43! (180deg=-7.06!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot -65:sc= 1.25 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -4.88! C(o=-4.9!,f=-11!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -0.982 K(o=-0.98,f=-5.3!) USER MOD Single : A 83 GLN : amide:sc= -0.0252 X(o=-0.025,f=0) USER MOD Single : A 91 ASN : amide:sc= -1.59 K(o=-1.6,f=-3.8) USER MOD Single : A 92 GLN :FLIP amide:sc= 0 F(o=-0.98,f=0) USER MOD Single : A 93 ASN : amide:sc= -0.616 K(o=-0.62,f=-3.1!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -167:sc= -0.0418 (180deg=-0.255) USER MOD Single : A 101 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.44) USER MOD Single : A 104 GLN : amide:sc= -4.52! C(o=-4.5!,f=-7.8!) USER MOD Single : A 111 GLN : amide:sc= -1.66! C(o=-1.7!,f=-2.1!) USER MOD Single : A 114 SER OG : rot -23:sc= 0.583 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 13:sc= 0.392 USER MOD Single : A 119 SER OG : rot -26:sc= 0.64 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot -39:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -60.639 -2.058 8.149 1.00 0.00 N ATOM 2 CA GLY A 1 -59.150 -2.094 8.155 1.00 0.00 C ATOM 3 C GLY A 1 -58.598 -3.097 9.151 1.00 0.00 C ATOM 4 O GLY A 1 -59.225 -3.364 10.176 1.00 0.00 O ATOM 0 H1 GLY A 1 -60.993 -2.466 7.260 1.00 0.00 H new ATOM 0 H2 GLY A 1 -61.003 -2.610 8.952 1.00 0.00 H new ATOM 0 H3 GLY A 1 -60.963 -1.073 8.231 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -58.792 -2.343 7.156 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -58.767 -1.102 8.393 1.00 0.00 H new ATOM 10 N PRO A 2 -57.414 -3.673 8.877 1.00 0.00 N ATOM 11 CA PRO A 2 -56.788 -4.654 9.769 1.00 0.00 C ATOM 12 C PRO A 2 -56.258 -4.017 11.050 1.00 0.00 C ATOM 13 O PRO A 2 -55.056 -4.042 11.318 1.00 0.00 O ATOM 14 CB PRO A 2 -55.635 -5.209 8.930 1.00 0.00 C ATOM 15 CG PRO A 2 -55.299 -4.114 7.978 1.00 0.00 C ATOM 16 CD PRO A 2 -56.596 -3.413 7.677 1.00 0.00 C ATOM 0 HA PRO A 2 -57.495 -5.414 10.102 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -54.780 -5.467 9.554 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -55.930 -6.116 8.402 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -54.576 -3.425 8.415 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -54.850 -4.512 7.068 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -56.447 -2.345 7.516 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -57.067 -3.808 6.777 1.00 0.00 H new ATOM 24 N LEU A 3 -57.163 -3.444 11.839 1.00 0.00 N ATOM 25 CA LEU A 3 -56.791 -2.795 13.095 1.00 0.00 C ATOM 26 C LEU A 3 -55.858 -3.682 13.917 1.00 0.00 C ATOM 27 O LEU A 3 -56.167 -4.842 14.187 1.00 0.00 O ATOM 28 CB LEU A 3 -58.039 -2.458 13.917 1.00 0.00 C ATOM 29 CG LEU A 3 -58.798 -3.662 14.484 1.00 0.00 C ATOM 30 CD1 LEU A 3 -59.988 -3.199 15.309 1.00 0.00 C ATOM 31 CD2 LEU A 3 -59.254 -4.589 13.367 1.00 0.00 C ATOM 0 H LEU A 3 -58.161 -3.415 11.631 1.00 0.00 H new ATOM 0 HA LEU A 3 -56.266 -1.873 12.848 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -57.745 -1.813 14.745 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -58.721 -1.882 13.291 1.00 0.00 H new ATOM 0 HG LEU A 3 -58.120 -4.217 15.132 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -60.516 -4.067 15.704 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -59.639 -2.579 16.135 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -60.663 -2.619 14.680 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -59.790 -5.436 13.794 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -59.913 -4.046 12.690 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -58.385 -4.950 12.816 1.00 0.00 H new ATOM 43 N GLY A 4 -54.716 -3.127 14.309 1.00 0.00 N ATOM 44 CA GLY A 4 -53.757 -3.881 15.095 1.00 0.00 C ATOM 45 C GLY A 4 -52.647 -3.010 15.648 1.00 0.00 C ATOM 46 O GLY A 4 -52.721 -2.548 16.786 1.00 0.00 O ATOM 0 H GLY A 4 -54.438 -2.169 14.097 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -54.274 -4.372 15.919 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -53.324 -4.667 14.477 1.00 0.00 H new ATOM 50 N SER A 5 -51.617 -2.783 14.840 1.00 0.00 N ATOM 51 CA SER A 5 -50.488 -1.959 15.252 1.00 0.00 C ATOM 52 C SER A 5 -50.200 -0.882 14.212 1.00 0.00 C ATOM 53 O SER A 5 -49.314 -1.040 13.372 1.00 0.00 O ATOM 54 CB SER A 5 -49.246 -2.826 15.464 1.00 0.00 C ATOM 55 OG SER A 5 -48.886 -3.502 14.271 1.00 0.00 O ATOM 0 H SER A 5 -51.541 -3.159 13.895 1.00 0.00 H new ATOM 0 HA SER A 5 -50.746 -1.474 16.193 1.00 0.00 H new ATOM 0 HB2 SER A 5 -48.416 -2.203 15.797 1.00 0.00 H new ATOM 0 HB3 SER A 5 -49.436 -3.552 16.254 1.00 0.00 H new ATOM 0 HG SER A 5 -48.753 -2.849 13.552 1.00 0.00 H new ATOM 61 N PRO A 6 -50.951 0.232 14.251 1.00 0.00 N ATOM 62 CA PRO A 6 -50.776 1.337 13.305 1.00 0.00 C ATOM 63 C PRO A 6 -49.592 2.233 13.660 1.00 0.00 C ATOM 64 O PRO A 6 -49.721 3.456 13.712 1.00 0.00 O ATOM 65 CB PRO A 6 -52.088 2.106 13.436 1.00 0.00 C ATOM 66 CG PRO A 6 -52.513 1.881 14.847 1.00 0.00 C ATOM 67 CD PRO A 6 -52.034 0.500 15.218 1.00 0.00 C ATOM 0 HA PRO A 6 -50.563 0.985 12.296 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -51.949 3.167 13.228 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -52.835 1.738 12.733 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -52.081 2.633 15.508 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -53.596 1.956 14.944 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -51.671 0.465 16.245 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -52.834 -0.236 15.137 1.00 0.00 H new ATOM 75 N SER A 7 -48.439 1.618 13.902 1.00 0.00 N ATOM 76 CA SER A 7 -47.233 2.361 14.249 1.00 0.00 C ATOM 77 C SER A 7 -46.022 1.862 13.460 1.00 0.00 C ATOM 78 O SER A 7 -44.904 2.336 13.665 1.00 0.00 O ATOM 79 CB SER A 7 -46.957 2.249 15.749 1.00 0.00 C ATOM 80 OG SER A 7 -45.788 2.966 16.108 1.00 0.00 O ATOM 0 H SER A 7 -48.314 0.606 13.864 1.00 0.00 H new ATOM 0 HA SER A 7 -47.400 3.406 13.988 1.00 0.00 H new ATOM 0 HB2 SER A 7 -47.810 2.634 16.308 1.00 0.00 H new ATOM 0 HB3 SER A 7 -46.843 1.200 16.024 1.00 0.00 H new ATOM 0 HG SER A 7 -45.172 2.989 15.346 1.00 0.00 H new ATOM 86 N LYS A 8 -46.244 0.904 12.559 1.00 0.00 N ATOM 87 CA LYS A 8 -45.163 0.351 11.749 1.00 0.00 C ATOM 88 C LYS A 8 -43.997 -0.100 12.626 1.00 0.00 C ATOM 89 O LYS A 8 -42.840 -0.053 12.210 1.00 0.00 O ATOM 90 CB LYS A 8 -44.676 1.379 10.722 1.00 0.00 C ATOM 91 CG LYS A 8 -45.671 1.660 9.603 1.00 0.00 C ATOM 92 CD LYS A 8 -46.945 2.316 10.116 1.00 0.00 C ATOM 93 CE LYS A 8 -46.659 3.650 10.788 1.00 0.00 C ATOM 94 NZ LYS A 8 -47.901 4.293 11.297 1.00 0.00 N ATOM 0 H LYS A 8 -47.161 0.497 12.374 1.00 0.00 H new ATOM 0 HA LYS A 8 -45.555 -0.518 11.220 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -44.452 2.313 11.237 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -43.743 1.025 10.284 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -45.205 2.307 8.860 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -45.923 0.726 9.100 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -47.636 2.467 9.287 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -47.438 1.650 10.824 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -45.964 3.499 11.614 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -46.170 4.317 10.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -47.679 4.856 12.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -48.297 4.914 10.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -48.596 3.559 11.542 1.00 0.00 H new ATOM 108 N ASP A 9 -44.313 -0.537 13.841 1.00 0.00 N ATOM 109 CA ASP A 9 -43.295 -0.997 14.778 1.00 0.00 C ATOM 110 C ASP A 9 -42.288 0.108 15.082 1.00 0.00 C ATOM 111 O ASP A 9 -41.150 -0.165 15.462 1.00 0.00 O ATOM 112 CB ASP A 9 -42.571 -2.222 14.215 1.00 0.00 C ATOM 113 CG ASP A 9 -43.512 -3.382 13.958 1.00 0.00 C ATOM 114 OD1 ASP A 9 -44.148 -3.856 14.923 1.00 0.00 O ATOM 115 OD2 ASP A 9 -43.613 -3.817 12.791 1.00 0.00 O ATOM 0 H ASP A 9 -45.267 -0.582 14.200 1.00 0.00 H new ATOM 0 HA ASP A 9 -43.793 -1.271 15.708 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -42.072 -1.950 13.285 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -41.795 -2.535 14.914 1.00 0.00 H new ATOM 120 N CYS A 10 -42.714 1.358 14.913 1.00 0.00 N ATOM 121 CA CYS A 10 -41.848 2.504 15.171 1.00 0.00 C ATOM 122 C CYS A 10 -40.527 2.372 14.420 1.00 0.00 C ATOM 123 O CYS A 10 -39.571 1.780 14.922 1.00 0.00 O ATOM 124 CB CYS A 10 -41.584 2.641 16.670 1.00 0.00 C ATOM 125 SG CYS A 10 -40.537 4.047 17.112 1.00 0.00 S ATOM 0 H CYS A 10 -43.653 1.602 14.599 1.00 0.00 H new ATOM 0 HA CYS A 10 -42.358 3.399 14.814 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -42.538 2.736 17.189 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -41.115 1.725 17.030 1.00 0.00 H new ATOM 0 HG CYS A 10 -40.374 4.078 18.401 1.00 0.00 H new ATOM 131 N GLY A 11 -40.482 2.925 13.214 1.00 0.00 N ATOM 132 CA GLY A 11 -39.276 2.857 12.411 1.00 0.00 C ATOM 133 C GLY A 11 -39.391 1.855 11.279 1.00 0.00 C ATOM 134 O GLY A 11 -38.382 1.363 10.772 1.00 0.00 O ATOM 0 H GLY A 11 -41.260 3.420 12.777 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -39.061 3.843 11.999 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -38.434 2.587 13.048 1.00 0.00 H new ATOM 138 N SER A 12 -40.623 1.550 10.882 1.00 0.00 N ATOM 139 CA SER A 12 -40.867 0.599 9.802 1.00 0.00 C ATOM 140 C SER A 12 -40.374 -0.795 10.182 1.00 0.00 C ATOM 141 O SER A 12 -39.535 -0.945 11.070 1.00 0.00 O ATOM 142 CB SER A 12 -40.180 1.066 8.516 1.00 0.00 C ATOM 143 OG SER A 12 -40.670 2.331 8.106 1.00 0.00 O ATOM 0 H SER A 12 -41.468 1.948 11.292 1.00 0.00 H new ATOM 0 HA SER A 12 -41.942 0.549 9.631 1.00 0.00 H new ATOM 0 HB2 SER A 12 -39.103 1.124 8.676 1.00 0.00 H new ATOM 0 HB3 SER A 12 -40.346 0.335 7.725 1.00 0.00 H new ATOM 0 HG SER A 12 -40.214 2.608 7.284 1.00 0.00 H new ATOM 149 N PRO A 13 -40.893 -1.840 9.511 1.00 0.00 N ATOM 150 CA PRO A 13 -40.506 -3.228 9.780 1.00 0.00 C ATOM 151 C PRO A 13 -39.000 -3.400 9.947 1.00 0.00 C ATOM 152 O PRO A 13 -38.528 -3.836 10.996 1.00 0.00 O ATOM 153 CB PRO A 13 -40.989 -3.962 8.532 1.00 0.00 C ATOM 154 CG PRO A 13 -42.185 -3.191 8.093 1.00 0.00 C ATOM 155 CD PRO A 13 -41.902 -1.751 8.435 1.00 0.00 C ATOM 0 HA PRO A 13 -40.932 -3.598 10.713 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -40.221 -3.980 7.759 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -41.243 -4.999 8.753 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -42.355 -3.311 7.023 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -43.083 -3.543 8.600 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -41.522 -1.202 7.574 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -42.801 -1.235 8.771 1.00 0.00 H new ATOM 163 N LYS A 14 -38.252 -3.062 8.903 1.00 0.00 N ATOM 164 CA LYS A 14 -36.800 -3.185 8.931 1.00 0.00 C ATOM 165 C LYS A 14 -36.145 -2.177 7.993 1.00 0.00 C ATOM 166 O LYS A 14 -35.386 -1.311 8.429 1.00 0.00 O ATOM 167 CB LYS A 14 -36.388 -4.607 8.543 1.00 0.00 C ATOM 168 CG LYS A 14 -36.808 -5.661 9.555 1.00 0.00 C ATOM 169 CD LYS A 14 -36.140 -5.438 10.902 1.00 0.00 C ATOM 170 CE LYS A 14 -36.569 -6.486 11.917 1.00 0.00 C ATOM 171 NZ LYS A 14 -35.920 -6.276 13.241 1.00 0.00 N ATOM 0 H LYS A 14 -38.628 -2.700 8.026 1.00 0.00 H new ATOM 0 HA LYS A 14 -36.460 -2.975 9.945 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -36.825 -4.851 7.575 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -35.305 -4.642 8.423 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -37.891 -5.639 9.677 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -36.550 -6.651 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -35.057 -5.468 10.782 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -36.392 -4.445 11.274 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -37.652 -6.455 12.035 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -36.317 -7.478 11.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -36.239 -7.011 13.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -34.887 -6.331 13.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -36.181 -5.339 13.611 1.00 0.00 H new ATOM 185 N TYR A 15 -36.441 -2.295 6.703 1.00 0.00 N ATOM 186 CA TYR A 15 -35.877 -1.393 5.705 1.00 0.00 C ATOM 187 C TYR A 15 -36.983 -0.719 4.898 1.00 0.00 C ATOM 188 O TYR A 15 -37.193 0.489 5.004 1.00 0.00 O ATOM 189 CB TYR A 15 -34.933 -2.161 4.774 1.00 0.00 C ATOM 190 CG TYR A 15 -34.214 -1.286 3.769 1.00 0.00 C ATOM 191 CD1 TYR A 15 -34.907 -0.648 2.748 1.00 0.00 C ATOM 192 CD2 TYR A 15 -32.840 -1.098 3.846 1.00 0.00 C ATOM 193 CE1 TYR A 15 -34.251 0.152 1.832 1.00 0.00 C ATOM 194 CE2 TYR A 15 -32.177 -0.299 2.934 1.00 0.00 C ATOM 195 CZ TYR A 15 -32.886 0.323 1.930 1.00 0.00 C ATOM 196 OH TYR A 15 -32.230 1.119 1.020 1.00 0.00 O ATOM 0 H TYR A 15 -37.067 -3.005 6.324 1.00 0.00 H new ATOM 0 HA TYR A 15 -35.311 -0.618 6.222 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -34.193 -2.688 5.377 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -35.505 -2.918 4.238 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -35.976 -0.779 2.669 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -32.281 -1.584 4.632 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -34.804 0.641 1.044 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -31.108 -0.163 3.008 1.00 0.00 H new ATOM 0 HH TYR A 15 -31.273 1.135 1.230 1.00 0.00 H new ATOM 206 N ALA A 16 -37.688 -1.509 4.093 1.00 0.00 N ATOM 207 CA ALA A 16 -38.775 -0.988 3.269 1.00 0.00 C ATOM 208 C ALA A 16 -39.426 -2.097 2.448 1.00 0.00 C ATOM 209 O ALA A 16 -40.634 -2.079 2.212 1.00 0.00 O ATOM 210 CB ALA A 16 -38.266 0.115 2.351 1.00 0.00 C ATOM 0 H ALA A 16 -37.526 -2.511 3.994 1.00 0.00 H new ATOM 0 HA ALA A 16 -39.530 -0.572 3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -39.089 0.492 1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -37.856 0.927 2.951 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -37.488 -0.284 1.700 1.00 0.00 H new ATOM 216 N TYR A 17 -38.619 -3.061 2.013 1.00 0.00 N ATOM 217 CA TYR A 17 -39.115 -4.173 1.218 1.00 0.00 C ATOM 218 C TYR A 17 -39.773 -3.677 -0.064 1.00 0.00 C ATOM 219 O TYR A 17 -40.658 -4.329 -0.615 1.00 0.00 O ATOM 220 CB TYR A 17 -40.098 -5.017 2.028 1.00 0.00 C ATOM 221 CG TYR A 17 -39.500 -5.572 3.301 1.00 0.00 C ATOM 222 CD1 TYR A 17 -39.198 -4.740 4.373 1.00 0.00 C ATOM 223 CD2 TYR A 17 -39.225 -6.927 3.426 1.00 0.00 C ATOM 224 CE1 TYR A 17 -38.641 -5.244 5.533 1.00 0.00 C ATOM 225 CE2 TYR A 17 -38.670 -7.437 4.582 1.00 0.00 C ATOM 226 CZ TYR A 17 -38.379 -6.593 5.632 1.00 0.00 C ATOM 227 OH TYR A 17 -37.825 -7.100 6.785 1.00 0.00 O ATOM 0 H TYR A 17 -37.617 -3.091 2.200 1.00 0.00 H new ATOM 0 HA TYR A 17 -38.264 -4.797 0.945 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -40.968 -4.410 2.278 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -40.452 -5.843 1.411 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -39.402 -3.682 4.298 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -39.449 -7.593 2.605 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -38.412 -4.584 6.357 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -38.464 -8.494 4.664 1.00 0.00 H new ATOM 0 HH TYR A 17 -37.705 -8.068 6.692 1.00 0.00 H new ATOM 237 N PHE A 18 -39.318 -2.524 -0.536 1.00 0.00 N ATOM 238 CA PHE A 18 -39.836 -1.936 -1.764 1.00 0.00 C ATOM 239 C PHE A 18 -39.516 -2.833 -2.959 1.00 0.00 C ATOM 240 O PHE A 18 -40.098 -2.684 -4.033 1.00 0.00 O ATOM 241 CB PHE A 18 -39.232 -0.543 -1.990 1.00 0.00 C ATOM 242 CG PHE A 18 -37.751 -0.562 -2.270 1.00 0.00 C ATOM 243 CD1 PHE A 18 -36.837 -0.859 -1.269 1.00 0.00 C ATOM 244 CD2 PHE A 18 -37.275 -0.301 -3.545 1.00 0.00 C ATOM 245 CE1 PHE A 18 -35.483 -0.892 -1.534 1.00 0.00 C ATOM 246 CE2 PHE A 18 -35.920 -0.329 -3.815 1.00 0.00 C ATOM 247 CZ PHE A 18 -35.023 -0.626 -2.808 1.00 0.00 C ATOM 0 H PHE A 18 -38.587 -1.975 -0.084 1.00 0.00 H new ATOM 0 HA PHE A 18 -40.918 -1.842 -1.667 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -39.744 -0.066 -2.825 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -39.418 0.071 -1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -37.190 -1.067 -0.270 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -37.972 -0.073 -4.338 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -34.784 -1.126 -0.745 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -35.563 -0.119 -4.812 1.00 0.00 H new ATOM 0 HZ PHE A 18 -33.964 -0.650 -3.017 1.00 0.00 H new ATOM 257 N ASN A 19 -38.574 -3.756 -2.759 1.00 0.00 N ATOM 258 CA ASN A 19 -38.148 -4.680 -3.805 1.00 0.00 C ATOM 259 C ASN A 19 -37.374 -3.949 -4.897 1.00 0.00 C ATOM 260 O ASN A 19 -36.147 -4.023 -4.955 1.00 0.00 O ATOM 261 CB ASN A 19 -39.344 -5.419 -4.417 1.00 0.00 C ATOM 262 CG ASN A 19 -40.024 -6.348 -3.431 1.00 0.00 C ATOM 263 OD1 ASN A 19 -40.536 -5.913 -2.402 1.00 0.00 O ATOM 264 ND2 ASN A 19 -40.033 -7.638 -3.744 1.00 0.00 N ATOM 0 H ASN A 19 -38.088 -3.882 -1.871 1.00 0.00 H new ATOM 0 HA ASN A 19 -37.490 -5.415 -3.341 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -40.068 -4.691 -4.782 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -39.008 -5.994 -5.280 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -40.477 -8.311 -3.120 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -39.596 -7.956 -4.609 1.00 0.00 H new ATOM 271 N GLY A 20 -38.097 -3.244 -5.761 1.00 0.00 N ATOM 272 CA GLY A 20 -37.455 -2.513 -6.838 1.00 0.00 C ATOM 273 C GLY A 20 -38.363 -1.470 -7.460 1.00 0.00 C ATOM 274 O GLY A 20 -39.250 -1.800 -8.248 1.00 0.00 O ATOM 0 H GLY A 20 -39.114 -3.166 -5.735 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -36.557 -2.026 -6.457 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -37.134 -3.215 -7.608 1.00 0.00 H new ATOM 278 N CYS A 21 -38.141 -0.208 -7.106 1.00 0.00 N ATOM 279 CA CYS A 21 -38.945 0.888 -7.636 1.00 0.00 C ATOM 280 C CYS A 21 -38.204 1.624 -8.750 1.00 0.00 C ATOM 281 O CYS A 21 -38.528 2.767 -9.070 1.00 0.00 O ATOM 282 CB CYS A 21 -39.303 1.871 -6.519 1.00 0.00 C ATOM 283 SG CYS A 21 -40.232 1.130 -5.156 1.00 0.00 S ATOM 0 H CYS A 21 -37.411 0.081 -6.455 1.00 0.00 H new ATOM 0 HA CYS A 21 -39.859 0.463 -8.050 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -38.385 2.307 -6.125 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -39.888 2.688 -6.942 1.00 0.00 H new ATOM 0 HG CYS A 21 -40.486 2.037 -4.260 1.00 0.00 H new ATOM 289 N SER A 22 -37.201 0.968 -9.333 1.00 0.00 N ATOM 290 CA SER A 22 -36.413 1.571 -10.405 1.00 0.00 C ATOM 291 C SER A 22 -35.929 2.960 -10.003 1.00 0.00 C ATOM 292 O SER A 22 -35.694 3.817 -10.854 1.00 0.00 O ATOM 293 CB SER A 22 -37.240 1.668 -11.687 1.00 0.00 C ATOM 294 OG SER A 22 -36.456 2.153 -12.763 1.00 0.00 O ATOM 0 H SER A 22 -36.916 0.021 -9.081 1.00 0.00 H new ATOM 0 HA SER A 22 -35.547 0.934 -10.585 1.00 0.00 H new ATOM 0 HB2 SER A 22 -37.642 0.687 -11.939 1.00 0.00 H new ATOM 0 HB3 SER A 22 -38.091 2.330 -11.526 1.00 0.00 H new ATOM 0 HG SER A 22 -35.916 2.912 -12.458 1.00 0.00 H new ATOM 300 N SER A 23 -35.791 3.178 -8.699 1.00 0.00 N ATOM 301 CA SER A 23 -35.346 4.463 -8.181 1.00 0.00 C ATOM 302 C SER A 23 -33.866 4.694 -8.456 1.00 0.00 C ATOM 303 O SER A 23 -33.011 4.028 -7.873 1.00 0.00 O ATOM 304 CB SER A 23 -35.600 4.547 -6.675 1.00 0.00 C ATOM 305 OG SER A 23 -36.988 4.562 -6.389 1.00 0.00 O ATOM 0 H SER A 23 -35.982 2.478 -7.982 1.00 0.00 H new ATOM 0 HA SER A 23 -35.918 5.237 -8.693 1.00 0.00 H new ATOM 0 HB2 SER A 23 -35.133 3.698 -6.177 1.00 0.00 H new ATOM 0 HB3 SER A 23 -35.134 5.447 -6.275 1.00 0.00 H new ATOM 0 HG SER A 23 -37.122 4.614 -5.420 1.00 0.00 H new ATOM 311 N PRO A 24 -33.533 5.665 -9.327 1.00 0.00 N ATOM 312 CA PRO A 24 -32.139 5.987 -9.636 1.00 0.00 C ATOM 313 C PRO A 24 -31.340 6.253 -8.362 1.00 0.00 C ATOM 314 O PRO A 24 -30.112 6.184 -8.358 1.00 0.00 O ATOM 315 CB PRO A 24 -32.241 7.258 -10.485 1.00 0.00 C ATOM 316 CG PRO A 24 -33.608 7.211 -11.076 1.00 0.00 C ATOM 317 CD PRO A 24 -34.478 6.535 -10.052 1.00 0.00 C ATOM 0 HA PRO A 24 -31.624 5.173 -10.146 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -32.103 8.152 -9.877 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -31.475 7.279 -11.260 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -33.973 8.214 -11.297 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -33.609 6.658 -12.015 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -34.952 7.257 -9.387 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -35.277 5.960 -10.519 1.00 0.00 H new ATOM 325 N THR A 25 -32.063 6.552 -7.281 1.00 0.00 N ATOM 326 CA THR A 25 -31.462 6.825 -5.982 1.00 0.00 C ATOM 327 C THR A 25 -30.640 5.635 -5.493 1.00 0.00 C ATOM 328 O THR A 25 -31.067 4.892 -4.609 1.00 0.00 O ATOM 329 CB THR A 25 -32.562 7.144 -4.969 1.00 0.00 C ATOM 330 OG1 THR A 25 -33.495 6.075 -4.897 1.00 0.00 O ATOM 331 CG2 THR A 25 -33.328 8.408 -5.297 1.00 0.00 C ATOM 0 H THR A 25 -33.081 6.611 -7.286 1.00 0.00 H new ATOM 0 HA THR A 25 -30.793 7.679 -6.085 1.00 0.00 H new ATOM 0 HB THR A 25 -32.052 7.289 -4.016 1.00 0.00 H new ATOM 0 HG1 THR A 25 -33.025 5.245 -4.673 1.00 0.00 H new ATOM 0 HG21 THR A 25 -34.093 8.577 -4.539 1.00 0.00 H new ATOM 0 HG22 THR A 25 -32.642 9.255 -5.315 1.00 0.00 H new ATOM 0 HG23 THR A 25 -33.801 8.304 -6.274 1.00 0.00 H new ATOM 339 N ALA A 26 -29.461 5.460 -6.076 1.00 0.00 N ATOM 340 CA ALA A 26 -28.578 4.361 -5.702 1.00 0.00 C ATOM 341 C ALA A 26 -27.780 4.696 -4.443 1.00 0.00 C ATOM 342 O ALA A 26 -27.758 3.917 -3.490 1.00 0.00 O ATOM 343 CB ALA A 26 -27.640 4.024 -6.853 1.00 0.00 C ATOM 0 H ALA A 26 -29.093 6.065 -6.810 1.00 0.00 H new ATOM 0 HA ALA A 26 -29.196 3.490 -5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -26.986 3.202 -6.561 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -28.225 3.730 -7.725 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -27.037 4.898 -7.098 1.00 0.00 H new ATOM 349 N PRO A 27 -27.109 5.862 -4.422 1.00 0.00 N ATOM 350 CA PRO A 27 -26.308 6.292 -3.271 1.00 0.00 C ATOM 351 C PRO A 27 -27.129 6.361 -1.988 1.00 0.00 C ATOM 352 O PRO A 27 -28.180 5.730 -1.875 1.00 0.00 O ATOM 353 CB PRO A 27 -25.820 7.690 -3.668 1.00 0.00 C ATOM 354 CG PRO A 27 -25.907 7.721 -5.153 1.00 0.00 C ATOM 355 CD PRO A 27 -27.075 6.850 -5.515 1.00 0.00 C ATOM 0 HA PRO A 27 -25.500 5.592 -3.058 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -26.440 8.466 -3.220 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -24.799 7.863 -3.329 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -26.052 8.739 -5.515 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.988 7.350 -5.606 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -28.002 7.421 -5.570 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -26.936 6.373 -6.485 1.00 0.00 H new ATOM 363 N LEU A 28 -26.642 7.134 -1.025 1.00 0.00 N ATOM 364 CA LEU A 28 -27.328 7.290 0.253 1.00 0.00 C ATOM 365 C LEU A 28 -27.456 8.763 0.624 1.00 0.00 C ATOM 366 O LEU A 28 -28.541 9.237 0.963 1.00 0.00 O ATOM 367 CB LEU A 28 -26.581 6.539 1.359 1.00 0.00 C ATOM 368 CG LEU A 28 -26.467 5.026 1.162 1.00 0.00 C ATOM 369 CD1 LEU A 28 -27.845 4.404 0.994 1.00 0.00 C ATOM 370 CD2 LEU A 28 -25.580 4.702 -0.032 1.00 0.00 C ATOM 0 H LEU A 28 -25.774 7.663 -1.104 1.00 0.00 H new ATOM 0 HA LEU A 28 -28.328 6.868 0.151 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -25.577 6.954 1.443 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -27.084 6.728 2.307 1.00 0.00 H new ATOM 0 HG LEU A 28 -26.005 4.599 2.052 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -27.744 3.328 0.855 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -28.444 4.600 1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -28.336 4.838 0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -25.513 3.621 -0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -26.007 5.142 -0.933 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -24.583 5.111 0.134 1.00 0.00 H new ATOM 382 N SER A 29 -26.341 9.484 0.551 1.00 0.00 N ATOM 383 CA SER A 29 -26.322 10.908 0.874 1.00 0.00 C ATOM 384 C SER A 29 -24.918 11.491 0.728 1.00 0.00 C ATOM 385 O SER A 29 -24.745 12.549 0.123 1.00 0.00 O ATOM 386 CB SER A 29 -26.848 11.154 2.292 1.00 0.00 C ATOM 387 OG SER A 29 -26.825 12.535 2.610 1.00 0.00 O ATOM 0 H SER A 29 -25.437 9.105 0.270 1.00 0.00 H new ATOM 0 HA SER A 29 -26.978 11.412 0.165 1.00 0.00 H new ATOM 0 HB2 SER A 29 -27.866 10.775 2.377 1.00 0.00 H new ATOM 0 HB3 SER A 29 -26.241 10.602 3.010 1.00 0.00 H new ATOM 0 HG SER A 29 -27.167 12.667 3.519 1.00 0.00 H new ATOM 393 N PRO A 30 -23.887 10.818 1.274 1.00 0.00 N ATOM 394 CA PRO A 30 -22.504 11.290 1.188 1.00 0.00 C ATOM 395 C PRO A 30 -21.895 11.045 -0.192 1.00 0.00 C ATOM 396 O PRO A 30 -20.749 10.608 -0.304 1.00 0.00 O ATOM 397 CB PRO A 30 -21.762 10.463 2.254 1.00 0.00 C ATOM 398 CG PRO A 30 -22.813 9.668 2.964 1.00 0.00 C ATOM 399 CD PRO A 30 -23.969 9.556 2.015 1.00 0.00 C ATOM 0 HA PRO A 30 -22.436 12.366 1.348 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -21.021 9.808 1.794 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -21.227 11.111 2.948 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -22.437 8.682 3.237 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -23.115 10.161 3.888 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -23.874 8.692 1.358 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -24.918 9.454 2.541 1.00 0.00 H new ATOM 407 N MET A 31 -22.665 11.327 -1.240 1.00 0.00 N ATOM 408 CA MET A 31 -22.197 11.135 -2.607 1.00 0.00 C ATOM 409 C MET A 31 -21.203 12.225 -2.998 1.00 0.00 C ATOM 410 O MET A 31 -21.123 13.267 -2.349 1.00 0.00 O ATOM 411 CB MET A 31 -23.383 11.130 -3.574 1.00 0.00 C ATOM 412 CG MET A 31 -22.988 10.941 -5.030 1.00 0.00 C ATOM 413 SD MET A 31 -24.415 10.849 -6.128 1.00 0.00 S ATOM 414 CE MET A 31 -25.214 12.412 -5.775 1.00 0.00 C ATOM 0 H MET A 31 -23.616 11.689 -1.167 1.00 0.00 H new ATOM 0 HA MET A 31 -21.689 10.172 -2.664 1.00 0.00 H new ATOM 0 HB2 MET A 31 -24.070 10.334 -3.287 1.00 0.00 H new ATOM 0 HB3 MET A 31 -23.925 12.070 -3.474 1.00 0.00 H new ATOM 0 HG2 MET A 31 -22.349 11.768 -5.340 1.00 0.00 H new ATOM 0 HG3 MET A 31 -22.399 10.029 -5.128 1.00 0.00 H new ATOM 0 HE1 MET A 31 -25.885 12.671 -6.594 1.00 0.00 H new ATOM 0 HE2 MET A 31 -25.785 12.328 -4.850 1.00 0.00 H new ATOM 0 HE3 MET A 31 -24.459 13.190 -5.665 1.00 0.00 H new ATOM 424 N SER A 32 -20.445 11.975 -4.061 1.00 0.00 N ATOM 425 CA SER A 32 -19.454 12.934 -4.537 1.00 0.00 C ATOM 426 C SER A 32 -19.983 13.724 -5.732 1.00 0.00 C ATOM 427 O SER A 32 -19.780 13.334 -6.881 1.00 0.00 O ATOM 428 CB SER A 32 -18.163 12.211 -4.924 1.00 0.00 C ATOM 429 OG SER A 32 -18.397 11.263 -5.952 1.00 0.00 O ATOM 0 H SER A 32 -20.498 11.116 -4.609 1.00 0.00 H new ATOM 0 HA SER A 32 -19.247 13.634 -3.727 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.422 12.937 -5.257 1.00 0.00 H new ATOM 0 HB3 SER A 32 -17.748 11.709 -4.050 1.00 0.00 H new ATOM 0 HG SER A 32 -18.969 11.662 -6.640 1.00 0.00 H new ATOM 435 N PRO A 33 -20.667 14.855 -5.478 1.00 0.00 N ATOM 436 CA PRO A 33 -21.216 15.699 -6.544 1.00 0.00 C ATOM 437 C PRO A 33 -20.121 16.234 -7.464 1.00 0.00 C ATOM 438 O PRO A 33 -18.936 16.022 -7.210 1.00 0.00 O ATOM 439 CB PRO A 33 -21.895 16.850 -5.788 1.00 0.00 C ATOM 440 CG PRO A 33 -21.282 16.839 -4.430 1.00 0.00 C ATOM 441 CD PRO A 33 -20.951 15.404 -4.141 1.00 0.00 C ATOM 0 HA PRO A 33 -21.898 15.148 -7.192 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -21.727 17.804 -6.289 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -22.974 16.704 -5.735 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -20.387 17.460 -4.400 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -21.972 17.238 -3.687 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -20.092 15.314 -3.477 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -21.781 14.887 -3.660 1.00 0.00 H new ATOM 449 N PRO A 34 -20.497 16.938 -8.550 1.00 0.00 N ATOM 450 CA PRO A 34 -19.535 17.500 -9.503 1.00 0.00 C ATOM 451 C PRO A 34 -18.427 18.291 -8.814 1.00 0.00 C ATOM 452 O PRO A 34 -18.530 19.506 -8.647 1.00 0.00 O ATOM 453 CB PRO A 34 -20.384 18.429 -10.386 1.00 0.00 C ATOM 454 CG PRO A 34 -21.719 18.517 -9.718 1.00 0.00 C ATOM 455 CD PRO A 34 -21.879 17.244 -8.941 1.00 0.00 C ATOM 0 HA PRO A 34 -19.024 16.716 -10.062 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -19.924 19.414 -10.473 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -20.478 18.031 -11.396 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -21.769 19.384 -9.060 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -22.516 18.628 -10.453 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -22.527 17.376 -8.074 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -22.315 16.450 -9.547 1.00 0.00 H new ATOM 463 N GLY A 35 -17.368 17.593 -8.417 1.00 0.00 N ATOM 464 CA GLY A 35 -16.257 18.247 -7.753 1.00 0.00 C ATOM 465 C GLY A 35 -15.114 18.552 -8.701 1.00 0.00 C ATOM 466 O GLY A 35 -14.345 17.662 -9.063 1.00 0.00 O ATOM 0 H GLY A 35 -17.260 16.587 -8.543 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -16.605 19.174 -7.298 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -15.895 17.611 -6.945 1.00 0.00 H new ATOM 470 N TYR A 36 -15.001 19.814 -9.101 1.00 0.00 N ATOM 471 CA TYR A 36 -13.940 20.234 -10.011 1.00 0.00 C ATOM 472 C TYR A 36 -12.963 21.170 -9.306 1.00 0.00 C ATOM 473 O TYR A 36 -13.007 22.386 -9.492 1.00 0.00 O ATOM 474 CB TYR A 36 -14.522 20.922 -11.251 1.00 0.00 C ATOM 475 CG TYR A 36 -15.312 22.178 -10.951 1.00 0.00 C ATOM 476 CD1 TYR A 36 -16.540 22.118 -10.303 1.00 0.00 C ATOM 477 CD2 TYR A 36 -14.823 23.428 -11.313 1.00 0.00 C ATOM 478 CE1 TYR A 36 -17.259 23.265 -10.027 1.00 0.00 C ATOM 479 CE2 TYR A 36 -15.537 24.580 -11.040 1.00 0.00 C ATOM 480 CZ TYR A 36 -16.753 24.493 -10.398 1.00 0.00 C ATOM 481 OH TYR A 36 -17.466 25.638 -10.124 1.00 0.00 O ATOM 0 H TYR A 36 -15.629 20.563 -8.810 1.00 0.00 H new ATOM 0 HA TYR A 36 -13.402 19.341 -10.330 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -13.707 21.173 -11.930 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -15.167 20.217 -11.775 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -16.939 21.158 -10.010 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -13.870 23.500 -11.816 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -18.212 23.200 -9.523 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -15.143 25.543 -11.329 1.00 0.00 H new ATOM 0 HH TYR A 36 -16.970 26.418 -10.450 1.00 0.00 H new ATOM 491 N LYS A 37 -12.082 20.591 -8.497 1.00 0.00 N ATOM 492 CA LYS A 37 -11.090 21.367 -7.762 1.00 0.00 C ATOM 493 C LYS A 37 -10.178 20.451 -6.950 1.00 0.00 C ATOM 494 O LYS A 37 -8.975 20.692 -6.846 1.00 0.00 O ATOM 495 CB LYS A 37 -11.772 22.378 -6.834 1.00 0.00 C ATOM 496 CG LYS A 37 -12.593 21.746 -5.717 1.00 0.00 C ATOM 497 CD LYS A 37 -13.794 20.982 -6.254 1.00 0.00 C ATOM 498 CE LYS A 37 -14.674 20.469 -5.125 1.00 0.00 C ATOM 499 NZ LYS A 37 -13.934 19.547 -4.220 1.00 0.00 N ATOM 0 H LYS A 37 -12.035 19.585 -8.334 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.485 21.909 -8.489 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.010 23.019 -6.391 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -12.422 23.019 -7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.961 21.070 -5.141 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.934 22.523 -5.033 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.378 21.631 -6.907 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.452 20.144 -6.861 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.056 21.313 -4.550 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -15.537 19.952 -5.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.603 19.089 -3.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.449 18.821 -4.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.233 20.086 -3.673 1.00 0.00 H new ATOM 513 N LEU A 38 -10.758 19.400 -6.379 1.00 0.00 N ATOM 514 CA LEU A 38 -10.001 18.445 -5.577 1.00 0.00 C ATOM 515 C LEU A 38 -9.402 19.117 -4.343 1.00 0.00 C ATOM 516 O LEU A 38 -9.958 19.028 -3.248 1.00 0.00 O ATOM 517 CB LEU A 38 -8.898 17.798 -6.420 1.00 0.00 C ATOM 518 CG LEU A 38 -8.014 16.800 -5.672 1.00 0.00 C ATOM 519 CD1 LEU A 38 -8.849 15.654 -5.121 1.00 0.00 C ATOM 520 CD2 LEU A 38 -6.918 16.272 -6.586 1.00 0.00 C ATOM 0 H LEU A 38 -11.753 19.188 -6.457 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.687 17.668 -5.239 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -9.360 17.289 -7.266 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.265 18.586 -6.829 1.00 0.00 H new ATOM 0 HG LEU A 38 -7.545 17.315 -4.834 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.202 14.954 -4.592 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -9.598 16.047 -4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -9.346 15.138 -5.943 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.298 15.563 -6.038 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.369 15.773 -7.444 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.301 17.102 -6.932 1.00 0.00 H new ATOM 532 N VAL A 39 -8.269 19.792 -4.523 1.00 0.00 N ATOM 533 CA VAL A 39 -7.605 20.476 -3.420 1.00 0.00 C ATOM 534 C VAL A 39 -7.051 21.824 -3.866 1.00 0.00 C ATOM 535 O VAL A 39 -7.408 22.867 -3.319 1.00 0.00 O ATOM 536 CB VAL A 39 -6.455 19.626 -2.839 1.00 0.00 C ATOM 537 CG1 VAL A 39 -5.807 20.330 -1.653 1.00 0.00 C ATOM 538 CG2 VAL A 39 -6.956 18.244 -2.440 1.00 0.00 C ATOM 0 H VAL A 39 -7.794 19.879 -5.421 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.356 20.632 -2.646 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.698 19.503 -3.614 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.999 19.712 -1.260 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.405 21.291 -1.975 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.552 20.491 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.130 17.661 -2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.736 18.344 -1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.361 17.737 -3.316 1.00 0.00 H new ATOM 548 N THR A 40 -6.173 21.790 -4.861 1.00 0.00 N ATOM 549 CA THR A 40 -5.556 23.005 -5.390 1.00 0.00 C ATOM 550 C THR A 40 -4.964 23.855 -4.268 1.00 0.00 C ATOM 551 O THR A 40 -4.844 25.074 -4.398 1.00 0.00 O ATOM 552 CB THR A 40 -6.579 23.821 -6.182 1.00 0.00 C ATOM 553 OG1 THR A 40 -7.662 24.210 -5.356 1.00 0.00 O ATOM 554 CG2 THR A 40 -7.152 23.074 -7.367 1.00 0.00 C ATOM 0 H THR A 40 -5.870 20.932 -5.321 1.00 0.00 H new ATOM 0 HA THR A 40 -4.747 22.707 -6.056 1.00 0.00 H new ATOM 0 HB THR A 40 -6.032 24.689 -6.549 1.00 0.00 H new ATOM 0 HG1 THR A 40 -7.427 24.060 -4.416 1.00 0.00 H new ATOM 0 HG21 THR A 40 -7.870 23.709 -7.885 1.00 0.00 H new ATOM 0 HG22 THR A 40 -6.347 22.804 -8.051 1.00 0.00 H new ATOM 0 HG23 THR A 40 -7.652 22.170 -7.020 1.00 0.00 H new ATOM 562 N GLY A 41 -4.599 23.205 -3.167 1.00 0.00 N ATOM 563 CA GLY A 41 -4.028 23.916 -2.039 1.00 0.00 C ATOM 564 C GLY A 41 -4.834 23.719 -0.772 1.00 0.00 C ATOM 565 O GLY A 41 -4.432 22.971 0.119 1.00 0.00 O ATOM 0 H GLY A 41 -4.689 22.197 -3.037 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.006 23.573 -1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.974 24.980 -2.272 1.00 0.00 H new ATOM 569 N ASP A 42 -5.981 24.383 -0.698 1.00 0.00 N ATOM 570 CA ASP A 42 -6.855 24.272 0.463 1.00 0.00 C ATOM 571 C ASP A 42 -7.569 22.929 0.464 1.00 0.00 C ATOM 572 O ASP A 42 -8.389 22.647 -0.409 1.00 0.00 O ATOM 573 CB ASP A 42 -7.876 25.411 0.473 1.00 0.00 C ATOM 574 CG ASP A 42 -8.796 25.356 1.678 1.00 0.00 C ATOM 575 OD1 ASP A 42 -8.287 25.427 2.816 1.00 0.00 O ATOM 576 OD2 ASP A 42 -10.024 25.241 1.482 1.00 0.00 O ATOM 0 H ASP A 42 -6.328 25.004 -1.429 1.00 0.00 H new ATOM 0 HA ASP A 42 -6.243 24.343 1.362 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.350 26.366 0.465 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -8.473 25.368 -0.438 1.00 0.00 H new ATOM 581 N ARG A 43 -7.250 22.106 1.454 1.00 0.00 N ATOM 582 CA ARG A 43 -7.858 20.790 1.581 1.00 0.00 C ATOM 583 C ARG A 43 -9.380 20.894 1.675 1.00 0.00 C ATOM 584 O ARG A 43 -10.084 19.900 1.501 1.00 0.00 O ATOM 585 CB ARG A 43 -7.302 20.072 2.811 1.00 0.00 C ATOM 586 CG ARG A 43 -5.792 19.905 2.781 1.00 0.00 C ATOM 587 CD ARG A 43 -5.280 19.223 4.039 1.00 0.00 C ATOM 588 NE ARG A 43 -3.828 19.066 4.025 1.00 0.00 N ATOM 589 CZ ARG A 43 -3.134 18.501 5.010 1.00 0.00 C ATOM 590 NH1 ARG A 43 -3.755 18.039 6.088 1.00 0.00 N ATOM 591 NH2 ARG A 43 -1.816 18.395 4.917 1.00 0.00 N ATOM 0 H ARG A 43 -6.571 22.328 2.182 1.00 0.00 H new ATOM 0 HA ARG A 43 -7.612 20.214 0.689 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -7.581 20.630 3.705 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.767 19.089 2.890 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -5.507 19.319 1.907 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -5.319 20.882 2.678 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -5.573 19.806 4.912 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -5.749 18.244 4.137 1.00 0.00 H new ATOM 0 HE ARG A 43 -3.316 19.410 3.213 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -4.769 18.116 6.165 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.218 17.607 6.840 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -1.333 18.747 4.090 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -1.285 17.962 5.672 1.00 0.00 H new ATOM 605 N ASN A 44 -9.879 22.103 1.958 1.00 0.00 N ATOM 606 CA ASN A 44 -11.317 22.351 2.082 1.00 0.00 C ATOM 607 C ASN A 44 -11.801 21.984 3.477 1.00 0.00 C ATOM 608 O ASN A 44 -12.500 22.757 4.132 1.00 0.00 O ATOM 609 CB ASN A 44 -12.109 21.553 1.040 1.00 0.00 C ATOM 610 CG ASN A 44 -11.479 21.609 -0.337 1.00 0.00 C ATOM 611 OD1 ASN A 44 -11.365 22.675 -0.940 1.00 0.00 O ATOM 612 ND2 ASN A 44 -11.058 20.452 -0.836 1.00 0.00 N ATOM 0 H ASN A 44 -9.301 22.930 2.106 1.00 0.00 H new ATOM 0 HA ASN A 44 -11.485 23.414 1.908 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.181 20.514 1.361 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -13.126 21.941 0.986 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.619 20.423 -1.756 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -11.174 19.593 -0.299 1.00 0.00 H new ATOM 619 N ASN A 45 -11.426 20.792 3.919 1.00 0.00 N ATOM 620 CA ASN A 45 -11.815 20.296 5.229 1.00 0.00 C ATOM 621 C ASN A 45 -10.600 19.815 6.023 1.00 0.00 C ATOM 622 O ASN A 45 -10.751 19.257 7.109 1.00 0.00 O ATOM 623 CB ASN A 45 -12.817 19.155 5.059 1.00 0.00 C ATOM 624 CG ASN A 45 -12.319 18.106 4.082 1.00 0.00 C ATOM 625 OD1 ASN A 45 -11.355 17.393 4.357 1.00 0.00 O ATOM 626 ND2 ASN A 45 -12.966 18.023 2.924 1.00 0.00 N ATOM 0 H ASN A 45 -10.847 20.146 3.383 1.00 0.00 H new ATOM 0 HA ASN A 45 -12.275 21.111 5.787 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -13.005 18.690 6.027 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -13.768 19.556 4.708 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -12.668 17.347 2.220 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -13.761 18.635 2.739 1.00 0.00 H new ATOM 633 N SER A 46 -9.396 20.024 5.470 1.00 0.00 N ATOM 634 CA SER A 46 -8.150 19.607 6.117 1.00 0.00 C ATOM 635 C SER A 46 -7.855 18.133 5.842 1.00 0.00 C ATOM 636 O SER A 46 -6.727 17.675 6.021 1.00 0.00 O ATOM 637 CB SER A 46 -8.192 19.859 7.627 1.00 0.00 C ATOM 638 OG SER A 46 -8.543 21.203 7.911 1.00 0.00 O ATOM 0 H SER A 46 -9.262 20.483 4.569 1.00 0.00 H new ATOM 0 HA SER A 46 -7.348 20.210 5.691 1.00 0.00 H new ATOM 0 HB2 SER A 46 -8.913 19.186 8.091 1.00 0.00 H new ATOM 0 HB3 SER A 46 -7.219 19.634 8.063 1.00 0.00 H new ATOM 0 HG SER A 46 -8.565 21.337 8.882 1.00 0.00 H new ATOM 644 N SER A 47 -8.872 17.397 5.396 1.00 0.00 N ATOM 645 CA SER A 47 -8.719 15.983 5.082 1.00 0.00 C ATOM 646 C SER A 47 -8.074 15.224 6.239 1.00 0.00 C ATOM 647 O SER A 47 -6.916 14.814 6.158 1.00 0.00 O ATOM 648 CB SER A 47 -7.882 15.825 3.815 1.00 0.00 C ATOM 649 OG SER A 47 -6.531 16.184 4.046 1.00 0.00 O ATOM 0 H SER A 47 -9.813 17.761 5.245 1.00 0.00 H new ATOM 0 HA SER A 47 -9.710 15.559 4.918 1.00 0.00 H new ATOM 0 HB2 SER A 47 -7.933 14.793 3.469 1.00 0.00 H new ATOM 0 HB3 SER A 47 -8.296 16.448 3.022 1.00 0.00 H new ATOM 0 HG SER A 47 -6.381 16.290 5.009 1.00 0.00 H new ATOM 655 N CYS A 48 -8.834 15.040 7.315 1.00 0.00 N ATOM 656 CA CYS A 48 -8.338 14.330 8.488 1.00 0.00 C ATOM 657 C CYS A 48 -9.480 13.659 9.246 1.00 0.00 C ATOM 658 O CYS A 48 -9.392 12.486 9.607 1.00 0.00 O ATOM 659 CB CYS A 48 -7.595 15.293 9.417 1.00 0.00 C ATOM 660 SG CYS A 48 -6.162 16.095 8.659 1.00 0.00 S ATOM 0 H CYS A 48 -9.795 15.373 7.398 1.00 0.00 H new ATOM 0 HA CYS A 48 -7.649 13.557 8.146 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -8.290 16.061 9.757 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -7.266 14.747 10.301 1.00 0.00 H new ATOM 0 HG CYS A 48 -5.996 15.638 7.453 1.00 0.00 H new ATOM 666 N ARG A 49 -10.548 14.414 9.490 1.00 0.00 N ATOM 667 CA ARG A 49 -11.704 13.892 10.213 1.00 0.00 C ATOM 668 C ARG A 49 -12.869 13.618 9.265 1.00 0.00 C ATOM 669 O ARG A 49 -13.906 14.279 9.331 1.00 0.00 O ATOM 670 CB ARG A 49 -12.143 14.870 11.307 1.00 0.00 C ATOM 671 CG ARG A 49 -11.159 14.999 12.462 1.00 0.00 C ATOM 672 CD ARG A 49 -9.832 15.597 12.017 1.00 0.00 C ATOM 673 NE ARG A 49 -8.936 15.845 13.144 1.00 0.00 N ATOM 674 CZ ARG A 49 -9.177 16.737 14.103 1.00 0.00 C ATOM 675 NH1 ARG A 49 -10.261 17.502 14.053 1.00 0.00 N ATOM 676 NH2 ARG A 49 -8.324 16.874 15.109 1.00 0.00 N ATOM 0 H ARG A 49 -10.637 15.387 9.198 1.00 0.00 H new ATOM 0 HA ARG A 49 -11.407 12.951 10.676 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -12.293 15.853 10.861 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -13.107 14.548 11.700 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -11.595 15.624 13.241 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -10.985 14.017 12.901 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -9.348 14.921 11.312 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -10.015 16.532 11.488 1.00 0.00 H new ATOM 0 HE ARG A 49 -8.074 15.302 13.200 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -10.916 17.409 13.276 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -10.439 18.183 14.791 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -7.484 16.296 15.148 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -8.508 17.557 15.844 1.00 0.00 H new ATOM 690 N ASN A 50 -12.694 12.636 8.387 1.00 0.00 N ATOM 691 CA ASN A 50 -13.733 12.273 7.428 1.00 0.00 C ATOM 692 C ASN A 50 -14.166 10.818 7.600 1.00 0.00 C ATOM 693 O ASN A 50 -15.270 10.442 7.204 1.00 0.00 O ATOM 694 CB ASN A 50 -13.243 12.506 5.999 1.00 0.00 C ATOM 695 CG ASN A 50 -12.999 13.973 5.706 1.00 0.00 C ATOM 696 OD1 ASN A 50 -11.765 14.309 5.350 1.00 0.00 O flip ATOM 697 ND2 ASN A 50 -13.910 14.796 5.797 1.00 0.00 N flip ATOM 0 H ASN A 50 -11.843 12.077 8.319 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.597 12.909 7.619 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.321 11.947 5.838 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.979 12.115 5.297 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -14.844 14.494 6.074 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.731 15.780 5.595 1.00 0.00 H new ATOM 704 N TYR A 51 -13.296 10.003 8.190 1.00 0.00 N ATOM 705 CA TYR A 51 -13.599 8.594 8.408 1.00 0.00 C ATOM 706 C TYR A 51 -13.849 7.881 7.083 1.00 0.00 C ATOM 707 O TYR A 51 -14.928 7.993 6.500 1.00 0.00 O ATOM 708 CB TYR A 51 -14.818 8.445 9.320 1.00 0.00 C ATOM 709 CG TYR A 51 -14.607 8.998 10.713 1.00 0.00 C ATOM 710 CD1 TYR A 51 -14.329 10.344 10.916 1.00 0.00 C ATOM 711 CD2 TYR A 51 -14.686 8.170 11.827 1.00 0.00 C ATOM 712 CE1 TYR A 51 -14.134 10.849 12.188 1.00 0.00 C ATOM 713 CE2 TYR A 51 -14.493 8.668 13.101 1.00 0.00 C ATOM 714 CZ TYR A 51 -14.218 10.008 13.276 1.00 0.00 C ATOM 715 OH TYR A 51 -14.025 10.507 14.544 1.00 0.00 O ATOM 0 H TYR A 51 -12.378 10.294 8.525 1.00 0.00 H new ATOM 0 HA TYR A 51 -12.737 8.134 8.891 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -15.667 8.952 8.862 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -15.079 7.389 9.393 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -14.264 11.007 10.066 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -14.902 7.120 11.694 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -13.917 11.898 12.328 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -14.557 8.011 13.956 1.00 0.00 H new ATOM 0 HH TYR A 51 -14.119 9.783 15.198 1.00 0.00 H new ATOM 725 N ASN A 52 -12.846 7.146 6.615 1.00 0.00 N ATOM 726 CA ASN A 52 -12.955 6.412 5.360 1.00 0.00 C ATOM 727 C ASN A 52 -13.153 4.924 5.622 1.00 0.00 C ATOM 728 O ASN A 52 -14.016 4.287 5.018 1.00 0.00 O ATOM 729 CB ASN A 52 -11.706 6.632 4.505 1.00 0.00 C ATOM 730 CG ASN A 52 -10.440 6.169 5.200 1.00 0.00 C ATOM 731 OD1 ASN A 52 -10.096 6.657 6.277 1.00 0.00 O ATOM 732 ND2 ASN A 52 -9.740 5.223 4.586 1.00 0.00 N ATOM 0 H ASN A 52 -11.947 7.043 7.087 1.00 0.00 H new ATOM 0 HA ASN A 52 -13.824 6.788 4.819 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -11.816 6.097 3.562 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -11.617 7.691 4.262 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -8.879 4.872 5.006 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -10.063 4.847 3.694 1.00 0.00 H new ATOM 739 N LYS A 53 -12.347 4.377 6.532 1.00 0.00 N ATOM 740 CA LYS A 53 -12.425 2.962 6.890 1.00 0.00 C ATOM 741 C LYS A 53 -12.594 2.077 5.656 1.00 0.00 C ATOM 742 O LYS A 53 -13.288 1.061 5.699 1.00 0.00 O ATOM 743 CB LYS A 53 -13.578 2.723 7.867 1.00 0.00 C ATOM 744 CG LYS A 53 -14.921 3.224 7.363 1.00 0.00 C ATOM 745 CD LYS A 53 -16.046 2.861 8.318 1.00 0.00 C ATOM 746 CE LYS A 53 -15.828 3.471 9.694 1.00 0.00 C ATOM 747 NZ LYS A 53 -16.927 3.121 10.637 1.00 0.00 N ATOM 0 H LYS A 53 -11.629 4.896 7.037 1.00 0.00 H new ATOM 0 HA LYS A 53 -11.484 2.692 7.370 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -13.653 1.655 8.072 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -13.349 3.214 8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -14.883 4.306 7.239 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -15.124 2.797 6.381 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -16.996 3.208 7.911 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -16.114 1.777 8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -14.878 3.123 10.099 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -15.758 4.555 9.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -16.741 3.556 11.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -17.831 3.475 10.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -16.977 2.088 10.743 1.00 0.00 H new ATOM 761 N GLN A 54 -11.954 2.470 4.559 1.00 0.00 N ATOM 762 CA GLN A 54 -12.032 1.712 3.316 1.00 0.00 C ATOM 763 C GLN A 54 -10.653 1.570 2.680 1.00 0.00 C ATOM 764 O GLN A 54 -9.651 2.009 3.244 1.00 0.00 O ATOM 765 CB GLN A 54 -12.991 2.392 2.337 1.00 0.00 C ATOM 766 CG GLN A 54 -12.580 3.808 1.968 1.00 0.00 C ATOM 767 CD GLN A 54 -13.544 4.458 0.995 1.00 0.00 C ATOM 768 OE1 GLN A 54 -14.729 4.614 1.287 1.00 0.00 O ATOM 769 NE2 GLN A 54 -13.038 4.840 -0.172 1.00 0.00 N ATOM 0 H GLN A 54 -11.376 3.309 4.506 1.00 0.00 H new ATOM 0 HA GLN A 54 -12.410 0.717 3.549 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -13.055 1.793 1.429 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -13.989 2.415 2.775 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -12.519 4.413 2.873 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.582 3.791 1.529 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -12.049 4.691 -0.372 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -13.638 5.282 -0.868 1.00 0.00 H new ATOM 778 N ALA A 55 -10.610 0.952 1.503 1.00 0.00 N ATOM 779 CA ALA A 55 -9.354 0.749 0.786 1.00 0.00 C ATOM 780 C ALA A 55 -8.468 -0.263 1.506 1.00 0.00 C ATOM 781 O ALA A 55 -8.218 -1.351 0.990 1.00 0.00 O ATOM 782 CB ALA A 55 -8.618 2.070 0.614 1.00 0.00 C ATOM 0 H ALA A 55 -11.432 0.582 1.025 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.591 0.350 -0.200 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.685 1.899 0.078 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.241 2.762 0.047 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.401 2.496 1.594 1.00 0.00 H new ATOM 788 N SER A 56 -8.002 0.116 2.700 1.00 0.00 N ATOM 789 CA SER A 56 -7.135 -0.729 3.532 1.00 0.00 C ATOM 790 C SER A 56 -5.667 -0.362 3.336 1.00 0.00 C ATOM 791 O SER A 56 -4.983 0.013 4.287 1.00 0.00 O ATOM 792 CB SER A 56 -7.338 -2.223 3.245 1.00 0.00 C ATOM 793 OG SER A 56 -6.616 -3.020 4.167 1.00 0.00 O ATOM 0 H SER A 56 -8.215 1.021 3.120 1.00 0.00 H new ATOM 0 HA SER A 56 -7.417 -0.544 4.569 1.00 0.00 H new ATOM 0 HB2 SER A 56 -8.399 -2.467 3.301 1.00 0.00 H new ATOM 0 HB3 SER A 56 -7.012 -2.449 2.230 1.00 0.00 H new ATOM 0 HG SER A 56 -6.762 -3.968 3.965 1.00 0.00 H new ATOM 799 N GLU A 57 -5.186 -0.470 2.100 1.00 0.00 N ATOM 800 CA GLU A 57 -3.796 -0.145 1.794 1.00 0.00 C ATOM 801 C GLU A 57 -3.483 -0.351 0.312 1.00 0.00 C ATOM 802 O GLU A 57 -3.021 -1.417 -0.094 1.00 0.00 O ATOM 803 CB GLU A 57 -2.850 -0.989 2.654 1.00 0.00 C ATOM 804 CG GLU A 57 -3.112 -2.485 2.567 1.00 0.00 C ATOM 805 CD GLU A 57 -2.182 -3.290 3.454 1.00 0.00 C ATOM 806 OE1 GLU A 57 -0.952 -3.214 3.249 1.00 0.00 O ATOM 807 OE2 GLU A 57 -2.684 -3.996 4.354 1.00 0.00 O ATOM 0 H GLU A 57 -5.735 -0.779 1.298 1.00 0.00 H new ATOM 0 HA GLU A 57 -3.645 0.910 2.024 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -1.823 -0.791 2.349 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -2.940 -0.674 3.693 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -4.145 -2.687 2.851 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.996 -2.811 1.534 1.00 0.00 H new ATOM 814 N GLN A 58 -3.729 0.681 -0.489 1.00 0.00 N ATOM 815 CA GLN A 58 -3.463 0.621 -1.924 1.00 0.00 C ATOM 816 C GLN A 58 -2.664 1.838 -2.378 1.00 0.00 C ATOM 817 O GLN A 58 -2.784 2.278 -3.522 1.00 0.00 O ATOM 818 CB GLN A 58 -4.770 0.540 -2.718 1.00 0.00 C ATOM 819 CG GLN A 58 -5.507 -0.782 -2.567 1.00 0.00 C ATOM 820 CD GLN A 58 -5.932 -1.059 -1.141 1.00 0.00 C ATOM 821 OE1 GLN A 58 -6.637 -0.260 -0.525 1.00 0.00 O ATOM 822 NE2 GLN A 58 -5.506 -2.200 -0.609 1.00 0.00 N ATOM 0 H GLN A 58 -4.113 1.570 -0.169 1.00 0.00 H new ATOM 0 HA GLN A 58 -2.878 -0.279 -2.114 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -5.427 1.349 -2.399 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -4.552 0.704 -3.773 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -6.388 -0.777 -3.209 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -4.865 -1.592 -2.913 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -4.923 -2.832 -1.158 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -5.762 -2.444 0.348 1.00 0.00 H new ATOM 831 N ASN A 59 -1.852 2.383 -1.477 1.00 0.00 N ATOM 832 CA ASN A 59 -1.040 3.553 -1.794 1.00 0.00 C ATOM 833 C ASN A 59 0.439 3.293 -1.530 1.00 0.00 C ATOM 834 O ASN A 59 1.213 4.226 -1.321 1.00 0.00 O ATOM 835 CB ASN A 59 -1.508 4.758 -0.979 1.00 0.00 C ATOM 836 CG ASN A 59 -1.425 4.513 0.515 1.00 0.00 C ATOM 837 OD1 ASN A 59 -0.348 4.258 1.055 1.00 0.00 O ATOM 838 ND2 ASN A 59 -2.565 4.589 1.191 1.00 0.00 N ATOM 0 H ASN A 59 -1.739 2.035 -0.525 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.163 3.764 -2.856 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.900 5.625 -1.236 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.537 4.998 -1.248 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.572 4.433 2.199 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.434 4.803 0.702 1.00 0.00 H new ATOM 845 N TRP A 60 0.827 2.024 -1.542 1.00 0.00 N ATOM 846 CA TRP A 60 2.215 1.651 -1.305 1.00 0.00 C ATOM 847 C TRP A 60 2.766 0.813 -2.456 1.00 0.00 C ATOM 848 O TRP A 60 3.966 0.831 -2.730 1.00 0.00 O ATOM 849 CB TRP A 60 2.334 0.885 0.010 1.00 0.00 C ATOM 850 CG TRP A 60 1.405 -0.284 0.095 1.00 0.00 C ATOM 851 CD1 TRP A 60 0.043 -0.243 0.177 1.00 0.00 C ATOM 852 CD2 TRP A 60 1.766 -1.668 0.095 1.00 0.00 C ATOM 853 NE1 TRP A 60 -0.464 -1.517 0.233 1.00 0.00 N ATOM 854 CE2 TRP A 60 0.573 -2.409 0.183 1.00 0.00 C ATOM 855 CE3 TRP A 60 2.982 -2.354 0.029 1.00 0.00 C ATOM 856 CZ2 TRP A 60 0.561 -3.798 0.206 1.00 0.00 C ATOM 857 CZ3 TRP A 60 2.968 -3.735 0.052 1.00 0.00 C ATOM 858 CH2 TRP A 60 1.764 -4.445 0.140 1.00 0.00 C ATOM 0 H TRP A 60 0.201 1.237 -1.713 1.00 0.00 H new ATOM 0 HA TRP A 60 2.806 2.565 -1.242 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.360 0.536 0.128 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.131 1.564 0.838 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.549 0.660 0.195 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -1.452 -1.760 0.301 1.00 0.00 H new ATOM 0 HE3 TRP A 60 3.915 -1.814 -0.039 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -0.366 -4.348 0.274 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 3.901 -4.276 0.001 1.00 0.00 H new ATOM 0 HH2 TRP A 60 1.786 -5.525 0.156 1.00 0.00 H new ATOM 869 N ALA A 61 1.882 0.080 -3.130 1.00 0.00 N ATOM 870 CA ALA A 61 2.278 -0.763 -4.254 1.00 0.00 C ATOM 871 C ALA A 61 2.992 -2.019 -3.774 1.00 0.00 C ATOM 872 O ALA A 61 4.139 -1.964 -3.331 1.00 0.00 O ATOM 873 CB ALA A 61 3.160 0.013 -5.223 1.00 0.00 C ATOM 0 H ALA A 61 0.885 0.054 -2.916 1.00 0.00 H new ATOM 0 HA ALA A 61 1.372 -1.069 -4.778 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.444 -0.633 -6.054 1.00 0.00 H new ATOM 0 HB2 ALA A 61 2.611 0.874 -5.605 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.057 0.354 -4.705 1.00 0.00 H new ATOM 879 N ASN A 62 2.304 -3.149 -3.868 1.00 0.00 N ATOM 880 CA ASN A 62 2.866 -4.426 -3.449 1.00 0.00 C ATOM 881 C ASN A 62 3.740 -5.034 -4.541 1.00 0.00 C ATOM 882 O ASN A 62 4.441 -6.018 -4.305 1.00 0.00 O ATOM 883 CB ASN A 62 1.745 -5.400 -3.084 1.00 0.00 C ATOM 884 CG ASN A 62 0.729 -5.548 -4.199 1.00 0.00 C ATOM 885 OD1 ASN A 62 1.054 -6.003 -5.296 1.00 0.00 O ATOM 886 ND2 ASN A 62 -0.510 -5.157 -3.924 1.00 0.00 N ATOM 0 H ASN A 62 1.353 -3.207 -4.232 1.00 0.00 H new ATOM 0 HA ASN A 62 3.490 -4.244 -2.574 1.00 0.00 H new ATOM 0 HB2 ASN A 62 2.174 -6.375 -2.854 1.00 0.00 H new ATOM 0 HB3 ASN A 62 1.243 -5.052 -2.181 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -1.237 -5.228 -4.636 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -0.735 -4.786 -3.001 1.00 0.00 H new ATOM 893 N TYR A 63 3.694 -4.454 -5.741 1.00 0.00 N ATOM 894 CA TYR A 63 4.482 -4.949 -6.873 1.00 0.00 C ATOM 895 C TYR A 63 3.971 -6.309 -7.339 1.00 0.00 C ATOM 896 O TYR A 63 4.117 -6.669 -8.507 1.00 0.00 O ATOM 897 CB TYR A 63 5.966 -5.060 -6.509 1.00 0.00 C ATOM 898 CG TYR A 63 6.530 -3.811 -5.874 1.00 0.00 C ATOM 899 CD1 TYR A 63 6.255 -3.508 -4.551 1.00 0.00 C ATOM 900 CD2 TYR A 63 7.318 -2.927 -6.600 1.00 0.00 C ATOM 901 CE1 TYR A 63 6.745 -2.369 -3.963 1.00 0.00 C ATOM 902 CE2 TYR A 63 7.819 -1.778 -6.016 1.00 0.00 C ATOM 903 CZ TYR A 63 7.529 -1.504 -4.696 1.00 0.00 C ATOM 904 OH TYR A 63 8.022 -0.361 -4.109 1.00 0.00 O ATOM 0 H TYR A 63 3.119 -3.639 -5.955 1.00 0.00 H new ATOM 0 HA TYR A 63 4.372 -4.229 -7.684 1.00 0.00 H new ATOM 0 HB2 TYR A 63 6.102 -5.898 -5.825 1.00 0.00 H new ATOM 0 HB3 TYR A 63 6.536 -5.288 -7.410 1.00 0.00 H new ATOM 0 HD1 TYR A 63 5.642 -4.182 -3.970 1.00 0.00 H new ATOM 0 HD2 TYR A 63 7.542 -3.140 -7.635 1.00 0.00 H new ATOM 0 HE1 TYR A 63 6.517 -2.151 -2.930 1.00 0.00 H new ATOM 0 HE2 TYR A 63 8.433 -1.100 -6.590 1.00 0.00 H new ATOM 0 HH TYR A 63 8.556 0.138 -4.762 1.00 0.00 H new ATOM 914 N SER A 64 3.381 -7.061 -6.413 1.00 0.00 N ATOM 915 CA SER A 64 2.852 -8.389 -6.711 1.00 0.00 C ATOM 916 C SER A 64 3.988 -9.386 -6.902 1.00 0.00 C ATOM 917 O SER A 64 3.957 -10.216 -7.810 1.00 0.00 O ATOM 918 CB SER A 64 1.961 -8.359 -7.957 1.00 0.00 C ATOM 919 OG SER A 64 0.899 -7.433 -7.802 1.00 0.00 O ATOM 0 H SER A 64 3.257 -6.770 -5.443 1.00 0.00 H new ATOM 0 HA SER A 64 2.245 -8.706 -5.863 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.558 -8.090 -8.828 1.00 0.00 H new ATOM 0 HB3 SER A 64 1.556 -9.354 -8.143 1.00 0.00 H new ATOM 0 HG SER A 64 0.971 -6.996 -6.928 1.00 0.00 H new ATOM 925 N ALA A 65 4.990 -9.296 -6.034 1.00 0.00 N ATOM 926 CA ALA A 65 6.142 -10.188 -6.100 1.00 0.00 C ATOM 927 C ALA A 65 6.843 -10.280 -4.749 1.00 0.00 C ATOM 928 O ALA A 65 8.045 -10.540 -4.679 1.00 0.00 O ATOM 929 CB ALA A 65 7.113 -9.714 -7.170 1.00 0.00 C ATOM 0 H ALA A 65 5.028 -8.614 -5.276 1.00 0.00 H new ATOM 0 HA ALA A 65 5.786 -11.184 -6.363 1.00 0.00 H new ATOM 0 HB1 ALA A 65 7.969 -10.388 -7.209 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.612 -9.706 -8.138 1.00 0.00 H new ATOM 0 HB3 ALA A 65 7.455 -8.707 -6.931 1.00 0.00 H new ATOM 935 N GLU A 66 6.086 -10.066 -3.678 1.00 0.00 N ATOM 936 CA GLU A 66 6.634 -10.125 -2.327 1.00 0.00 C ATOM 937 C GLU A 66 6.034 -11.283 -1.534 1.00 0.00 C ATOM 938 O GLU A 66 6.531 -11.633 -0.465 1.00 0.00 O ATOM 939 CB GLU A 66 6.381 -8.806 -1.594 1.00 0.00 C ATOM 940 CG GLU A 66 7.013 -7.602 -2.273 1.00 0.00 C ATOM 941 CD GLU A 66 8.520 -7.721 -2.387 1.00 0.00 C ATOM 942 OE1 GLU A 66 9.187 -7.833 -1.337 1.00 0.00 O ATOM 943 OE2 GLU A 66 9.033 -7.702 -3.525 1.00 0.00 O ATOM 0 H GLU A 66 5.090 -9.850 -3.719 1.00 0.00 H new ATOM 0 HA GLU A 66 7.708 -10.290 -2.411 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.306 -8.645 -1.514 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.768 -8.884 -0.578 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.585 -7.485 -3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.765 -6.701 -1.712 1.00 0.00 H new ATOM 950 N GLN A 67 4.965 -11.878 -2.058 1.00 0.00 N ATOM 951 CA GLN A 67 4.315 -12.994 -1.383 1.00 0.00 C ATOM 952 C GLN A 67 5.305 -14.106 -1.087 1.00 0.00 C ATOM 953 O GLN A 67 5.322 -14.647 0.013 1.00 0.00 O ATOM 954 CB GLN A 67 3.164 -13.541 -2.217 1.00 0.00 C ATOM 955 CG GLN A 67 2.073 -12.521 -2.502 1.00 0.00 C ATOM 956 CD GLN A 67 1.422 -11.993 -1.238 1.00 0.00 C ATOM 957 OE1 GLN A 67 2.082 -11.397 -0.387 1.00 0.00 O ATOM 958 NE2 GLN A 67 0.118 -12.209 -1.110 1.00 0.00 N ATOM 0 H GLN A 67 4.534 -11.607 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 67 3.919 -12.617 -0.440 1.00 0.00 H new ATOM 0 HB2 GLN A 67 3.558 -13.912 -3.163 1.00 0.00 H new ATOM 0 HB3 GLN A 67 2.725 -14.393 -1.698 1.00 0.00 H new ATOM 0 HG2 GLN A 67 2.497 -11.688 -3.063 1.00 0.00 H new ATOM 0 HG3 GLN A 67 1.312 -12.977 -3.135 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -0.390 -12.708 -1.840 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -0.375 -11.876 -0.282 1.00 0.00 H new ATOM 967 N ASN A 68 6.138 -14.441 -2.065 1.00 0.00 N ATOM 968 CA ASN A 68 7.132 -15.486 -1.869 1.00 0.00 C ATOM 969 C ASN A 68 7.982 -15.155 -0.659 1.00 0.00 C ATOM 970 O ASN A 68 8.257 -16.011 0.188 1.00 0.00 O ATOM 971 CB ASN A 68 8.013 -15.640 -3.112 1.00 0.00 C ATOM 972 CG ASN A 68 7.243 -16.061 -4.359 1.00 0.00 C ATOM 973 OD1 ASN A 68 5.947 -16.338 -4.219 1.00 0.00 O flip ATOM 974 ND2 ASN A 68 7.816 -16.146 -5.445 1.00 0.00 N flip ATOM 0 H ASN A 68 6.145 -14.010 -2.990 1.00 0.00 H new ATOM 0 HA ASN A 68 6.618 -16.433 -1.702 1.00 0.00 H new ATOM 0 HB2 ASN A 68 8.517 -14.694 -3.309 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.789 -16.378 -2.908 1.00 0.00 H new ATOM 0 HD21 ASN A 68 8.810 -15.926 -5.516 1.00 0.00 H new ATOM 0 HD22 ASN A 68 7.297 -16.436 -6.274 1.00 0.00 H new ATOM 981 N ARG A 69 8.367 -13.893 -0.569 1.00 0.00 N ATOM 982 CA ARG A 69 9.155 -13.428 0.548 1.00 0.00 C ATOM 983 C ARG A 69 8.373 -13.595 1.839 1.00 0.00 C ATOM 984 O ARG A 69 8.890 -14.104 2.833 1.00 0.00 O ATOM 985 CB ARG A 69 9.540 -11.964 0.357 1.00 0.00 C ATOM 986 CG ARG A 69 10.717 -11.757 -0.582 1.00 0.00 C ATOM 987 CD ARG A 69 10.430 -12.310 -1.968 1.00 0.00 C ATOM 988 NE ARG A 69 11.553 -12.111 -2.881 1.00 0.00 N ATOM 989 CZ ARG A 69 11.556 -12.509 -4.152 1.00 0.00 C ATOM 990 NH1 ARG A 69 10.499 -13.127 -4.663 1.00 0.00 N ATOM 991 NH2 ARG A 69 12.619 -12.287 -4.913 1.00 0.00 N ATOM 0 H ARG A 69 8.144 -13.176 -1.259 1.00 0.00 H new ATOM 0 HA ARG A 69 10.067 -14.023 0.603 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.679 -11.419 -0.029 1.00 0.00 H new ATOM 0 HB3 ARG A 69 9.781 -11.532 1.328 1.00 0.00 H new ATOM 0 HG2 ARG A 69 10.943 -10.693 -0.654 1.00 0.00 H new ATOM 0 HG3 ARG A 69 11.601 -12.244 -0.171 1.00 0.00 H new ATOM 0 HD2 ARG A 69 10.207 -13.374 -1.894 1.00 0.00 H new ATOM 0 HD3 ARG A 69 9.542 -11.826 -2.375 1.00 0.00 H new ATOM 0 HE ARG A 69 12.384 -11.639 -2.524 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.679 -13.299 -4.082 1.00 0.00 H new ATOM 0 HH12 ARG A 69 10.507 -13.430 -5.637 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.434 -11.812 -4.525 1.00 0.00 H new ATOM 0 HH22 ARG A 69 12.622 -12.592 -5.886 1.00 0.00 H new ATOM 1005 N MET A 70 7.114 -13.173 1.810 1.00 0.00 N ATOM 1006 CA MET A 70 6.252 -13.289 2.979 1.00 0.00 C ATOM 1007 C MET A 70 6.082 -14.749 3.359 1.00 0.00 C ATOM 1008 O MET A 70 5.970 -15.088 4.538 1.00 0.00 O ATOM 1009 CB MET A 70 4.889 -12.650 2.721 1.00 0.00 C ATOM 1010 CG MET A 70 4.950 -11.180 2.323 1.00 0.00 C ATOM 1011 SD MET A 70 5.634 -10.119 3.614 1.00 0.00 S ATOM 1012 CE MET A 70 7.377 -10.518 3.517 1.00 0.00 C ATOM 0 H MET A 70 6.670 -12.750 0.995 1.00 0.00 H new ATOM 0 HA MET A 70 6.725 -12.758 3.805 1.00 0.00 H new ATOM 0 HB2 MET A 70 4.383 -13.207 1.932 1.00 0.00 H new ATOM 0 HB3 MET A 70 4.280 -12.746 3.620 1.00 0.00 H new ATOM 0 HG2 MET A 70 5.554 -11.080 1.422 1.00 0.00 H new ATOM 0 HG3 MET A 70 3.946 -10.836 2.074 1.00 0.00 H new ATOM 0 HE1 MET A 70 7.967 -9.634 3.761 1.00 0.00 H new ATOM 0 HE2 MET A 70 7.608 -11.315 4.224 1.00 0.00 H new ATOM 0 HE3 MET A 70 7.619 -10.848 2.507 1.00 0.00 H new ATOM 1022 N GLY A 71 6.092 -15.610 2.355 1.00 0.00 N ATOM 1023 CA GLY A 71 5.967 -17.025 2.599 1.00 0.00 C ATOM 1024 C GLY A 71 7.126 -17.526 3.425 1.00 0.00 C ATOM 1025 O GLY A 71 6.939 -18.218 4.426 1.00 0.00 O ATOM 0 H GLY A 71 6.185 -15.350 1.373 1.00 0.00 H new ATOM 0 HA2 GLY A 71 5.030 -17.229 3.117 1.00 0.00 H new ATOM 0 HA3 GLY A 71 5.931 -17.561 1.651 1.00 0.00 H new ATOM 1029 N GLN A 72 8.329 -17.137 3.019 1.00 0.00 N ATOM 1030 CA GLN A 72 9.535 -17.508 3.742 1.00 0.00 C ATOM 1031 C GLN A 72 9.477 -16.947 5.153 1.00 0.00 C ATOM 1032 O GLN A 72 9.448 -17.687 6.136 1.00 0.00 O ATOM 1033 CB GLN A 72 10.765 -16.958 3.025 1.00 0.00 C ATOM 1034 CG GLN A 72 11.108 -17.694 1.742 1.00 0.00 C ATOM 1035 CD GLN A 72 12.339 -17.132 1.058 1.00 0.00 C ATOM 1036 OE1 GLN A 72 12.373 -15.961 0.681 1.00 0.00 O ATOM 1037 NE2 GLN A 72 13.358 -17.967 0.894 1.00 0.00 N ATOM 0 H GLN A 72 8.493 -16.564 2.191 1.00 0.00 H new ATOM 0 HA GLN A 72 9.603 -18.595 3.784 1.00 0.00 H new ATOM 0 HB2 GLN A 72 10.600 -15.905 2.796 1.00 0.00 H new ATOM 0 HB3 GLN A 72 11.619 -17.007 3.700 1.00 0.00 H new ATOM 0 HG2 GLN A 72 11.270 -18.749 1.965 1.00 0.00 H new ATOM 0 HG3 GLN A 72 10.261 -17.639 1.059 1.00 0.00 H new ATOM 0 HE21 GLN A 72 13.286 -18.930 1.222 1.00 0.00 H new ATOM 0 HE22 GLN A 72 14.213 -17.645 0.440 1.00 0.00 H new ATOM 1046 N ALA A 73 9.452 -15.620 5.226 1.00 0.00 N ATOM 1047 CA ALA A 73 9.385 -14.896 6.495 1.00 0.00 C ATOM 1048 C ALA A 73 8.493 -15.611 7.510 1.00 0.00 C ATOM 1049 O ALA A 73 8.878 -15.802 8.663 1.00 0.00 O ATOM 1050 CB ALA A 73 8.871 -13.483 6.256 1.00 0.00 C ATOM 0 H ALA A 73 9.478 -15.013 4.406 1.00 0.00 H new ATOM 0 HA ALA A 73 10.392 -14.856 6.910 1.00 0.00 H new ATOM 0 HB1 ALA A 73 8.823 -12.948 7.204 1.00 0.00 H new ATOM 0 HB2 ALA A 73 9.546 -12.960 5.578 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.876 -13.528 5.814 1.00 0.00 H new ATOM 1056 N GLY A 74 7.300 -16.000 7.071 1.00 0.00 N ATOM 1057 CA GLY A 74 6.373 -16.686 7.953 1.00 0.00 C ATOM 1058 C GLY A 74 6.691 -18.161 8.096 1.00 0.00 C ATOM 1059 O GLY A 74 6.422 -18.763 9.136 1.00 0.00 O ATOM 0 H GLY A 74 6.959 -15.853 6.121 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.396 -16.216 8.936 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.359 -16.572 7.569 1.00 0.00 H new ATOM 1063 N SER A 75 7.264 -18.745 7.049 1.00 0.00 N ATOM 1064 CA SER A 75 7.619 -20.159 7.062 1.00 0.00 C ATOM 1065 C SER A 75 8.709 -20.442 8.090 1.00 0.00 C ATOM 1066 O SER A 75 8.839 -21.565 8.577 1.00 0.00 O ATOM 1067 CB SER A 75 8.084 -20.602 5.673 1.00 0.00 C ATOM 1068 OG SER A 75 8.432 -21.975 5.666 1.00 0.00 O ATOM 0 H SER A 75 7.492 -18.261 6.181 1.00 0.00 H new ATOM 0 HA SER A 75 6.731 -20.726 7.340 1.00 0.00 H new ATOM 0 HB2 SER A 75 7.292 -20.421 4.946 1.00 0.00 H new ATOM 0 HB3 SER A 75 8.942 -20.004 5.366 1.00 0.00 H new ATOM 0 HG SER A 75 8.724 -22.234 4.767 1.00 0.00 H new ATOM 1074 N THR A 76 9.492 -19.419 8.416 1.00 0.00 N ATOM 1075 CA THR A 76 10.570 -19.561 9.387 1.00 0.00 C ATOM 1076 C THR A 76 10.023 -19.957 10.754 1.00 0.00 C ATOM 1077 O THR A 76 10.669 -20.686 11.506 1.00 0.00 O ATOM 1078 CB THR A 76 11.357 -18.255 9.499 1.00 0.00 C ATOM 1079 OG1 THR A 76 10.514 -17.195 9.915 1.00 0.00 O ATOM 1080 CG2 THR A 76 12.012 -17.838 8.200 1.00 0.00 C ATOM 0 H THR A 76 9.400 -18.483 8.022 1.00 0.00 H new ATOM 0 HA THR A 76 11.236 -20.351 9.040 1.00 0.00 H new ATOM 0 HB THR A 76 12.137 -18.450 10.234 1.00 0.00 H new ATOM 0 HG1 THR A 76 9.843 -17.020 9.223 1.00 0.00 H new ATOM 0 HG21 THR A 76 12.554 -16.904 8.349 1.00 0.00 H new ATOM 0 HG22 THR A 76 12.707 -18.613 7.878 1.00 0.00 H new ATOM 0 HG23 THR A 76 11.247 -17.696 7.436 1.00 0.00 H new ATOM 1088 N ILE A 77 8.828 -19.472 11.066 1.00 0.00 N ATOM 1089 CA ILE A 77 8.188 -19.772 12.341 1.00 0.00 C ATOM 1090 C ILE A 77 9.040 -19.287 13.510 1.00 0.00 C ATOM 1091 O ILE A 77 10.123 -19.816 13.764 1.00 0.00 O ATOM 1092 CB ILE A 77 7.927 -21.285 12.496 1.00 0.00 C ATOM 1093 CG1 ILE A 77 7.062 -21.795 11.343 1.00 0.00 C ATOM 1094 CG2 ILE A 77 7.259 -21.580 13.833 1.00 0.00 C ATOM 1095 CD1 ILE A 77 5.708 -21.123 11.263 1.00 0.00 C ATOM 0 H ILE A 77 8.281 -18.868 10.452 1.00 0.00 H new ATOM 0 HA ILE A 77 7.234 -19.246 12.350 1.00 0.00 H new ATOM 0 HB ILE A 77 8.885 -21.805 12.470 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.593 -21.639 10.404 1.00 0.00 H new ATOM 0 HG13 ILE A 77 6.920 -22.870 11.454 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.083 -22.652 13.923 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.907 -21.249 14.644 1.00 0.00 H new ATOM 0 HG23 ILE A 77 6.308 -21.050 13.889 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.147 -21.533 10.423 1.00 0.00 H new ATOM 0 HD12 ILE A 77 5.158 -21.301 12.187 1.00 0.00 H new ATOM 0 HD13 ILE A 77 5.842 -20.051 11.121 1.00 0.00 H new ATOM 1107 N SER A 78 8.544 -18.279 14.220 1.00 0.00 N ATOM 1108 CA SER A 78 9.260 -17.724 15.363 1.00 0.00 C ATOM 1109 C SER A 78 8.427 -16.655 16.059 1.00 0.00 C ATOM 1110 O SER A 78 8.443 -16.539 17.285 1.00 0.00 O ATOM 1111 CB SER A 78 10.599 -17.136 14.917 1.00 0.00 C ATOM 1112 OG SER A 78 11.304 -16.582 16.014 1.00 0.00 O ATOM 0 H SER A 78 7.649 -17.830 14.024 1.00 0.00 H new ATOM 0 HA SER A 78 9.445 -18.532 16.071 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.203 -17.913 14.448 1.00 0.00 H new ATOM 0 HB3 SER A 78 10.429 -16.366 14.164 1.00 0.00 H new ATOM 0 HG SER A 78 12.157 -16.214 15.702 1.00 0.00 H new ATOM 1118 N ASN A 79 7.703 -15.875 15.268 1.00 0.00 N ATOM 1119 CA ASN A 79 6.863 -14.811 15.800 1.00 0.00 C ATOM 1120 C ASN A 79 5.398 -15.042 15.437 1.00 0.00 C ATOM 1121 O ASN A 79 4.875 -14.427 14.508 1.00 0.00 O ATOM 1122 CB ASN A 79 7.329 -13.458 15.261 1.00 0.00 C ATOM 1123 CG ASN A 79 6.518 -12.302 15.815 1.00 0.00 C ATOM 1124 OD1 ASN A 79 5.305 -12.229 15.619 1.00 0.00 O ATOM 1125 ND2 ASN A 79 7.188 -11.392 16.512 1.00 0.00 N ATOM 0 H ASN A 79 7.681 -15.960 14.252 1.00 0.00 H new ATOM 0 HA ASN A 79 6.952 -14.814 16.886 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.380 -13.313 15.511 1.00 0.00 H new ATOM 0 HB3 ASN A 79 7.258 -13.460 14.173 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.697 -10.592 16.910 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.194 -11.493 16.649 1.00 0.00 H new ATOM 1132 N SER A 80 4.743 -15.931 16.176 1.00 0.00 N ATOM 1133 CA SER A 80 3.339 -16.243 15.932 1.00 0.00 C ATOM 1134 C SER A 80 2.439 -15.526 16.934 1.00 0.00 C ATOM 1135 O SER A 80 1.560 -16.136 17.544 1.00 0.00 O ATOM 1136 CB SER A 80 3.110 -17.754 16.009 1.00 0.00 C ATOM 1137 OG SER A 80 3.466 -18.260 17.284 1.00 0.00 O ATOM 0 H SER A 80 5.162 -16.448 16.949 1.00 0.00 H new ATOM 0 HA SER A 80 3.084 -15.895 14.931 1.00 0.00 H new ATOM 0 HB2 SER A 80 2.063 -17.977 15.805 1.00 0.00 H new ATOM 0 HB3 SER A 80 3.698 -18.254 15.239 1.00 0.00 H new ATOM 0 HG SER A 80 3.309 -19.227 17.308 1.00 0.00 H new ATOM 1143 N HIS A 81 2.665 -14.227 17.099 1.00 0.00 N ATOM 1144 CA HIS A 81 1.878 -13.422 18.027 1.00 0.00 C ATOM 1145 C HIS A 81 2.311 -11.961 17.995 1.00 0.00 C ATOM 1146 O HIS A 81 1.473 -11.061 17.944 1.00 0.00 O ATOM 1147 CB HIS A 81 1.978 -13.992 19.448 1.00 0.00 C ATOM 1148 CG HIS A 81 3.372 -14.352 19.871 1.00 0.00 C ATOM 1149 ND1 HIS A 81 4.360 -13.419 20.106 1.00 0.00 N ATOM 1150 CD2 HIS A 81 3.940 -15.561 20.097 1.00 0.00 C ATOM 1151 CE1 HIS A 81 5.473 -14.038 20.457 1.00 0.00 C ATOM 1152 NE2 HIS A 81 5.245 -15.337 20.460 1.00 0.00 N ATOM 0 H HIS A 81 3.388 -13.708 16.601 1.00 0.00 H new ATOM 0 HA HIS A 81 0.836 -13.463 17.711 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.575 -13.261 20.149 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.349 -14.880 19.516 1.00 0.00 H new ATOM 0 HD2 HIS A 81 3.456 -16.522 20.008 1.00 0.00 H new ATOM 0 HE1 HIS A 81 6.411 -13.561 20.700 1.00 0.00 H new ATOM 0 HE2 HIS A 81 5.927 -16.058 20.694 1.00 0.00 H new ATOM 1161 N ALA A 82 3.620 -11.726 18.016 1.00 0.00 N ATOM 1162 CA ALA A 82 4.154 -10.366 17.984 1.00 0.00 C ATOM 1163 C ALA A 82 3.410 -9.453 18.956 1.00 0.00 C ATOM 1164 O ALA A 82 3.323 -8.243 18.746 1.00 0.00 O ATOM 1165 CB ALA A 82 4.077 -9.812 16.569 1.00 0.00 C ATOM 0 H ALA A 82 4.330 -12.457 18.055 1.00 0.00 H new ATOM 0 HA ALA A 82 5.197 -10.402 18.298 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.477 -8.798 16.553 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.661 -10.443 15.899 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.038 -9.798 16.240 1.00 0.00 H new ATOM 1171 N GLN A 83 2.873 -10.042 20.018 1.00 0.00 N ATOM 1172 CA GLN A 83 2.135 -9.283 21.019 1.00 0.00 C ATOM 1173 C GLN A 83 3.054 -8.814 22.149 1.00 0.00 C ATOM 1174 O GLN A 83 2.989 -7.658 22.566 1.00 0.00 O ATOM 1175 CB GLN A 83 0.988 -10.123 21.588 1.00 0.00 C ATOM 1176 CG GLN A 83 0.061 -10.692 20.528 1.00 0.00 C ATOM 1177 CD GLN A 83 -1.109 -11.450 21.124 1.00 0.00 C ATOM 1178 OE1 GLN A 83 -1.907 -10.891 21.877 1.00 0.00 O ATOM 1179 NE2 GLN A 83 -1.217 -12.730 20.790 1.00 0.00 N ATOM 0 H GLN A 83 2.935 -11.042 20.208 1.00 0.00 H new ATOM 0 HA GLN A 83 1.721 -8.401 20.530 1.00 0.00 H new ATOM 0 HB2 GLN A 83 1.406 -10.944 22.171 1.00 0.00 H new ATOM 0 HB3 GLN A 83 0.406 -9.508 22.275 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -0.316 -9.880 19.906 1.00 0.00 H new ATOM 0 HG3 GLN A 83 0.626 -11.358 19.876 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -0.533 -13.153 20.163 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -1.984 -13.291 21.161 1.00 0.00 H new ATOM 1188 N PRO A 84 3.922 -9.704 22.670 1.00 0.00 N ATOM 1189 CA PRO A 84 4.843 -9.363 23.761 1.00 0.00 C ATOM 1190 C PRO A 84 5.825 -8.250 23.385 1.00 0.00 C ATOM 1191 O PRO A 84 6.198 -7.438 24.232 1.00 0.00 O ATOM 1192 CB PRO A 84 5.582 -10.681 24.037 1.00 0.00 C ATOM 1193 CG PRO A 84 4.712 -11.738 23.454 1.00 0.00 C ATOM 1194 CD PRO A 84 4.075 -11.108 22.254 1.00 0.00 C ATOM 0 HA PRO A 84 4.312 -8.973 24.629 1.00 0.00 H new ATOM 0 HB2 PRO A 84 6.570 -10.684 23.576 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.729 -10.835 25.106 1.00 0.00 H new ATOM 0 HG2 PRO A 84 5.294 -12.617 23.175 1.00 0.00 H new ATOM 0 HG3 PRO A 84 3.960 -12.068 24.171 1.00 0.00 H new ATOM 0 HD2 PRO A 84 4.701 -11.202 21.367 1.00 0.00 H new ATOM 0 HD3 PRO A 84 3.115 -11.567 22.017 1.00 0.00 H new ATOM 1202 N PHE A 85 6.231 -8.198 22.115 1.00 0.00 N ATOM 1203 CA PHE A 85 7.155 -7.155 21.658 1.00 0.00 C ATOM 1204 C PHE A 85 7.092 -6.959 20.146 1.00 0.00 C ATOM 1205 O PHE A 85 6.722 -5.886 19.670 1.00 0.00 O ATOM 1206 CB PHE A 85 8.603 -7.447 22.084 1.00 0.00 C ATOM 1207 CG PHE A 85 9.005 -8.893 22.005 1.00 0.00 C ATOM 1208 CD1 PHE A 85 8.579 -9.794 22.963 1.00 0.00 C ATOM 1209 CD2 PHE A 85 9.809 -9.349 20.974 1.00 0.00 C ATOM 1210 CE1 PHE A 85 8.946 -11.125 22.897 1.00 0.00 C ATOM 1211 CE2 PHE A 85 10.180 -10.678 20.900 1.00 0.00 C ATOM 1212 CZ PHE A 85 9.748 -11.568 21.863 1.00 0.00 C ATOM 0 H PHE A 85 5.940 -8.856 21.392 1.00 0.00 H new ATOM 0 HA PHE A 85 6.832 -6.232 22.139 1.00 0.00 H new ATOM 0 HB2 PHE A 85 9.276 -6.863 21.456 1.00 0.00 H new ATOM 0 HB3 PHE A 85 8.742 -7.101 23.108 1.00 0.00 H new ATOM 0 HD1 PHE A 85 7.951 -9.454 23.773 1.00 0.00 H new ATOM 0 HD2 PHE A 85 10.150 -8.657 20.218 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.606 -11.818 23.653 1.00 0.00 H new ATOM 0 HE2 PHE A 85 10.807 -11.020 20.090 1.00 0.00 H new ATOM 0 HZ PHE A 85 10.036 -12.607 21.808 1.00 0.00 H new ATOM 1222 N ASP A 86 7.462 -7.990 19.394 1.00 0.00 N ATOM 1223 CA ASP A 86 7.453 -7.915 17.936 1.00 0.00 C ATOM 1224 C ASP A 86 8.489 -6.909 17.438 1.00 0.00 C ATOM 1225 O ASP A 86 8.338 -6.326 16.365 1.00 0.00 O ATOM 1226 CB ASP A 86 6.064 -7.518 17.429 1.00 0.00 C ATOM 1227 CG ASP A 86 5.952 -7.589 15.918 1.00 0.00 C ATOM 1228 OD1 ASP A 86 6.933 -8.004 15.266 1.00 0.00 O ATOM 1229 OD2 ASP A 86 4.879 -7.235 15.386 1.00 0.00 O ATOM 0 H ASP A 86 7.772 -8.887 19.769 1.00 0.00 H new ATOM 0 HA ASP A 86 7.707 -8.901 17.547 1.00 0.00 H new ATOM 0 HB2 ASP A 86 5.317 -8.174 17.876 1.00 0.00 H new ATOM 0 HB3 ASP A 86 5.837 -6.504 17.759 1.00 0.00 H new ATOM 1234 N PHE A 87 9.542 -6.708 18.225 1.00 0.00 N ATOM 1235 CA PHE A 87 10.598 -5.770 17.860 1.00 0.00 C ATOM 1236 C PHE A 87 11.614 -6.410 16.911 1.00 0.00 C ATOM 1237 O PHE A 87 11.985 -5.811 15.902 1.00 0.00 O ATOM 1238 CB PHE A 87 11.299 -5.237 19.115 1.00 0.00 C ATOM 1239 CG PHE A 87 10.439 -4.322 19.939 1.00 0.00 C ATOM 1240 CD1 PHE A 87 9.884 -3.183 19.380 1.00 0.00 C ATOM 1241 CD2 PHE A 87 10.190 -4.599 21.273 1.00 0.00 C ATOM 1242 CE1 PHE A 87 9.095 -2.337 20.136 1.00 0.00 C ATOM 1243 CE2 PHE A 87 9.401 -3.758 22.034 1.00 0.00 C ATOM 1244 CZ PHE A 87 8.852 -2.625 21.465 1.00 0.00 C ATOM 0 H PHE A 87 9.686 -7.181 19.117 1.00 0.00 H new ATOM 0 HA PHE A 87 10.133 -4.935 17.335 1.00 0.00 H new ATOM 0 HB2 PHE A 87 11.614 -6.079 19.731 1.00 0.00 H new ATOM 0 HB3 PHE A 87 12.202 -4.704 18.818 1.00 0.00 H new ATOM 0 HD1 PHE A 87 10.070 -2.953 18.341 1.00 0.00 H new ATOM 0 HD2 PHE A 87 10.617 -5.483 21.724 1.00 0.00 H new ATOM 0 HE1 PHE A 87 8.669 -1.451 19.688 1.00 0.00 H new ATOM 0 HE2 PHE A 87 9.214 -3.986 23.073 1.00 0.00 H new ATOM 0 HZ PHE A 87 8.235 -1.966 22.058 1.00 0.00 H new ATOM 1254 N PRO A 88 12.081 -7.638 17.212 1.00 0.00 N ATOM 1255 CA PRO A 88 13.055 -8.337 16.364 1.00 0.00 C ATOM 1256 C PRO A 88 12.534 -8.551 14.948 1.00 0.00 C ATOM 1257 O PRO A 88 13.300 -8.533 13.984 1.00 0.00 O ATOM 1258 CB PRO A 88 13.253 -9.686 17.066 1.00 0.00 C ATOM 1259 CG PRO A 88 12.799 -9.464 18.467 1.00 0.00 C ATOM 1260 CD PRO A 88 11.704 -8.441 18.387 1.00 0.00 C ATOM 0 HA PRO A 88 13.976 -7.765 16.253 1.00 0.00 H new ATOM 0 HB2 PRO A 88 12.671 -10.471 16.583 1.00 0.00 H new ATOM 0 HB3 PRO A 88 14.297 -9.997 17.034 1.00 0.00 H new ATOM 0 HG2 PRO A 88 12.436 -10.391 18.912 1.00 0.00 H new ATOM 0 HG3 PRO A 88 13.619 -9.110 19.092 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.726 -8.906 18.260 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.653 -7.834 19.291 1.00 0.00 H new ATOM 1268 N ASP A 89 11.226 -8.754 14.831 1.00 0.00 N ATOM 1269 CA ASP A 89 10.599 -8.973 13.534 1.00 0.00 C ATOM 1270 C ASP A 89 10.139 -7.651 12.926 1.00 0.00 C ATOM 1271 O ASP A 89 8.990 -7.513 12.506 1.00 0.00 O ATOM 1272 CB ASP A 89 9.413 -9.930 13.673 1.00 0.00 C ATOM 1273 CG ASP A 89 8.745 -10.229 12.344 1.00 0.00 C ATOM 1274 OD1 ASP A 89 9.204 -9.692 11.314 1.00 0.00 O ATOM 1275 OD2 ASP A 89 7.764 -11.001 12.333 1.00 0.00 O ATOM 0 H ASP A 89 10.580 -8.771 15.620 1.00 0.00 H new ATOM 0 HA ASP A 89 11.337 -9.420 12.868 1.00 0.00 H new ATOM 0 HB2 ASP A 89 9.754 -10.863 14.122 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.680 -9.498 14.355 1.00 0.00 H new ATOM 1280 N ASP A 90 11.045 -6.680 12.883 1.00 0.00 N ATOM 1281 CA ASP A 90 10.736 -5.369 12.327 1.00 0.00 C ATOM 1282 C ASP A 90 11.994 -4.712 11.767 1.00 0.00 C ATOM 1283 O ASP A 90 12.214 -3.513 11.941 1.00 0.00 O ATOM 1284 CB ASP A 90 10.107 -4.474 13.397 1.00 0.00 C ATOM 1285 CG ASP A 90 9.672 -3.127 12.849 1.00 0.00 C ATOM 1286 OD1 ASP A 90 9.837 -2.898 11.632 1.00 0.00 O ATOM 1287 OD2 ASP A 90 9.165 -2.302 13.638 1.00 0.00 O ATOM 0 H ASP A 90 12.000 -6.777 13.227 1.00 0.00 H new ATOM 0 HA ASP A 90 10.023 -5.501 11.513 1.00 0.00 H new ATOM 0 HB2 ASP A 90 9.245 -4.982 13.829 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.824 -4.320 14.204 1.00 0.00 H new ATOM 1292 N ASN A 91 12.818 -5.508 11.093 1.00 0.00 N ATOM 1293 CA ASN A 91 14.055 -5.008 10.506 1.00 0.00 C ATOM 1294 C ASN A 91 14.176 -5.439 9.049 1.00 0.00 C ATOM 1295 O ASN A 91 14.491 -4.630 8.176 1.00 0.00 O ATOM 1296 CB ASN A 91 15.263 -5.508 11.302 1.00 0.00 C ATOM 1297 CG ASN A 91 15.346 -7.021 11.339 1.00 0.00 C ATOM 1298 OD1 ASN A 91 14.433 -7.693 11.820 1.00 0.00 O ATOM 1299 ND2 ASN A 91 16.445 -7.566 10.830 1.00 0.00 N ATOM 0 H ASN A 91 12.651 -6.503 10.940 1.00 0.00 H new ATOM 0 HA ASN A 91 14.032 -3.919 10.544 1.00 0.00 H new ATOM 0 HB2 ASN A 91 16.176 -5.108 10.861 1.00 0.00 H new ATOM 0 HB3 ASN A 91 15.207 -5.125 12.321 1.00 0.00 H new ATOM 0 HD21 ASN A 91 16.557 -8.580 10.827 1.00 0.00 H new ATOM 0 HD22 ASN A 91 17.177 -6.971 10.442 1.00 0.00 H new ATOM 1306 N GLN A 92 13.920 -6.718 8.790 1.00 0.00 N ATOM 1307 CA GLN A 92 13.997 -7.252 7.436 1.00 0.00 C ATOM 1308 C GLN A 92 12.853 -6.720 6.581 1.00 0.00 C ATOM 1309 O GLN A 92 13.053 -5.885 5.701 1.00 0.00 O ATOM 1310 CB GLN A 92 13.964 -8.782 7.465 1.00 0.00 C ATOM 1311 CG GLN A 92 15.115 -9.402 8.244 1.00 0.00 C ATOM 1312 CD GLN A 92 15.082 -10.925 8.274 1.00 0.00 C ATOM 1313 OE1 GLN A 92 14.082 -11.531 7.634 1.00 0.00 O flip ATOM 1314 NE2 GLN A 92 15.954 -11.555 8.872 1.00 0.00 N flip ATOM 0 H GLN A 92 13.658 -7.402 9.500 1.00 0.00 H new ATOM 0 HA GLN A 92 14.939 -6.928 6.994 1.00 0.00 H new ATOM 0 HB2 GLN A 92 13.021 -9.108 7.905 1.00 0.00 H new ATOM 0 HB3 GLN A 92 13.985 -9.157 6.442 1.00 0.00 H new ATOM 0 HG2 GLN A 92 16.057 -9.076 7.804 1.00 0.00 H new ATOM 0 HG3 GLN A 92 15.094 -9.026 9.267 1.00 0.00 H new ATOM 0 HE21 GLN A 92 16.705 -11.058 9.351 1.00 0.00 H new ATOM 0 HE22 GLN A 92 15.926 -12.574 8.889 1.00 0.00 H new ATOM 1323 N ASN A 93 11.647 -7.201 6.851 1.00 0.00 N ATOM 1324 CA ASN A 93 10.468 -6.766 6.108 1.00 0.00 C ATOM 1325 C ASN A 93 10.354 -5.242 6.097 1.00 0.00 C ATOM 1326 O ASN A 93 9.692 -4.668 5.232 1.00 0.00 O ATOM 1327 CB ASN A 93 9.205 -7.378 6.714 1.00 0.00 C ATOM 1328 CG ASN A 93 9.010 -6.983 8.164 1.00 0.00 C ATOM 1329 OD1 ASN A 93 8.881 -5.802 8.485 1.00 0.00 O ATOM 1330 ND2 ASN A 93 8.989 -7.972 9.049 1.00 0.00 N ATOM 0 H ASN A 93 11.458 -7.891 7.577 1.00 0.00 H new ATOM 0 HA ASN A 93 10.575 -7.109 5.079 1.00 0.00 H new ATOM 0 HB2 ASN A 93 8.337 -7.062 6.134 1.00 0.00 H new ATOM 0 HB3 ASN A 93 9.259 -8.464 6.640 1.00 0.00 H new ATOM 0 HD21 ASN A 93 8.862 -7.767 10.040 1.00 0.00 H new ATOM 0 HD22 ASN A 93 9.100 -8.937 8.738 1.00 0.00 H new ATOM 1337 N ALA A 94 10.997 -4.593 7.065 1.00 0.00 N ATOM 1338 CA ALA A 94 10.959 -3.141 7.165 1.00 0.00 C ATOM 1339 C ALA A 94 12.088 -2.486 6.372 1.00 0.00 C ATOM 1340 O ALA A 94 11.963 -1.340 5.940 1.00 0.00 O ATOM 1341 CB ALA A 94 11.025 -2.714 8.623 1.00 0.00 C ATOM 0 H ALA A 94 11.549 -5.052 7.789 1.00 0.00 H new ATOM 0 HA ALA A 94 10.016 -2.806 6.733 1.00 0.00 H new ATOM 0 HB1 ALA A 94 10.996 -1.626 8.685 1.00 0.00 H new ATOM 0 HB2 ALA A 94 10.175 -3.131 9.163 1.00 0.00 H new ATOM 0 HB3 ALA A 94 11.951 -3.078 9.067 1.00 0.00 H new ATOM 1347 N LYS A 95 13.195 -3.205 6.187 1.00 0.00 N ATOM 1348 CA LYS A 95 14.331 -2.657 5.450 1.00 0.00 C ATOM 1349 C LYS A 95 14.173 -2.866 3.947 1.00 0.00 C ATOM 1350 O LYS A 95 14.519 -1.989 3.156 1.00 0.00 O ATOM 1351 CB LYS A 95 15.648 -3.266 5.931 1.00 0.00 C ATOM 1352 CG LYS A 95 15.822 -4.734 5.582 1.00 0.00 C ATOM 1353 CD LYS A 95 17.096 -5.300 6.187 1.00 0.00 C ATOM 1354 CE LYS A 95 17.361 -6.719 5.709 1.00 0.00 C ATOM 1355 NZ LYS A 95 18.621 -7.270 6.280 1.00 0.00 N ATOM 0 H LYS A 95 13.328 -4.155 6.532 1.00 0.00 H new ATOM 0 HA LYS A 95 14.354 -1.585 5.645 1.00 0.00 H new ATOM 0 HB2 LYS A 95 16.475 -2.702 5.500 1.00 0.00 H new ATOM 0 HB3 LYS A 95 15.714 -3.151 7.013 1.00 0.00 H new ATOM 0 HG2 LYS A 95 14.963 -5.300 5.943 1.00 0.00 H new ATOM 0 HG3 LYS A 95 15.848 -4.851 4.499 1.00 0.00 H new ATOM 0 HD2 LYS A 95 17.940 -4.663 5.922 1.00 0.00 H new ATOM 0 HD3 LYS A 95 17.019 -5.290 7.274 1.00 0.00 H new ATOM 0 HE2 LYS A 95 16.525 -7.359 5.990 1.00 0.00 H new ATOM 0 HE3 LYS A 95 17.420 -6.731 4.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 18.766 -8.239 5.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.423 -6.674 5.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 18.555 -7.283 7.318 1.00 0.00 H new ATOM 1369 N LYS A 96 13.635 -4.019 3.551 1.00 0.00 N ATOM 1370 CA LYS A 96 13.426 -4.301 2.133 1.00 0.00 C ATOM 1371 C LYS A 96 12.538 -3.236 1.495 1.00 0.00 C ATOM 1372 O LYS A 96 12.489 -3.108 0.271 1.00 0.00 O ATOM 1373 CB LYS A 96 12.800 -5.685 1.926 1.00 0.00 C ATOM 1374 CG LYS A 96 13.779 -6.841 2.074 1.00 0.00 C ATOM 1375 CD LYS A 96 14.186 -7.059 3.520 1.00 0.00 C ATOM 1376 CE LYS A 96 15.198 -8.185 3.649 1.00 0.00 C ATOM 1377 NZ LYS A 96 14.666 -9.472 3.122 1.00 0.00 N ATOM 0 H LYS A 96 13.340 -4.763 4.183 1.00 0.00 H new ATOM 0 HA LYS A 96 14.404 -4.287 1.651 1.00 0.00 H new ATOM 0 HB2 LYS A 96 11.990 -5.816 2.643 1.00 0.00 H new ATOM 0 HB3 LYS A 96 12.355 -5.725 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 96 13.326 -7.752 1.683 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.667 -6.644 1.473 1.00 0.00 H new ATOM 0 HD2 LYS A 96 14.610 -6.139 3.923 1.00 0.00 H new ATOM 0 HD3 LYS A 96 13.304 -7.291 4.117 1.00 0.00 H new ATOM 0 HE2 LYS A 96 16.107 -7.920 3.109 1.00 0.00 H new ATOM 0 HE3 LYS A 96 15.473 -8.308 4.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 15.285 -10.252 3.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 13.707 -9.629 3.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.634 -9.435 2.083 1.00 0.00 H new ATOM 1391 N VAL A 97 11.836 -2.472 2.331 1.00 0.00 N ATOM 1392 CA VAL A 97 10.952 -1.420 1.844 1.00 0.00 C ATOM 1393 C VAL A 97 11.553 -0.041 2.097 1.00 0.00 C ATOM 1394 O VAL A 97 11.309 0.901 1.344 1.00 0.00 O ATOM 1395 CB VAL A 97 9.566 -1.498 2.515 1.00 0.00 C ATOM 1396 CG1 VAL A 97 8.633 -0.436 1.952 1.00 0.00 C ATOM 1397 CG2 VAL A 97 8.968 -2.886 2.344 1.00 0.00 C ATOM 0 H VAL A 97 11.864 -2.563 3.347 1.00 0.00 H new ATOM 0 HA VAL A 97 10.836 -1.571 0.771 1.00 0.00 H new ATOM 0 HB VAL A 97 9.691 -1.307 3.581 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.661 -0.510 2.440 1.00 0.00 H new ATOM 0 HG12 VAL A 97 9.056 0.552 2.133 1.00 0.00 H new ATOM 0 HG13 VAL A 97 8.513 -0.589 0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 97 7.990 -2.922 2.824 1.00 0.00 H new ATOM 0 HG22 VAL A 97 8.860 -3.107 1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 97 9.625 -3.624 2.803 1.00 0.00 H new ATOM 1407 N ALA A 98 12.341 0.071 3.163 1.00 0.00 N ATOM 1408 CA ALA A 98 12.977 1.334 3.515 1.00 0.00 C ATOM 1409 C ALA A 98 13.832 1.856 2.365 1.00 0.00 C ATOM 1410 O ALA A 98 13.928 3.063 2.147 1.00 0.00 O ATOM 1411 CB ALA A 98 13.821 1.169 4.770 1.00 0.00 C ATOM 0 H ALA A 98 12.554 -0.699 3.797 1.00 0.00 H new ATOM 0 HA ALA A 98 12.193 2.065 3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 98 14.290 2.120 5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 98 13.186 0.849 5.596 1.00 0.00 H new ATOM 0 HB3 ALA A 98 14.593 0.420 4.594 1.00 0.00 H new ATOM 1417 N ALA A 99 14.449 0.936 1.631 1.00 0.00 N ATOM 1418 CA ALA A 99 15.293 1.297 0.504 1.00 0.00 C ATOM 1419 C ALA A 99 14.458 1.519 -0.753 1.00 0.00 C ATOM 1420 O ALA A 99 14.675 0.874 -1.780 1.00 0.00 O ATOM 1421 CB ALA A 99 16.343 0.222 0.264 1.00 0.00 C ATOM 0 H ALA A 99 14.378 -0.068 1.799 1.00 0.00 H new ATOM 0 HA ALA A 99 15.799 2.232 0.743 1.00 0.00 H new ATOM 0 HB1 ALA A 99 16.968 0.506 -0.583 1.00 0.00 H new ATOM 0 HB2 ALA A 99 16.964 0.115 1.153 1.00 0.00 H new ATOM 0 HB3 ALA A 99 15.850 -0.726 0.050 1.00 0.00 H new ATOM 1427 N GLY A 100 13.500 2.435 -0.664 1.00 0.00 N ATOM 1428 CA GLY A 100 12.643 2.727 -1.798 1.00 0.00 C ATOM 1429 C GLY A 100 11.403 3.503 -1.404 1.00 0.00 C ATOM 1430 O GLY A 100 10.846 4.248 -2.211 1.00 0.00 O ATOM 0 H GLY A 100 13.301 2.981 0.174 1.00 0.00 H new ATOM 0 HA2 GLY A 100 13.205 3.298 -2.537 1.00 0.00 H new ATOM 0 HA3 GLY A 100 12.347 1.793 -2.275 1.00 0.00 H new ATOM 1434 N HIS A 101 10.970 3.332 -0.159 1.00 0.00 N ATOM 1435 CA HIS A 101 9.789 4.026 0.342 1.00 0.00 C ATOM 1436 C HIS A 101 10.104 5.483 0.686 1.00 0.00 C ATOM 1437 O HIS A 101 9.225 6.227 1.121 1.00 0.00 O ATOM 1438 CB HIS A 101 9.236 3.307 1.574 1.00 0.00 C ATOM 1439 CG HIS A 101 8.002 3.943 2.136 1.00 0.00 C ATOM 1440 ND1 HIS A 101 6.836 4.089 1.414 1.00 0.00 N ATOM 1441 CD2 HIS A 101 7.755 4.471 3.359 1.00 0.00 C ATOM 1442 CE1 HIS A 101 5.926 4.680 2.167 1.00 0.00 C ATOM 1443 NE2 HIS A 101 6.458 4.922 3.351 1.00 0.00 N ATOM 0 H HIS A 101 11.419 2.719 0.521 1.00 0.00 H new ATOM 0 HA HIS A 101 9.037 4.018 -0.447 1.00 0.00 H new ATOM 0 HB2 HIS A 101 9.014 2.273 1.312 1.00 0.00 H new ATOM 0 HB3 HIS A 101 10.005 3.282 2.346 1.00 0.00 H new ATOM 0 HD2 HIS A 101 8.448 4.527 4.185 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.918 4.924 1.866 1.00 0.00 H new ATOM 0 HE2 HIS A 101 5.982 5.371 4.133 1.00 0.00 H new ATOM 1452 N GLU A 102 11.357 5.887 0.488 1.00 0.00 N ATOM 1453 CA GLU A 102 11.773 7.251 0.776 1.00 0.00 C ATOM 1454 C GLU A 102 11.381 8.184 -0.363 1.00 0.00 C ATOM 1455 O GLU A 102 11.067 9.353 -0.140 1.00 0.00 O ATOM 1456 CB GLU A 102 13.285 7.309 0.998 1.00 0.00 C ATOM 1457 CG GLU A 102 13.764 6.440 2.151 1.00 0.00 C ATOM 1458 CD GLU A 102 15.265 6.511 2.354 1.00 0.00 C ATOM 1459 OE1 GLU A 102 15.935 7.244 1.595 1.00 0.00 O ATOM 1460 OE2 GLU A 102 15.772 5.835 3.274 1.00 0.00 O ATOM 0 H GLU A 102 12.099 5.287 0.129 1.00 0.00 H new ATOM 0 HA GLU A 102 11.267 7.577 1.685 1.00 0.00 H new ATOM 0 HB2 GLU A 102 13.790 6.997 0.084 1.00 0.00 H new ATOM 0 HB3 GLU A 102 13.577 8.342 1.187 1.00 0.00 H new ATOM 0 HG2 GLU A 102 13.263 6.751 3.067 1.00 0.00 H new ATOM 0 HG3 GLU A 102 13.475 5.406 1.965 1.00 0.00 H new ATOM 1467 N LEU A 103 11.399 7.659 -1.584 1.00 0.00 N ATOM 1468 CA LEU A 103 11.042 8.450 -2.755 1.00 0.00 C ATOM 1469 C LEU A 103 11.044 7.590 -4.015 1.00 0.00 C ATOM 1470 O LEU A 103 10.094 7.620 -4.798 1.00 0.00 O ATOM 1471 CB LEU A 103 12.013 9.624 -2.915 1.00 0.00 C ATOM 1472 CG LEU A 103 11.578 10.701 -3.912 1.00 0.00 C ATOM 1473 CD1 LEU A 103 11.545 10.149 -5.330 1.00 0.00 C ATOM 1474 CD2 LEU A 103 10.215 11.255 -3.523 1.00 0.00 C ATOM 0 H LEU A 103 11.656 6.693 -1.787 1.00 0.00 H new ATOM 0 HA LEU A 103 10.034 8.839 -2.610 1.00 0.00 H new ATOM 0 HB2 LEU A 103 12.157 10.091 -1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 103 12.982 9.233 -3.227 1.00 0.00 H new ATOM 0 HG LEU A 103 12.308 11.510 -3.883 1.00 0.00 H new ATOM 0 HD11 LEU A 103 11.233 10.934 -6.019 1.00 0.00 H new ATOM 0 HD12 LEU A 103 12.539 9.797 -5.607 1.00 0.00 H new ATOM 0 HD13 LEU A 103 10.839 9.320 -5.381 1.00 0.00 H new ATOM 0 HD21 LEU A 103 9.915 12.020 -4.239 1.00 0.00 H new ATOM 0 HD22 LEU A 103 9.481 10.449 -3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 103 10.271 11.693 -2.526 1.00 0.00 H new ATOM 1486 N GLN A 104 12.114 6.825 -4.209 1.00 0.00 N ATOM 1487 CA GLN A 104 12.229 5.962 -5.380 1.00 0.00 C ATOM 1488 C GLN A 104 12.814 4.602 -5.003 1.00 0.00 C ATOM 1489 O GLN A 104 13.800 4.526 -4.270 1.00 0.00 O ATOM 1490 CB GLN A 104 13.102 6.622 -6.452 1.00 0.00 C ATOM 1491 CG GLN A 104 14.553 6.808 -6.035 1.00 0.00 C ATOM 1492 CD GLN A 104 14.713 7.759 -4.866 1.00 0.00 C ATOM 1493 OE1 GLN A 104 14.357 8.934 -4.953 1.00 0.00 O ATOM 1494 NE2 GLN A 104 15.253 7.255 -3.762 1.00 0.00 N ATOM 0 H GLN A 104 12.911 6.785 -3.573 1.00 0.00 H new ATOM 0 HA GLN A 104 11.227 5.811 -5.781 1.00 0.00 H new ATOM 0 HB2 GLN A 104 13.069 6.016 -7.357 1.00 0.00 H new ATOM 0 HB3 GLN A 104 12.679 7.594 -6.704 1.00 0.00 H new ATOM 0 HG2 GLN A 104 14.977 5.839 -5.770 1.00 0.00 H new ATOM 0 HG3 GLN A 104 15.124 7.184 -6.884 1.00 0.00 H new ATOM 0 HE21 GLN A 104 15.534 6.275 -3.733 1.00 0.00 H new ATOM 0 HE22 GLN A 104 15.387 7.848 -2.943 1.00 0.00 H new ATOM 1503 N PRO A 105 12.216 3.505 -5.503 1.00 0.00 N ATOM 1504 CA PRO A 105 12.688 2.149 -5.213 1.00 0.00 C ATOM 1505 C PRO A 105 13.949 1.794 -5.995 1.00 0.00 C ATOM 1506 O PRO A 105 14.889 1.218 -5.448 1.00 0.00 O ATOM 1507 CB PRO A 105 11.519 1.271 -5.657 1.00 0.00 C ATOM 1508 CG PRO A 105 10.863 2.046 -6.746 1.00 0.00 C ATOM 1509 CD PRO A 105 11.034 3.499 -6.390 1.00 0.00 C ATOM 0 HA PRO A 105 12.961 2.025 -4.165 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.864 0.300 -6.013 1.00 0.00 H new ATOM 0 HB3 PRO A 105 10.830 1.082 -4.834 1.00 0.00 H new ATOM 0 HG2 PRO A 105 11.320 1.825 -7.711 1.00 0.00 H new ATOM 0 HG3 PRO A 105 9.807 1.787 -6.827 1.00 0.00 H new ATOM 0 HD2 PRO A 105 11.195 4.112 -7.277 1.00 0.00 H new ATOM 0 HD3 PRO A 105 10.152 3.894 -5.885 1.00 0.00 H new ATOM 1517 N LEU A 106 13.961 2.143 -7.277 1.00 0.00 N ATOM 1518 CA LEU A 106 15.107 1.861 -8.134 1.00 0.00 C ATOM 1519 C LEU A 106 15.285 2.950 -9.188 1.00 0.00 C ATOM 1520 O LEU A 106 14.398 3.778 -9.396 1.00 0.00 O ATOM 1521 CB LEU A 106 14.944 0.492 -8.804 1.00 0.00 C ATOM 1522 CG LEU A 106 13.635 0.287 -9.574 1.00 0.00 C ATOM 1523 CD1 LEU A 106 13.554 1.229 -10.765 1.00 0.00 C ATOM 1524 CD2 LEU A 106 13.507 -1.159 -10.027 1.00 0.00 C ATOM 0 H LEU A 106 13.191 2.621 -7.745 1.00 0.00 H new ATOM 0 HA LEU A 106 16.001 1.845 -7.511 1.00 0.00 H new ATOM 0 HB2 LEU A 106 15.777 0.341 -9.491 1.00 0.00 H new ATOM 0 HB3 LEU A 106 15.019 -0.280 -8.038 1.00 0.00 H new ATOM 0 HG LEU A 106 12.806 0.516 -8.905 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.616 1.065 -11.296 1.00 0.00 H new ATOM 0 HD12 LEU A 106 13.598 2.261 -10.416 1.00 0.00 H new ATOM 0 HD13 LEU A 106 14.390 1.038 -11.438 1.00 0.00 H new ATOM 0 HD21 LEU A 106 12.572 -1.288 -10.572 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.344 -1.412 -10.677 1.00 0.00 H new ATOM 0 HD23 LEU A 106 13.513 -1.815 -9.156 1.00 0.00 H new ATOM 1536 N ALA A 107 16.437 2.942 -9.850 1.00 0.00 N ATOM 1537 CA ALA A 107 16.733 3.927 -10.882 1.00 0.00 C ATOM 1538 C ALA A 107 17.966 3.524 -11.685 1.00 0.00 C ATOM 1539 O ALA A 107 18.881 4.324 -11.882 1.00 0.00 O ATOM 1540 CB ALA A 107 16.930 5.301 -10.258 1.00 0.00 C ATOM 0 H ALA A 107 17.181 2.263 -9.690 1.00 0.00 H new ATOM 0 HA ALA A 107 15.885 3.970 -11.565 1.00 0.00 H new ATOM 0 HB1 ALA A 107 17.151 6.028 -11.040 1.00 0.00 H new ATOM 0 HB2 ALA A 107 16.021 5.596 -9.734 1.00 0.00 H new ATOM 0 HB3 ALA A 107 17.760 5.264 -9.552 1.00 0.00 H new ATOM 1546 N ILE A 108 17.986 2.273 -12.138 1.00 0.00 N ATOM 1547 CA ILE A 108 19.107 1.755 -12.912 1.00 0.00 C ATOM 1548 C ILE A 108 20.354 1.674 -12.036 1.00 0.00 C ATOM 1549 O ILE A 108 21.483 1.756 -12.519 1.00 0.00 O ATOM 1550 CB ILE A 108 19.396 2.623 -14.162 1.00 0.00 C ATOM 1551 CG1 ILE A 108 18.162 2.696 -15.070 1.00 0.00 C ATOM 1552 CG2 ILE A 108 20.582 2.070 -14.941 1.00 0.00 C ATOM 1553 CD1 ILE A 108 17.001 3.462 -14.475 1.00 0.00 C ATOM 0 H ILE A 108 17.236 1.599 -11.981 1.00 0.00 H new ATOM 0 HA ILE A 108 18.836 0.757 -13.257 1.00 0.00 H new ATOM 0 HB ILE A 108 19.640 3.629 -13.821 1.00 0.00 H new ATOM 0 HG12 ILE A 108 18.446 3.162 -16.013 1.00 0.00 H new ATOM 0 HG13 ILE A 108 17.834 1.683 -15.301 1.00 0.00 H new ATOM 0 HG21 ILE A 108 20.767 2.695 -15.815 1.00 0.00 H new ATOM 0 HG22 ILE A 108 21.466 2.066 -14.304 1.00 0.00 H new ATOM 0 HG23 ILE A 108 20.363 1.052 -15.263 1.00 0.00 H new ATOM 0 HD11 ILE A 108 16.169 3.467 -15.179 1.00 0.00 H new ATOM 0 HD12 ILE A 108 16.688 2.985 -13.547 1.00 0.00 H new ATOM 0 HD13 ILE A 108 17.309 4.487 -14.270 1.00 0.00 H new ATOM 1565 N VAL A 109 20.134 1.509 -10.736 1.00 0.00 N ATOM 1566 CA VAL A 109 21.230 1.414 -9.781 1.00 0.00 C ATOM 1567 C VAL A 109 20.872 0.475 -8.634 1.00 0.00 C ATOM 1568 O VAL A 109 21.029 0.815 -7.461 1.00 0.00 O ATOM 1569 CB VAL A 109 21.606 2.799 -9.215 1.00 0.00 C ATOM 1570 CG1 VAL A 109 20.427 3.419 -8.480 1.00 0.00 C ATOM 1571 CG2 VAL A 109 22.821 2.695 -8.303 1.00 0.00 C ATOM 0 H VAL A 109 19.205 1.438 -10.320 1.00 0.00 H new ATOM 0 HA VAL A 109 22.090 1.012 -10.317 1.00 0.00 H new ATOM 0 HB VAL A 109 21.864 3.451 -10.050 1.00 0.00 H new ATOM 0 HG11 VAL A 109 20.714 4.395 -8.089 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.590 3.536 -9.168 1.00 0.00 H new ATOM 0 HG13 VAL A 109 20.131 2.771 -7.655 1.00 0.00 H new ATOM 0 HG21 VAL A 109 23.070 3.682 -7.914 1.00 0.00 H new ATOM 0 HG22 VAL A 109 22.597 2.024 -7.473 1.00 0.00 H new ATOM 0 HG23 VAL A 109 23.667 2.304 -8.868 1.00 0.00 H new ATOM 1581 N ASP A 110 20.391 -0.710 -8.987 1.00 0.00 N ATOM 1582 CA ASP A 110 20.009 -1.706 -7.995 1.00 0.00 C ATOM 1583 C ASP A 110 21.233 -2.238 -7.258 1.00 0.00 C ATOM 1584 O ASP A 110 21.149 -2.620 -6.091 1.00 0.00 O ATOM 1585 CB ASP A 110 19.268 -2.860 -8.668 1.00 0.00 C ATOM 1586 CG ASP A 110 18.016 -2.402 -9.389 1.00 0.00 C ATOM 1587 OD1 ASP A 110 17.118 -1.845 -8.723 1.00 0.00 O ATOM 1588 OD2 ASP A 110 17.933 -2.600 -10.619 1.00 0.00 O ATOM 0 H ASP A 110 20.256 -1.005 -9.954 1.00 0.00 H new ATOM 0 HA ASP A 110 19.350 -1.228 -7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 110 19.934 -3.350 -9.378 1.00 0.00 H new ATOM 0 HB3 ASP A 110 19.000 -3.603 -7.917 1.00 0.00 H new ATOM 1593 N GLN A 111 22.369 -2.260 -7.947 1.00 0.00 N ATOM 1594 CA GLN A 111 23.610 -2.744 -7.355 1.00 0.00 C ATOM 1595 C GLN A 111 24.141 -1.756 -6.325 1.00 0.00 C ATOM 1596 O GLN A 111 24.350 -2.118 -5.169 1.00 0.00 O ATOM 1597 CB GLN A 111 24.668 -2.986 -8.436 1.00 0.00 C ATOM 1598 CG GLN A 111 24.333 -4.133 -9.378 1.00 0.00 C ATOM 1599 CD GLN A 111 23.054 -3.899 -10.158 1.00 0.00 C ATOM 1600 OE1 GLN A 111 22.940 -2.933 -10.912 1.00 0.00 O ATOM 1601 NE2 GLN A 111 22.082 -4.786 -9.979 1.00 0.00 N ATOM 0 H GLN A 111 22.456 -1.949 -8.914 1.00 0.00 H new ATOM 0 HA GLN A 111 23.394 -3.688 -6.855 1.00 0.00 H new ATOM 0 HB2 GLN A 111 24.793 -2.074 -9.019 1.00 0.00 H new ATOM 0 HB3 GLN A 111 25.625 -3.191 -7.955 1.00 0.00 H new ATOM 0 HG2 GLN A 111 25.158 -4.276 -10.076 1.00 0.00 H new ATOM 0 HG3 GLN A 111 24.239 -5.054 -8.803 1.00 0.00 H new ATOM 0 HE21 GLN A 111 22.220 -5.572 -9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 111 21.198 -4.681 -10.477 1.00 0.00 H new ATOM 1610 N ARG A 112 24.358 -0.512 -6.771 1.00 0.00 N ATOM 1611 CA ARG A 112 24.873 0.586 -5.934 1.00 0.00 C ATOM 1612 C ARG A 112 26.350 0.878 -6.227 1.00 0.00 C ATOM 1613 O ARG A 112 26.694 2.004 -6.588 1.00 0.00 O ATOM 1614 CB ARG A 112 24.662 0.344 -4.430 1.00 0.00 C ATOM 1615 CG ARG A 112 23.235 0.600 -3.960 1.00 0.00 C ATOM 1616 CD ARG A 112 22.217 -0.210 -4.750 1.00 0.00 C ATOM 1617 NE ARG A 112 20.846 0.067 -4.324 1.00 0.00 N ATOM 1618 CZ ARG A 112 20.239 1.241 -4.490 1.00 0.00 C ATOM 1619 NH1 ARG A 112 20.857 2.236 -5.113 1.00 0.00 N ATOM 1620 NH2 ARG A 112 19.002 1.415 -4.043 1.00 0.00 N ATOM 0 H ARG A 112 24.179 -0.233 -7.736 1.00 0.00 H new ATOM 0 HA ARG A 112 24.286 1.464 -6.204 1.00 0.00 H new ATOM 0 HB2 ARG A 112 24.933 -0.686 -4.196 1.00 0.00 H new ATOM 0 HB3 ARG A 112 25.340 0.987 -3.869 1.00 0.00 H new ATOM 0 HG2 ARG A 112 23.152 0.352 -2.902 1.00 0.00 H new ATOM 0 HG3 ARG A 112 23.007 1.661 -4.057 1.00 0.00 H new ATOM 0 HD2 ARG A 112 22.319 0.016 -5.811 1.00 0.00 H new ATOM 0 HD3 ARG A 112 22.427 -1.273 -4.629 1.00 0.00 H new ATOM 0 HE ARG A 112 20.323 -0.684 -3.873 1.00 0.00 H new ATOM 0 HH11 ARG A 112 21.804 2.105 -5.469 1.00 0.00 H new ATOM 0 HH12 ARG A 112 20.385 3.132 -5.236 1.00 0.00 H new ATOM 0 HH21 ARG A 112 18.517 0.650 -3.573 1.00 0.00 H new ATOM 0 HH22 ARG A 112 18.536 2.313 -4.169 1.00 0.00 H new ATOM 1634 N PRO A 113 27.252 -0.116 -6.089 1.00 0.00 N ATOM 1635 CA PRO A 113 28.682 0.083 -6.357 1.00 0.00 C ATOM 1636 C PRO A 113 28.936 0.758 -7.695 1.00 0.00 C ATOM 1637 O PRO A 113 29.668 1.744 -7.773 1.00 0.00 O ATOM 1638 CB PRO A 113 29.239 -1.340 -6.365 1.00 0.00 C ATOM 1639 CG PRO A 113 28.330 -2.096 -5.464 1.00 0.00 C ATOM 1640 CD PRO A 113 26.965 -1.502 -5.671 1.00 0.00 C ATOM 0 HA PRO A 113 29.146 0.737 -5.619 1.00 0.00 H new ATOM 0 HB2 PRO A 113 29.242 -1.760 -7.371 1.00 0.00 H new ATOM 0 HB3 PRO A 113 30.268 -1.366 -6.005 1.00 0.00 H new ATOM 0 HG2 PRO A 113 28.335 -3.159 -5.705 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.644 -2.004 -4.424 1.00 0.00 H new ATOM 0 HD2 PRO A 113 26.403 -2.043 -6.433 1.00 0.00 H new ATOM 0 HD3 PRO A 113 26.372 -1.531 -4.757 1.00 0.00 H new ATOM 1648 N SER A 114 28.341 0.211 -8.750 1.00 0.00 N ATOM 1649 CA SER A 114 28.513 0.749 -10.096 1.00 0.00 C ATOM 1650 C SER A 114 29.937 0.518 -10.603 1.00 0.00 C ATOM 1651 O SER A 114 30.251 0.832 -11.751 1.00 0.00 O ATOM 1652 CB SER A 114 28.180 2.244 -10.130 1.00 0.00 C ATOM 1653 OG SER A 114 28.310 2.763 -11.442 1.00 0.00 O ATOM 0 H SER A 114 27.734 -0.607 -8.699 1.00 0.00 H new ATOM 0 HA SER A 114 27.823 0.221 -10.754 1.00 0.00 H new ATOM 0 HB2 SER A 114 27.163 2.402 -9.772 1.00 0.00 H new ATOM 0 HB3 SER A 114 28.843 2.784 -9.454 1.00 0.00 H new ATOM 0 HG SER A 114 28.919 2.196 -11.959 1.00 0.00 H new ATOM 1659 N SER A 115 30.797 -0.037 -9.747 1.00 0.00 N ATOM 1660 CA SER A 115 32.179 -0.309 -10.125 1.00 0.00 C ATOM 1661 C SER A 115 32.360 -1.783 -10.475 1.00 0.00 C ATOM 1662 O SER A 115 33.179 -2.136 -11.323 1.00 0.00 O ATOM 1663 CB SER A 115 33.128 0.079 -8.989 1.00 0.00 C ATOM 1664 OG SER A 115 34.476 -0.178 -9.341 1.00 0.00 O ATOM 0 H SER A 115 30.559 -0.305 -8.792 1.00 0.00 H new ATOM 0 HA SER A 115 32.417 0.290 -11.004 1.00 0.00 H new ATOM 0 HB2 SER A 115 33.005 1.136 -8.754 1.00 0.00 H new ATOM 0 HB3 SER A 115 32.871 -0.480 -8.089 1.00 0.00 H new ATOM 0 HG SER A 115 35.063 0.080 -8.599 1.00 0.00 H new ATOM 1670 N ARG A 116 31.584 -2.637 -9.815 1.00 0.00 N ATOM 1671 CA ARG A 116 31.647 -4.074 -10.052 1.00 0.00 C ATOM 1672 C ARG A 116 30.869 -4.444 -11.312 1.00 0.00 C ATOM 1673 O ARG A 116 30.544 -3.578 -12.125 1.00 0.00 O ATOM 1674 CB ARG A 116 31.098 -4.838 -8.841 1.00 0.00 C ATOM 1675 CG ARG A 116 31.960 -4.723 -7.591 1.00 0.00 C ATOM 1676 CD ARG A 116 32.079 -3.285 -7.109 1.00 0.00 C ATOM 1677 NE ARG A 116 32.799 -3.190 -5.841 1.00 0.00 N ATOM 1678 CZ ARG A 116 34.089 -3.484 -5.694 1.00 0.00 C ATOM 1679 NH1 ARG A 116 34.821 -3.841 -6.743 1.00 0.00 N ATOM 1680 NH2 ARG A 116 34.654 -3.405 -4.497 1.00 0.00 N ATOM 0 H ARG A 116 30.902 -2.357 -9.110 1.00 0.00 H new ATOM 0 HA ARG A 116 32.690 -4.355 -10.197 1.00 0.00 H new ATOM 0 HB2 ARG A 116 30.098 -4.469 -8.615 1.00 0.00 H new ATOM 0 HB3 ARG A 116 30.997 -5.891 -9.104 1.00 0.00 H new ATOM 0 HG2 ARG A 116 31.532 -5.336 -6.798 1.00 0.00 H new ATOM 0 HG3 ARG A 116 32.954 -5.119 -7.799 1.00 0.00 H new ATOM 0 HD2 ARG A 116 32.594 -2.691 -7.864 1.00 0.00 H new ATOM 0 HD3 ARG A 116 31.083 -2.858 -6.993 1.00 0.00 H new ATOM 0 HE ARG A 116 32.282 -2.880 -5.019 1.00 0.00 H new ATOM 0 HH11 ARG A 116 34.395 -3.891 -7.669 1.00 0.00 H new ATOM 0 HH12 ARG A 116 35.809 -4.065 -6.623 1.00 0.00 H new ATOM 0 HH21 ARG A 116 34.100 -3.119 -3.690 1.00 0.00 H new ATOM 0 HH22 ARG A 116 35.642 -3.630 -4.384 1.00 0.00 H new ATOM 1694 N ALA A 117 30.581 -5.731 -11.476 1.00 0.00 N ATOM 1695 CA ALA A 117 29.852 -6.205 -12.645 1.00 0.00 C ATOM 1696 C ALA A 117 30.677 -6.011 -13.914 1.00 0.00 C ATOM 1697 O ALA A 117 30.136 -5.980 -15.019 1.00 0.00 O ATOM 1698 CB ALA A 117 28.512 -5.491 -12.765 1.00 0.00 C ATOM 0 H ALA A 117 30.841 -6.463 -10.815 1.00 0.00 H new ATOM 0 HA ALA A 117 29.665 -7.272 -12.520 1.00 0.00 H new ATOM 0 HB1 ALA A 117 27.982 -5.858 -13.644 1.00 0.00 H new ATOM 0 HB2 ALA A 117 27.915 -5.685 -11.874 1.00 0.00 H new ATOM 0 HB3 ALA A 117 28.679 -4.418 -12.864 1.00 0.00 H new ATOM 1704 N SER A 118 31.992 -5.878 -13.744 1.00 0.00 N ATOM 1705 CA SER A 118 32.901 -5.686 -14.870 1.00 0.00 C ATOM 1706 C SER A 118 32.454 -4.526 -15.750 1.00 0.00 C ATOM 1707 O SER A 118 32.414 -4.638 -16.975 1.00 0.00 O ATOM 1708 CB SER A 118 33.007 -6.968 -15.700 1.00 0.00 C ATOM 1709 OG SER A 118 31.749 -7.337 -16.238 1.00 0.00 O ATOM 0 H SER A 118 32.451 -5.900 -12.834 1.00 0.00 H new ATOM 0 HA SER A 118 33.884 -5.445 -14.465 1.00 0.00 H new ATOM 0 HB2 SER A 118 33.723 -6.822 -16.509 1.00 0.00 H new ATOM 0 HB3 SER A 118 33.390 -7.776 -15.077 1.00 0.00 H new ATOM 0 HG SER A 118 31.121 -6.591 -16.143 1.00 0.00 H new ATOM 1715 N SER A 119 32.134 -3.404 -15.116 1.00 0.00 N ATOM 1716 CA SER A 119 31.709 -2.215 -15.841 1.00 0.00 C ATOM 1717 C SER A 119 32.912 -1.503 -16.461 1.00 0.00 C ATOM 1718 O SER A 119 32.756 -0.510 -17.171 1.00 0.00 O ATOM 1719 CB SER A 119 30.961 -1.262 -14.908 1.00 0.00 C ATOM 1720 OG SER A 119 30.539 -0.098 -15.598 1.00 0.00 O ATOM 0 H SER A 119 32.161 -3.294 -14.102 1.00 0.00 H new ATOM 0 HA SER A 119 31.037 -2.525 -16.642 1.00 0.00 H new ATOM 0 HB2 SER A 119 30.096 -1.770 -14.482 1.00 0.00 H new ATOM 0 HB3 SER A 119 31.607 -0.981 -14.076 1.00 0.00 H new ATOM 0 HG SER A 119 31.130 0.061 -16.364 1.00 0.00 H new ATOM 1726 N ARG A 120 34.112 -2.016 -16.188 1.00 0.00 N ATOM 1727 CA ARG A 120 35.336 -1.427 -16.720 1.00 0.00 C ATOM 1728 C ARG A 120 35.777 -2.133 -17.999 1.00 0.00 C ATOM 1729 O ARG A 120 36.551 -1.588 -18.786 1.00 0.00 O ATOM 1730 CB ARG A 120 36.449 -1.495 -15.677 1.00 0.00 C ATOM 1731 CG ARG A 120 36.113 -0.775 -14.381 1.00 0.00 C ATOM 1732 CD ARG A 120 37.247 -0.881 -13.375 1.00 0.00 C ATOM 1733 NE ARG A 120 38.485 -0.290 -13.878 1.00 0.00 N ATOM 1734 CZ ARG A 120 39.624 -0.256 -13.190 1.00 0.00 C ATOM 1735 NH1 ARG A 120 39.687 -0.779 -11.972 1.00 0.00 N ATOM 1736 NH2 ARG A 120 40.704 0.300 -13.723 1.00 0.00 N ATOM 0 H ARG A 120 34.260 -2.838 -15.602 1.00 0.00 H new ATOM 0 HA ARG A 120 35.131 -0.384 -16.960 1.00 0.00 H new ATOM 0 HB2 ARG A 120 36.666 -2.540 -15.457 1.00 0.00 H new ATOM 0 HB3 ARG A 120 37.357 -1.063 -16.098 1.00 0.00 H new ATOM 0 HG2 ARG A 120 35.907 0.275 -14.590 1.00 0.00 H new ATOM 0 HG3 ARG A 120 35.205 -1.199 -13.953 1.00 0.00 H new ATOM 0 HD2 ARG A 120 36.958 -0.383 -12.450 1.00 0.00 H new ATOM 0 HD3 ARG A 120 37.419 -1.930 -13.132 1.00 0.00 H new ATOM 0 HE ARG A 120 38.476 0.121 -14.812 1.00 0.00 H new ATOM 0 HH11 ARG A 120 38.860 -1.210 -11.559 1.00 0.00 H new ATOM 0 HH12 ARG A 120 40.562 -0.750 -11.449 1.00 0.00 H new ATOM 0 HH21 ARG A 120 40.661 0.701 -14.660 1.00 0.00 H new ATOM 0 HH22 ARG A 120 41.577 0.326 -13.196 1.00 0.00 H new ATOM 1750 N ALA A 121 35.277 -3.346 -18.201 1.00 0.00 N ATOM 1751 CA ALA A 121 35.614 -4.128 -19.385 1.00 0.00 C ATOM 1752 C ALA A 121 37.118 -4.368 -19.497 1.00 0.00 C ATOM 1753 O ALA A 121 37.778 -3.838 -20.391 1.00 0.00 O ATOM 1754 CB ALA A 121 35.094 -3.436 -20.636 1.00 0.00 C ATOM 0 H ALA A 121 34.635 -3.811 -17.559 1.00 0.00 H new ATOM 0 HA ALA A 121 35.133 -5.101 -19.287 1.00 0.00 H new ATOM 0 HB1 ALA A 121 35.352 -4.029 -21.514 1.00 0.00 H new ATOM 0 HB2 ALA A 121 34.011 -3.334 -20.572 1.00 0.00 H new ATOM 0 HB3 ALA A 121 35.547 -2.448 -20.720 1.00 0.00 H new ATOM 1760 N SER A 122 37.651 -5.180 -18.589 1.00 0.00 N ATOM 1761 CA SER A 122 39.073 -5.506 -18.588 1.00 0.00 C ATOM 1762 C SER A 122 39.934 -4.250 -18.503 1.00 0.00 C ATOM 1763 O SER A 122 40.660 -3.916 -19.440 1.00 0.00 O ATOM 1764 CB SER A 122 39.433 -6.302 -19.844 1.00 0.00 C ATOM 1765 OG SER A 122 38.698 -7.512 -19.910 1.00 0.00 O ATOM 0 H SER A 122 37.118 -5.625 -17.842 1.00 0.00 H new ATOM 0 HA SER A 122 39.275 -6.113 -17.705 1.00 0.00 H new ATOM 0 HB2 SER A 122 39.230 -5.701 -20.730 1.00 0.00 H new ATOM 0 HB3 SER A 122 40.501 -6.521 -19.846 1.00 0.00 H new ATOM 0 HG SER A 122 38.945 -8.001 -20.723 1.00 0.00 H new ATOM 1771 N SER A 123 39.855 -3.560 -17.371 1.00 0.00 N ATOM 1772 CA SER A 123 40.635 -2.345 -17.162 1.00 0.00 C ATOM 1773 C SER A 123 41.661 -2.543 -16.053 1.00 0.00 C ATOM 1774 O SER A 123 42.026 -1.595 -15.357 1.00 0.00 O ATOM 1775 CB SER A 123 39.716 -1.174 -16.815 1.00 0.00 C ATOM 1776 OG SER A 123 40.453 0.026 -16.664 1.00 0.00 O ATOM 0 H SER A 123 39.260 -3.820 -16.585 1.00 0.00 H new ATOM 0 HA SER A 123 41.163 -2.120 -18.089 1.00 0.00 H new ATOM 0 HB2 SER A 123 38.969 -1.049 -17.599 1.00 0.00 H new ATOM 0 HB3 SER A 123 39.177 -1.392 -15.893 1.00 0.00 H new ATOM 0 HG SER A 123 41.302 -0.166 -16.213 1.00 0.00 H new ATOM 1782 N ARG A 124 42.125 -3.777 -15.894 1.00 0.00 N ATOM 1783 CA ARG A 124 43.111 -4.090 -14.868 1.00 0.00 C ATOM 1784 C ARG A 124 44.293 -4.858 -15.449 1.00 0.00 C ATOM 1785 O ARG A 124 44.115 -5.821 -16.195 1.00 0.00 O ATOM 1786 CB ARG A 124 42.482 -4.911 -13.744 1.00 0.00 C ATOM 1787 CG ARG A 124 41.429 -4.156 -12.949 1.00 0.00 C ATOM 1788 CD ARG A 124 40.842 -5.018 -11.842 1.00 0.00 C ATOM 1789 NE ARG A 124 39.817 -4.308 -11.078 1.00 0.00 N ATOM 1790 CZ ARG A 124 38.647 -3.923 -11.582 1.00 0.00 C ATOM 1791 NH1 ARG A 124 38.325 -4.218 -12.836 1.00 0.00 N ATOM 1792 NH2 ARG A 124 37.788 -3.255 -10.825 1.00 0.00 N ATOM 0 H ARG A 124 41.835 -4.574 -16.460 1.00 0.00 H new ATOM 0 HA ARG A 124 43.470 -3.142 -14.467 1.00 0.00 H new ATOM 0 HB2 ARG A 124 42.030 -5.807 -14.170 1.00 0.00 H new ATOM 0 HB3 ARG A 124 43.268 -5.243 -13.065 1.00 0.00 H new ATOM 0 HG2 ARG A 124 41.872 -3.259 -12.517 1.00 0.00 H new ATOM 0 HG3 ARG A 124 40.633 -3.828 -13.617 1.00 0.00 H new ATOM 0 HD2 ARG A 124 40.411 -5.920 -12.276 1.00 0.00 H new ATOM 0 HD3 ARG A 124 41.639 -5.337 -11.170 1.00 0.00 H new ATOM 0 HE ARG A 124 40.011 -4.095 -10.099 1.00 0.00 H new ATOM 0 HH11 ARG A 124 38.976 -4.743 -13.420 1.00 0.00 H new ATOM 0 HH12 ARG A 124 37.426 -3.920 -13.215 1.00 0.00 H new ATOM 0 HH21 ARG A 124 38.024 -3.036 -9.857 1.00 0.00 H new ATOM 0 HH22 ARG A 124 36.891 -2.960 -11.210 1.00 0.00 H new ATOM 1806 N PRO A 125 45.523 -4.450 -15.098 1.00 0.00 N ATOM 1807 CA PRO A 125 46.737 -5.115 -15.573 1.00 0.00 C ATOM 1808 C PRO A 125 46.867 -6.521 -14.984 1.00 0.00 C ATOM 1809 O PRO A 125 45.863 -7.165 -14.681 1.00 0.00 O ATOM 1810 CB PRO A 125 47.860 -4.192 -15.079 1.00 0.00 C ATOM 1811 CG PRO A 125 47.284 -3.485 -13.904 1.00 0.00 C ATOM 1812 CD PRO A 125 45.822 -3.319 -14.199 1.00 0.00 C ATOM 0 HA PRO A 125 46.751 -5.258 -16.653 1.00 0.00 H new ATOM 0 HB2 PRO A 125 48.747 -4.762 -14.802 1.00 0.00 H new ATOM 0 HB3 PRO A 125 48.163 -3.488 -15.854 1.00 0.00 H new ATOM 0 HG2 PRO A 125 47.435 -4.059 -12.990 1.00 0.00 H new ATOM 0 HG3 PRO A 125 47.765 -2.518 -13.756 1.00 0.00 H new ATOM 0 HD2 PRO A 125 45.222 -3.359 -13.290 1.00 0.00 H new ATOM 0 HD3 PRO A 125 45.615 -2.361 -14.676 1.00 0.00 H new ATOM 1820 N ARG A 126 48.097 -6.993 -14.816 1.00 0.00 N ATOM 1821 CA ARG A 126 48.329 -8.323 -14.254 1.00 0.00 C ATOM 1822 C ARG A 126 49.629 -8.381 -13.447 1.00 0.00 C ATOM 1823 O ARG A 126 49.627 -8.836 -12.304 1.00 0.00 O ATOM 1824 CB ARG A 126 48.332 -9.393 -15.353 1.00 0.00 C ATOM 1825 CG ARG A 126 47.049 -9.432 -16.167 1.00 0.00 C ATOM 1826 CD ARG A 126 47.105 -10.506 -17.242 1.00 0.00 C ATOM 1827 NE ARG A 126 45.877 -10.555 -18.032 1.00 0.00 N ATOM 1828 CZ ARG A 126 45.674 -11.407 -19.034 1.00 0.00 C ATOM 1829 NH1 ARG A 126 46.613 -12.283 -19.370 1.00 0.00 N ATOM 1830 NH2 ARG A 126 44.528 -11.385 -19.700 1.00 0.00 N ATOM 0 H ARG A 126 48.945 -6.481 -15.058 1.00 0.00 H new ATOM 0 HA ARG A 126 47.505 -8.530 -13.571 1.00 0.00 H new ATOM 0 HB2 ARG A 126 49.172 -9.211 -16.023 1.00 0.00 H new ATOM 0 HB3 ARG A 126 48.493 -10.370 -14.897 1.00 0.00 H new ATOM 0 HG2 ARG A 126 46.203 -9.621 -15.506 1.00 0.00 H new ATOM 0 HG3 ARG A 126 46.881 -8.460 -16.630 1.00 0.00 H new ATOM 0 HD2 ARG A 126 47.952 -10.316 -17.901 1.00 0.00 H new ATOM 0 HD3 ARG A 126 47.275 -11.477 -16.776 1.00 0.00 H new ATOM 0 HE ARG A 126 45.132 -9.898 -17.802 1.00 0.00 H new ATOM 0 HH11 ARG A 126 47.496 -12.306 -18.859 1.00 0.00 H new ATOM 0 HH12 ARG A 126 46.452 -12.934 -20.139 1.00 0.00 H new ATOM 0 HH21 ARG A 126 43.802 -10.715 -19.444 1.00 0.00 H new ATOM 0 HH22 ARG A 126 44.372 -12.038 -20.468 1.00 0.00 H new ATOM 1844 N PRO A 127 50.762 -7.924 -14.018 1.00 0.00 N ATOM 1845 CA PRO A 127 52.052 -7.936 -13.330 1.00 0.00 C ATOM 1846 C PRO A 127 52.179 -6.778 -12.350 1.00 0.00 C ATOM 1847 O PRO A 127 52.845 -6.885 -11.321 1.00 0.00 O ATOM 1848 CB PRO A 127 53.078 -7.794 -14.470 1.00 0.00 C ATOM 1849 CG PRO A 127 52.284 -7.781 -15.741 1.00 0.00 C ATOM 1850 CD PRO A 127 50.895 -7.361 -15.363 1.00 0.00 C ATOM 0 HA PRO A 127 52.191 -8.839 -12.735 1.00 0.00 H new ATOM 0 HB2 PRO A 127 53.657 -6.877 -14.362 1.00 0.00 H new ATOM 0 HB3 PRO A 127 53.788 -8.621 -14.462 1.00 0.00 H new ATOM 0 HG2 PRO A 127 52.717 -7.089 -16.463 1.00 0.00 H new ATOM 0 HG3 PRO A 127 52.279 -8.766 -16.207 1.00 0.00 H new ATOM 0 HD2 PRO A 127 50.782 -6.277 -15.364 1.00 0.00 H new ATOM 0 HD3 PRO A 127 50.147 -7.760 -16.048 1.00 0.00 H new ATOM 1858 N ASP A 128 51.530 -5.673 -12.693 1.00 0.00 N ATOM 1859 CA ASP A 128 51.539 -4.463 -11.881 1.00 0.00 C ATOM 1860 C ASP A 128 50.931 -3.323 -12.683 1.00 0.00 C ATOM 1861 O ASP A 128 50.214 -2.478 -12.148 1.00 0.00 O ATOM 1862 CB ASP A 128 52.966 -4.095 -11.458 1.00 0.00 C ATOM 1863 CG ASP A 128 53.017 -2.825 -10.632 1.00 0.00 C ATOM 1864 OD1 ASP A 128 52.386 -2.792 -9.554 1.00 0.00 O ATOM 1865 OD2 ASP A 128 53.688 -1.863 -11.061 1.00 0.00 O ATOM 0 H ASP A 128 50.979 -5.590 -13.548 1.00 0.00 H new ATOM 0 HA ASP A 128 50.954 -4.641 -10.979 1.00 0.00 H new ATOM 0 HB2 ASP A 128 53.394 -4.916 -10.883 1.00 0.00 H new ATOM 0 HB3 ASP A 128 53.585 -3.972 -12.347 1.00 0.00 H new ATOM 1870 N ASP A 129 51.224 -3.330 -13.981 1.00 0.00 N ATOM 1871 CA ASP A 129 50.720 -2.320 -14.910 1.00 0.00 C ATOM 1872 C ASP A 129 51.431 -2.438 -16.251 1.00 0.00 C ATOM 1873 O ASP A 129 51.841 -1.443 -16.847 1.00 0.00 O ATOM 1874 CB ASP A 129 50.897 -0.909 -14.339 1.00 0.00 C ATOM 1875 CG ASP A 129 50.366 0.166 -15.267 1.00 0.00 C ATOM 1876 OD1 ASP A 129 49.156 0.140 -15.576 1.00 0.00 O ATOM 1877 OD2 ASP A 129 51.160 1.035 -15.685 1.00 0.00 O ATOM 0 H ASP A 129 51.817 -4.035 -14.419 1.00 0.00 H new ATOM 0 HA ASP A 129 49.654 -2.495 -15.056 1.00 0.00 H new ATOM 0 HB2 ASP A 129 50.383 -0.842 -13.380 1.00 0.00 H new ATOM 0 HB3 ASP A 129 51.955 -0.729 -14.147 1.00 0.00 H new ATOM 1882 N LEU A 130 51.573 -3.672 -16.715 1.00 0.00 N ATOM 1883 CA LEU A 130 52.233 -3.944 -17.982 1.00 0.00 C ATOM 1884 C LEU A 130 53.665 -3.419 -17.981 1.00 0.00 C ATOM 1885 O LEU A 130 54.258 -3.207 -19.039 1.00 0.00 O ATOM 1886 CB LEU A 130 51.449 -3.326 -19.142 1.00 0.00 C ATOM 1887 CG LEU A 130 50.030 -3.869 -19.334 1.00 0.00 C ATOM 1888 CD1 LEU A 130 49.160 -3.538 -18.132 1.00 0.00 C ATOM 1889 CD2 LEU A 130 49.416 -3.312 -20.610 1.00 0.00 C ATOM 0 H LEU A 130 51.238 -4.504 -16.229 1.00 0.00 H new ATOM 0 HA LEU A 130 52.264 -5.026 -18.114 1.00 0.00 H new ATOM 0 HB2 LEU A 130 51.390 -2.249 -18.986 1.00 0.00 H new ATOM 0 HB3 LEU A 130 52.009 -3.485 -20.063 1.00 0.00 H new ATOM 0 HG LEU A 130 50.087 -4.954 -19.424 1.00 0.00 H new ATOM 0 HD11 LEU A 130 48.156 -3.933 -18.289 1.00 0.00 H new ATOM 0 HD12 LEU A 130 49.590 -3.987 -17.237 1.00 0.00 H new ATOM 0 HD13 LEU A 130 49.109 -2.456 -18.007 1.00 0.00 H new ATOM 0 HD21 LEU A 130 48.408 -3.708 -20.731 1.00 0.00 H new ATOM 0 HD22 LEU A 130 49.374 -2.225 -20.549 1.00 0.00 H new ATOM 0 HD23 LEU A 130 50.026 -3.604 -21.465 1.00 0.00 H new ATOM 1901 N GLU A 131 54.220 -3.218 -16.790 1.00 0.00 N ATOM 1902 CA GLU A 131 55.584 -2.726 -16.658 1.00 0.00 C ATOM 1903 C GLU A 131 56.495 -3.820 -16.115 1.00 0.00 C ATOM 1904 O GLU A 131 57.483 -3.539 -15.437 1.00 0.00 O ATOM 1905 CB GLU A 131 55.625 -1.508 -15.733 1.00 0.00 C ATOM 1906 CG GLU A 131 55.197 -1.814 -14.307 1.00 0.00 C ATOM 1907 CD GLU A 131 55.188 -0.582 -13.424 1.00 0.00 C ATOM 1908 OE1 GLU A 131 56.259 0.040 -13.262 1.00 0.00 O ATOM 1909 OE2 GLU A 131 54.110 -0.238 -12.896 1.00 0.00 O ATOM 0 H GLU A 131 53.745 -3.389 -15.904 1.00 0.00 H new ATOM 0 HA GLU A 131 55.938 -2.431 -17.646 1.00 0.00 H new ATOM 0 HB2 GLU A 131 56.638 -1.105 -15.721 1.00 0.00 H new ATOM 0 HB3 GLU A 131 54.977 -0.731 -16.139 1.00 0.00 H new ATOM 0 HG2 GLU A 131 54.201 -2.256 -14.318 1.00 0.00 H new ATOM 0 HG3 GLU A 131 55.871 -2.557 -13.881 1.00 0.00 H new ATOM 1916 N ILE A 132 56.152 -5.070 -16.415 1.00 0.00 N ATOM 1917 CA ILE A 132 56.935 -6.212 -15.956 1.00 0.00 C ATOM 1918 C ILE A 132 56.851 -6.356 -14.440 1.00 0.00 C ATOM 1919 O ILE A 132 57.276 -5.419 -13.732 1.00 0.00 O ATOM 1920 CB ILE A 132 58.416 -6.083 -16.371 1.00 0.00 C ATOM 1921 CG1 ILE A 132 58.528 -5.914 -17.888 1.00 0.00 C ATOM 1922 CG2 ILE A 132 59.208 -7.299 -15.909 1.00 0.00 C ATOM 1923 CD1 ILE A 132 59.953 -5.762 -18.375 1.00 0.00 C ATOM 1924 OXT ILE A 132 56.360 -7.405 -13.972 1.00 0.00 O ATOM 0 H ILE A 132 55.336 -5.317 -16.975 1.00 0.00 H new ATOM 0 HA ILE A 132 56.512 -7.099 -16.428 1.00 0.00 H new ATOM 0 HB ILE A 132 58.836 -5.199 -15.891 1.00 0.00 H new ATOM 0 HG12 ILE A 132 58.076 -6.777 -18.376 1.00 0.00 H new ATOM 0 HG13 ILE A 132 57.953 -5.039 -18.192 1.00 0.00 H new ATOM 0 HG21 ILE A 132 60.250 -7.191 -16.210 1.00 0.00 H new ATOM 0 HG22 ILE A 132 59.151 -7.380 -14.823 1.00 0.00 H new ATOM 0 HG23 ILE A 132 58.791 -8.198 -16.362 1.00 0.00 H new ATOM 0 HD11 ILE A 132 59.957 -5.647 -19.459 1.00 0.00 H new ATOM 0 HD12 ILE A 132 60.403 -4.882 -17.915 1.00 0.00 H new ATOM 0 HD13 ILE A 132 60.527 -6.648 -18.102 1.00 0.00 H new TER 1936 ILE A 132