USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1089 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 100 TYR OH : rot 15:sc= -0.614 USER MOD Set 1.2: A 104 MET CE :methyl 175:sc= -2.99 (180deg=-3.13) USER MOD Set 2.1: A 83 SER OG : rot 22:sc= 0.0376 USER MOD Set 2.2: A 88 SER OG : rot 109:sc= 0.00808 USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.0954 (180deg=0) USER MOD Single : A 2 SER OG : rot -150:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 15:sc= 0.377! USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -170:sc= -0.385 (180deg=-0.528) USER MOD Single : A 14 HIS : no HD1:sc= -3.65! C(o=-3.6!,f=-4.6!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.366) USER MOD Single : A 28 TYR OH : rot -92:sc= 0.366 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 31 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-3.4!) USER MOD Single : A 36 LYS NZ :NH3+ -129:sc= -0.316 (180deg=-1.13!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0121 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -4.72! C(o=-4.7!,f=-4.7!) USER MOD Single : A 55 GLN :FLIP amide:sc= -2.65! C(o=-5.6!,f=-2.7!) USER MOD Single : A 56 GLN : amide:sc= -0.0333 K(o=-0.033,f=-1) USER MOD Single : A 58 ASN : amide:sc= -1.95 K(o=-1.9,f=-11!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 CYS SG : rot -72:sc= 0.615 USER MOD Single : A 69 ASN : amide:sc= -0.139 K(o=-0.14,f=-1.4!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.0129 X(o=-0.013,f=-0.013) USER MOD Single : A 74 LYS NZ :NH3+ 156:sc= -0.0653 (180deg=-0.446) USER MOD Single : A 76 CYS SG : rot 180:sc= -1.42 USER MOD Single : A 78 LYS NZ :NH3+ 175:sc= -1.69 (180deg=-1.79) USER MOD Single : A 87 MET CE :methyl 154:sc= -0.615 (180deg=-1.22) USER MOD Single : A 91 TYR OH : rot 117:sc= 0.226 USER MOD Single : A 94 CYS SG : rot -120:sc= -0.612 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 GLN : amide:sc= -0.887 K(o=-0.89,f=-6.4!) USER MOD Single : A 99 GLN : amide:sc= -0.422 K(o=-0.42,f=-2.8!) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl 165:sc= -1.58 (180deg=-2.13) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.0174 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.196 K(o=-0.2,f=-1.8!) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -3.47! C(o=-3.5!,f=-3.2!) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.253 -15.392 4.784 1.00 0.00 N ATOM 2 CA GLY A 1 3.607 -15.722 5.187 1.00 0.00 C ATOM 3 C GLY A 1 4.319 -14.553 5.839 1.00 0.00 C ATOM 4 O GLY A 1 3.746 -13.474 5.989 1.00 0.00 O ATOM 0 H1 GLY A 1 1.586 -16.050 5.236 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.031 -14.419 5.076 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.170 -15.470 3.750 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.582 -16.561 5.882 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.173 -16.048 4.314 1.00 0.00 H new ATOM 8 N SER A 2 5.572 -14.768 6.229 1.00 0.00 N ATOM 9 CA SER A 2 6.361 -13.725 6.874 1.00 0.00 C ATOM 10 C SER A 2 7.820 -14.150 7.003 1.00 0.00 C ATOM 11 O SER A 2 8.120 -15.328 7.196 1.00 0.00 O ATOM 12 CB SER A 2 5.787 -13.403 8.255 1.00 0.00 C ATOM 13 OG SER A 2 6.679 -12.594 9.002 1.00 0.00 O ATOM 0 H SER A 2 6.062 -15.655 6.109 1.00 0.00 H new ATOM 0 HA SER A 2 6.315 -12.831 6.252 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.832 -12.890 8.145 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.591 -14.329 8.796 1.00 0.00 H new ATOM 0 HG SER A 2 6.568 -12.781 9.958 1.00 0.00 H new ATOM 19 N SER A 3 8.724 -13.182 6.895 1.00 0.00 N ATOM 20 CA SER A 3 10.153 -13.454 6.996 1.00 0.00 C ATOM 21 C SER A 3 10.873 -12.320 7.719 1.00 0.00 C ATOM 22 O SER A 3 10.646 -11.145 7.436 1.00 0.00 O ATOM 23 CB SER A 3 10.756 -13.650 5.603 1.00 0.00 C ATOM 24 OG SER A 3 10.386 -12.593 4.735 1.00 0.00 O ATOM 0 H SER A 3 8.492 -12.201 6.737 1.00 0.00 H new ATOM 0 HA SER A 3 10.283 -14.369 7.573 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.842 -13.701 5.677 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.420 -14.600 5.188 1.00 0.00 H new ATOM 0 HG SER A 3 10.785 -12.740 3.852 1.00 0.00 H new ATOM 30 N GLY A 4 11.744 -12.683 8.657 1.00 0.00 N ATOM 31 CA GLY A 4 12.484 -11.686 9.407 1.00 0.00 C ATOM 32 C GLY A 4 13.712 -11.196 8.666 1.00 0.00 C ATOM 33 O GLY A 4 14.564 -11.991 8.268 1.00 0.00 O ATOM 0 H GLY A 4 11.950 -13.650 8.910 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.832 -10.840 9.622 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.786 -12.107 10.366 1.00 0.00 H new ATOM 37 N SER A 5 13.803 -9.883 8.477 1.00 0.00 N ATOM 38 CA SER A 5 14.933 -9.289 7.773 1.00 0.00 C ATOM 39 C SER A 5 15.802 -8.477 8.729 1.00 0.00 C ATOM 40 O SER A 5 15.314 -7.589 9.427 1.00 0.00 O ATOM 41 CB SER A 5 14.439 -8.396 6.633 1.00 0.00 C ATOM 42 OG SER A 5 13.957 -7.159 7.127 1.00 0.00 O ATOM 0 H SER A 5 13.108 -9.211 8.802 1.00 0.00 H new ATOM 0 HA SER A 5 15.536 -10.097 7.358 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.251 -8.218 5.928 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.647 -8.906 6.085 1.00 0.00 H new ATOM 0 HG SER A 5 14.251 -7.040 8.054 1.00 0.00 H new ATOM 48 N SER A 6 17.094 -8.790 8.754 1.00 0.00 N ATOM 49 CA SER A 6 18.032 -8.093 9.627 1.00 0.00 C ATOM 50 C SER A 6 18.128 -6.617 9.253 1.00 0.00 C ATOM 51 O SER A 6 18.655 -6.265 8.199 1.00 0.00 O ATOM 52 CB SER A 6 19.415 -8.742 9.545 1.00 0.00 C ATOM 53 OG SER A 6 19.475 -9.917 10.336 1.00 0.00 O ATOM 0 H SER A 6 17.515 -9.521 8.180 1.00 0.00 H new ATOM 0 HA SER A 6 17.663 -8.168 10.650 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.645 -8.986 8.508 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.173 -8.034 9.881 1.00 0.00 H new ATOM 0 HG SER A 6 20.368 -10.314 10.265 1.00 0.00 H new ATOM 59 N GLY A 7 17.612 -5.757 10.127 1.00 0.00 N ATOM 60 CA GLY A 7 17.649 -4.329 9.872 1.00 0.00 C ATOM 61 C GLY A 7 16.292 -3.774 9.486 1.00 0.00 C ATOM 62 O GLY A 7 15.337 -4.528 9.299 1.00 0.00 O ATOM 0 H GLY A 7 17.169 -6.024 11.006 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.009 -3.813 10.762 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.363 -4.124 9.074 1.00 0.00 H new ATOM 66 N ILE A 8 16.207 -2.454 9.368 1.00 0.00 N ATOM 67 CA ILE A 8 14.957 -1.799 9.002 1.00 0.00 C ATOM 68 C ILE A 8 14.197 -2.610 7.957 1.00 0.00 C ATOM 69 O ILE A 8 14.517 -2.592 6.768 1.00 0.00 O ATOM 70 CB ILE A 8 15.203 -0.381 8.455 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.915 0.477 9.503 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.888 0.263 8.041 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.105 0.689 10.763 1.00 0.00 C ATOM 0 H ILE A 8 16.989 -1.817 9.520 1.00 0.00 H new ATOM 0 HA ILE A 8 14.359 -1.730 9.911 1.00 0.00 H new ATOM 0 HB ILE A 8 15.843 -0.453 7.575 1.00 0.00 H new ATOM 0 HG12 ILE A 8 16.862 0.005 9.765 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.153 1.447 9.066 1.00 0.00 H new ATOM 0 HG21 ILE A 8 14.079 1.265 7.656 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.416 -0.340 7.265 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.226 0.326 8.905 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.672 1.306 11.460 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.169 1.189 10.514 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.890 -0.275 11.224 1.00 0.00 H new ATOM 85 N PRO A 9 13.165 -3.337 8.409 1.00 0.00 N ATOM 86 CA PRO A 9 12.336 -4.167 7.529 1.00 0.00 C ATOM 87 C PRO A 9 11.466 -3.332 6.596 1.00 0.00 C ATOM 88 O PRO A 9 10.404 -2.849 6.989 1.00 0.00 O ATOM 89 CB PRO A 9 11.464 -4.959 8.506 1.00 0.00 C ATOM 90 CG PRO A 9 11.402 -4.113 9.731 1.00 0.00 C ATOM 91 CD PRO A 9 12.727 -3.406 9.813 1.00 0.00 C ATOM 0 HA PRO A 9 12.940 -4.793 6.871 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.470 -5.135 8.096 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.897 -5.936 8.721 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.581 -3.398 9.671 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.229 -4.723 10.618 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.626 -2.413 10.252 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.438 -3.956 10.429 1.00 0.00 H new ATOM 99 N GLU A 10 11.922 -3.166 5.358 1.00 0.00 N ATOM 100 CA GLU A 10 11.184 -2.389 4.370 1.00 0.00 C ATOM 101 C GLU A 10 10.755 -3.266 3.197 1.00 0.00 C ATOM 102 O GLU A 10 11.416 -4.253 2.872 1.00 0.00 O ATOM 103 CB GLU A 10 12.037 -1.224 3.864 1.00 0.00 C ATOM 104 CG GLU A 10 12.457 -0.257 4.958 1.00 0.00 C ATOM 105 CD GLU A 10 13.739 0.481 4.625 1.00 0.00 C ATOM 106 OE1 GLU A 10 13.657 1.567 4.014 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.825 -0.028 4.974 1.00 0.00 O ATOM 0 H GLU A 10 12.799 -3.559 5.016 1.00 0.00 H new ATOM 0 HA GLU A 10 10.290 -1.993 4.852 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.929 -1.621 3.380 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.478 -0.679 3.104 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.659 0.466 5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.590 -0.805 5.891 1.00 0.00 H new ATOM 114 N LEU A 11 9.645 -2.900 2.567 1.00 0.00 N ATOM 115 CA LEU A 11 9.126 -3.653 1.431 1.00 0.00 C ATOM 116 C LEU A 11 9.476 -2.965 0.116 1.00 0.00 C ATOM 117 O LEU A 11 9.434 -1.739 0.013 1.00 0.00 O ATOM 118 CB LEU A 11 7.609 -3.811 1.548 1.00 0.00 C ATOM 119 CG LEU A 11 7.118 -5.062 2.278 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.798 -4.787 2.981 1.00 0.00 C ATOM 121 CD2 LEU A 11 6.976 -6.225 1.307 1.00 0.00 C ATOM 0 H LEU A 11 9.087 -2.086 2.824 1.00 0.00 H new ATOM 0 HA LEU A 11 9.590 -4.639 1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.211 -2.936 2.062 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.185 -3.811 0.544 1.00 0.00 H new ATOM 0 HG LEU A 11 7.857 -5.333 3.032 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.465 -5.689 3.495 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.932 -3.985 3.706 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.049 -4.490 2.246 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.626 -7.107 1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.258 -5.964 0.530 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.943 -6.438 0.851 1.00 0.00 H new ATOM 133 N LYS A 12 9.822 -3.762 -0.890 1.00 0.00 N ATOM 134 CA LYS A 12 10.177 -3.231 -2.200 1.00 0.00 C ATOM 135 C LYS A 12 9.308 -3.849 -3.291 1.00 0.00 C ATOM 136 O LYS A 12 9.491 -5.009 -3.662 1.00 0.00 O ATOM 137 CB LYS A 12 11.654 -3.498 -2.498 1.00 0.00 C ATOM 138 CG LYS A 12 12.585 -3.097 -1.367 1.00 0.00 C ATOM 139 CD LYS A 12 13.049 -1.657 -1.511 1.00 0.00 C ATOM 140 CE LYS A 12 14.069 -1.291 -0.445 1.00 0.00 C ATOM 141 NZ LYS A 12 13.515 -1.444 0.929 1.00 0.00 N ATOM 0 H LYS A 12 9.864 -4.779 -0.822 1.00 0.00 H new ATOM 0 HA LYS A 12 10.004 -2.155 -2.187 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.787 -4.559 -2.708 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.938 -2.956 -3.400 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.074 -3.222 -0.412 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.450 -3.760 -1.355 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.486 -1.511 -2.499 1.00 0.00 H new ATOM 0 HD3 LYS A 12 12.191 -0.988 -1.440 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.950 -1.923 -0.554 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.395 -0.261 -0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.174 -1.028 1.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 12.598 -0.957 0.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 13.385 -2.454 1.141 1.00 0.00 H new ATOM 155 N ASP A 13 8.362 -3.068 -3.802 1.00 0.00 N ATOM 156 CA ASP A 13 7.467 -3.538 -4.852 1.00 0.00 C ATOM 157 C ASP A 13 6.572 -2.407 -5.349 1.00 0.00 C ATOM 158 O ASP A 13 6.123 -1.567 -4.568 1.00 0.00 O ATOM 159 CB ASP A 13 6.609 -4.696 -4.340 1.00 0.00 C ATOM 160 CG ASP A 13 7.297 -6.038 -4.494 1.00 0.00 C ATOM 161 OD1 ASP A 13 7.785 -6.330 -5.606 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.346 -6.797 -3.503 1.00 0.00 O ATOM 0 H ASP A 13 8.196 -2.106 -3.506 1.00 0.00 H new ATOM 0 HA ASP A 13 8.076 -3.888 -5.685 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.371 -4.531 -3.289 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.664 -4.711 -4.882 1.00 0.00 H new ATOM 167 N HIS A 14 6.317 -2.390 -6.654 1.00 0.00 N ATOM 168 CA HIS A 14 5.476 -1.361 -7.256 1.00 0.00 C ATOM 169 C HIS A 14 4.080 -1.904 -7.548 1.00 0.00 C ATOM 170 O HIS A 14 3.905 -2.760 -8.416 1.00 0.00 O ATOM 171 CB HIS A 14 6.114 -0.840 -8.544 1.00 0.00 C ATOM 172 CG HIS A 14 5.156 -0.112 -9.435 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.727 -0.612 -10.646 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.541 1.084 -9.284 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.891 0.247 -11.203 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.761 1.284 -10.396 1.00 0.00 N ATOM 0 H HIS A 14 6.681 -3.077 -7.315 1.00 0.00 H new ATOM 0 HA HIS A 14 5.386 -0.538 -6.547 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.937 -0.173 -8.288 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.542 -1.679 -9.093 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.645 1.756 -8.445 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.398 0.122 -12.156 1.00 0.00 H new ATOM 0 HE2 HIS A 14 3.176 2.101 -10.570 1.00 0.00 H new ATOM 185 N LEU A 15 3.091 -1.401 -6.819 1.00 0.00 N ATOM 186 CA LEU A 15 1.710 -1.835 -7.000 1.00 0.00 C ATOM 187 C LEU A 15 1.014 -1.004 -8.073 1.00 0.00 C ATOM 188 O LEU A 15 1.635 -0.159 -8.718 1.00 0.00 O ATOM 189 CB LEU A 15 0.944 -1.728 -5.680 1.00 0.00 C ATOM 190 CG LEU A 15 1.669 -2.251 -4.439 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.213 -1.498 -3.199 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.435 -3.745 -4.275 1.00 0.00 C ATOM 0 H LEU A 15 3.219 -0.692 -6.097 1.00 0.00 H new ATOM 0 HA LEU A 15 1.722 -2.876 -7.323 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.691 -0.681 -5.514 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.004 -2.271 -5.783 1.00 0.00 H new ATOM 0 HG LEU A 15 2.738 -2.084 -4.568 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.739 -1.883 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.433 -0.437 -3.316 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.140 -1.634 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.958 -4.100 -3.387 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.367 -3.936 -4.168 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.812 -4.271 -5.152 1.00 0.00 H new ATOM 204 N ARG A 16 -0.279 -1.249 -8.258 1.00 0.00 N ATOM 205 CA ARG A 16 -1.060 -0.523 -9.253 1.00 0.00 C ATOM 206 C ARG A 16 -1.512 0.829 -8.708 1.00 0.00 C ATOM 207 O ARG A 16 -2.287 0.896 -7.753 1.00 0.00 O ATOM 208 CB ARG A 16 -2.277 -1.347 -9.677 1.00 0.00 C ATOM 209 CG ARG A 16 -2.716 -1.090 -11.110 1.00 0.00 C ATOM 210 CD ARG A 16 -3.468 -2.281 -11.683 1.00 0.00 C ATOM 211 NE ARG A 16 -2.573 -3.387 -12.012 1.00 0.00 N ATOM 212 CZ ARG A 16 -2.908 -4.390 -12.817 1.00 0.00 C ATOM 213 NH1 ARG A 16 -4.112 -4.424 -13.372 1.00 0.00 N ATOM 214 NH2 ARG A 16 -2.039 -5.360 -13.067 1.00 0.00 N ATOM 0 H ARG A 16 -0.808 -1.945 -7.732 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.425 -0.351 -10.122 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.047 -2.406 -9.561 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.107 -1.126 -9.006 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -3.352 -0.206 -11.144 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -1.843 -0.878 -11.727 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -4.213 -2.620 -10.963 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -4.007 -1.972 -12.579 1.00 0.00 H new ATOM 0 HE ARG A 16 -1.639 -3.390 -11.601 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -4.783 -3.680 -13.181 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -4.367 -5.195 -13.990 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -1.112 -5.337 -12.641 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -2.297 -6.129 -13.685 1.00 0.00 H new ATOM 228 N ILE A 17 -1.024 1.901 -9.321 1.00 0.00 N ATOM 229 CA ILE A 17 -1.378 3.250 -8.898 1.00 0.00 C ATOM 230 C ILE A 17 -2.159 3.980 -9.985 1.00 0.00 C ATOM 231 O ILE A 17 -1.819 3.904 -11.166 1.00 0.00 O ATOM 232 CB ILE A 17 -0.128 4.074 -8.539 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.435 3.626 -7.188 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.461 5.559 -8.513 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.663 4.398 -6.759 1.00 0.00 C ATOM 0 H ILE A 17 -0.382 1.862 -10.113 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.003 3.148 -8.011 1.00 0.00 H new ATOM 0 HB ILE A 17 0.631 3.905 -9.303 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.338 3.736 -6.427 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.682 2.566 -7.240 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.433 6.128 -8.258 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -0.820 5.869 -9.494 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.235 5.745 -7.768 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.007 4.027 -5.794 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.452 4.268 -7.500 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.416 5.456 -6.674 1.00 0.00 H new ATOM 247 N PHE A 18 -3.207 4.690 -9.579 1.00 0.00 N ATOM 248 CA PHE A 18 -4.036 5.435 -10.518 1.00 0.00 C ATOM 249 C PHE A 18 -4.688 6.634 -9.836 1.00 0.00 C ATOM 250 O PHE A 18 -5.180 6.531 -8.712 1.00 0.00 O ATOM 251 CB PHE A 18 -5.114 4.525 -11.113 1.00 0.00 C ATOM 252 CG PHE A 18 -6.369 5.255 -11.498 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.322 6.327 -12.373 1.00 0.00 C ATOM 254 CD2 PHE A 18 -7.596 4.869 -10.983 1.00 0.00 C ATOM 255 CE1 PHE A 18 -7.475 7.001 -12.730 1.00 0.00 C ATOM 256 CE2 PHE A 18 -8.752 5.538 -11.336 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.692 6.606 -12.210 1.00 0.00 C ATOM 0 H PHE A 18 -3.502 4.765 -8.605 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.394 5.800 -11.320 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.710 4.024 -11.993 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.362 3.748 -10.390 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.373 6.641 -12.782 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -7.649 4.036 -10.298 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -7.424 7.835 -13.414 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -9.702 5.226 -10.929 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.595 7.131 -12.486 1.00 0.00 H new ATOM 267 N ARG A 19 -4.685 7.772 -10.523 1.00 0.00 N ATOM 268 CA ARG A 19 -5.274 8.992 -9.983 1.00 0.00 C ATOM 269 C ARG A 19 -5.947 9.804 -11.085 1.00 0.00 C ATOM 270 O ARG A 19 -5.292 10.452 -11.901 1.00 0.00 O ATOM 271 CB ARG A 19 -4.202 9.838 -9.293 1.00 0.00 C ATOM 272 CG ARG A 19 -3.802 9.315 -7.923 1.00 0.00 C ATOM 273 CD ARG A 19 -2.666 10.131 -7.326 1.00 0.00 C ATOM 274 NE ARG A 19 -1.357 9.633 -7.742 1.00 0.00 N ATOM 275 CZ ARG A 19 -0.738 10.029 -8.849 1.00 0.00 C ATOM 276 NH1 ARG A 19 -1.306 10.924 -9.646 1.00 0.00 N ATOM 277 NH2 ARG A 19 0.451 9.530 -9.160 1.00 0.00 N ATOM 0 H ARG A 19 -4.281 7.875 -11.454 1.00 0.00 H new ATOM 0 HA ARG A 19 -6.030 8.708 -9.251 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.318 9.879 -9.929 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -4.568 10.860 -9.190 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -4.663 9.345 -7.255 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -3.498 8.271 -8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -2.770 11.173 -7.628 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.734 10.106 -6.238 1.00 0.00 H new ATOM 0 HE ARG A 19 -0.893 8.944 -7.150 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -2.220 11.310 -9.410 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.829 11.226 -10.495 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.891 8.842 -8.549 1.00 0.00 H new ATOM 0 HH22 ARG A 19 0.925 9.835 -10.010 1.00 0.00 H new ATOM 291 N PRO A 20 -7.288 9.769 -11.111 1.00 0.00 N ATOM 292 CA PRO A 20 -8.080 10.496 -12.108 1.00 0.00 C ATOM 293 C PRO A 20 -8.025 12.006 -11.902 1.00 0.00 C ATOM 294 O PRO A 20 -8.545 12.772 -12.714 1.00 0.00 O ATOM 295 CB PRO A 20 -9.501 9.976 -11.880 1.00 0.00 C ATOM 296 CG PRO A 20 -9.518 9.529 -10.459 1.00 0.00 C ATOM 297 CD PRO A 20 -8.134 9.017 -10.170 1.00 0.00 C ATOM 0 HA PRO A 20 -7.710 10.334 -13.120 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.241 10.756 -12.058 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.735 9.154 -12.556 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.776 10.353 -9.794 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.263 8.749 -10.304 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.846 9.201 -9.135 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.061 7.942 -10.335 1.00 0.00 H new ATOM 305 N ARG A 21 -7.394 12.427 -10.811 1.00 0.00 N ATOM 306 CA ARG A 21 -7.273 13.846 -10.499 1.00 0.00 C ATOM 307 C ARG A 21 -6.728 14.622 -11.694 1.00 0.00 C ATOM 308 O ARG A 21 -7.327 15.601 -12.139 1.00 0.00 O ATOM 309 CB ARG A 21 -6.360 14.047 -9.287 1.00 0.00 C ATOM 310 CG ARG A 21 -6.407 15.455 -8.717 1.00 0.00 C ATOM 311 CD ARG A 21 -5.379 16.359 -9.378 1.00 0.00 C ATOM 312 NE ARG A 21 -5.568 17.761 -9.015 1.00 0.00 N ATOM 313 CZ ARG A 21 -5.269 18.257 -7.819 1.00 0.00 C ATOM 314 NH1 ARG A 21 -4.769 17.469 -6.877 1.00 0.00 N ATOM 315 NH2 ARG A 21 -5.469 19.544 -7.564 1.00 0.00 N ATOM 0 H ARG A 21 -6.959 11.806 -10.129 1.00 0.00 H new ATOM 0 HA ARG A 21 -8.267 14.227 -10.264 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.643 13.339 -8.508 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.334 13.814 -9.573 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.404 15.872 -8.858 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -6.225 15.420 -7.643 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -4.377 16.041 -9.088 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.446 16.253 -10.461 1.00 0.00 H new ATOM 0 HE ARG A 21 -5.950 18.394 -9.718 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -4.613 16.480 -7.070 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -4.540 17.852 -5.960 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.853 20.153 -8.286 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -5.239 19.924 -6.646 1.00 0.00 H new ATOM 329 N LYS A 22 -5.587 14.178 -12.211 1.00 0.00 N ATOM 330 CA LYS A 22 -4.960 14.828 -13.355 1.00 0.00 C ATOM 331 C LYS A 22 -5.979 15.083 -14.461 1.00 0.00 C ATOM 332 O LYS A 22 -7.067 14.507 -14.462 1.00 0.00 O ATOM 333 CB LYS A 22 -3.813 13.968 -13.891 1.00 0.00 C ATOM 334 CG LYS A 22 -2.509 14.152 -13.134 1.00 0.00 C ATOM 335 CD LYS A 22 -1.714 15.330 -13.670 1.00 0.00 C ATOM 336 CE LYS A 22 -0.835 14.922 -14.843 1.00 0.00 C ATOM 337 NZ LYS A 22 -0.578 16.061 -15.767 1.00 0.00 N ATOM 0 H LYS A 22 -5.077 13.369 -11.855 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.562 15.787 -13.024 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.105 12.919 -13.845 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -3.650 14.208 -14.942 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.720 14.306 -12.076 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.911 13.244 -13.211 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -2.397 16.119 -13.983 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.093 15.743 -12.875 1.00 0.00 H new ATOM 0 HE2 LYS A 22 0.114 14.537 -14.469 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.315 14.111 -15.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 0.024 15.742 -16.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.481 16.413 -16.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -0.097 16.825 -15.251 1.00 0.00 H new ATOM 351 N LEU A 23 -5.618 15.948 -15.403 1.00 0.00 N ATOM 352 CA LEU A 23 -6.500 16.278 -16.517 1.00 0.00 C ATOM 353 C LEU A 23 -6.376 15.247 -17.634 1.00 0.00 C ATOM 354 O LEU A 23 -7.370 14.666 -18.072 1.00 0.00 O ATOM 355 CB LEU A 23 -6.175 17.672 -17.056 1.00 0.00 C ATOM 356 CG LEU A 23 -6.823 18.045 -18.389 1.00 0.00 C ATOM 357 CD1 LEU A 23 -8.334 18.144 -18.239 1.00 0.00 C ATOM 358 CD2 LEU A 23 -6.251 19.353 -18.914 1.00 0.00 C ATOM 0 H LEU A 23 -4.721 16.433 -15.417 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.526 16.268 -16.150 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.477 18.407 -16.310 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -5.094 17.754 -17.165 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.600 17.259 -19.111 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.778 18.410 -19.198 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.731 17.184 -17.910 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -8.577 18.909 -17.502 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.725 19.602 -19.864 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.442 20.149 -18.194 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.176 19.247 -19.061 1.00 0.00 H new ATOM 370 N THR A 24 -5.148 15.022 -18.091 1.00 0.00 N ATOM 371 CA THR A 24 -4.893 14.060 -19.156 1.00 0.00 C ATOM 372 C THR A 24 -4.946 12.631 -18.630 1.00 0.00 C ATOM 373 O THR A 24 -4.318 12.306 -17.622 1.00 0.00 O ATOM 374 CB THR A 24 -3.522 14.302 -19.815 1.00 0.00 C ATOM 375 OG1 THR A 24 -3.347 13.413 -20.924 1.00 0.00 O ATOM 376 CG2 THR A 24 -2.396 14.098 -18.812 1.00 0.00 C ATOM 0 H THR A 24 -4.314 15.493 -17.740 1.00 0.00 H new ATOM 0 HA THR A 24 -5.676 14.199 -19.902 1.00 0.00 H new ATOM 0 HB THR A 24 -3.490 15.333 -20.168 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.474 13.575 -21.338 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.438 14.274 -19.300 1.00 0.00 H new ATOM 0 HG22 THR A 24 -2.515 14.797 -17.984 1.00 0.00 H new ATOM 0 HG23 THR A 24 -2.427 13.077 -18.432 1.00 0.00 H new ATOM 384 N LEU A 25 -5.698 11.779 -19.319 1.00 0.00 N ATOM 385 CA LEU A 25 -5.832 10.382 -18.921 1.00 0.00 C ATOM 386 C LEU A 25 -4.466 9.759 -18.653 1.00 0.00 C ATOM 387 O LEU A 25 -3.703 9.485 -19.579 1.00 0.00 O ATOM 388 CB LEU A 25 -6.562 9.590 -20.008 1.00 0.00 C ATOM 389 CG LEU A 25 -8.088 9.562 -19.907 1.00 0.00 C ATOM 390 CD1 LEU A 25 -8.535 8.571 -18.845 1.00 0.00 C ATOM 391 CD2 LEU A 25 -8.628 10.952 -19.603 1.00 0.00 C ATOM 0 H LEU A 25 -6.224 12.031 -20.156 1.00 0.00 H new ATOM 0 HA LEU A 25 -6.414 10.346 -18.000 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.290 10.006 -20.978 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.197 8.563 -19.988 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.490 9.239 -20.867 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -9.623 8.565 -18.788 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.180 7.574 -19.105 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.123 8.862 -17.879 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -9.715 10.913 -19.535 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -8.217 11.303 -18.656 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -8.339 11.637 -20.400 1.00 0.00 H new ATOM 403 N LYS A 26 -4.165 9.535 -17.378 1.00 0.00 N ATOM 404 CA LYS A 26 -2.893 8.940 -16.986 1.00 0.00 C ATOM 405 C LYS A 26 -3.052 7.449 -16.708 1.00 0.00 C ATOM 406 O LYS A 26 -2.176 6.649 -17.035 1.00 0.00 O ATOM 407 CB LYS A 26 -2.338 9.644 -15.746 1.00 0.00 C ATOM 408 CG LYS A 26 -1.666 10.972 -16.050 1.00 0.00 C ATOM 409 CD LYS A 26 -0.278 10.773 -16.636 1.00 0.00 C ATOM 410 CE LYS A 26 0.757 10.532 -15.548 1.00 0.00 C ATOM 411 NZ LYS A 26 1.966 9.841 -16.075 1.00 0.00 N ATOM 0 H LYS A 26 -4.785 9.757 -16.599 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.193 9.065 -17.812 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.151 9.811 -15.039 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -1.620 8.987 -15.256 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.279 11.540 -16.750 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -1.595 11.563 -15.137 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.290 9.926 -17.322 1.00 0.00 H new ATOM 0 HD3 LYS A 26 0.002 11.651 -17.218 1.00 0.00 H new ATOM 0 HE2 LYS A 26 1.047 11.485 -15.106 1.00 0.00 H new ATOM 0 HE3 LYS A 26 0.314 9.933 -14.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.340 9.194 -15.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 1.713 9.299 -16.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.691 10.546 -16.317 1.00 0.00 H new ATOM 425 N GLY A 27 -4.177 7.081 -16.103 1.00 0.00 N ATOM 426 CA GLY A 27 -4.431 5.686 -15.793 1.00 0.00 C ATOM 427 C GLY A 27 -3.375 5.093 -14.881 1.00 0.00 C ATOM 428 O GLY A 27 -3.383 5.333 -13.673 1.00 0.00 O ATOM 0 H GLY A 27 -4.917 7.724 -15.822 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.409 5.594 -15.320 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.470 5.113 -16.719 1.00 0.00 H new ATOM 432 N TYR A 28 -2.465 4.317 -15.458 1.00 0.00 N ATOM 433 CA TYR A 28 -1.400 3.685 -14.689 1.00 0.00 C ATOM 434 C TYR A 28 -0.080 3.722 -15.453 1.00 0.00 C ATOM 435 O TYR A 28 -0.059 3.649 -16.681 1.00 0.00 O ATOM 436 CB TYR A 28 -1.771 2.238 -14.358 1.00 0.00 C ATOM 437 CG TYR A 28 -3.136 2.092 -13.726 1.00 0.00 C ATOM 438 CD1 TYR A 28 -4.292 2.202 -14.488 1.00 0.00 C ATOM 439 CD2 TYR A 28 -3.270 1.843 -12.365 1.00 0.00 C ATOM 440 CE1 TYR A 28 -5.542 2.070 -13.913 1.00 0.00 C ATOM 441 CE2 TYR A 28 -4.515 1.708 -11.782 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.648 1.823 -12.561 1.00 0.00 C ATOM 443 OH TYR A 28 -6.891 1.689 -11.985 1.00 0.00 O ATOM 0 H TYR A 28 -2.443 4.110 -16.457 1.00 0.00 H new ATOM 0 HA TYR A 28 -1.277 4.243 -13.761 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.738 1.645 -15.272 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.021 1.825 -13.683 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.213 2.394 -15.548 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.385 1.753 -11.753 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.431 2.160 -14.520 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.601 1.514 -10.723 1.00 0.00 H new ATOM 0 HH TYR A 28 -7.195 2.561 -11.656 1.00 0.00 H new ATOM 453 N ARG A 29 1.020 3.836 -14.715 1.00 0.00 N ATOM 454 CA ARG A 29 2.345 3.883 -15.322 1.00 0.00 C ATOM 455 C ARG A 29 3.363 3.140 -14.462 1.00 0.00 C ATOM 456 O ARG A 29 3.070 2.756 -13.330 1.00 0.00 O ATOM 457 CB ARG A 29 2.788 5.334 -15.517 1.00 0.00 C ATOM 458 CG ARG A 29 2.286 5.956 -16.810 1.00 0.00 C ATOM 459 CD ARG A 29 3.262 5.728 -17.953 1.00 0.00 C ATOM 460 NE ARG A 29 3.048 4.439 -18.607 1.00 0.00 N ATOM 461 CZ ARG A 29 3.860 3.942 -19.534 1.00 0.00 C ATOM 462 NH1 ARG A 29 4.933 4.622 -19.914 1.00 0.00 N ATOM 463 NH2 ARG A 29 3.598 2.763 -20.082 1.00 0.00 N ATOM 0 H ARG A 29 1.020 3.897 -13.697 1.00 0.00 H new ATOM 0 HA ARG A 29 2.290 3.393 -16.294 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.433 5.929 -14.676 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.877 5.378 -15.502 1.00 0.00 H new ATOM 0 HG2 ARG A 29 1.316 5.530 -17.068 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.136 7.026 -16.666 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.156 6.528 -18.685 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.283 5.777 -17.573 1.00 0.00 H new ATOM 0 HE ARG A 29 2.231 3.891 -18.337 1.00 0.00 H new ATOM 0 HH11 ARG A 29 5.137 5.529 -19.494 1.00 0.00 H new ATOM 0 HH12 ARG A 29 5.555 4.238 -20.626 1.00 0.00 H new ATOM 0 HH21 ARG A 29 2.773 2.238 -19.792 1.00 0.00 H new ATOM 0 HH22 ARG A 29 4.221 2.382 -20.794 1.00 0.00 H new ATOM 477 N GLN A 30 4.558 2.942 -15.008 1.00 0.00 N ATOM 478 CA GLN A 30 5.619 2.244 -14.291 1.00 0.00 C ATOM 479 C GLN A 30 6.292 3.168 -13.280 1.00 0.00 C ATOM 480 O GLN A 30 7.023 4.086 -13.654 1.00 0.00 O ATOM 481 CB GLN A 30 6.657 1.702 -15.274 1.00 0.00 C ATOM 482 CG GLN A 30 7.588 0.665 -14.666 1.00 0.00 C ATOM 483 CD GLN A 30 8.403 -0.072 -15.711 1.00 0.00 C ATOM 484 OE1 GLN A 30 8.329 0.233 -16.901 1.00 0.00 O ATOM 485 NE2 GLN A 30 9.187 -1.049 -15.270 1.00 0.00 N ATOM 0 H GLN A 30 4.816 3.255 -15.944 1.00 0.00 H new ATOM 0 HA GLN A 30 5.170 1.410 -13.751 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.142 1.260 -16.127 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.251 2.532 -15.656 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.263 1.155 -13.964 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.001 -0.054 -14.095 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.218 -1.268 -14.274 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.759 -1.580 -15.927 1.00 0.00 H new ATOM 494 N HIS A 31 6.040 2.919 -11.999 1.00 0.00 N ATOM 495 CA HIS A 31 6.622 3.728 -10.934 1.00 0.00 C ATOM 496 C HIS A 31 7.235 2.844 -9.853 1.00 0.00 C ATOM 497 O HIS A 31 7.039 1.629 -9.846 1.00 0.00 O ATOM 498 CB HIS A 31 5.561 4.642 -10.322 1.00 0.00 C ATOM 499 CG HIS A 31 4.862 5.506 -11.326 1.00 0.00 C ATOM 500 ND1 HIS A 31 5.532 6.331 -12.204 1.00 0.00 N ATOM 501 CD2 HIS A 31 3.544 5.669 -11.589 1.00 0.00 C ATOM 502 CE1 HIS A 31 4.656 6.966 -12.964 1.00 0.00 C ATOM 503 NE2 HIS A 31 3.443 6.581 -12.611 1.00 0.00 N ATOM 0 H HIS A 31 5.437 2.164 -11.673 1.00 0.00 H new ATOM 0 HA HIS A 31 7.412 4.341 -11.367 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.822 4.031 -9.804 1.00 0.00 H new ATOM 0 HB3 HIS A 31 6.031 5.278 -9.572 1.00 0.00 H new ATOM 0 HD2 HIS A 31 2.725 5.174 -11.089 1.00 0.00 H new ATOM 0 HE1 HIS A 31 4.892 7.678 -13.741 1.00 0.00 H new ATOM 0 HE2 HIS A 31 2.572 6.908 -13.030 1.00 0.00 H new ATOM 512 N TRP A 32 7.978 3.461 -8.942 1.00 0.00 N ATOM 513 CA TRP A 32 8.620 2.729 -7.856 1.00 0.00 C ATOM 514 C TRP A 32 7.995 3.089 -6.512 1.00 0.00 C ATOM 515 O TRP A 32 7.872 4.265 -6.169 1.00 0.00 O ATOM 516 CB TRP A 32 10.121 3.027 -7.830 1.00 0.00 C ATOM 517 CG TRP A 32 10.856 2.279 -6.760 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.622 2.815 -5.764 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.897 0.859 -6.580 1.00 0.00 C ATOM 520 NE1 TRP A 32 12.136 1.813 -4.976 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.706 0.604 -5.455 1.00 0.00 C ATOM 522 CE3 TRP A 32 10.328 -0.222 -7.259 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.959 -0.686 -4.997 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.580 -1.502 -6.803 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.389 -1.725 -5.681 1.00 0.00 C ATOM 0 H TRP A 32 8.151 4.466 -8.933 1.00 0.00 H new ATOM 0 HA TRP A 32 8.471 1.664 -8.031 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.551 2.776 -8.800 1.00 0.00 H new ATOM 0 HB3 TRP A 32 10.269 4.097 -7.683 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.798 3.870 -5.617 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.740 1.948 -4.165 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.703 -0.060 -8.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.583 -0.860 -4.133 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 10.146 -2.345 -7.320 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.566 -2.737 -5.349 1.00 0.00 H new ATOM 536 N VAL A 33 7.602 2.070 -5.755 1.00 0.00 N ATOM 537 CA VAL A 33 6.991 2.279 -4.448 1.00 0.00 C ATOM 538 C VAL A 33 7.767 1.553 -3.356 1.00 0.00 C ATOM 539 O VAL A 33 8.316 0.474 -3.581 1.00 0.00 O ATOM 540 CB VAL A 33 5.528 1.798 -4.429 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.932 1.953 -3.038 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.704 2.557 -5.459 1.00 0.00 C ATOM 0 H VAL A 33 7.696 1.091 -6.025 1.00 0.00 H new ATOM 0 HA VAL A 33 7.016 3.352 -4.255 1.00 0.00 H new ATOM 0 HB VAL A 33 5.509 0.740 -4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.898 1.608 -3.045 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.508 1.360 -2.327 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.962 3.002 -2.744 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.673 2.204 -5.432 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.729 3.623 -5.231 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.119 2.388 -6.453 1.00 0.00 H new ATOM 552 N VAL A 34 7.810 2.152 -2.170 1.00 0.00 N ATOM 553 CA VAL A 34 8.518 1.562 -1.040 1.00 0.00 C ATOM 554 C VAL A 34 7.784 1.829 0.269 1.00 0.00 C ATOM 555 O VAL A 34 7.481 2.975 0.601 1.00 0.00 O ATOM 556 CB VAL A 34 9.955 2.108 -0.931 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.647 1.548 0.302 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.745 1.783 -2.190 1.00 0.00 C ATOM 0 H VAL A 34 7.363 3.046 -1.967 1.00 0.00 H new ATOM 0 HA VAL A 34 8.558 0.487 -1.218 1.00 0.00 H new ATOM 0 HB VAL A 34 9.907 3.192 -0.830 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.660 1.945 0.362 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.091 1.837 1.194 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.686 0.461 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.757 2.176 -2.096 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.786 0.702 -2.325 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.258 2.238 -3.053 1.00 0.00 H new ATOM 568 N PHE A 35 7.500 0.763 1.009 1.00 0.00 N ATOM 569 CA PHE A 35 6.800 0.881 2.283 1.00 0.00 C ATOM 570 C PHE A 35 7.787 0.892 3.447 1.00 0.00 C ATOM 571 O PHE A 35 8.543 -0.059 3.645 1.00 0.00 O ATOM 572 CB PHE A 35 5.808 -0.271 2.453 1.00 0.00 C ATOM 573 CG PHE A 35 5.285 -0.410 3.854 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.608 0.634 4.462 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.472 -1.586 4.563 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.125 0.509 5.752 1.00 0.00 C ATOM 577 CE2 PHE A 35 4.991 -1.717 5.852 1.00 0.00 C ATOM 578 CZ PHE A 35 4.318 -0.668 6.448 1.00 0.00 C ATOM 0 H PHE A 35 7.744 -0.193 0.749 1.00 0.00 H new ATOM 0 HA PHE A 35 6.254 1.825 2.283 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.969 -0.121 1.774 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.292 -1.203 2.160 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.455 1.557 3.922 1.00 0.00 H new ATOM 0 HD2 PHE A 35 5.999 -2.409 4.103 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.598 1.330 6.214 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.141 -2.639 6.393 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.944 -0.768 7.456 1.00 0.00 H new ATOM 588 N LYS A 36 7.775 1.977 4.215 1.00 0.00 N ATOM 589 CA LYS A 36 8.667 2.114 5.360 1.00 0.00 C ATOM 590 C LYS A 36 7.912 1.892 6.667 1.00 0.00 C ATOM 591 O LYS A 36 6.692 2.041 6.722 1.00 0.00 O ATOM 592 CB LYS A 36 9.316 3.500 5.363 1.00 0.00 C ATOM 593 CG LYS A 36 10.304 3.706 6.498 1.00 0.00 C ATOM 594 CD LYS A 36 11.530 2.823 6.338 1.00 0.00 C ATOM 595 CE LYS A 36 12.767 3.472 6.941 1.00 0.00 C ATOM 596 NZ LYS A 36 13.041 4.807 6.341 1.00 0.00 N ATOM 0 H LYS A 36 7.157 2.774 4.065 1.00 0.00 H new ATOM 0 HA LYS A 36 9.445 1.355 5.277 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.829 3.654 4.414 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.535 4.258 5.430 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.610 4.752 6.530 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.818 3.487 7.449 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.352 1.861 6.818 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.701 2.624 5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.633 3.578 8.018 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.629 2.822 6.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.033 4.851 6.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.415 4.955 5.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.867 5.548 7.049 1.00 0.00 H new ATOM 610 N GLU A 37 8.648 1.537 7.716 1.00 0.00 N ATOM 611 CA GLU A 37 8.046 1.295 9.023 1.00 0.00 C ATOM 612 C GLU A 37 6.833 2.195 9.238 1.00 0.00 C ATOM 613 O GLU A 37 5.689 1.744 9.164 1.00 0.00 O ATOM 614 CB GLU A 37 9.073 1.531 10.133 1.00 0.00 C ATOM 615 CG GLU A 37 10.309 0.655 10.015 1.00 0.00 C ATOM 616 CD GLU A 37 11.078 0.553 11.318 1.00 0.00 C ATOM 617 OE1 GLU A 37 10.651 -0.223 12.199 1.00 0.00 O ATOM 618 OE2 GLU A 37 12.106 1.248 11.456 1.00 0.00 O ATOM 0 H GLU A 37 9.660 1.411 7.687 1.00 0.00 H new ATOM 0 HA GLU A 37 7.717 0.256 9.057 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.377 2.578 10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.600 1.350 11.098 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.013 -0.343 9.693 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.963 1.058 9.242 1.00 0.00 H new ATOM 625 N THR A 38 7.090 3.472 9.506 1.00 0.00 N ATOM 626 CA THR A 38 6.020 4.435 9.734 1.00 0.00 C ATOM 627 C THR A 38 5.999 5.501 8.644 1.00 0.00 C ATOM 628 O THR A 38 5.512 6.612 8.857 1.00 0.00 O ATOM 629 CB THR A 38 6.165 5.121 11.105 1.00 0.00 C ATOM 630 OG1 THR A 38 7.550 5.306 11.417 1.00 0.00 O ATOM 631 CG2 THR A 38 5.500 4.295 12.196 1.00 0.00 C ATOM 0 H THR A 38 8.030 3.863 9.570 1.00 0.00 H new ATOM 0 HA THR A 38 5.083 3.878 9.712 1.00 0.00 H new ATOM 0 HB THR A 38 5.672 6.092 11.055 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.633 5.744 12.290 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.615 4.799 13.155 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.440 4.181 11.971 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.968 3.312 12.244 1.00 0.00 H new ATOM 639 N THR A 39 6.531 5.158 7.475 1.00 0.00 N ATOM 640 CA THR A 39 6.574 6.086 6.353 1.00 0.00 C ATOM 641 C THR A 39 6.346 5.361 5.031 1.00 0.00 C ATOM 642 O THR A 39 6.406 4.132 4.967 1.00 0.00 O ATOM 643 CB THR A 39 7.921 6.830 6.291 1.00 0.00 C ATOM 644 OG1 THR A 39 8.408 7.074 7.615 1.00 0.00 O ATOM 645 CG2 THR A 39 7.776 8.150 5.547 1.00 0.00 C ATOM 0 H THR A 39 6.938 4.243 7.281 1.00 0.00 H new ATOM 0 HA THR A 39 5.774 6.810 6.510 1.00 0.00 H new ATOM 0 HB THR A 39 8.632 6.204 5.753 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.265 7.546 7.566 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.740 8.658 5.516 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.434 7.959 4.530 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.050 8.780 6.062 1.00 0.00 H new ATOM 653 N LEU A 40 6.085 6.128 3.979 1.00 0.00 N ATOM 654 CA LEU A 40 5.848 5.559 2.657 1.00 0.00 C ATOM 655 C LEU A 40 6.082 6.598 1.566 1.00 0.00 C ATOM 656 O LEU A 40 5.483 7.674 1.580 1.00 0.00 O ATOM 657 CB LEU A 40 4.421 5.016 2.562 1.00 0.00 C ATOM 658 CG LEU A 40 4.175 3.957 1.487 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.838 3.269 1.711 1.00 0.00 C ATOM 660 CD2 LEU A 40 4.230 4.581 0.100 1.00 0.00 C ATOM 0 H LEU A 40 6.032 7.146 4.015 1.00 0.00 H new ATOM 0 HA LEU A 40 6.553 4.740 2.510 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.150 4.593 3.529 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.747 5.853 2.380 1.00 0.00 H new ATOM 0 HG LEU A 40 4.963 3.207 1.557 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.681 2.519 0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.836 2.787 2.689 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.037 4.007 1.669 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.053 3.812 -0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.465 5.353 0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.212 5.026 -0.060 1.00 0.00 H new ATOM 672 N SER A 41 6.957 6.269 0.620 1.00 0.00 N ATOM 673 CA SER A 41 7.272 7.176 -0.478 1.00 0.00 C ATOM 674 C SER A 41 7.417 6.410 -1.790 1.00 0.00 C ATOM 675 O SER A 41 7.649 5.200 -1.793 1.00 0.00 O ATOM 676 CB SER A 41 8.559 7.945 -0.179 1.00 0.00 C ATOM 677 OG SER A 41 8.467 8.631 1.058 1.00 0.00 O ATOM 0 H SER A 41 7.460 5.382 0.592 1.00 0.00 H new ATOM 0 HA SER A 41 6.450 7.884 -0.579 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.402 7.254 -0.154 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.755 8.658 -0.980 1.00 0.00 H new ATOM 0 HG SER A 41 9.303 9.114 1.227 1.00 0.00 H new ATOM 683 N TYR A 42 7.279 7.123 -2.902 1.00 0.00 N ATOM 684 CA TYR A 42 7.392 6.511 -4.221 1.00 0.00 C ATOM 685 C TYR A 42 8.086 7.453 -5.200 1.00 0.00 C ATOM 686 O TYR A 42 8.309 8.625 -4.899 1.00 0.00 O ATOM 687 CB TYR A 42 6.008 6.134 -4.752 1.00 0.00 C ATOM 688 CG TYR A 42 5.092 7.321 -4.950 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.622 8.050 -3.865 1.00 0.00 C ATOM 690 CD2 TYR A 42 4.697 7.713 -6.224 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.784 9.134 -4.042 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.861 8.797 -6.410 1.00 0.00 C ATOM 693 CZ TYR A 42 3.407 9.504 -5.316 1.00 0.00 C ATOM 694 OH TYR A 42 2.574 10.584 -5.497 1.00 0.00 O ATOM 0 H TYR A 42 7.089 8.125 -2.917 1.00 0.00 H new ATOM 0 HA TYR A 42 7.995 5.608 -4.124 1.00 0.00 H new ATOM 0 HB2 TYR A 42 6.122 5.611 -5.702 1.00 0.00 H new ATOM 0 HB3 TYR A 42 5.540 5.436 -4.058 1.00 0.00 H new ATOM 0 HD1 TYR A 42 4.917 7.765 -2.866 1.00 0.00 H new ATOM 0 HD2 TYR A 42 5.050 7.161 -7.083 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.426 9.689 -3.187 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.565 9.089 -7.407 1.00 0.00 H new ATOM 0 HH TYR A 42 2.407 10.711 -6.454 1.00 0.00 H new ATOM 704 N TYR A 43 8.423 6.930 -6.374 1.00 0.00 N ATOM 705 CA TYR A 43 9.094 7.722 -7.398 1.00 0.00 C ATOM 706 C TYR A 43 8.615 7.327 -8.792 1.00 0.00 C ATOM 707 O TYR A 43 7.951 6.305 -8.968 1.00 0.00 O ATOM 708 CB TYR A 43 10.610 7.546 -7.299 1.00 0.00 C ATOM 709 CG TYR A 43 11.105 7.351 -5.883 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.777 6.209 -5.163 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.899 8.309 -5.266 1.00 0.00 C ATOM 712 CE1 TYR A 43 11.226 6.027 -3.869 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.355 8.135 -3.974 1.00 0.00 C ATOM 714 CZ TYR A 43 12.015 6.992 -3.279 1.00 0.00 C ATOM 715 OH TYR A 43 12.465 6.816 -1.991 1.00 0.00 O ATOM 0 H TYR A 43 8.243 5.962 -6.640 1.00 0.00 H new ATOM 0 HA TYR A 43 8.846 8.770 -7.231 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.908 6.687 -7.901 1.00 0.00 H new ATOM 0 HB3 TYR A 43 11.098 8.421 -7.728 1.00 0.00 H new ATOM 0 HD1 TYR A 43 10.161 5.451 -5.623 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.165 9.206 -5.806 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.961 5.134 -3.323 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.974 8.889 -3.510 1.00 0.00 H new ATOM 0 HH TYR A 43 13.009 7.587 -1.726 1.00 0.00 H new ATOM 725 N LYS A 44 8.957 8.145 -9.782 1.00 0.00 N ATOM 726 CA LYS A 44 8.566 7.883 -11.162 1.00 0.00 C ATOM 727 C LYS A 44 9.320 6.681 -11.722 1.00 0.00 C ATOM 728 O LYS A 44 8.910 6.090 -12.721 1.00 0.00 O ATOM 729 CB LYS A 44 8.829 9.114 -12.031 1.00 0.00 C ATOM 730 CG LYS A 44 8.102 10.361 -11.557 1.00 0.00 C ATOM 731 CD LYS A 44 8.542 11.592 -12.331 1.00 0.00 C ATOM 732 CE LYS A 44 8.138 11.503 -13.795 1.00 0.00 C ATOM 733 NZ LYS A 44 8.689 12.634 -14.592 1.00 0.00 N ATOM 0 H LYS A 44 9.505 8.996 -9.654 1.00 0.00 H new ATOM 0 HA LYS A 44 7.499 7.659 -11.175 1.00 0.00 H new ATOM 0 HB2 LYS A 44 9.900 9.313 -12.049 1.00 0.00 H new ATOM 0 HB3 LYS A 44 8.528 8.896 -13.056 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.027 10.222 -11.673 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.291 10.512 -10.494 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.099 12.482 -11.884 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.624 11.702 -12.257 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.490 10.559 -14.212 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.051 11.500 -13.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 8.391 12.537 -15.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.333 13.534 -14.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 9.728 12.622 -14.539 1.00 0.00 H new ATOM 747 N SER A 45 10.423 6.325 -11.072 1.00 0.00 N ATOM 748 CA SER A 45 11.235 5.195 -11.508 1.00 0.00 C ATOM 749 C SER A 45 12.185 4.749 -10.399 1.00 0.00 C ATOM 750 O SER A 45 12.619 5.556 -9.578 1.00 0.00 O ATOM 751 CB SER A 45 12.033 5.565 -12.759 1.00 0.00 C ATOM 752 OG SER A 45 12.882 4.502 -13.156 1.00 0.00 O ATOM 0 H SER A 45 10.775 6.802 -10.242 1.00 0.00 H new ATOM 0 HA SER A 45 10.565 4.368 -11.744 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.349 5.811 -13.571 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.629 6.457 -12.564 1.00 0.00 H new ATOM 0 HG SER A 45 13.380 4.763 -13.959 1.00 0.00 H new ATOM 758 N GLN A 46 12.502 3.458 -10.384 1.00 0.00 N ATOM 759 CA GLN A 46 13.399 2.905 -9.376 1.00 0.00 C ATOM 760 C GLN A 46 14.766 3.576 -9.437 1.00 0.00 C ATOM 761 O GLN A 46 15.378 3.855 -8.406 1.00 0.00 O ATOM 762 CB GLN A 46 13.549 1.395 -9.571 1.00 0.00 C ATOM 763 CG GLN A 46 14.432 0.731 -8.527 1.00 0.00 C ATOM 764 CD GLN A 46 15.874 1.196 -8.602 1.00 0.00 C ATOM 765 OE1 GLN A 46 16.482 1.200 -9.673 1.00 0.00 O ATOM 766 NE2 GLN A 46 16.428 1.591 -7.462 1.00 0.00 N ATOM 0 H GLN A 46 12.152 2.777 -11.057 1.00 0.00 H new ATOM 0 HA GLN A 46 12.965 3.096 -8.395 1.00 0.00 H new ATOM 0 HB2 GLN A 46 12.562 0.934 -9.546 1.00 0.00 H new ATOM 0 HB3 GLN A 46 13.965 1.204 -10.560 1.00 0.00 H new ATOM 0 HG2 GLN A 46 14.037 0.944 -7.534 1.00 0.00 H new ATOM 0 HG3 GLN A 46 14.395 -0.350 -8.660 1.00 0.00 H new ATOM 0 HE21 GLN A 46 15.886 1.571 -6.598 1.00 0.00 H new ATOM 0 HE22 GLN A 46 17.395 1.915 -7.450 1.00 0.00 H new ATOM 775 N ASP A 47 15.240 3.832 -10.651 1.00 0.00 N ATOM 776 CA ASP A 47 16.536 4.472 -10.847 1.00 0.00 C ATOM 777 C ASP A 47 16.618 5.783 -10.072 1.00 0.00 C ATOM 778 O ASP A 47 17.522 5.980 -9.261 1.00 0.00 O ATOM 779 CB ASP A 47 16.783 4.729 -12.335 1.00 0.00 C ATOM 780 CG ASP A 47 17.920 5.702 -12.573 1.00 0.00 C ATOM 781 OD1 ASP A 47 19.086 5.256 -12.608 1.00 0.00 O ATOM 782 OD2 ASP A 47 17.644 6.911 -12.724 1.00 0.00 O ATOM 0 H ASP A 47 14.746 3.606 -11.515 1.00 0.00 H new ATOM 0 HA ASP A 47 17.306 3.799 -10.470 1.00 0.00 H new ATOM 0 HB2 ASP A 47 17.007 3.785 -12.832 1.00 0.00 H new ATOM 0 HB3 ASP A 47 15.873 5.120 -12.789 1.00 0.00 H new ATOM 787 N GLU A 48 15.667 6.676 -10.328 1.00 0.00 N ATOM 788 CA GLU A 48 15.634 7.969 -9.654 1.00 0.00 C ATOM 789 C GLU A 48 15.979 7.822 -8.175 1.00 0.00 C ATOM 790 O GLU A 48 16.866 8.505 -7.663 1.00 0.00 O ATOM 791 CB GLU A 48 14.253 8.612 -9.805 1.00 0.00 C ATOM 792 CG GLU A 48 13.977 9.140 -11.203 1.00 0.00 C ATOM 793 CD GLU A 48 14.632 10.483 -11.459 1.00 0.00 C ATOM 794 OE1 GLU A 48 14.153 11.493 -10.901 1.00 0.00 O ATOM 795 OE2 GLU A 48 15.623 10.525 -12.218 1.00 0.00 O ATOM 0 H GLU A 48 14.910 6.528 -10.996 1.00 0.00 H new ATOM 0 HA GLU A 48 16.380 8.612 -10.121 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.490 7.878 -9.546 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.163 9.431 -9.092 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.336 8.419 -11.937 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.900 9.232 -11.347 1.00 0.00 H new ATOM 802 N ALA A 49 15.272 6.926 -7.495 1.00 0.00 N ATOM 803 CA ALA A 49 15.504 6.687 -6.076 1.00 0.00 C ATOM 804 C ALA A 49 16.995 6.571 -5.776 1.00 0.00 C ATOM 805 O ALA A 49 17.739 5.874 -6.465 1.00 0.00 O ATOM 806 CB ALA A 49 14.773 5.431 -5.626 1.00 0.00 C ATOM 0 H ALA A 49 14.534 6.353 -7.904 1.00 0.00 H new ATOM 0 HA ALA A 49 15.114 7.539 -5.520 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.955 5.265 -4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.703 5.552 -5.796 1.00 0.00 H new ATOM 0 HB3 ALA A 49 15.136 4.575 -6.195 1.00 0.00 H new ATOM 812 N PRO A 50 17.443 7.270 -4.722 1.00 0.00 N ATOM 813 CA PRO A 50 16.566 8.103 -3.894 1.00 0.00 C ATOM 814 C PRO A 50 16.078 9.344 -4.634 1.00 0.00 C ATOM 815 O PRO A 50 14.922 9.744 -4.501 1.00 0.00 O ATOM 816 CB PRO A 50 17.461 8.500 -2.718 1.00 0.00 C ATOM 817 CG PRO A 50 18.849 8.419 -3.253 1.00 0.00 C ATOM 818 CD PRO A 50 18.840 7.300 -4.259 1.00 0.00 C ATOM 0 HA PRO A 50 15.660 7.573 -3.599 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.230 9.506 -2.367 1.00 0.00 H new ATOM 0 HB3 PRO A 50 17.323 7.828 -1.871 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.144 9.360 -3.718 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.564 8.220 -2.455 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.531 7.492 -5.080 1.00 0.00 H new ATOM 0 HD3 PRO A 50 19.135 6.352 -3.809 1.00 0.00 H new ATOM 826 N GLY A 51 16.967 9.950 -5.416 1.00 0.00 N ATOM 827 CA GLY A 51 16.607 11.139 -6.166 1.00 0.00 C ATOM 828 C GLY A 51 15.625 12.020 -5.419 1.00 0.00 C ATOM 829 O GLY A 51 16.018 12.813 -4.564 1.00 0.00 O ATOM 0 H GLY A 51 17.930 9.638 -5.543 1.00 0.00 H new ATOM 0 HA2 GLY A 51 17.508 11.711 -6.388 1.00 0.00 H new ATOM 0 HA3 GLY A 51 16.173 10.845 -7.121 1.00 0.00 H new ATOM 833 N ASP A 52 14.345 11.882 -5.744 1.00 0.00 N ATOM 834 CA ASP A 52 13.303 12.672 -5.098 1.00 0.00 C ATOM 835 C ASP A 52 11.945 11.990 -5.227 1.00 0.00 C ATOM 836 O ASP A 52 11.465 11.710 -6.326 1.00 0.00 O ATOM 837 CB ASP A 52 13.243 14.073 -5.709 1.00 0.00 C ATOM 838 CG ASP A 52 12.704 15.106 -4.739 1.00 0.00 C ATOM 839 OD1 ASP A 52 12.965 14.972 -3.525 1.00 0.00 O ATOM 840 OD2 ASP A 52 12.020 16.047 -5.193 1.00 0.00 O ATOM 0 H ASP A 52 14.003 11.231 -6.451 1.00 0.00 H new ATOM 0 HA ASP A 52 13.549 12.755 -4.039 1.00 0.00 H new ATOM 0 HB2 ASP A 52 14.241 14.368 -6.032 1.00 0.00 H new ATOM 0 HB3 ASP A 52 12.614 14.051 -6.599 1.00 0.00 H new ATOM 845 N PRO A 53 11.310 11.714 -4.078 1.00 0.00 N ATOM 846 CA PRO A 53 9.998 11.060 -4.036 1.00 0.00 C ATOM 847 C PRO A 53 8.883 11.964 -4.549 1.00 0.00 C ATOM 848 O PRO A 53 8.689 13.072 -4.047 1.00 0.00 O ATOM 849 CB PRO A 53 9.800 10.758 -2.549 1.00 0.00 C ATOM 850 CG PRO A 53 10.637 11.768 -1.842 1.00 0.00 C ATOM 851 CD PRO A 53 11.823 12.019 -2.732 1.00 0.00 C ATOM 0 HA PRO A 53 9.963 10.176 -4.673 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.751 10.844 -2.264 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.115 9.743 -2.306 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.077 12.687 -1.670 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.953 11.399 -0.866 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.170 13.050 -2.658 1.00 0.00 H new ATOM 0 HD3 PRO A 53 12.666 11.380 -2.469 1.00 0.00 H new ATOM 859 N ILE A 54 8.153 11.486 -5.551 1.00 0.00 N ATOM 860 CA ILE A 54 7.056 12.251 -6.130 1.00 0.00 C ATOM 861 C ILE A 54 6.262 12.977 -5.050 1.00 0.00 C ATOM 862 O ILE A 54 5.907 14.145 -5.206 1.00 0.00 O ATOM 863 CB ILE A 54 6.102 11.348 -6.934 1.00 0.00 C ATOM 864 CG1 ILE A 54 6.817 10.776 -8.160 1.00 0.00 C ATOM 865 CG2 ILE A 54 4.863 12.125 -7.352 1.00 0.00 C ATOM 866 CD1 ILE A 54 6.016 9.721 -8.890 1.00 0.00 C ATOM 0 H ILE A 54 8.302 10.572 -5.979 1.00 0.00 H new ATOM 0 HA ILE A 54 7.503 12.983 -6.803 1.00 0.00 H new ATOM 0 HB ILE A 54 5.790 10.519 -6.299 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.045 11.589 -8.849 1.00 0.00 H new ATOM 0 HG13 ILE A 54 7.769 10.346 -7.848 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.199 11.473 -7.919 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.344 12.488 -6.465 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.157 12.972 -7.972 1.00 0.00 H new ATOM 0 HD11 ILE A 54 6.585 9.361 -9.747 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.810 8.889 -8.216 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.075 10.151 -9.233 1.00 0.00 H new ATOM 878 N GLN A 55 5.987 12.277 -3.954 1.00 0.00 N ATOM 879 CA GLN A 55 5.235 12.856 -2.847 1.00 0.00 C ATOM 880 C GLN A 55 5.334 11.978 -1.604 1.00 0.00 C ATOM 881 O GLN A 55 4.734 10.905 -1.541 1.00 0.00 O ATOM 882 CB GLN A 55 3.768 13.040 -3.240 1.00 0.00 C ATOM 883 CG GLN A 55 3.087 14.195 -2.524 1.00 0.00 C ATOM 884 CD GLN A 55 1.580 14.038 -2.466 1.00 0.00 C ATOM 885 OE1 GLN A 55 1.108 13.177 -1.573 1.00 0.00 O flip ATOM 886 NE2 GLN A 55 0.848 14.685 -3.216 1.00 0.00 N flip ATOM 0 H GLN A 55 6.273 11.309 -3.809 1.00 0.00 H new ATOM 0 HA GLN A 55 5.667 13.830 -2.617 1.00 0.00 H new ATOM 0 HB2 GLN A 55 3.706 13.203 -4.316 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.225 12.120 -3.026 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.480 14.271 -1.510 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.332 15.128 -3.032 1.00 0.00 H new ATOM 0 HE21 GLN A 55 1.254 15.336 -3.888 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -0.164 14.570 -3.165 1.00 0.00 H new ATOM 895 N GLN A 56 6.096 12.441 -0.618 1.00 0.00 N ATOM 896 CA GLN A 56 6.274 11.696 0.623 1.00 0.00 C ATOM 897 C GLN A 56 5.263 12.141 1.675 1.00 0.00 C ATOM 898 O GLN A 56 4.944 13.326 1.782 1.00 0.00 O ATOM 899 CB GLN A 56 7.696 11.881 1.155 1.00 0.00 C ATOM 900 CG GLN A 56 7.939 13.246 1.780 1.00 0.00 C ATOM 901 CD GLN A 56 9.181 13.277 2.648 1.00 0.00 C ATOM 902 OE1 GLN A 56 9.511 12.297 3.315 1.00 0.00 O ATOM 903 NE2 GLN A 56 9.879 14.407 2.643 1.00 0.00 N ATOM 0 H GLN A 56 6.599 13.327 -0.654 1.00 0.00 H new ATOM 0 HA GLN A 56 6.108 10.640 0.410 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.901 11.109 1.897 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.403 11.734 0.338 1.00 0.00 H new ATOM 0 HG2 GLN A 56 8.033 13.991 0.990 1.00 0.00 H new ATOM 0 HG3 GLN A 56 7.073 13.526 2.381 1.00 0.00 H new ATOM 0 HE21 GLN A 56 9.569 15.195 2.075 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.725 14.486 3.207 1.00 0.00 H new ATOM 912 N LEU A 57 4.763 11.185 2.450 1.00 0.00 N ATOM 913 CA LEU A 57 3.787 11.479 3.494 1.00 0.00 C ATOM 914 C LEU A 57 3.940 10.517 4.668 1.00 0.00 C ATOM 915 O LEU A 57 4.578 9.472 4.547 1.00 0.00 O ATOM 916 CB LEU A 57 2.367 11.394 2.931 1.00 0.00 C ATOM 917 CG LEU A 57 2.157 12.001 1.544 1.00 0.00 C ATOM 918 CD1 LEU A 57 0.997 11.322 0.834 1.00 0.00 C ATOM 919 CD2 LEU A 57 1.917 13.500 1.649 1.00 0.00 C ATOM 0 H LEU A 57 5.017 10.200 2.375 1.00 0.00 H new ATOM 0 HA LEU A 57 3.968 12.492 3.852 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.075 10.345 2.894 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.691 11.889 3.628 1.00 0.00 H new ATOM 0 HG LEU A 57 3.061 11.838 0.957 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.863 11.768 -0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.209 10.258 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.086 11.453 1.418 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.770 13.916 0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.029 13.685 2.254 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.780 13.975 2.116 1.00 0.00 H new ATOM 931 N ASN A 58 3.348 10.876 5.802 1.00 0.00 N ATOM 932 CA ASN A 58 3.416 10.044 6.997 1.00 0.00 C ATOM 933 C ASN A 58 2.138 9.229 7.167 1.00 0.00 C ATOM 934 O ASN A 58 1.043 9.784 7.272 1.00 0.00 O ATOM 935 CB ASN A 58 3.649 10.912 8.236 1.00 0.00 C ATOM 936 CG ASN A 58 3.890 10.085 9.484 1.00 0.00 C ATOM 937 OD1 ASN A 58 3.021 9.329 9.919 1.00 0.00 O ATOM 938 ND2 ASN A 58 5.075 10.226 10.067 1.00 0.00 N ATOM 0 H ASN A 58 2.815 11.738 5.918 1.00 0.00 H new ATOM 0 HA ASN A 58 4.252 9.355 6.881 1.00 0.00 H new ATOM 0 HB2 ASN A 58 4.506 11.563 8.064 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.784 11.557 8.392 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.295 9.696 10.910 1.00 0.00 H new ATOM 0 HD22 ASN A 58 5.765 10.864 9.671 1.00 0.00 H new ATOM 945 N LEU A 59 2.284 7.908 7.193 1.00 0.00 N ATOM 946 CA LEU A 59 1.141 7.015 7.351 1.00 0.00 C ATOM 947 C LEU A 59 0.536 7.146 8.745 1.00 0.00 C ATOM 948 O LEU A 59 -0.682 7.097 8.913 1.00 0.00 O ATOM 949 CB LEU A 59 1.562 5.567 7.099 1.00 0.00 C ATOM 950 CG LEU A 59 1.733 5.163 5.634 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.350 3.777 5.531 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.396 5.208 4.909 1.00 0.00 C ATOM 0 H LEU A 59 3.182 7.432 7.107 1.00 0.00 H new ATOM 0 HA LEU A 59 0.385 7.300 6.619 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.504 5.388 7.617 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.820 4.910 7.552 1.00 0.00 H new ATOM 0 HG LEU A 59 2.407 5.875 5.157 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.464 3.507 4.481 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.327 3.777 6.014 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.702 3.053 6.024 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.537 4.918 3.868 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.300 4.519 5.387 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.007 6.220 4.952 1.00 0.00 H new ATOM 964 N LYS A 60 1.396 7.313 9.744 1.00 0.00 N ATOM 965 CA LYS A 60 0.949 7.455 11.125 1.00 0.00 C ATOM 966 C LYS A 60 0.031 8.663 11.278 1.00 0.00 C ATOM 967 O LYS A 60 0.488 9.805 11.289 1.00 0.00 O ATOM 968 CB LYS A 60 2.151 7.592 12.061 1.00 0.00 C ATOM 969 CG LYS A 60 1.909 7.027 13.450 1.00 0.00 C ATOM 970 CD LYS A 60 1.201 8.031 14.344 1.00 0.00 C ATOM 971 CE LYS A 60 1.536 7.805 15.810 1.00 0.00 C ATOM 972 NZ LYS A 60 2.794 8.496 16.205 1.00 0.00 N ATOM 0 H LYS A 60 2.408 7.353 9.623 1.00 0.00 H new ATOM 0 HA LYS A 60 0.389 6.559 11.393 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.007 7.085 11.616 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.415 8.646 12.148 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.310 6.119 13.375 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.861 6.745 13.900 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.488 9.042 14.056 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.124 7.952 14.200 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.714 8.164 16.430 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.634 6.736 15.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.987 8.317 17.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.583 8.135 15.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.692 9.519 16.049 1.00 0.00 H new ATOM 986 N GLY A 61 -1.268 8.403 11.397 1.00 0.00 N ATOM 987 CA GLY A 61 -2.229 9.480 11.550 1.00 0.00 C ATOM 988 C GLY A 61 -3.273 9.485 10.451 1.00 0.00 C ATOM 989 O GLY A 61 -4.354 10.051 10.615 1.00 0.00 O ATOM 0 H GLY A 61 -1.672 7.466 11.390 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.724 9.387 12.517 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.703 10.435 11.552 1.00 0.00 H new ATOM 993 N CYS A 62 -2.950 8.854 9.327 1.00 0.00 N ATOM 994 CA CYS A 62 -3.868 8.790 8.195 1.00 0.00 C ATOM 995 C CYS A 62 -4.925 7.712 8.412 1.00 0.00 C ATOM 996 O CYS A 62 -4.932 7.035 9.440 1.00 0.00 O ATOM 997 CB CYS A 62 -3.098 8.514 6.903 1.00 0.00 C ATOM 998 SG CYS A 62 -2.720 6.767 6.627 1.00 0.00 S ATOM 0 H CYS A 62 -2.060 8.380 9.175 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.371 9.754 8.111 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.679 8.886 6.060 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.165 9.078 6.921 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.795 6.387 7.457 1.00 0.00 H new ATOM 1004 N GLU A 63 -5.816 7.560 7.438 1.00 0.00 N ATOM 1005 CA GLU A 63 -6.880 6.566 7.525 1.00 0.00 C ATOM 1006 C GLU A 63 -6.654 5.439 6.521 1.00 0.00 C ATOM 1007 O GLU A 63 -5.927 5.602 5.541 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.241 7.219 7.277 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.385 6.540 8.012 1.00 0.00 C ATOM 1010 CD GLU A 63 -9.548 7.048 9.431 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -10.295 8.029 9.629 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -8.930 6.462 10.345 1.00 0.00 O ATOM 0 H GLU A 63 -5.823 8.112 6.580 1.00 0.00 H new ATOM 0 HA GLU A 63 -6.866 6.144 8.530 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.194 8.264 7.582 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.450 7.208 6.207 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.312 6.703 7.463 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.211 5.464 8.033 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.281 4.295 6.774 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.149 3.140 5.893 1.00 0.00 C ATOM 1021 C VAL A 64 -8.488 2.433 5.712 1.00 0.00 C ATOM 1022 O VAL A 64 -9.024 1.844 6.651 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.119 2.133 6.438 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.028 0.917 5.529 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -4.758 2.796 6.593 1.00 0.00 C ATOM 0 H VAL A 64 -7.885 4.143 7.581 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.805 3.514 4.929 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.449 1.797 7.421 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.295 0.217 5.930 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.002 0.431 5.473 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -5.721 1.231 4.531 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.042 2.071 6.979 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.418 3.161 5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -4.838 3.632 7.288 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.023 2.494 4.497 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.298 1.858 4.190 1.00 0.00 C ATOM 1037 C VAL A 65 -10.100 0.616 3.327 1.00 0.00 C ATOM 1038 O VAL A 65 -9.891 0.698 2.117 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.249 2.827 3.464 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.609 2.181 3.249 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.384 4.126 4.245 1.00 0.00 C ATOM 0 H VAL A 65 -8.593 2.978 3.709 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.743 1.568 5.142 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.826 3.059 2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.267 2.881 2.735 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.493 1.281 2.645 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.043 1.917 4.213 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -12.060 4.799 3.717 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.784 3.914 5.237 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.405 4.596 4.341 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.167 -0.563 3.963 1.00 0.00 N ATOM 1052 CA PRO A 66 -9.998 -1.845 3.273 1.00 0.00 C ATOM 1053 C PRO A 66 -11.169 -2.165 2.350 1.00 0.00 C ATOM 1054 O PRO A 66 -12.320 -2.211 2.786 1.00 0.00 O ATOM 1055 CB PRO A 66 -9.927 -2.858 4.418 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.662 -2.212 5.541 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.412 -0.735 5.405 1.00 0.00 C ATOM 0 HA PRO A 66 -9.119 -1.848 2.628 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.387 -3.806 4.137 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.894 -3.073 4.693 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.728 -2.434 5.488 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.307 -2.581 6.503 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.268 -0.150 5.740 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.556 -0.416 5.999 1.00 0.00 H new ATOM 1065 N ASP A 67 -10.869 -2.386 1.075 1.00 0.00 N ATOM 1066 CA ASP A 67 -11.897 -2.704 0.091 1.00 0.00 C ATOM 1067 C ASP A 67 -11.677 -4.095 -0.496 1.00 0.00 C ATOM 1068 O ASP A 67 -11.224 -4.236 -1.632 1.00 0.00 O ATOM 1069 CB ASP A 67 -11.904 -1.660 -1.026 1.00 0.00 C ATOM 1070 CG ASP A 67 -12.640 -0.395 -0.633 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -13.208 -0.360 0.480 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -12.649 0.561 -1.436 1.00 0.00 O ATOM 0 H ASP A 67 -9.922 -2.351 0.698 1.00 0.00 H new ATOM 0 HA ASP A 67 -12.863 -2.692 0.595 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -10.877 -1.411 -1.293 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.370 -2.086 -1.915 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.999 -5.120 0.287 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.836 -6.500 -0.155 1.00 0.00 C ATOM 1079 C VAL A 68 -13.169 -7.098 -0.592 1.00 0.00 C ATOM 1080 O VAL A 68 -14.107 -7.192 0.199 1.00 0.00 O ATOM 1081 CB VAL A 68 -11.232 -7.377 0.957 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -11.145 -8.827 0.505 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -9.862 -6.854 1.363 1.00 0.00 C ATOM 0 H VAL A 68 -12.374 -5.021 1.230 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.153 -6.482 -1.005 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.886 -7.331 1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.716 -9.432 1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.143 -9.195 0.268 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.513 -8.895 -0.381 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.450 -7.486 2.150 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.196 -6.869 0.500 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.957 -5.832 1.730 1.00 0.00 H new ATOM 1093 N ASN A 69 -13.245 -7.501 -1.856 1.00 0.00 N ATOM 1094 CA ASN A 69 -14.463 -8.091 -2.398 1.00 0.00 C ATOM 1095 C ASN A 69 -14.233 -9.545 -2.797 1.00 0.00 C ATOM 1096 O ASN A 69 -14.249 -9.886 -3.980 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.948 -7.289 -3.608 1.00 0.00 C ATOM 1098 CG ASN A 69 -16.448 -7.395 -3.808 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -17.206 -7.520 -2.846 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -16.882 -7.345 -5.062 1.00 0.00 N ATOM 0 H ASN A 69 -12.477 -7.430 -2.524 1.00 0.00 H new ATOM 0 HA ASN A 69 -15.227 -8.063 -1.621 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.674 -6.242 -3.480 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -14.439 -7.644 -4.504 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -17.881 -7.411 -5.259 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -16.217 -7.241 -5.828 1.00 0.00 H new ATOM 1107 N VAL A 70 -14.019 -10.400 -1.802 1.00 0.00 N ATOM 1108 CA VAL A 70 -13.787 -11.818 -2.048 1.00 0.00 C ATOM 1109 C VAL A 70 -14.690 -12.337 -3.161 1.00 0.00 C ATOM 1110 O VAL A 70 -14.340 -13.283 -3.867 1.00 0.00 O ATOM 1111 CB VAL A 70 -14.025 -12.655 -0.777 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -13.776 -14.130 -1.053 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -13.142 -12.160 0.359 1.00 0.00 C ATOM 0 H VAL A 70 -14.002 -10.135 -0.817 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.745 -11.920 -2.351 1.00 0.00 H new ATOM 0 HB VAL A 70 -15.066 -12.538 -0.476 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -13.949 -14.705 -0.143 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.454 -14.474 -1.834 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -12.746 -14.270 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -13.323 -12.762 1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.095 -12.246 0.070 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -13.375 -11.117 0.573 1.00 0.00 H new ATOM 1123 N SER A 71 -15.853 -11.712 -3.313 1.00 0.00 N ATOM 1124 CA SER A 71 -16.808 -12.113 -4.339 1.00 0.00 C ATOM 1125 C SER A 71 -16.105 -12.351 -5.672 1.00 0.00 C ATOM 1126 O SER A 71 -16.346 -13.354 -6.343 1.00 0.00 O ATOM 1127 CB SER A 71 -17.890 -11.044 -4.504 1.00 0.00 C ATOM 1128 OG SER A 71 -19.073 -11.596 -5.055 1.00 0.00 O ATOM 0 H SER A 71 -16.157 -10.926 -2.739 1.00 0.00 H new ATOM 0 HA SER A 71 -17.274 -13.046 -4.022 1.00 0.00 H new ATOM 0 HB2 SER A 71 -18.112 -10.594 -3.536 1.00 0.00 H new ATOM 0 HB3 SER A 71 -17.522 -10.247 -5.150 1.00 0.00 H new ATOM 0 HG SER A 71 -19.749 -10.893 -5.149 1.00 0.00 H new ATOM 1134 N GLY A 72 -15.235 -11.420 -6.050 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.510 -11.546 -7.301 1.00 0.00 C ATOM 1136 C GLY A 72 -13.008 -11.479 -7.111 1.00 0.00 C ATOM 1137 O GLY A 72 -12.306 -10.830 -7.886 1.00 0.00 O ATOM 0 H GLY A 72 -15.019 -10.581 -5.512 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.771 -12.492 -7.775 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.823 -10.753 -7.980 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.514 -12.150 -6.075 1.00 0.00 N ATOM 1142 CA GLN A 73 -11.085 -12.160 -5.784 1.00 0.00 C ATOM 1143 C GLN A 73 -10.476 -10.778 -5.992 1.00 0.00 C ATOM 1144 O GLN A 73 -9.463 -10.630 -6.676 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.370 -13.184 -6.668 1.00 0.00 C ATOM 1146 CG GLN A 73 -10.873 -14.606 -6.480 1.00 0.00 C ATOM 1147 CD GLN A 73 -10.524 -15.173 -5.118 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -9.353 -15.252 -4.747 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -11.542 -15.572 -4.364 1.00 0.00 N ATOM 0 H GLN A 73 -13.081 -12.693 -5.424 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.956 -12.439 -4.738 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.493 -12.899 -7.713 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.302 -13.154 -6.453 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.955 -14.625 -6.611 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.447 -15.243 -7.255 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -12.497 -15.488 -4.711 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.368 -15.962 -3.438 1.00 0.00 H new ATOM 1158 N LYS A 74 -11.101 -9.766 -5.399 1.00 0.00 N ATOM 1159 CA LYS A 74 -10.622 -8.394 -5.518 1.00 0.00 C ATOM 1160 C LYS A 74 -9.970 -7.931 -4.220 1.00 0.00 C ATOM 1161 O LYS A 74 -10.536 -8.090 -3.138 1.00 0.00 O ATOM 1162 CB LYS A 74 -11.777 -7.459 -5.884 1.00 0.00 C ATOM 1163 CG LYS A 74 -11.384 -5.992 -5.915 1.00 0.00 C ATOM 1164 CD LYS A 74 -10.457 -5.687 -7.080 1.00 0.00 C ATOM 1165 CE LYS A 74 -11.238 -5.408 -8.355 1.00 0.00 C ATOM 1166 NZ LYS A 74 -12.024 -4.147 -8.260 1.00 0.00 N ATOM 0 H LYS A 74 -11.941 -9.871 -4.831 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.874 -8.364 -6.310 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.168 -7.743 -6.861 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.585 -7.595 -5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -12.280 -5.376 -5.991 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.893 -5.726 -4.979 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -9.836 -4.825 -6.836 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.784 -6.529 -7.241 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.548 -5.343 -9.196 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -11.911 -6.241 -8.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -12.203 -3.777 -9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.931 -4.338 -7.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -11.488 -3.445 -7.711 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.777 -7.356 -4.334 1.00 0.00 N ATOM 1181 CA PHE A 75 -8.048 -6.869 -3.169 1.00 0.00 C ATOM 1182 C PHE A 75 -7.419 -5.508 -3.450 1.00 0.00 C ATOM 1183 O PHE A 75 -6.435 -5.407 -4.184 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.964 -7.870 -2.764 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.481 -9.267 -2.568 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -8.108 -9.629 -1.386 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.340 -10.218 -3.566 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -8.585 -10.913 -1.203 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.815 -11.504 -3.388 1.00 0.00 C ATOM 1190 CZ PHE A 75 -8.437 -11.852 -2.205 1.00 0.00 C ATOM 0 H PHE A 75 -8.295 -7.216 -5.222 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.757 -6.759 -2.348 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -6.188 -7.882 -3.529 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.495 -7.532 -1.840 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -8.225 -8.899 -0.599 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.854 -9.952 -4.493 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -9.073 -11.182 -0.278 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.700 -12.236 -4.174 1.00 0.00 H new ATOM 0 HZ PHE A 75 -8.807 -12.857 -2.064 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.995 -4.465 -2.863 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.492 -3.108 -3.051 1.00 0.00 C ATOM 1202 C CYS A 76 -7.340 -2.394 -1.712 1.00 0.00 C ATOM 1203 O CYS A 76 -8.077 -2.667 -0.765 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.431 -2.316 -3.962 1.00 0.00 C ATOM 1205 SG CYS A 76 -8.301 -2.747 -5.713 1.00 0.00 S ATOM 0 H CYS A 76 -8.810 -4.532 -2.253 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.511 -3.172 -3.521 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -9.458 -2.477 -3.635 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.222 -1.253 -3.844 1.00 0.00 H new ATOM 0 HG CYS A 76 -9.136 -2.025 -6.401 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.378 -1.480 -1.641 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.129 -0.728 -0.418 1.00 0.00 C ATOM 1213 C ILE A 77 -6.350 0.765 -0.636 1.00 0.00 C ATOM 1214 O ILE A 77 -5.754 1.369 -1.529 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.696 -0.953 0.100 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.394 -2.450 0.195 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.510 -0.282 1.452 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -2.924 -2.760 0.374 1.00 0.00 C ATOM 0 H ILE A 77 -5.759 -1.243 -2.416 1.00 0.00 H new ATOM 0 HA ILE A 77 -6.837 -1.093 0.326 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.996 -0.505 -0.605 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.951 -2.872 1.032 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.754 -2.943 -0.708 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.492 -0.450 1.805 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.688 0.789 1.354 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.216 -0.703 2.167 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.784 -3.839 0.434 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.364 -2.368 -0.475 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.564 -2.296 1.292 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.209 1.357 0.187 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.507 2.781 0.087 1.00 0.00 C ATOM 1232 C LYS A 78 -6.780 3.567 1.173 1.00 0.00 C ATOM 1233 O LYS A 78 -7.128 3.485 2.352 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.016 3.015 0.197 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.434 4.440 -0.121 1.00 0.00 C ATOM 1236 CD LYS A 78 -10.914 4.525 -0.455 1.00 0.00 C ATOM 1237 CE LYS A 78 -11.439 5.945 -0.304 1.00 0.00 C ATOM 1238 NZ LYS A 78 -11.616 6.321 1.126 1.00 0.00 N ATOM 0 H LYS A 78 -7.711 0.873 0.931 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.160 3.132 -0.885 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.531 2.334 -0.480 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.341 2.766 1.207 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.215 5.083 0.731 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -8.848 4.813 -0.961 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.078 4.182 -1.477 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -11.475 3.857 0.199 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.747 6.640 -0.780 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.392 6.037 -0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.894 7.321 1.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.357 5.728 1.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -10.721 6.177 1.636 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.769 4.328 0.770 1.00 0.00 N ATOM 1253 CA LEU A 79 -4.993 5.131 1.709 1.00 0.00 C ATOM 1254 C LEU A 79 -5.464 6.582 1.704 1.00 0.00 C ATOM 1255 O LEU A 79 -5.319 7.289 0.706 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.505 5.064 1.359 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.533 5.210 2.530 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -2.699 4.058 3.509 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.099 5.284 2.027 1.00 0.00 C ATOM 0 H LEU A 79 -5.467 4.406 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.144 4.723 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.310 4.111 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.288 5.847 0.633 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.761 6.139 3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.999 4.179 4.336 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.718 4.052 3.895 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.499 3.116 2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.421 5.388 2.874 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.858 4.373 1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.989 6.144 1.367 1.00 0.00 H new ATOM 1271 N LEU A 80 -6.026 7.020 2.825 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.516 8.388 2.951 1.00 0.00 C ATOM 1273 C LEU A 80 -5.557 9.236 3.781 1.00 0.00 C ATOM 1274 O LEU A 80 -5.582 9.196 5.011 1.00 0.00 O ATOM 1275 CB LEU A 80 -7.905 8.396 3.591 1.00 0.00 C ATOM 1276 CG LEU A 80 -9.085 8.204 2.637 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -10.391 8.129 3.412 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -9.133 9.330 1.615 1.00 0.00 C ATOM 0 H LEU A 80 -6.154 6.448 3.660 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.580 8.818 1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.941 7.609 4.344 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.037 9.343 4.114 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.948 7.263 2.105 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.219 7.992 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -10.356 7.288 4.104 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.536 9.053 3.971 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.979 9.177 0.945 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.246 10.284 2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.209 9.337 1.037 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.713 10.003 3.099 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.747 10.863 3.772 1.00 0.00 C ATOM 1292 C VAL A 81 -4.132 12.332 3.638 1.00 0.00 C ATOM 1293 O VAL A 81 -4.433 12.825 2.551 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.328 10.663 3.208 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.333 11.556 3.935 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -1.917 9.202 3.308 1.00 0.00 C ATOM 0 H VAL A 81 -4.679 10.046 2.081 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.754 10.583 4.825 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.331 10.945 2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.336 11.401 3.523 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.620 12.600 3.807 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.329 11.308 4.996 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.912 9.078 2.905 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.930 8.891 4.353 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.614 8.588 2.738 1.00 0.00 H new ATOM 1306 N PRO A 82 -4.124 13.052 4.771 1.00 0.00 N ATOM 1307 CA PRO A 82 -4.470 14.476 4.806 1.00 0.00 C ATOM 1308 C PRO A 82 -3.415 15.345 4.131 1.00 0.00 C ATOM 1309 O PRO A 82 -2.233 15.002 4.113 1.00 0.00 O ATOM 1310 CB PRO A 82 -4.540 14.787 6.303 1.00 0.00 C ATOM 1311 CG PRO A 82 -3.657 13.772 6.943 1.00 0.00 C ATOM 1312 CD PRO A 82 -3.777 12.530 6.103 1.00 0.00 C ATOM 0 HA PRO A 82 -5.396 14.684 4.269 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -4.196 15.800 6.513 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.562 14.714 6.675 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.625 14.120 6.979 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.965 13.579 7.971 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.844 11.966 6.083 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.547 11.859 6.485 1.00 0.00 H new ATOM 1320 N SER A 83 -3.850 16.472 3.576 1.00 0.00 N ATOM 1321 CA SER A 83 -2.943 17.389 2.896 1.00 0.00 C ATOM 1322 C SER A 83 -3.348 18.839 3.145 1.00 0.00 C ATOM 1323 O SER A 83 -4.501 19.144 3.452 1.00 0.00 O ATOM 1324 CB SER A 83 -2.927 17.104 1.393 1.00 0.00 C ATOM 1325 OG SER A 83 -2.038 16.044 1.085 1.00 0.00 O ATOM 0 H SER A 83 -4.825 16.772 3.584 1.00 0.00 H new ATOM 0 HA SER A 83 -1.942 17.235 3.299 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.932 16.849 1.057 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.628 18.002 0.852 1.00 0.00 H new ATOM 0 HG SER A 83 -1.887 15.500 1.886 1.00 0.00 H new ATOM 1331 N PRO A 84 -2.378 19.755 3.011 1.00 0.00 N ATOM 1332 CA PRO A 84 -2.609 21.188 3.217 1.00 0.00 C ATOM 1333 C PRO A 84 -3.473 21.799 2.119 1.00 0.00 C ATOM 1334 O PRO A 84 -3.837 22.973 2.185 1.00 0.00 O ATOM 1335 CB PRO A 84 -1.199 21.783 3.181 1.00 0.00 C ATOM 1336 CG PRO A 84 -0.403 20.822 2.367 1.00 0.00 C ATOM 1337 CD PRO A 84 -0.981 19.463 2.648 1.00 0.00 C ATOM 0 HA PRO A 84 -3.146 21.385 4.145 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -1.200 22.776 2.732 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -0.788 21.887 4.185 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -0.468 21.062 1.306 1.00 0.00 H new ATOM 0 HG3 PRO A 84 0.652 20.861 2.638 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -0.920 18.812 1.776 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.452 18.961 3.458 1.00 0.00 H new ATOM 1345 N GLU A 85 -3.798 20.996 1.111 1.00 0.00 N ATOM 1346 CA GLU A 85 -4.619 21.460 -0.001 1.00 0.00 C ATOM 1347 C GLU A 85 -6.027 20.877 0.083 1.00 0.00 C ATOM 1348 O GLU A 85 -7.012 21.565 -0.178 1.00 0.00 O ATOM 1349 CB GLU A 85 -3.975 21.077 -1.335 1.00 0.00 C ATOM 1350 CG GLU A 85 -2.636 21.751 -1.580 1.00 0.00 C ATOM 1351 CD GLU A 85 -2.777 23.225 -1.907 1.00 0.00 C ATOM 1352 OE1 GLU A 85 -3.160 23.544 -3.052 1.00 0.00 O ATOM 1353 OE2 GLU A 85 -2.503 24.060 -1.020 1.00 0.00 O ATOM 0 H GLU A 85 -3.505 20.021 1.042 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.689 22.546 0.061 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.839 19.996 -1.366 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -4.656 21.336 -2.145 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -2.009 21.637 -0.696 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -2.125 21.248 -2.401 1.00 0.00 H new ATOM 1360 N GLY A 86 -6.112 19.601 0.447 1.00 0.00 N ATOM 1361 CA GLY A 86 -7.402 18.946 0.558 1.00 0.00 C ATOM 1362 C GLY A 86 -7.290 17.531 1.090 1.00 0.00 C ATOM 1363 O GLY A 86 -7.282 17.315 2.302 1.00 0.00 O ATOM 0 H GLY A 86 -5.311 19.010 0.667 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -8.046 19.528 1.217 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.881 18.926 -0.421 1.00 0.00 H new ATOM 1367 N MET A 87 -7.206 16.564 0.183 1.00 0.00 N ATOM 1368 CA MET A 87 -7.095 15.162 0.569 1.00 0.00 C ATOM 1369 C MET A 87 -6.419 14.347 -0.530 1.00 0.00 C ATOM 1370 O MET A 87 -6.891 14.308 -1.666 1.00 0.00 O ATOM 1371 CB MET A 87 -8.478 14.582 0.872 1.00 0.00 C ATOM 1372 CG MET A 87 -8.518 13.063 0.855 1.00 0.00 C ATOM 1373 SD MET A 87 -7.087 12.322 1.663 1.00 0.00 S ATOM 1374 CE MET A 87 -7.667 12.222 3.355 1.00 0.00 C ATOM 0 H MET A 87 -7.213 16.725 -0.824 1.00 0.00 H new ATOM 0 HA MET A 87 -6.481 15.107 1.468 1.00 0.00 H new ATOM 0 HB2 MET A 87 -8.804 14.935 1.850 1.00 0.00 H new ATOM 0 HB3 MET A 87 -9.191 14.964 0.141 1.00 0.00 H new ATOM 0 HG2 MET A 87 -9.427 12.722 1.350 1.00 0.00 H new ATOM 0 HG3 MET A 87 -8.568 12.716 -0.177 1.00 0.00 H new ATOM 0 HE1 MET A 87 -7.147 11.415 3.871 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.468 13.165 3.864 1.00 0.00 H new ATOM 0 HE3 MET A 87 -8.739 12.025 3.361 1.00 0.00 H new ATOM 1384 N SER A 88 -5.312 13.698 -0.184 1.00 0.00 N ATOM 1385 CA SER A 88 -4.569 12.888 -1.142 1.00 0.00 C ATOM 1386 C SER A 88 -4.947 11.415 -1.016 1.00 0.00 C ATOM 1387 O SER A 88 -4.393 10.691 -0.189 1.00 0.00 O ATOM 1388 CB SER A 88 -3.064 13.061 -0.930 1.00 0.00 C ATOM 1389 OG SER A 88 -2.583 14.212 -1.602 1.00 0.00 O ATOM 0 H SER A 88 -4.910 13.717 0.753 1.00 0.00 H new ATOM 0 HA SER A 88 -4.828 13.227 -2.145 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.851 13.143 0.136 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.539 12.178 -1.293 1.00 0.00 H new ATOM 0 HG SER A 88 -2.358 14.904 -0.946 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.893 10.980 -1.843 1.00 0.00 N ATOM 1396 CA GLU A 89 -6.345 9.594 -1.823 1.00 0.00 C ATOM 1397 C GLU A 89 -5.617 8.769 -2.881 1.00 0.00 C ATOM 1398 O GLU A 89 -5.720 9.046 -4.077 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.855 9.524 -2.055 1.00 0.00 C ATOM 1400 CG GLU A 89 -8.267 9.843 -3.483 1.00 0.00 C ATOM 1401 CD GLU A 89 -9.668 10.417 -3.571 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -10.096 11.090 -2.610 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.336 10.192 -4.602 1.00 0.00 O ATOM 0 H GLU A 89 -6.360 11.567 -2.534 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.116 9.178 -0.842 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.208 8.525 -1.799 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.351 10.220 -1.379 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.560 10.553 -3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.212 8.936 -4.085 1.00 0.00 H new ATOM 1410 N ILE A 90 -4.883 7.757 -2.432 1.00 0.00 N ATOM 1411 CA ILE A 90 -4.140 6.892 -3.340 1.00 0.00 C ATOM 1412 C ILE A 90 -4.798 5.521 -3.455 1.00 0.00 C ATOM 1413 O ILE A 90 -5.223 4.939 -2.457 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.682 6.712 -2.877 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -1.897 8.011 -3.073 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -2.023 5.569 -3.635 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.712 8.147 -2.143 1.00 0.00 C ATOM 0 H ILE A 90 -4.787 7.516 -1.446 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.146 7.378 -4.316 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.681 6.466 -1.815 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.547 8.063 -4.104 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.567 8.857 -2.921 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.993 5.454 -3.297 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.571 4.645 -3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.032 5.788 -4.703 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.203 9.091 -2.338 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.057 8.128 -1.109 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.021 7.321 -2.311 1.00 0.00 H new ATOM 1429 N TYR A 91 -4.877 5.011 -4.679 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.483 3.708 -4.926 1.00 0.00 C ATOM 1431 C TYR A 91 -4.421 2.670 -5.274 1.00 0.00 C ATOM 1432 O TYR A 91 -3.630 2.858 -6.199 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.507 3.806 -6.059 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.685 4.696 -5.735 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.355 4.582 -4.523 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -8.129 5.651 -6.641 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.432 5.393 -4.223 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.204 6.467 -6.349 1.00 0.00 C ATOM 1439 CZ TYR A 91 -9.853 6.334 -5.139 1.00 0.00 C ATOM 1440 OH TYR A 91 -10.926 7.145 -4.845 1.00 0.00 O ATOM 0 H TYR A 91 -4.529 5.480 -5.515 1.00 0.00 H new ATOM 0 HA TYR A 91 -5.988 3.392 -4.014 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.012 4.184 -6.953 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.872 2.806 -6.295 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -8.028 3.846 -3.803 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.625 5.757 -7.590 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -9.942 5.291 -3.276 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.535 7.205 -7.064 1.00 0.00 H new ATOM 0 HH TYR A 91 -10.630 8.078 -4.807 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.409 1.572 -4.525 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.445 0.501 -4.753 1.00 0.00 C ATOM 1452 C LEU A 92 -4.154 -0.832 -4.971 1.00 0.00 C ATOM 1453 O LEU A 92 -4.796 -1.360 -4.063 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.484 0.393 -3.568 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.914 1.711 -3.043 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.269 1.510 -1.681 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -0.910 2.288 -4.031 1.00 0.00 C ATOM 0 H LEU A 92 -5.056 1.400 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.878 0.741 -5.652 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.003 -0.107 -2.750 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.652 -0.249 -3.858 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.734 2.420 -2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.869 2.459 -1.324 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.015 1.142 -0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.460 0.784 -1.765 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.514 3.226 -3.642 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.093 1.581 -4.174 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.403 2.471 -4.986 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.030 -1.371 -6.179 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.658 -2.643 -6.516 1.00 0.00 C ATOM 1471 C ARG A 93 -3.631 -3.771 -6.523 1.00 0.00 C ATOM 1472 O ARG A 93 -2.761 -3.827 -7.393 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.341 -2.553 -7.882 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.139 -3.794 -8.247 1.00 0.00 C ATOM 1475 CD ARG A 93 -6.967 -3.574 -9.503 1.00 0.00 C ATOM 1476 NE ARG A 93 -8.006 -2.567 -9.305 1.00 0.00 N ATOM 1477 CZ ARG A 93 -9.057 -2.428 -10.105 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -9.208 -3.227 -11.152 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -9.960 -1.488 -9.858 1.00 0.00 N ATOM 0 H ARG A 93 -3.501 -0.947 -6.941 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.408 -2.862 -5.756 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.005 -1.689 -7.890 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.584 -2.380 -8.647 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.460 -4.633 -8.400 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -6.796 -4.062 -7.419 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.313 -3.265 -10.318 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -7.427 -4.515 -9.803 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.920 -1.936 -8.508 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.516 -3.951 -11.345 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -10.016 -3.118 -11.765 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.847 -0.871 -9.053 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -10.767 -1.382 -10.473 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.737 -4.667 -5.548 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.817 -5.793 -5.440 1.00 0.00 C ATOM 1495 C CYS A 94 -3.211 -6.911 -6.399 1.00 0.00 C ATOM 1496 O CYS A 94 -4.339 -6.952 -6.889 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.790 -6.322 -4.005 1.00 0.00 C ATOM 1498 SG CYS A 94 -2.326 -5.084 -2.771 1.00 0.00 S ATOM 0 H CYS A 94 -4.451 -4.635 -4.821 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.821 -5.442 -5.709 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.775 -6.716 -3.756 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.090 -7.155 -3.949 1.00 0.00 H new ATOM 0 HG CYS A 94 -1.254 -5.473 -2.148 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.274 -7.815 -6.664 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.523 -8.933 -7.567 1.00 0.00 C ATOM 1506 C GLN A 95 -3.340 -10.019 -6.875 1.00 0.00 C ATOM 1507 O GLN A 95 -4.448 -10.343 -7.302 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.201 -9.514 -8.070 1.00 0.00 C ATOM 1509 CG GLN A 95 -1.349 -10.370 -9.318 1.00 0.00 C ATOM 1510 CD GLN A 95 -0.042 -10.540 -10.068 1.00 0.00 C ATOM 1511 OE1 GLN A 95 0.974 -10.925 -9.489 1.00 0.00 O ATOM 1512 NE2 GLN A 95 -0.062 -10.252 -11.364 1.00 0.00 N ATOM 0 H GLN A 95 -1.335 -7.795 -6.266 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.094 -8.561 -8.418 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -0.511 -8.697 -8.280 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.753 -10.115 -7.278 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -1.733 -11.351 -9.038 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -2.087 -9.916 -9.980 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -0.927 -9.936 -11.803 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.787 -10.347 -11.921 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.785 -10.580 -5.807 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.462 -11.630 -5.055 1.00 0.00 C ATOM 1523 C ASP A 96 -3.642 -11.225 -3.596 1.00 0.00 C ATOM 1524 O ASP A 96 -3.237 -10.136 -3.190 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.672 -12.938 -5.141 1.00 0.00 C ATOM 1526 CG ASP A 96 -1.219 -12.763 -4.746 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -0.782 -11.604 -4.591 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -0.519 -13.786 -4.592 1.00 0.00 O ATOM 0 H ASP A 96 -1.867 -10.325 -5.442 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.448 -11.780 -5.495 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -3.135 -13.682 -4.493 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -2.725 -13.325 -6.159 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.252 -12.108 -2.812 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.487 -11.841 -1.398 1.00 0.00 C ATOM 1535 C GLU A 97 -3.176 -11.856 -0.616 1.00 0.00 C ATOM 1536 O GLU A 97 -3.052 -11.200 0.418 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.453 -12.873 -0.814 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.826 -14.240 -0.597 1.00 0.00 C ATOM 1539 CD GLU A 97 -4.944 -15.136 -1.814 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -6.082 -15.495 -2.179 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -3.896 -15.477 -2.402 1.00 0.00 O ATOM 0 H GLU A 97 -4.592 -13.015 -3.132 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.931 -10.849 -1.311 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.835 -12.503 0.137 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.308 -12.977 -1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.773 -14.116 -0.342 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -5.305 -14.724 0.254 1.00 0.00 H new ATOM 1548 N GLN A 98 -2.203 -12.609 -1.119 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.903 -12.710 -0.467 1.00 0.00 C ATOM 1550 C GLN A 98 -0.256 -11.337 -0.326 1.00 0.00 C ATOM 1551 O GLN A 98 0.063 -10.902 0.781 1.00 0.00 O ATOM 1552 CB GLN A 98 0.017 -13.641 -1.259 1.00 0.00 C ATOM 1553 CG GLN A 98 -0.414 -15.098 -1.223 1.00 0.00 C ATOM 1554 CD GLN A 98 -0.089 -15.771 0.096 1.00 0.00 C ATOM 1555 OE1 GLN A 98 -0.426 -15.262 1.165 1.00 0.00 O ATOM 1556 NE2 GLN A 98 0.571 -16.921 0.027 1.00 0.00 N ATOM 0 H GLN A 98 -2.290 -13.157 -1.975 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.056 -13.123 0.530 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.053 -13.307 -2.296 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.029 -13.560 -0.863 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -1.487 -15.160 -1.403 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.077 -15.638 -2.033 1.00 0.00 H new ATOM 0 HE21 GLN A 98 0.830 -17.306 -0.881 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.819 -17.419 0.882 1.00 0.00 H new ATOM 1565 N GLN A 99 -0.065 -10.659 -1.453 1.00 0.00 N ATOM 1566 CA GLN A 99 0.545 -9.335 -1.453 1.00 0.00 C ATOM 1567 C GLN A 99 -0.327 -8.333 -0.703 1.00 0.00 C ATOM 1568 O GLN A 99 0.180 -7.428 -0.040 1.00 0.00 O ATOM 1569 CB GLN A 99 0.774 -8.856 -2.888 1.00 0.00 C ATOM 1570 CG GLN A 99 1.527 -7.538 -2.977 1.00 0.00 C ATOM 1571 CD GLN A 99 3.016 -7.700 -2.742 1.00 0.00 C ATOM 1572 OE1 GLN A 99 3.441 -8.180 -1.691 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.817 -7.300 -3.722 1.00 0.00 N ATOM 0 H GLN A 99 -0.324 -11.005 -2.377 1.00 0.00 H new ATOM 0 HA GLN A 99 1.506 -9.406 -0.943 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.329 -9.620 -3.433 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.190 -8.748 -3.384 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.364 -7.096 -3.960 1.00 0.00 H new ATOM 0 HG3 GLN A 99 1.121 -6.842 -2.243 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.421 -6.908 -4.576 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.828 -7.385 -3.621 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.640 -8.501 -0.813 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.583 -7.610 -0.147 1.00 0.00 C ATOM 1584 C TYR A 100 -2.368 -7.621 1.363 1.00 0.00 C ATOM 1585 O TYR A 100 -2.140 -6.578 1.976 1.00 0.00 O ATOM 1586 CB TYR A 100 -4.020 -8.020 -0.473 1.00 0.00 C ATOM 1587 CG TYR A 100 -5.040 -7.475 0.501 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.307 -6.113 0.569 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.738 -8.322 1.353 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.237 -5.611 1.458 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.672 -7.829 2.244 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.917 -6.472 2.293 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.846 -5.976 3.179 1.00 0.00 O ATOM 0 H TYR A 100 -2.076 -9.246 -1.357 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.409 -6.598 -0.513 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.268 -7.676 -1.477 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -4.085 -9.108 -0.484 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.778 -5.435 -0.085 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.547 -9.384 1.318 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.431 -4.549 1.499 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.207 -8.502 2.898 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.075 -5.056 2.932 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.444 -8.807 1.957 1.00 0.00 N ATOM 1604 CA ALA A 101 -2.255 -8.956 3.395 1.00 0.00 C ATOM 1605 C ALA A 101 -0.929 -8.349 3.840 1.00 0.00 C ATOM 1606 O ALA A 101 -0.885 -7.547 4.773 1.00 0.00 O ATOM 1607 CB ALA A 101 -2.325 -10.424 3.787 1.00 0.00 C ATOM 0 H ALA A 101 -2.635 -9.679 1.464 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.058 -8.418 3.900 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -2.182 -10.520 4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.300 -10.828 3.513 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.543 -10.977 3.266 1.00 0.00 H new ATOM 1613 N ARG A 102 0.149 -8.737 3.168 1.00 0.00 N ATOM 1614 CA ARG A 102 1.477 -8.233 3.497 1.00 0.00 C ATOM 1615 C ARG A 102 1.478 -6.709 3.566 1.00 0.00 C ATOM 1616 O ARG A 102 1.731 -6.126 4.621 1.00 0.00 O ATOM 1617 CB ARG A 102 2.497 -8.707 2.459 1.00 0.00 C ATOM 1618 CG ARG A 102 2.775 -10.200 2.516 1.00 0.00 C ATOM 1619 CD ARG A 102 3.462 -10.688 1.251 1.00 0.00 C ATOM 1620 NE ARG A 102 4.327 -11.837 1.506 1.00 0.00 N ATOM 1621 CZ ARG A 102 4.830 -12.605 0.546 1.00 0.00 C ATOM 1622 NH1 ARG A 102 4.556 -12.348 -0.726 1.00 0.00 N ATOM 1623 NH2 ARG A 102 5.609 -13.633 0.857 1.00 0.00 N ATOM 0 H ARG A 102 0.129 -9.399 2.392 1.00 0.00 H new ATOM 0 HA ARG A 102 1.755 -8.625 4.476 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.135 -8.451 1.463 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.432 -8.166 2.607 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.401 -10.422 3.380 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.839 -10.740 2.654 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.709 -10.958 0.511 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.052 -9.878 0.824 1.00 0.00 H new ATOM 0 HE ARG A 102 4.557 -12.062 2.474 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.958 -11.559 -0.969 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.944 -12.940 -1.461 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.822 -13.834 1.834 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.995 -14.222 0.119 1.00 0.00 H new ATOM 1637 N TRP A 103 1.193 -6.070 2.437 1.00 0.00 N ATOM 1638 CA TRP A 103 1.161 -4.613 2.371 1.00 0.00 C ATOM 1639 C TRP A 103 0.113 -4.048 3.322 1.00 0.00 C ATOM 1640 O TRP A 103 0.440 -3.314 4.254 1.00 0.00 O ATOM 1641 CB TRP A 103 0.871 -4.154 0.941 1.00 0.00 C ATOM 1642 CG TRP A 103 2.090 -4.117 0.070 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.633 -5.160 -0.625 1.00 0.00 C ATOM 1644 CD2 TRP A 103 2.919 -2.981 -0.197 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.749 -4.740 -1.308 1.00 0.00 N ATOM 1646 CE2 TRP A 103 3.945 -3.407 -1.063 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.893 -1.644 0.209 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 4.934 -2.544 -1.526 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.875 -0.788 -0.251 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.884 -1.240 -1.112 1.00 0.00 C ATOM 0 H TRP A 103 0.981 -6.537 1.555 1.00 0.00 H new ATOM 0 HA TRP A 103 2.139 -4.238 2.674 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.135 -4.822 0.495 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.424 -3.161 0.970 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.243 -6.167 -0.636 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.336 -5.326 -1.901 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.118 -1.286 0.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.713 -2.891 -2.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.865 0.247 0.058 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.637 -0.546 -1.456 1.00 0.00 H new ATOM 1661 N MET A 104 -1.147 -4.394 3.081 1.00 0.00 N ATOM 1662 CA MET A 104 -2.243 -3.920 3.918 1.00 0.00 C ATOM 1663 C MET A 104 -1.854 -3.953 5.393 1.00 0.00 C ATOM 1664 O MET A 104 -1.721 -2.910 6.032 1.00 0.00 O ATOM 1665 CB MET A 104 -3.493 -4.773 3.690 1.00 0.00 C ATOM 1666 CG MET A 104 -4.597 -4.515 4.702 1.00 0.00 C ATOM 1667 SD MET A 104 -4.879 -2.758 4.991 1.00 0.00 S ATOM 1668 CE MET A 104 -6.184 -2.426 3.810 1.00 0.00 C ATOM 0 H MET A 104 -1.435 -5.001 2.313 1.00 0.00 H new ATOM 0 HA MET A 104 -2.459 -2.889 3.640 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.877 -4.580 2.688 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.216 -5.827 3.727 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.521 -4.974 4.351 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.340 -4.997 5.645 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.530 -1.399 3.929 1.00 0.00 H new ATOM 0 HE2 MET A 104 -5.803 -2.566 2.798 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.014 -3.111 3.983 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.672 -5.156 5.926 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.296 -5.324 7.324 1.00 0.00 C ATOM 1680 C ALA A 105 -0.287 -4.263 7.752 1.00 0.00 C ATOM 1681 O ALA A 105 -0.320 -3.782 8.884 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.729 -6.717 7.556 1.00 0.00 C ATOM 0 H ALA A 105 -1.779 -6.030 5.410 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.193 -5.203 7.932 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.453 -6.827 8.605 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.480 -7.463 7.298 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.153 -6.859 6.932 1.00 0.00 H new ATOM 1688 N GLY A 106 0.609 -3.902 6.839 1.00 0.00 N ATOM 1689 CA GLY A 106 1.615 -2.900 7.142 1.00 0.00 C ATOM 1690 C GLY A 106 1.016 -1.526 7.367 1.00 0.00 C ATOM 1691 O GLY A 106 1.251 -0.901 8.402 1.00 0.00 O ATOM 0 H GLY A 106 0.657 -4.285 5.895 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.168 -3.202 8.032 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.332 -2.850 6.323 1.00 0.00 H new ATOM 1695 N CYS A 107 0.241 -1.054 6.396 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.391 0.257 6.492 1.00 0.00 C ATOM 1697 C CYS A 107 -1.232 0.363 7.760 1.00 0.00 C ATOM 1698 O CYS A 107 -1.248 1.401 8.421 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.265 0.515 5.264 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.334 0.719 3.727 1.00 0.00 S ATOM 0 H CYS A 107 0.036 -1.559 5.534 1.00 0.00 H new ATOM 0 HA CYS A 107 0.396 1.010 6.535 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.963 -0.314 5.147 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -1.861 1.411 5.437 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.159 0.930 2.745 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.931 -0.718 8.093 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.777 -0.745 9.280 1.00 0.00 C ATOM 1708 C ARG A 108 -1.948 -0.531 10.543 1.00 0.00 C ATOM 1709 O ARG A 108 -2.399 0.107 11.495 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.526 -2.075 9.368 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.723 -2.163 8.434 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.175 -3.602 8.242 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.385 -4.285 9.516 1.00 0.00 N ATOM 1714 CZ ARG A 108 -6.479 -4.140 10.256 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -7.457 -3.342 9.850 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -6.596 -4.795 11.404 1.00 0.00 N ATOM 0 H ARG A 108 -1.928 -1.586 7.557 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.500 0.067 9.199 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.836 -2.887 9.138 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.864 -2.225 10.393 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.546 -1.573 8.838 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.465 -1.730 7.468 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.100 -3.617 7.666 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.428 -4.142 7.660 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.652 -4.907 9.856 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -7.371 -2.838 8.968 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -8.296 -3.233 10.420 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -5.846 -5.410 11.719 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.436 -4.683 11.972 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.733 -1.070 10.545 1.00 0.00 N ATOM 1731 CA LEU A 109 0.159 -0.939 11.692 1.00 0.00 C ATOM 1732 C LEU A 109 0.595 0.510 11.880 1.00 0.00 C ATOM 1733 O LEU A 109 0.456 1.074 12.965 1.00 0.00 O ATOM 1734 CB LEU A 109 1.388 -1.833 11.511 1.00 0.00 C ATOM 1735 CG LEU A 109 1.135 -3.340 11.566 1.00 0.00 C ATOM 1736 CD1 LEU A 109 2.250 -4.095 10.859 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.003 -3.807 13.008 1.00 0.00 C ATOM 0 H LEU A 109 -0.344 -1.601 9.766 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.385 -1.254 12.582 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.846 -1.596 10.551 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.115 -1.578 12.282 1.00 0.00 H new ATOM 0 HG LEU A 109 0.198 -3.550 11.050 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.053 -5.166 10.909 1.00 0.00 H new ATOM 0 HD12 LEU A 109 2.296 -3.782 9.816 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.201 -3.879 11.345 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.823 -4.882 13.027 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.923 -3.583 13.549 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.168 -3.291 13.483 1.00 0.00 H new ATOM 1749 N ALA A 110 1.120 1.108 10.816 1.00 0.00 N ATOM 1750 CA ALA A 110 1.572 2.493 10.863 1.00 0.00 C ATOM 1751 C ALA A 110 0.416 3.437 11.179 1.00 0.00 C ATOM 1752 O ALA A 110 0.570 4.386 11.947 1.00 0.00 O ATOM 1753 CB ALA A 110 2.227 2.880 9.545 1.00 0.00 C ATOM 0 H ALA A 110 1.243 0.655 9.910 1.00 0.00 H new ATOM 0 HA ALA A 110 2.308 2.582 11.662 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.560 3.917 9.595 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.084 2.232 9.361 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.507 2.768 8.734 1.00 0.00 H new ATOM 1759 N SER A 111 -0.740 3.170 10.580 1.00 0.00 N ATOM 1760 CA SER A 111 -1.921 3.999 10.794 1.00 0.00 C ATOM 1761 C SER A 111 -2.031 4.421 12.256 1.00 0.00 C ATOM 1762 O SER A 111 -2.522 5.506 12.566 1.00 0.00 O ATOM 1763 CB SER A 111 -3.183 3.244 10.372 1.00 0.00 C ATOM 1764 OG SER A 111 -4.344 3.851 10.911 1.00 0.00 O ATOM 0 H SER A 111 -0.884 2.387 9.943 1.00 0.00 H new ATOM 0 HA SER A 111 -1.821 4.896 10.182 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.251 3.223 9.284 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.121 2.209 10.708 1.00 0.00 H new ATOM 0 HG SER A 111 -5.137 3.351 10.626 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.569 3.554 13.151 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.613 3.835 14.581 1.00 0.00 C ATOM 1772 C LYS A 112 -0.225 4.180 15.111 1.00 0.00 C ATOM 1773 O LYS A 112 -0.087 4.751 16.192 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.176 2.631 15.341 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.594 2.265 14.935 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.589 3.331 15.363 1.00 0.00 C ATOM 1777 CE LYS A 112 -5.986 2.753 15.530 1.00 0.00 C ATOM 1778 NZ LYS A 112 -6.146 2.058 16.838 1.00 0.00 N ATOM 0 H LYS A 112 -1.160 2.651 12.911 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.266 4.694 14.737 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.526 1.771 15.176 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.157 2.845 16.410 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.642 2.134 13.854 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.867 1.310 15.384 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.264 3.778 16.303 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.610 4.129 14.621 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.722 3.553 15.452 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.189 2.053 14.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.111 1.678 16.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -5.461 1.278 16.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -5.978 2.732 17.612 1.00 0.00 H new ATOM 1792 N GLY A 113 0.801 3.830 14.342 1.00 0.00 N ATOM 1793 CA GLY A 113 2.165 4.112 14.750 1.00 0.00 C ATOM 1794 C GLY A 113 3.017 2.861 14.830 1.00 0.00 C ATOM 1795 O GLY A 113 4.236 2.941 14.979 1.00 0.00 O ATOM 0 H GLY A 113 0.712 3.356 13.443 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.615 4.810 14.044 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.156 4.604 15.723 1.00 0.00 H new ATOM 1799 N ARG A 114 2.374 1.702 14.733 1.00 0.00 N ATOM 1800 CA ARG A 114 3.080 0.428 14.798 1.00 0.00 C ATOM 1801 C ARG A 114 3.969 0.236 13.572 1.00 0.00 C ATOM 1802 O ARG A 114 3.683 0.762 12.496 1.00 0.00 O ATOM 1803 CB ARG A 114 2.084 -0.727 14.905 1.00 0.00 C ATOM 1804 CG ARG A 114 1.434 -0.846 16.274 1.00 0.00 C ATOM 1805 CD ARG A 114 0.471 -2.022 16.333 1.00 0.00 C ATOM 1806 NE ARG A 114 0.268 -2.495 17.700 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.479 -3.549 18.009 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.089 -4.237 17.054 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -0.615 -3.918 19.277 1.00 0.00 N ATOM 0 H ARG A 114 1.365 1.619 14.609 1.00 0.00 H new ATOM 0 HA ARG A 114 3.712 0.436 15.686 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.306 -0.596 14.153 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.597 -1.660 14.673 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.205 -0.967 17.035 1.00 0.00 H new ATOM 0 HG3 ARG A 114 0.900 0.075 16.506 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.487 -1.728 15.905 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.856 -2.837 15.721 1.00 0.00 H new ATOM 0 HE ARG A 114 0.725 -1.988 18.458 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -0.985 -3.957 16.079 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -1.662 -5.046 17.295 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.146 -3.392 20.014 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -1.189 -4.727 19.514 1.00 0.00 H new ATOM 1823 N THR A 115 5.048 -0.521 13.743 1.00 0.00 N ATOM 1824 CA THR A 115 5.979 -0.782 12.652 1.00 0.00 C ATOM 1825 C THR A 115 6.059 -2.272 12.342 1.00 0.00 C ATOM 1826 O THR A 115 5.968 -3.108 13.240 1.00 0.00 O ATOM 1827 CB THR A 115 7.391 -0.261 12.982 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.892 -0.915 14.154 1.00 0.00 O ATOM 1829 CG2 THR A 115 7.375 1.244 13.203 1.00 0.00 C ATOM 0 H THR A 115 5.299 -0.964 14.627 1.00 0.00 H new ATOM 0 HA THR A 115 5.599 -0.252 11.779 1.00 0.00 H new ATOM 0 HB THR A 115 8.043 -0.481 12.136 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.790 -0.580 14.357 1.00 0.00 H new ATOM 0 HG21 THR A 115 8.383 1.588 13.435 1.00 0.00 H new ATOM 0 HG22 THR A 115 7.020 1.741 12.300 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.710 1.483 14.033 1.00 0.00 H new ATOM 1837 N MET A 116 6.230 -2.597 11.064 1.00 0.00 N ATOM 1838 CA MET A 116 6.324 -3.988 10.636 1.00 0.00 C ATOM 1839 C MET A 116 7.242 -4.780 11.561 1.00 0.00 C ATOM 1840 O MET A 116 6.992 -5.952 11.845 1.00 0.00 O ATOM 1841 CB MET A 116 6.839 -4.067 9.198 1.00 0.00 C ATOM 1842 CG MET A 116 6.329 -5.280 8.436 1.00 0.00 C ATOM 1843 SD MET A 116 6.421 -5.067 6.648 1.00 0.00 S ATOM 1844 CE MET A 116 7.921 -4.099 6.500 1.00 0.00 C ATOM 0 H MET A 116 6.306 -1.917 10.308 1.00 0.00 H new ATOM 0 HA MET A 116 5.326 -4.425 10.682 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.544 -3.163 8.665 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.929 -4.088 9.212 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.911 -6.156 8.724 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.295 -5.476 8.722 1.00 0.00 H new ATOM 0 HE1 MET A 116 8.260 -4.110 5.464 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.723 -3.072 6.806 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.694 -4.526 7.139 1.00 0.00 H new ATOM 1854 N ALA A 117 8.306 -4.134 12.028 1.00 0.00 N ATOM 1855 CA ALA A 117 9.260 -4.779 12.922 1.00 0.00 C ATOM 1856 C ALA A 117 8.543 -5.572 14.009 1.00 0.00 C ATOM 1857 O ALA A 117 8.998 -6.644 14.410 1.00 0.00 O ATOM 1858 CB ALA A 117 10.183 -3.742 13.545 1.00 0.00 C ATOM 0 H ALA A 117 8.529 -3.165 11.802 1.00 0.00 H new ATOM 0 HA ALA A 117 9.858 -5.476 12.334 1.00 0.00 H new ATOM 0 HB1 ALA A 117 10.890 -4.237 14.210 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.729 -3.221 12.758 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.592 -3.024 14.113 1.00 0.00 H new ATOM 1864 N ASP A 118 7.422 -5.040 14.483 1.00 0.00 N ATOM 1865 CA ASP A 118 6.642 -5.699 15.524 1.00 0.00 C ATOM 1866 C ASP A 118 6.199 -7.087 15.074 1.00 0.00 C ATOM 1867 O ASP A 118 5.734 -7.266 13.948 1.00 0.00 O ATOM 1868 CB ASP A 118 5.422 -4.853 15.889 1.00 0.00 C ATOM 1869 CG ASP A 118 4.865 -5.201 17.256 1.00 0.00 C ATOM 1870 OD1 ASP A 118 4.428 -6.355 17.442 1.00 0.00 O ATOM 1871 OD2 ASP A 118 4.865 -4.318 18.139 1.00 0.00 O ATOM 0 H ASP A 118 7.033 -4.153 14.163 1.00 0.00 H new ATOM 0 HA ASP A 118 7.275 -5.808 16.405 1.00 0.00 H new ATOM 0 HB2 ASP A 118 5.696 -3.798 15.869 1.00 0.00 H new ATOM 0 HB3 ASP A 118 4.646 -4.995 15.137 1.00 0.00 H new ATOM 1876 N SER A 119 6.347 -8.067 15.960 1.00 0.00 N ATOM 1877 CA SER A 119 5.966 -9.440 15.652 1.00 0.00 C ATOM 1878 C SER A 119 4.496 -9.520 15.252 1.00 0.00 C ATOM 1879 O SER A 119 4.093 -10.404 14.496 1.00 0.00 O ATOM 1880 CB SER A 119 6.229 -10.347 16.856 1.00 0.00 C ATOM 1881 OG SER A 119 7.603 -10.348 17.203 1.00 0.00 O ATOM 0 H SER A 119 6.728 -7.935 16.897 1.00 0.00 H new ATOM 0 HA SER A 119 6.572 -9.779 14.812 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.636 -10.009 17.706 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.908 -11.363 16.627 1.00 0.00 H new ATOM 0 HG SER A 119 7.745 -10.933 17.976 1.00 0.00 H new ATOM 1887 N SER A 120 3.698 -8.589 15.767 1.00 0.00 N ATOM 1888 CA SER A 120 2.271 -8.555 15.468 1.00 0.00 C ATOM 1889 C SER A 120 2.033 -8.492 13.963 1.00 0.00 C ATOM 1890 O SER A 120 1.064 -9.055 13.452 1.00 0.00 O ATOM 1891 CB SER A 120 1.614 -7.354 16.151 1.00 0.00 C ATOM 1892 OG SER A 120 2.040 -6.137 15.561 1.00 0.00 O ATOM 0 H SER A 120 4.016 -7.849 16.393 1.00 0.00 H new ATOM 0 HA SER A 120 1.822 -9.472 15.851 1.00 0.00 H new ATOM 0 HB2 SER A 120 0.530 -7.438 16.077 1.00 0.00 H new ATOM 0 HB3 SER A 120 1.862 -7.354 17.212 1.00 0.00 H new ATOM 0 HG SER A 120 1.605 -5.384 16.014 1.00 0.00 H new ATOM 1898 N TYR A 121 2.923 -7.804 13.258 1.00 0.00 N ATOM 1899 CA TYR A 121 2.810 -7.664 11.811 1.00 0.00 C ATOM 1900 C TYR A 121 2.266 -8.943 11.181 1.00 0.00 C ATOM 1901 O TYR A 121 1.165 -8.958 10.629 1.00 0.00 O ATOM 1902 CB TYR A 121 4.171 -7.322 11.202 1.00 0.00 C ATOM 1903 CG TYR A 121 4.271 -7.638 9.727 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.415 -7.043 8.809 1.00 0.00 C ATOM 1905 CD2 TYR A 121 5.223 -8.532 9.251 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.503 -7.330 7.460 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.319 -8.823 7.904 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.457 -8.220 7.013 1.00 0.00 C ATOM 1909 OH TYR A 121 4.548 -8.508 5.670 1.00 0.00 O ATOM 0 H TYR A 121 3.732 -7.334 13.665 1.00 0.00 H new ATOM 0 HA TYR A 121 2.113 -6.852 11.604 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.370 -6.261 11.352 1.00 0.00 H new ATOM 0 HB3 TYR A 121 4.947 -7.871 11.736 1.00 0.00 H new ATOM 0 HD1 TYR A 121 2.668 -6.344 9.155 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.899 -9.007 9.946 1.00 0.00 H new ATOM 0 HE1 TYR A 121 2.828 -6.860 6.760 1.00 0.00 H new ATOM 0 HE2 TYR A 121 6.065 -9.519 7.551 1.00 0.00 H new ATOM 0 HH TYR A 121 5.272 -9.152 5.522 1.00 0.00 H new ATOM 1919 N THR A 122 3.046 -10.016 11.269 1.00 0.00 N ATOM 1920 CA THR A 122 2.644 -11.300 10.708 1.00 0.00 C ATOM 1921 C THR A 122 1.274 -11.722 11.225 1.00 0.00 C ATOM 1922 O THR A 122 0.504 -12.369 10.516 1.00 0.00 O ATOM 1923 CB THR A 122 3.667 -12.403 11.041 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.440 -13.548 10.212 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.574 -12.803 12.505 1.00 0.00 C ATOM 0 H THR A 122 3.959 -10.021 11.723 1.00 0.00 H new ATOM 0 HA THR A 122 2.597 -11.171 9.627 1.00 0.00 H new ATOM 0 HB THR A 122 4.666 -12.011 10.851 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.095 -14.244 10.429 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.306 -13.583 12.716 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.777 -11.935 13.133 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.573 -13.178 12.717 1.00 0.00 H new ATOM 1933 N SER A 123 0.974 -11.349 12.466 1.00 0.00 N ATOM 1934 CA SER A 123 -0.304 -11.692 13.079 1.00 0.00 C ATOM 1935 C SER A 123 -1.466 -11.176 12.236 1.00 0.00 C ATOM 1936 O SER A 123 -2.558 -11.744 12.252 1.00 0.00 O ATOM 1937 CB SER A 123 -0.387 -11.112 14.492 1.00 0.00 C ATOM 1938 OG SER A 123 -1.279 -11.861 15.299 1.00 0.00 O ATOM 0 H SER A 123 1.598 -10.810 13.066 1.00 0.00 H new ATOM 0 HA SER A 123 -0.373 -12.778 13.135 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.604 -11.109 14.946 1.00 0.00 H new ATOM 0 HB3 SER A 123 -0.719 -10.075 14.444 1.00 0.00 H new ATOM 0 HG SER A 123 -1.313 -11.471 16.197 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.223 -10.095 11.502 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.250 -9.501 10.653 1.00 0.00 C ATOM 1946 C GLU A 124 -2.338 -10.230 9.315 1.00 0.00 C ATOM 1947 O GLU A 124 -3.428 -10.527 8.828 1.00 0.00 O ATOM 1948 CB GLU A 124 -1.956 -8.018 10.421 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.560 -7.105 11.474 1.00 0.00 C ATOM 1950 CD GLU A 124 -4.069 -7.227 11.556 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -4.712 -7.368 10.495 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -4.607 -7.182 12.682 1.00 0.00 O ATOM 0 H GLU A 124 -0.325 -9.613 11.478 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.208 -9.598 11.163 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.876 -7.869 10.400 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.337 -7.730 9.441 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.127 -7.341 12.446 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -2.294 -6.072 11.249 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.181 -10.514 8.726 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.126 -11.208 7.445 1.00 0.00 C ATOM 1961 C VAL A 125 -1.908 -12.516 7.494 1.00 0.00 C ATOM 1962 O VAL A 125 -2.531 -12.914 6.511 1.00 0.00 O ATOM 1963 CB VAL A 125 0.327 -11.507 7.030 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.367 -12.171 5.662 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.156 -10.231 7.037 1.00 0.00 C ATOM 0 H VAL A 125 -0.269 -10.274 9.115 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.578 -10.545 6.707 1.00 0.00 H new ATOM 0 HB VAL A 125 0.758 -12.198 7.755 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.402 -12.374 5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.190 -13.107 5.696 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.082 -11.508 4.922 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.180 -10.461 6.741 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.728 -9.515 6.336 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.155 -9.802 8.039 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.870 -13.179 8.645 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.575 -14.442 8.822 1.00 0.00 C ATOM 1977 C GLN A 126 -4.071 -14.209 9.008 1.00 0.00 C ATOM 1978 O GLN A 126 -4.889 -14.730 8.251 1.00 0.00 O ATOM 1979 CB GLN A 126 -2.012 -15.201 10.025 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.493 -15.214 10.080 1.00 0.00 C ATOM 1981 CD GLN A 126 0.108 -16.393 9.341 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.526 -17.439 9.196 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.338 -16.231 8.867 1.00 0.00 N ATOM 0 H GLN A 126 -1.358 -12.862 9.469 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.428 -15.040 7.923 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.396 -14.751 10.940 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.375 -16.228 9.998 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.110 -14.288 9.651 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.171 -15.240 11.121 1.00 0.00 H new ATOM 0 HE21 GLN A 126 1.827 -15.347 9.010 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.793 -16.990 8.360 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.421 -13.424 10.022 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.818 -13.120 10.306 1.00 0.00 C ATOM 1994 C ALA A 127 -6.581 -12.797 9.026 1.00 0.00 C ATOM 1995 O ALA A 127 -7.750 -13.155 8.882 1.00 0.00 O ATOM 1996 CB ALA A 127 -5.918 -11.963 11.289 1.00 0.00 C ATOM 0 H ALA A 127 -3.756 -12.987 10.660 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.272 -14.003 10.755 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -6.967 -11.747 11.492 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.417 -12.231 12.219 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.442 -11.080 10.862 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.913 -12.118 8.100 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.529 -11.747 6.832 1.00 0.00 C ATOM 2004 C ILE A 128 -6.697 -12.962 5.926 1.00 0.00 C ATOM 2005 O ILE A 128 -7.817 -13.396 5.652 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.698 -10.681 6.093 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.567 -9.420 6.951 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -6.334 -10.350 4.751 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -4.451 -8.501 6.506 1.00 0.00 C ATOM 0 H ILE A 128 -4.945 -11.813 8.204 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.510 -11.333 7.067 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.700 -11.081 5.912 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.509 -8.873 6.925 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.396 -9.711 7.987 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.735 -9.595 4.241 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.381 -11.251 4.139 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.342 -9.967 4.911 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.416 -7.628 7.158 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.500 -9.031 6.558 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.631 -8.180 5.480 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.578 -13.508 5.465 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.600 -14.676 4.591 1.00 0.00 C ATOM 2023 C LEU A 129 -6.725 -15.628 4.983 1.00 0.00 C ATOM 2024 O LEU A 129 -7.480 -16.097 4.132 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.256 -15.405 4.646 1.00 0.00 C ATOM 2026 CG LEU A 129 -3.124 -14.788 3.824 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.802 -15.472 4.139 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -3.433 -14.881 2.337 1.00 0.00 C ATOM 0 H LEU A 129 -4.644 -13.161 5.682 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.778 -14.333 3.572 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.936 -15.457 5.687 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.407 -16.430 4.307 1.00 0.00 H new ATOM 0 HG LEU A 129 -3.038 -13.735 4.092 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -1.008 -15.020 3.545 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.575 -15.354 5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.875 -16.533 3.900 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.617 -14.437 1.767 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -3.546 -15.927 2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.358 -14.345 2.123 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.831 -15.909 6.278 1.00 0.00 N ATOM 2041 CA ALA A 130 -7.866 -16.802 6.783 1.00 0.00 C ATOM 2042 C ALA A 130 -9.244 -16.155 6.688 1.00 0.00 C ATOM 2043 O ALA A 130 -10.129 -16.655 5.993 1.00 0.00 O ATOM 2044 CB ALA A 130 -7.565 -17.198 8.221 1.00 0.00 C ATOM 0 H ALA A 130 -6.213 -15.531 6.996 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.871 -17.699 6.164 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.346 -17.865 8.586 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.603 -17.708 8.264 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.530 -16.305 8.845 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.419 -15.041 7.392 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.690 -14.326 7.388 1.00 0.00 C ATOM 2052 C PHE A 131 -11.302 -14.313 5.990 1.00 0.00 C ATOM 2053 O PHE A 131 -12.498 -14.556 5.821 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.495 -12.893 7.885 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.727 -12.042 7.760 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.878 -12.360 8.463 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.734 -10.925 6.940 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -14.013 -11.579 8.352 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.866 -10.141 6.825 1.00 0.00 C ATOM 2060 CZ PHE A 131 -14.007 -10.469 7.530 1.00 0.00 C ATOM 0 H PHE A 131 -8.697 -14.614 7.972 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.373 -14.846 8.060 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -10.185 -12.918 8.930 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.684 -12.429 7.323 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -12.888 -13.228 9.105 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.845 -10.664 6.385 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.903 -11.836 8.907 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.858 -9.272 6.184 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.893 -9.859 7.439 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.475 -14.028 4.991 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.933 -13.982 3.607 1.00 0.00 C ATOM 2072 C LEU A 132 -11.725 -15.237 3.254 1.00 0.00 C ATOM 2073 O LEU A 132 -12.808 -15.156 2.674 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.742 -13.834 2.659 1.00 0.00 C ATOM 2075 CG LEU A 132 -8.980 -12.511 2.739 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.700 -12.581 1.922 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.856 -11.361 2.264 1.00 0.00 C ATOM 0 H LEU A 132 -9.483 -13.825 5.113 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.588 -13.118 3.496 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -9.042 -14.646 2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -10.099 -13.964 1.637 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.712 -12.331 3.780 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.172 -11.630 1.991 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.065 -13.378 2.308 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.944 -12.785 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -9.297 -10.427 2.328 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -10.155 -11.535 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.744 -11.296 2.893 1.00 0.00 H new ATOM 2089 N SER A 133 -11.179 -16.395 3.609 1.00 0.00 N ATOM 2090 CA SER A 133 -11.834 -17.667 3.329 1.00 0.00 C ATOM 2091 C SER A 133 -13.212 -17.725 3.983 1.00 0.00 C ATOM 2092 O SER A 133 -14.198 -18.101 3.348 1.00 0.00 O ATOM 2093 CB SER A 133 -10.972 -18.829 3.826 1.00 0.00 C ATOM 2094 OG SER A 133 -11.239 -20.012 3.092 1.00 0.00 O ATOM 0 H SER A 133 -10.284 -16.479 4.091 1.00 0.00 H new ATOM 0 HA SER A 133 -11.960 -17.753 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.917 -18.570 3.733 1.00 0.00 H new ATOM 0 HB3 SER A 133 -11.165 -19.003 4.885 1.00 0.00 H new ATOM 0 HG SER A 133 -10.674 -20.739 3.427 1.00 0.00 H new ATOM 2100 N LEU A 134 -13.271 -17.350 5.256 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.527 -17.358 5.998 1.00 0.00 C ATOM 2102 C LEU A 134 -15.612 -16.599 5.241 1.00 0.00 C ATOM 2103 O LEU A 134 -16.731 -17.086 5.088 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.328 -16.740 7.383 1.00 0.00 C ATOM 2105 CG LEU A 134 -13.257 -17.389 8.260 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.298 -16.814 9.667 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -13.440 -18.900 8.294 1.00 0.00 C ATOM 0 H LEU A 134 -12.464 -17.037 5.796 1.00 0.00 H new ATOM 0 HA LEU A 134 -14.846 -18.394 6.112 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.076 -15.687 7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -15.278 -16.779 7.916 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.280 -17.170 7.829 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.529 -17.288 10.276 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.118 -15.740 9.626 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.277 -17.001 10.108 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.669 -19.346 8.923 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -14.423 -19.138 8.701 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -13.359 -19.299 7.283 1.00 0.00 H new ATOM 2119 N GLN A 135 -15.271 -15.404 4.769 1.00 0.00 N ATOM 2120 CA GLN A 135 -16.216 -14.579 4.026 1.00 0.00 C ATOM 2121 C GLN A 135 -16.918 -15.394 2.945 1.00 0.00 C ATOM 2122 O GLN A 135 -18.138 -15.326 2.797 1.00 0.00 O ATOM 2123 CB GLN A 135 -15.497 -13.385 3.395 1.00 0.00 C ATOM 2124 CG GLN A 135 -14.774 -12.507 4.405 1.00 0.00 C ATOM 2125 CD GLN A 135 -15.654 -11.401 4.952 1.00 0.00 C ATOM 2126 OE1 GLN A 135 -16.779 -11.645 5.389 1.00 0.00 O ATOM 2127 NE2 GLN A 135 -15.145 -10.175 4.931 1.00 0.00 N ATOM 0 H GLN A 135 -14.348 -14.986 4.888 1.00 0.00 H new ATOM 0 HA GLN A 135 -16.968 -14.213 4.725 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.777 -13.750 2.663 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -16.223 -12.779 2.853 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.419 -13.125 5.230 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.894 -12.067 3.935 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -14.208 -10.018 4.560 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.691 -9.390 5.286 1.00 0.00 H new ATOM 2136 N ARG A 136 -16.139 -16.163 2.191 1.00 0.00 N ATOM 2137 CA ARG A 136 -16.686 -16.989 1.122 1.00 0.00 C ATOM 2138 C ARG A 136 -17.979 -17.668 1.567 1.00 0.00 C ATOM 2139 O ARG A 136 -18.159 -17.972 2.747 1.00 0.00 O ATOM 2140 CB ARG A 136 -15.666 -18.044 0.691 1.00 0.00 C ATOM 2141 CG ARG A 136 -14.384 -17.456 0.126 1.00 0.00 C ATOM 2142 CD ARG A 136 -13.441 -18.543 -0.365 1.00 0.00 C ATOM 2143 NE ARG A 136 -14.032 -19.335 -1.441 1.00 0.00 N ATOM 2144 CZ ARG A 136 -14.823 -20.382 -1.233 1.00 0.00 C ATOM 2145 NH1 ARG A 136 -15.117 -20.760 0.003 1.00 0.00 N ATOM 2146 NH2 ARG A 136 -15.322 -21.052 -2.264 1.00 0.00 N ATOM 0 H ARG A 136 -15.127 -16.231 2.301 1.00 0.00 H new ATOM 0 HA ARG A 136 -16.909 -16.341 0.274 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -15.421 -18.672 1.548 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -16.120 -18.691 -0.059 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -14.623 -16.782 -0.696 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -13.887 -16.861 0.892 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -12.515 -18.088 -0.716 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -13.179 -19.198 0.466 1.00 0.00 H new ATOM 0 HE ARG A 136 -13.826 -19.070 -2.404 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -14.736 -20.247 0.798 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -15.725 -21.564 0.159 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -15.098 -20.763 -3.216 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -15.929 -21.856 -2.104 1.00 0.00 H new ATOM 2160 N THR A 137 -18.876 -17.903 0.615 1.00 0.00 N ATOM 2161 CA THR A 137 -20.152 -18.544 0.908 1.00 0.00 C ATOM 2162 C THR A 137 -20.005 -19.577 2.019 1.00 0.00 C ATOM 2163 O THR A 137 -19.478 -20.668 1.802 1.00 0.00 O ATOM 2164 CB THR A 137 -20.736 -19.230 -0.341 1.00 0.00 C ATOM 2165 OG1 THR A 137 -20.913 -18.270 -1.390 1.00 0.00 O ATOM 2166 CG2 THR A 137 -22.068 -19.891 -0.022 1.00 0.00 C ATOM 0 H THR A 137 -18.742 -17.659 -0.366 1.00 0.00 H new ATOM 0 HA THR A 137 -20.833 -17.758 1.234 1.00 0.00 H new ATOM 0 HB THR A 137 -20.036 -19.999 -0.667 1.00 0.00 H new ATOM 0 HG1 THR A 137 -21.283 -18.714 -2.181 1.00 0.00 H new ATOM 0 HG21 THR A 137 -22.461 -20.369 -0.919 1.00 0.00 H new ATOM 0 HG22 THR A 137 -21.925 -20.641 0.756 1.00 0.00 H new ATOM 0 HG23 THR A 137 -22.774 -19.137 0.327 1.00 0.00 H new TER 2174 THR A 137