USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 0 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 110 THR OG1 : rot -157:sc= -0.124! USER MOD Set 1.2: A 139 TYR OH : rot -140:sc= 0.634 USER MOD Set 2.1: A 126 LYS NZ :NH3+ -152:sc= -0.107 (180deg=-0.859) USER MOD Set 2.2: A 128 ASN : amide:sc= -0.918 K(o=-1,f=-0.22) USER MOD Set 3.1: A 113 SER OG : rot -149:sc= 0.741 USER MOD Set 3.2: A 116 HIS : no HD1:sc= -2.85 K(o=-2.7,f=-4.5) USER MOD Set 3.3: A 119 LYS NZ :NH3+ -154:sc= -0.592 (180deg=0) USER MOD Set 4.1: A 109 ASN : amide:sc= 0.653 K(o=0.12,f=-1.8) USER MOD Set 4.2: A 111 TYR OH : rot 19:sc= -0.53 USER MOD Set 5.1: A 72 SER OG : rot -89:sc= 1.1 USER MOD Set 5.2: A 75 THR OG1 : rot 150:sc= 0.385 USER MOD Set 6.1: A 52 SER OG : rot 119:sc= 0 USER MOD Set 6.2: A 54 GLN : amide:sc= 0.795 K(o=-4,f=-6) USER MOD Set 6.3: A 55 HIS : no HD1:sc= -4.82! C(o=-4!,f=-8.3!) USER MOD Set 7.1: A 32 ASN : amide:sc= -4.07! C(o=-3.2!,f=-7.9!) USER MOD Set 7.2: A 127 LYS NZ :NH3+ -136:sc= 0.897 (180deg=-0.502) USER MOD Single : A 30 CYS SG : rot -70:sc= -3.52! USER MOD Single : A 31 SER OG : rot 59:sc= -0.331 USER MOD Single : A 35 HIS : no HE2:sc= -2.08! X(o=-2.1!,f=-2.3) USER MOD Single : A 44 THR OG1 : rot -109:sc= 0.503 USER MOD Single : A 48 THR OG1 : rot 170:sc= -0.149 USER MOD Single : A 57 GLN : amide:sc= -1.29! C(o=-1.3!,f=-5.8!) USER MOD Single : A 59 GLN : amide:sc= -0.671 X(o=-0.67,f=-0.78) USER MOD Single : A 61 SER OG : rot -10:sc= 0.159 USER MOD Single : A 64 SER OG : rot 180:sc= 0.605 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 96:sc= 1.35 USER MOD Single : A 77 GLN : amide:sc=-0.00128 K(o=-0.0013,f=-0.61) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -118:sc= -1.48 (180deg=-2.82!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= -0.229 USER MOD Single : A 90 SER OG : rot -93:sc= 1.17 USER MOD Single : A 91 GLN : amide:sc= -2.18! C(o=-2.2!,f=-3.6!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.153 USER MOD Single : A 94 ASN : amide:sc= -0.357 K(o=-0.36,f=-5.6!) USER MOD Single : A 97 CYS SG : rot -22:sc= -3.56! USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00561) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 90:sc= 1.43 USER MOD Single : A 131 CYS SG : rot 130:sc= -6.9! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 47:sc= 0.67 USER MOD Single : A 138 HIS : no HE2:sc= 0.681 K(o=0.68,f=-2.1!) USER MOD Single : A 141 GLN : amide:sc= 0.119 K(o=0.12,f=-1.8!) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -8.649 4.184 3.026 1.00 0.00 N ATOM 22 CA CYS A 30 -9.205 2.888 2.597 1.00 0.00 C ATOM 23 C CYS A 30 -10.665 2.750 3.047 1.00 0.00 C ATOM 24 O CYS A 30 -11.002 3.166 4.159 1.00 0.00 O ATOM 25 CB CYS A 30 -8.422 1.724 3.231 1.00 0.00 C ATOM 26 SG CYS A 30 -8.422 1.754 5.067 1.00 0.00 S ATOM 0 HA CYS A 30 -9.133 2.852 1.510 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -8.850 0.781 2.891 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.392 1.753 2.875 1.00 0.00 H new ATOM 0 HG CYS A 30 -7.695 2.747 5.485 1.00 0.00 H new ATOM 27 N SER A 31 -11.426 1.968 2.306 1.00 0.00 N ATOM 28 CA SER A 31 -12.785 1.549 2.725 1.00 0.00 C ATOM 29 C SER A 31 -12.706 0.304 3.639 1.00 0.00 C ATOM 30 O SER A 31 -13.262 -0.760 3.356 1.00 0.00 O ATOM 31 CB SER A 31 -13.652 1.296 1.490 1.00 0.00 C ATOM 32 OG SER A 31 -13.068 0.271 0.702 1.00 0.00 O ATOM 0 H SER A 31 -11.139 1.598 1.400 1.00 0.00 H new ATOM 0 HA SER A 31 -13.250 2.347 3.304 1.00 0.00 H new ATOM 0 HB2 SER A 31 -14.659 1.007 1.793 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.745 2.211 0.905 1.00 0.00 H new ATOM 0 HG SER A 31 -12.988 -0.547 1.236 1.00 0.00 H new ATOM 33 N ASN A 32 -11.869 0.443 4.665 1.00 0.00 N ATOM 34 CA ASN A 32 -11.547 -0.609 5.653 1.00 0.00 C ATOM 35 C ASN A 32 -11.440 0.014 7.067 1.00 0.00 C ATOM 36 O ASN A 32 -12.205 0.913 7.402 1.00 0.00 O ATOM 37 CB ASN A 32 -10.233 -1.223 5.136 1.00 0.00 C ATOM 38 CG ASN A 32 -9.669 -2.399 5.936 1.00 0.00 C ATOM 39 OD1 ASN A 32 -10.094 -3.536 5.848 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.651 -2.120 6.725 1.00 0.00 N ATOM 0 H ASN A 32 -11.375 1.317 4.846 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.309 -1.382 5.751 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -10.391 -1.553 4.109 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.478 -0.437 5.105 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.210 -2.861 7.270 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.304 -1.163 6.790 1.00 0.00 H new ATOM 41 N GLY A 33 -10.587 -0.551 7.928 1.00 0.00 N ATOM 42 CA GLY A 33 -10.092 0.103 9.164 1.00 0.00 C ATOM 43 C GLY A 33 -9.264 1.313 8.701 1.00 0.00 C ATOM 44 O GLY A 33 -8.208 1.126 8.095 1.00 0.00 O ATOM 0 H GLY A 33 -10.210 -1.489 7.792 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.921 0.417 9.798 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.484 -0.584 9.752 1.00 0.00 H new ATOM 45 N GLY A 34 -10.016 2.404 8.638 1.00 0.00 N ATOM 46 CA GLY A 34 -9.626 3.729 8.101 1.00 0.00 C ATOM 47 C GLY A 34 -8.389 4.386 8.715 1.00 0.00 C ATOM 48 O GLY A 34 -8.469 5.474 9.287 1.00 0.00 O ATOM 0 H GLY A 34 -10.978 2.402 8.978 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.458 3.625 7.029 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.469 4.408 8.227 1.00 0.00 H new ATOM 49 N HIS A 35 -7.257 3.815 8.358 1.00 0.00 N ATOM 50 CA HIS A 35 -5.923 4.341 8.684 1.00 0.00 C ATOM 51 C HIS A 35 -5.314 4.892 7.368 1.00 0.00 C ATOM 52 O HIS A 35 -6.044 5.207 6.425 1.00 0.00 O ATOM 53 CB HIS A 35 -5.070 3.229 9.315 1.00 0.00 C ATOM 54 CG HIS A 35 -5.735 2.528 10.504 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.574 1.504 10.418 1.00 0.00 N ATOM 56 CD2 HIS A 35 -5.707 2.910 11.777 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.109 1.274 11.609 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.568 2.147 12.454 1.00 0.00 N ATOM 0 H HIS A 35 -7.225 2.950 7.819 1.00 0.00 H new ATOM 0 HA HIS A 35 -5.968 5.147 9.416 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -4.839 2.486 8.552 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.122 3.655 9.642 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -6.776 0.976 9.569 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.096 3.698 12.190 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.845 0.520 11.848 1.00 0.00 H new ATOM 59 N PHE A 36 -3.990 4.900 7.280 1.00 0.00 N ATOM 60 CA PHE A 36 -3.267 5.444 6.108 1.00 0.00 C ATOM 61 C PHE A 36 -2.117 4.512 5.724 1.00 0.00 C ATOM 62 O PHE A 36 -1.642 3.714 6.543 1.00 0.00 O ATOM 63 CB PHE A 36 -2.690 6.824 6.421 1.00 0.00 C ATOM 64 CG PHE A 36 -3.735 7.917 6.655 1.00 0.00 C ATOM 65 CD1 PHE A 36 -4.255 8.634 5.561 1.00 0.00 C ATOM 66 CD2 PHE A 36 -4.087 8.270 7.979 1.00 0.00 C ATOM 67 CE1 PHE A 36 -5.130 9.724 5.775 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.957 9.361 8.206 1.00 0.00 C ATOM 69 CZ PHE A 36 -5.473 10.077 7.103 1.00 0.00 C ATOM 0 H PHE A 36 -3.378 4.534 8.009 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.976 5.526 5.284 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.060 6.747 7.307 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.045 7.128 5.597 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -3.985 8.351 4.555 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.693 7.708 8.813 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.530 10.278 4.939 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -5.225 9.644 9.213 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.141 10.908 7.275 1.00 0.00 H new ATOM 70 N LEU A 37 -1.639 4.673 4.501 1.00 0.00 N ATOM 71 CA LEU A 37 -0.464 3.918 4.009 1.00 0.00 C ATOM 72 C LEU A 37 0.868 4.573 4.388 1.00 0.00 C ATOM 73 O LEU A 37 1.745 4.827 3.557 1.00 0.00 O ATOM 74 CB LEU A 37 -0.612 3.715 2.504 1.00 0.00 C ATOM 75 CG LEU A 37 -1.590 2.604 2.160 1.00 0.00 C ATOM 76 CD1 LEU A 37 -2.049 2.751 0.711 1.00 0.00 C ATOM 77 CD2 LEU A 37 -0.956 1.223 2.381 1.00 0.00 C ATOM 0 H LEU A 37 -2.037 5.318 3.818 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.439 2.946 4.501 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.948 4.645 2.047 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.362 3.483 2.074 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.453 2.686 2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.750 1.952 0.469 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.539 3.716 0.581 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.186 2.690 0.048 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.678 0.447 2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.075 1.121 1.747 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.664 1.120 3.426 1.00 0.00 H new ATOM 78 N ARG A 38 1.047 4.707 5.699 1.00 0.00 N ATOM 79 CA ARG A 38 2.252 5.322 6.274 1.00 0.00 C ATOM 80 C ARG A 38 3.510 4.466 6.039 1.00 0.00 C ATOM 81 O ARG A 38 3.619 3.347 6.529 1.00 0.00 O ATOM 82 CB ARG A 38 2.038 5.638 7.757 1.00 0.00 C ATOM 83 CG ARG A 38 3.218 6.437 8.323 1.00 0.00 C ATOM 84 CD ARG A 38 3.043 7.023 9.731 1.00 0.00 C ATOM 85 NE ARG A 38 2.755 5.915 10.640 1.00 0.00 N ATOM 86 CZ ARG A 38 2.744 5.943 11.971 1.00 0.00 C ATOM 87 NH1 ARG A 38 3.010 7.036 12.679 1.00 0.00 N ATOM 88 NH2 ARG A 38 2.479 4.831 12.638 1.00 0.00 N ATOM 0 H ARG A 38 0.368 4.396 6.394 1.00 0.00 H new ATOM 0 HA ARG A 38 2.427 6.264 5.753 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.116 6.206 7.882 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.920 4.710 8.317 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.095 5.789 8.331 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.433 7.257 7.638 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.946 7.548 10.042 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.231 7.750 9.745 1.00 0.00 H new ATOM 0 HE ARG A 38 2.538 5.018 10.205 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.237 7.909 12.203 1.00 0.00 H new ATOM 0 HH12 ARG A 38 2.987 7.001 13.698 1.00 0.00 H new ATOM 0 HH21 ARG A 38 2.286 3.966 12.132 1.00 0.00 H new ATOM 0 HH22 ARG A 38 2.467 4.839 13.658 1.00 0.00 H new ATOM 89 N ILE A 39 4.358 5.003 5.169 1.00 0.00 N ATOM 90 CA ILE A 39 5.726 4.476 4.985 1.00 0.00 C ATOM 91 C ILE A 39 6.622 5.190 5.966 1.00 0.00 C ATOM 92 O ILE A 39 7.027 6.349 5.813 1.00 0.00 O ATOM 93 CB ILE A 39 6.202 4.618 3.525 1.00 0.00 C ATOM 94 CG1 ILE A 39 5.202 4.015 2.527 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.504 3.839 3.381 1.00 0.00 C ATOM 96 CD1 ILE A 39 4.633 5.039 1.556 1.00 0.00 C ATOM 0 H ILE A 39 4.133 5.802 4.576 1.00 0.00 H new ATOM 0 HA ILE A 39 5.753 3.405 5.185 1.00 0.00 H new ATOM 0 HB ILE A 39 6.314 5.680 3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.695 3.223 1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.383 3.552 3.078 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.866 3.921 2.356 1.00 0.00 H new ATOM 0 HG22 ILE A 39 8.250 4.248 4.063 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.329 2.790 3.621 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.934 4.549 0.879 1.00 0.00 H new ATOM 0 HD12 ILE A 39 4.113 5.818 2.113 1.00 0.00 H new ATOM 0 HD13 ILE A 39 5.444 5.484 0.980 1.00 0.00 H new ATOM 97 N LEU A 40 6.840 4.434 7.023 1.00 0.00 N ATOM 98 CA LEU A 40 7.506 4.922 8.236 1.00 0.00 C ATOM 99 C LEU A 40 8.968 5.309 7.983 1.00 0.00 C ATOM 100 O LEU A 40 9.636 4.592 7.229 1.00 0.00 O ATOM 101 CB LEU A 40 7.457 3.883 9.369 1.00 0.00 C ATOM 102 CG LEU A 40 6.144 3.717 10.143 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.883 5.021 10.879 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.953 3.338 9.281 1.00 0.00 C ATOM 0 H LEU A 40 6.561 3.454 7.075 1.00 0.00 H new ATOM 0 HA LEU A 40 6.955 5.813 8.537 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.718 2.914 8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.237 4.136 10.087 1.00 0.00 H new ATOM 0 HG LEU A 40 6.261 2.879 10.831 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.954 4.941 11.443 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.707 5.224 11.564 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.801 5.835 10.159 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.066 3.241 9.908 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.785 4.112 8.532 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.151 2.389 8.784 1.00 0.00 H new ATOM 105 N PRO A 41 9.495 6.264 8.743 1.00 0.00 N ATOM 106 CA PRO A 41 10.947 6.555 8.765 1.00 0.00 C ATOM 107 C PRO A 41 11.736 5.333 9.269 1.00 0.00 C ATOM 108 O PRO A 41 12.843 5.068 8.817 1.00 0.00 O ATOM 109 CB PRO A 41 11.100 7.777 9.667 1.00 0.00 C ATOM 110 CG PRO A 41 9.905 7.690 10.616 1.00 0.00 C ATOM 111 CD PRO A 41 8.795 7.050 9.777 1.00 0.00 C ATOM 0 HA PRO A 41 11.350 6.763 7.774 1.00 0.00 H new ATOM 0 HB2 PRO A 41 12.044 7.755 10.211 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.085 8.702 9.091 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.138 7.086 11.493 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.612 8.676 10.976 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.156 6.414 10.389 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.154 7.809 9.328 1.00 0.00 H new ATOM 112 N ASP A 42 11.029 4.491 10.031 1.00 0.00 N ATOM 113 CA ASP A 42 11.508 3.200 10.567 1.00 0.00 C ATOM 114 C ASP A 42 11.373 2.025 9.576 1.00 0.00 C ATOM 115 O ASP A 42 11.050 0.905 9.961 1.00 0.00 O ATOM 116 CB ASP A 42 10.740 2.953 11.876 1.00 0.00 C ATOM 117 CG ASP A 42 11.303 3.847 12.987 1.00 0.00 C ATOM 118 OD1 ASP A 42 10.964 5.045 12.970 1.00 0.00 O ATOM 119 OD2 ASP A 42 12.079 3.306 13.803 1.00 0.00 O ATOM 0 H ASP A 42 10.068 4.693 10.306 1.00 0.00 H new ATOM 0 HA ASP A 42 12.581 3.257 10.748 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.680 3.162 11.731 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.822 1.905 12.164 1.00 0.00 H new ATOM 120 N GLY A 43 11.461 2.357 8.278 1.00 0.00 N ATOM 121 CA GLY A 43 11.537 1.403 7.157 1.00 0.00 C ATOM 122 C GLY A 43 10.477 0.290 7.118 1.00 0.00 C ATOM 123 O GLY A 43 10.718 -0.759 6.527 1.00 0.00 O ATOM 0 H GLY A 43 11.482 3.329 7.969 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.471 1.967 6.227 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.521 0.934 7.177 1.00 0.00 H new ATOM 124 N THR A 44 9.265 0.620 7.573 1.00 0.00 N ATOM 125 CA THR A 44 8.145 -0.349 7.573 1.00 0.00 C ATOM 126 C THR A 44 6.870 0.373 7.138 1.00 0.00 C ATOM 127 O THR A 44 6.795 1.601 7.220 1.00 0.00 O ATOM 128 CB THR A 44 7.976 -1.082 8.920 1.00 0.00 C ATOM 129 OG1 THR A 44 6.928 -2.047 8.774 1.00 0.00 O ATOM 130 CG2 THR A 44 7.709 -0.146 10.111 1.00 0.00 C ATOM 0 H THR A 44 9.027 1.540 7.945 1.00 0.00 H new ATOM 0 HA THR A 44 8.373 -1.140 6.859 1.00 0.00 H new ATOM 0 HB THR A 44 8.922 -1.569 9.158 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.144 -1.758 9.285 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.602 -0.736 11.021 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.543 0.546 10.224 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.792 0.416 9.933 1.00 0.00 H new ATOM 131 N VAL A 45 5.929 -0.374 6.581 1.00 0.00 N ATOM 132 CA VAL A 45 4.680 0.228 6.113 1.00 0.00 C ATOM 133 C VAL A 45 3.536 -0.214 7.035 1.00 0.00 C ATOM 134 O VAL A 45 3.113 -1.369 7.048 1.00 0.00 O ATOM 135 CB VAL A 45 4.422 -0.070 4.625 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.127 0.567 4.143 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.541 0.494 3.759 1.00 0.00 C ATOM 0 H VAL A 45 5.999 -1.382 6.441 1.00 0.00 H new ATOM 0 HA VAL A 45 4.753 1.314 6.169 1.00 0.00 H new ATOM 0 HB VAL A 45 4.366 -1.155 4.535 1.00 0.00 H new ATOM 0 HG11 VAL A 45 2.978 0.335 3.088 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.291 0.175 4.722 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.183 1.648 4.273 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.338 0.272 2.711 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.598 1.574 3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.489 0.041 4.049 1.00 0.00 H new ATOM 138 N ASP A 46 3.128 0.743 7.860 1.00 0.00 N ATOM 139 CA ASP A 46 2.099 0.502 8.880 1.00 0.00 C ATOM 140 C ASP A 46 1.047 1.605 8.946 1.00 0.00 C ATOM 141 O ASP A 46 1.375 2.778 9.065 1.00 0.00 O ATOM 142 CB ASP A 46 2.683 0.334 10.284 1.00 0.00 C ATOM 143 CG ASP A 46 3.457 -0.981 10.439 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.787 -2.005 10.681 1.00 0.00 O ATOM 145 OD2 ASP A 46 4.697 -0.925 10.407 1.00 0.00 O ATOM 0 H ASP A 46 3.491 1.696 7.847 1.00 0.00 H new ATOM 0 HA ASP A 46 1.629 -0.428 8.561 1.00 0.00 H new ATOM 0 HB2 ASP A 46 3.346 1.171 10.502 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.877 0.367 11.017 1.00 0.00 H new ATOM 146 N GLY A 47 -0.188 1.173 8.740 1.00 0.00 N ATOM 147 CA GLY A 47 -1.397 1.955 9.084 1.00 0.00 C ATOM 148 C GLY A 47 -1.400 2.218 10.595 1.00 0.00 C ATOM 149 O GLY A 47 -0.730 1.544 11.381 1.00 0.00 O ATOM 0 H GLY A 47 -0.396 0.264 8.327 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.406 2.898 8.537 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.295 1.410 8.794 1.00 0.00 H new ATOM 150 N THR A 48 -2.272 3.126 10.983 1.00 0.00 N ATOM 151 CA THR A 48 -2.002 3.898 12.208 1.00 0.00 C ATOM 152 C THR A 48 -3.164 4.478 13.009 1.00 0.00 C ATOM 153 O THR A 48 -3.896 5.352 12.544 1.00 0.00 O ATOM 154 CB THR A 48 -0.991 4.998 11.859 1.00 0.00 C ATOM 155 OG1 THR A 48 -0.641 5.697 13.062 1.00 0.00 O ATOM 156 CG2 THR A 48 -1.445 5.926 10.721 1.00 0.00 C ATOM 0 H THR A 48 -3.142 3.352 10.501 1.00 0.00 H new ATOM 0 HA THR A 48 -1.628 3.149 12.906 1.00 0.00 H new ATOM 0 HB THR A 48 -0.097 4.527 11.449 1.00 0.00 H new ATOM 0 HG1 THR A 48 0.118 6.291 12.886 1.00 0.00 H new ATOM 0 HG21 THR A 48 -0.676 6.676 10.534 1.00 0.00 H new ATOM 0 HG22 THR A 48 -1.607 5.340 9.816 1.00 0.00 H new ATOM 0 HG23 THR A 48 -2.374 6.421 11.004 1.00 0.00 H new ATOM 157 N ARG A 49 -3.322 3.917 14.200 1.00 0.00 N ATOM 158 CA ARG A 49 -4.149 4.511 15.272 1.00 0.00 C ATOM 159 C ARG A 49 -3.642 5.881 15.755 1.00 0.00 C ATOM 160 O ARG A 49 -4.404 6.684 16.304 1.00 0.00 O ATOM 161 CB ARG A 49 -4.202 3.574 16.483 1.00 0.00 C ATOM 162 CG ARG A 49 -4.899 2.258 16.156 1.00 0.00 C ATOM 163 CD ARG A 49 -5.101 1.450 17.438 1.00 0.00 C ATOM 164 NE ARG A 49 -5.781 0.192 17.106 1.00 0.00 N ATOM 165 CZ ARG A 49 -6.070 -0.791 17.960 1.00 0.00 C ATOM 166 NH1 ARG A 49 -5.503 -0.872 19.157 1.00 0.00 N ATOM 167 NH2 ARG A 49 -6.772 -1.849 17.585 1.00 0.00 N ATOM 0 H ARG A 49 -2.884 3.034 14.463 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.137 4.653 14.833 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -3.189 3.371 16.829 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -4.726 4.068 17.301 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -5.861 2.453 15.682 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -4.303 1.687 15.445 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -4.140 1.246 17.910 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -5.693 2.021 18.154 1.00 0.00 H new ATOM 0 HE ARG A 49 -6.058 0.057 16.134 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -4.824 -0.169 19.448 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -5.747 -1.637 19.786 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -7.105 -1.926 16.624 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -6.980 -2.588 18.257 1.00 0.00 H new ATOM 168 N ASP A 50 -2.336 6.101 15.644 1.00 0.00 N ATOM 169 CA ASP A 50 -1.693 7.366 16.068 1.00 0.00 C ATOM 170 C ASP A 50 -1.042 8.045 14.855 1.00 0.00 C ATOM 171 O ASP A 50 0.157 7.916 14.600 1.00 0.00 O ATOM 172 CB ASP A 50 -0.690 7.038 17.187 1.00 0.00 C ATOM 173 CG ASP A 50 -0.128 8.262 17.935 1.00 0.00 C ATOM 174 OD1 ASP A 50 -0.544 9.400 17.614 1.00 0.00 O ATOM 175 OD2 ASP A 50 0.698 8.021 18.838 1.00 0.00 O ATOM 0 H ASP A 50 -1.684 5.417 15.260 1.00 0.00 H new ATOM 0 HA ASP A 50 -2.421 8.074 16.464 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.175 6.381 17.909 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.142 6.480 16.757 1.00 0.00 H new ATOM 176 N ARG A 51 -1.896 8.714 14.095 1.00 0.00 N ATOM 177 CA ARG A 51 -1.515 9.391 12.830 1.00 0.00 C ATOM 178 C ARG A 51 -0.577 10.565 13.071 1.00 0.00 C ATOM 179 O ARG A 51 -0.991 11.684 13.408 1.00 0.00 O ATOM 180 CB ARG A 51 -2.782 9.839 12.087 1.00 0.00 C ATOM 181 CG ARG A 51 -3.702 8.667 11.722 1.00 0.00 C ATOM 182 CD ARG A 51 -5.101 8.882 12.297 1.00 0.00 C ATOM 183 NE ARG A 51 -5.933 7.706 11.979 1.00 0.00 N ATOM 184 CZ ARG A 51 -6.590 6.942 12.845 1.00 0.00 C ATOM 185 NH1 ARG A 51 -6.686 7.230 14.140 1.00 0.00 N ATOM 186 NH2 ARG A 51 -7.239 5.871 12.417 1.00 0.00 N ATOM 0 H ARG A 51 -2.884 8.813 14.327 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.969 8.678 12.212 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.331 10.546 12.708 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -2.497 10.368 11.178 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.760 8.567 10.638 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.284 7.736 12.106 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.047 9.025 13.376 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.547 9.784 11.877 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.012 7.454 10.994 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.243 8.071 14.510 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -7.203 6.610 14.763 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -7.234 5.634 11.425 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.744 5.282 13.079 1.00 0.00 H new ATOM 187 N SER A 52 0.701 10.265 12.910 1.00 0.00 N ATOM 188 CA SER A 52 1.809 11.242 13.046 1.00 0.00 C ATOM 189 C SER A 52 1.646 12.489 12.152 1.00 0.00 C ATOM 190 O SER A 52 2.299 13.503 12.374 1.00 0.00 O ATOM 191 CB SER A 52 3.162 10.607 12.722 1.00 0.00 C ATOM 192 OG SER A 52 3.263 10.227 11.347 1.00 0.00 O ATOM 0 H SER A 52 1.020 9.325 12.677 1.00 0.00 H new ATOM 0 HA SER A 52 1.771 11.556 14.089 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.959 11.311 12.963 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.310 9.730 13.352 1.00 0.00 H new ATOM 0 HG SER A 52 3.999 10.718 10.925 1.00 0.00 H new ATOM 193 N ASP A 53 0.984 12.255 11.027 1.00 0.00 N ATOM 194 CA ASP A 53 0.641 13.230 9.969 1.00 0.00 C ATOM 195 C ASP A 53 1.717 13.502 8.919 1.00 0.00 C ATOM 196 O ASP A 53 1.394 13.824 7.776 1.00 0.00 O ATOM 197 CB ASP A 53 0.018 14.533 10.507 1.00 0.00 C ATOM 198 CG ASP A 53 -1.452 14.357 10.894 1.00 0.00 C ATOM 199 OD1 ASP A 53 -1.967 13.212 10.815 1.00 0.00 O ATOM 200 OD2 ASP A 53 -2.090 15.411 11.132 1.00 0.00 O ATOM 0 H ASP A 53 0.644 11.320 10.802 1.00 0.00 H new ATOM 0 HA ASP A 53 -0.135 12.698 9.419 1.00 0.00 H new ATOM 0 HB2 ASP A 53 0.582 14.871 11.376 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.101 15.313 9.750 1.00 0.00 H new ATOM 201 N GLN A 54 2.936 13.090 9.255 1.00 0.00 N ATOM 202 CA GLN A 54 4.092 13.239 8.357 1.00 0.00 C ATOM 203 C GLN A 54 4.126 12.162 7.263 1.00 0.00 C ATOM 204 O GLN A 54 3.540 12.355 6.213 1.00 0.00 O ATOM 205 CB GLN A 54 5.376 13.310 9.201 1.00 0.00 C ATOM 206 CG GLN A 54 6.542 13.863 8.377 1.00 0.00 C ATOM 207 CD GLN A 54 7.908 13.496 8.970 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.127 13.449 10.176 1.00 0.00 O ATOM 209 NE2 GLN A 54 8.811 13.073 8.116 1.00 0.00 N ATOM 0 H GLN A 54 3.156 12.647 10.147 1.00 0.00 H new ATOM 0 HA GLN A 54 4.004 14.175 7.805 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.209 13.943 10.072 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.627 12.317 9.573 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.477 13.479 7.359 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.456 14.948 8.315 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.624 13.114 7.114 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.699 12.703 8.454 1.00 0.00 H new ATOM 210 N HIS A 55 4.607 10.967 7.597 1.00 0.00 N ATOM 211 CA HIS A 55 4.867 9.841 6.656 1.00 0.00 C ATOM 212 C HIS A 55 3.636 9.268 5.910 1.00 0.00 C ATOM 213 O HIS A 55 3.762 8.614 4.876 1.00 0.00 O ATOM 214 CB HIS A 55 5.624 8.716 7.414 1.00 0.00 C ATOM 215 CG HIS A 55 6.334 9.157 8.696 1.00 0.00 C ATOM 216 ND1 HIS A 55 5.890 8.932 9.933 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.290 10.074 8.771 1.00 0.00 C ATOM 218 CE1 HIS A 55 6.521 9.750 10.758 1.00 0.00 C ATOM 219 NE2 HIS A 55 7.394 10.456 10.042 1.00 0.00 N ATOM 0 H HIS A 55 4.840 10.731 8.562 1.00 0.00 H new ATOM 0 HA HIS A 55 5.472 10.266 5.855 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.914 7.927 7.664 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.362 8.279 6.741 1.00 0.00 H new ATOM 0 HD2 HIS A 55 7.880 10.445 7.946 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.358 9.831 11.822 1.00 0.00 H new ATOM 0 HE2 HIS A 55 8.031 11.166 10.404 1.00 0.00 H new ATOM 220 N ILE A 56 2.442 9.506 6.464 1.00 0.00 N ATOM 221 CA ILE A 56 1.133 8.986 5.973 1.00 0.00 C ATOM 222 C ILE A 56 0.639 9.138 4.531 1.00 0.00 C ATOM 223 O ILE A 56 -0.091 8.256 4.070 1.00 0.00 O ATOM 224 CB ILE A 56 -0.008 9.439 6.913 1.00 0.00 C ATOM 225 CG1 ILE A 56 -0.062 10.966 7.049 1.00 0.00 C ATOM 226 CG2 ILE A 56 0.038 8.753 8.272 1.00 0.00 C ATOM 227 CD1 ILE A 56 -1.480 11.516 6.882 1.00 0.00 C ATOM 0 H ILE A 56 2.342 10.086 7.297 1.00 0.00 H new ATOM 0 HA ILE A 56 1.394 7.928 5.979 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.937 9.120 6.440 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.324 11.255 8.026 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.591 11.418 6.302 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -0.787 9.111 8.888 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.050 7.675 8.138 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.984 8.982 8.763 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.464 12.601 6.987 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.858 11.252 5.894 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.129 11.087 7.646 1.00 0.00 H new ATOM 228 N GLN A 57 0.915 10.273 3.896 1.00 0.00 N ATOM 229 CA GLN A 57 0.326 10.533 2.571 1.00 0.00 C ATOM 230 C GLN A 57 1.294 10.130 1.455 1.00 0.00 C ATOM 231 O GLN A 57 2.420 10.628 1.356 1.00 0.00 O ATOM 232 CB GLN A 57 -0.207 11.973 2.434 1.00 0.00 C ATOM 233 CG GLN A 57 0.831 13.116 2.372 1.00 0.00 C ATOM 234 CD GLN A 57 1.863 13.071 3.496 1.00 0.00 C ATOM 235 OE1 GLN A 57 3.003 12.663 3.310 1.00 0.00 O ATOM 236 NE2 GLN A 57 1.449 13.366 4.697 1.00 0.00 N ATOM 0 H GLN A 57 1.521 11.010 4.256 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.554 9.899 2.466 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -0.815 12.022 1.531 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.871 12.167 3.276 1.00 0.00 H new ATOM 0 HG2 GLN A 57 1.349 13.073 1.414 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.308 14.072 2.409 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.498 13.705 4.840 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.077 13.258 5.494 1.00 0.00 H new ATOM 237 N LEU A 58 0.805 9.241 0.612 1.00 0.00 N ATOM 238 CA LEU A 58 1.657 8.678 -0.434 1.00 0.00 C ATOM 239 C LEU A 58 1.386 9.278 -1.812 1.00 0.00 C ATOM 240 O LEU A 58 0.283 9.708 -2.138 1.00 0.00 O ATOM 241 CB LEU A 58 1.645 7.139 -0.408 1.00 0.00 C ATOM 242 CG LEU A 58 0.311 6.439 -0.737 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.134 6.594 -2.193 1.00 0.00 C ATOM 244 CD2 LEU A 58 0.536 4.947 -0.516 1.00 0.00 C ATOM 0 H LEU A 58 -0.154 8.895 0.623 1.00 0.00 H new ATOM 0 HA LEU A 58 2.681 8.974 -0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.396 6.783 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.961 6.815 0.584 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.456 6.889 -0.107 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.080 6.073 -2.342 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.262 7.652 -2.424 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.622 6.168 -2.852 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.383 4.404 -0.736 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.331 4.597 -1.175 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.821 4.772 0.521 1.00 0.00 H new ATOM 245 N GLN A 59 2.466 9.260 -2.581 1.00 0.00 N ATOM 246 CA GLN A 59 2.514 9.718 -3.971 1.00 0.00 C ATOM 247 C GLN A 59 3.019 8.590 -4.849 1.00 0.00 C ATOM 248 O GLN A 59 3.911 7.838 -4.462 1.00 0.00 O ATOM 249 CB GLN A 59 3.516 10.885 -3.965 1.00 0.00 C ATOM 250 CG GLN A 59 3.497 11.784 -5.220 1.00 0.00 C ATOM 251 CD GLN A 59 4.064 11.099 -6.467 1.00 0.00 C ATOM 252 OE1 GLN A 59 3.387 10.883 -7.470 1.00 0.00 O ATOM 253 NE2 GLN A 59 5.331 10.752 -6.450 1.00 0.00 N ATOM 0 H GLN A 59 3.366 8.915 -2.247 1.00 0.00 H new ATOM 0 HA GLN A 59 1.540 10.023 -4.354 1.00 0.00 H new ATOM 0 HB2 GLN A 59 3.318 11.506 -3.091 1.00 0.00 H new ATOM 0 HB3 GLN A 59 4.520 10.478 -3.846 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.472 12.095 -5.420 1.00 0.00 H new ATOM 0 HG3 GLN A 59 4.071 12.689 -5.019 1.00 0.00 H new ATOM 0 HE21 GLN A 59 5.897 10.929 -5.620 1.00 0.00 H new ATOM 0 HE22 GLN A 59 5.749 10.306 -7.267 1.00 0.00 H new ATOM 254 N LEU A 60 2.375 8.473 -5.998 1.00 0.00 N ATOM 255 CA LEU A 60 2.675 7.315 -6.831 1.00 0.00 C ATOM 256 C LEU A 60 3.013 7.584 -8.302 1.00 0.00 C ATOM 257 O LEU A 60 2.281 8.240 -9.045 1.00 0.00 O ATOM 258 CB LEU A 60 1.662 6.208 -6.612 1.00 0.00 C ATOM 259 CG LEU A 60 0.206 6.567 -6.880 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.432 5.218 -7.091 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.495 7.287 -5.725 1.00 0.00 C ATOM 0 H LEU A 60 1.679 9.123 -6.363 1.00 0.00 H new ATOM 0 HA LEU A 60 3.641 6.960 -6.471 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.931 5.366 -7.250 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.746 5.865 -5.581 1.00 0.00 H new ATOM 0 HG LEU A 60 0.127 7.264 -7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.495 5.346 -7.295 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.042 4.719 -7.936 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.305 4.611 -6.194 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.526 7.503 -6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.484 6.651 -4.840 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.026 8.220 -5.508 1.00 0.00 H new ATOM 262 N SER A 61 4.055 6.866 -8.701 1.00 0.00 N ATOM 263 CA SER A 61 4.718 7.004 -10.011 1.00 0.00 C ATOM 264 C SER A 61 4.714 5.740 -10.858 1.00 0.00 C ATOM 265 O SER A 61 5.350 4.728 -10.527 1.00 0.00 O ATOM 266 CB SER A 61 6.166 7.442 -9.875 1.00 0.00 C ATOM 267 OG SER A 61 6.901 6.566 -9.017 1.00 0.00 O ATOM 0 H SER A 61 4.481 6.149 -8.113 1.00 0.00 H new ATOM 0 HA SER A 61 4.120 7.764 -10.514 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.634 7.466 -10.859 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.204 8.457 -9.479 1.00 0.00 H new ATOM 0 HG SER A 61 6.282 5.953 -8.568 1.00 0.00 H new ATOM 268 N ALA A 62 3.982 5.845 -11.939 1.00 0.00 N ATOM 269 CA ALA A 62 4.027 4.832 -12.997 1.00 0.00 C ATOM 270 C ALA A 62 5.271 4.842 -13.869 1.00 0.00 C ATOM 271 O ALA A 62 5.731 5.860 -14.367 1.00 0.00 O ATOM 272 CB ALA A 62 2.773 4.915 -13.888 1.00 0.00 C ATOM 0 H ALA A 62 3.343 6.618 -12.122 1.00 0.00 H new ATOM 0 HA ALA A 62 4.060 3.886 -12.456 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.829 4.154 -14.666 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.883 4.749 -13.281 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.719 5.901 -14.349 1.00 0.00 H new ATOM 273 N GLU A 63 5.853 3.651 -13.887 1.00 0.00 N ATOM 274 CA GLU A 63 6.998 3.279 -14.742 1.00 0.00 C ATOM 275 C GLU A 63 6.520 2.846 -16.141 1.00 0.00 C ATOM 276 O GLU A 63 7.220 3.020 -17.136 1.00 0.00 O ATOM 277 CB GLU A 63 7.708 2.110 -14.060 1.00 0.00 C ATOM 278 CG GLU A 63 8.930 1.645 -14.857 1.00 0.00 C ATOM 279 CD GLU A 63 9.457 0.301 -14.369 1.00 0.00 C ATOM 280 OE1 GLU A 63 8.732 -0.690 -14.569 1.00 0.00 O ATOM 281 OE2 GLU A 63 10.588 0.302 -13.824 1.00 0.00 O ATOM 0 H GLU A 63 5.539 2.884 -13.292 1.00 0.00 H new ATOM 0 HA GLU A 63 7.665 4.132 -14.868 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.019 2.408 -13.059 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.012 1.279 -13.944 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.666 1.569 -15.912 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.719 2.393 -14.779 1.00 0.00 H new ATOM 282 N SER A 64 5.363 2.185 -16.155 1.00 0.00 N ATOM 283 CA SER A 64 4.831 1.444 -17.314 1.00 0.00 C ATOM 284 C SER A 64 3.324 1.174 -17.143 1.00 0.00 C ATOM 285 O SER A 64 2.685 1.722 -16.250 1.00 0.00 O ATOM 286 CB SER A 64 5.684 0.166 -17.428 1.00 0.00 C ATOM 287 OG SER A 64 5.319 -0.622 -18.556 1.00 0.00 O ATOM 0 H SER A 64 4.748 2.145 -15.342 1.00 0.00 H new ATOM 0 HA SER A 64 4.903 2.011 -18.242 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.737 0.439 -17.502 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.571 -0.427 -16.520 1.00 0.00 H new ATOM 0 HG SER A 64 5.884 -1.422 -18.593 1.00 0.00 H new ATOM 288 N VAL A 65 2.817 0.206 -17.903 1.00 0.00 N ATOM 289 CA VAL A 65 1.399 -0.207 -18.054 1.00 0.00 C ATOM 290 C VAL A 65 0.770 -0.703 -16.733 1.00 0.00 C ATOM 291 O VAL A 65 1.039 -1.803 -16.259 1.00 0.00 O ATOM 292 CB VAL A 65 1.315 -1.207 -19.219 1.00 0.00 C ATOM 293 CG1 VAL A 65 2.243 -2.418 -19.053 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.119 -1.665 -19.498 1.00 0.00 C ATOM 0 H VAL A 65 3.429 -0.367 -18.484 1.00 0.00 H new ATOM 0 HA VAL A 65 0.784 0.658 -18.302 1.00 0.00 H new ATOM 0 HB VAL A 65 1.667 -0.651 -20.088 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.132 -3.082 -19.911 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.277 -2.078 -18.988 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.980 -2.956 -18.142 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.121 -2.370 -20.330 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.525 -2.150 -18.610 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.734 -0.802 -19.753 1.00 0.00 H new ATOM 295 N GLY A 66 0.152 0.268 -16.081 1.00 0.00 N ATOM 296 CA GLY A 66 -0.470 0.119 -14.742 1.00 0.00 C ATOM 297 C GLY A 66 0.547 0.118 -13.599 1.00 0.00 C ATOM 298 O GLY A 66 0.232 0.445 -12.452 1.00 0.00 O ATOM 0 H GLY A 66 0.058 1.209 -16.462 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.180 0.931 -14.587 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.038 -0.811 -14.714 1.00 0.00 H new ATOM 299 N GLU A 67 1.776 -0.202 -13.961 1.00 0.00 N ATOM 300 CA GLU A 67 2.897 -0.439 -13.063 1.00 0.00 C ATOM 301 C GLU A 67 3.453 0.808 -12.376 1.00 0.00 C ATOM 302 O GLU A 67 4.196 1.609 -12.942 1.00 0.00 O ATOM 303 CB GLU A 67 4.005 -1.106 -13.880 1.00 0.00 C ATOM 304 CG GLU A 67 3.644 -2.503 -14.355 1.00 0.00 C ATOM 305 CD GLU A 67 4.525 -2.944 -15.531 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.769 -2.973 -15.350 1.00 0.00 O ATOM 307 OE2 GLU A 67 3.956 -3.143 -16.614 1.00 0.00 O ATOM 0 H GLU A 67 2.035 -0.310 -14.942 1.00 0.00 H new ATOM 0 HA GLU A 67 2.529 -1.067 -12.251 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.234 -0.484 -14.745 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.911 -1.158 -13.276 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.756 -3.208 -13.531 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.596 -2.527 -14.655 1.00 0.00 H new ATOM 308 N VAL A 68 3.212 0.790 -11.073 1.00 0.00 N ATOM 309 CA VAL A 68 3.451 1.912 -10.162 1.00 0.00 C ATOM 310 C VAL A 68 4.311 1.627 -8.922 1.00 0.00 C ATOM 311 O VAL A 68 3.986 0.858 -8.022 1.00 0.00 O ATOM 312 CB VAL A 68 2.128 2.547 -9.805 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.119 1.597 -9.144 1.00 0.00 C ATOM 314 CG2 VAL A 68 2.202 3.749 -8.898 1.00 0.00 C ATOM 0 H VAL A 68 2.832 -0.030 -10.601 1.00 0.00 H new ATOM 0 HA VAL A 68 4.080 2.609 -10.716 1.00 0.00 H new ATOM 0 HB VAL A 68 1.794 2.849 -10.798 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.200 2.139 -8.923 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.900 0.771 -9.821 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.541 1.205 -8.218 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.196 4.124 -8.708 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.668 3.465 -7.955 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.795 4.529 -9.375 1.00 0.00 H new ATOM 315 N TYR A 69 5.202 2.587 -8.815 1.00 0.00 N ATOM 316 CA TYR A 69 6.147 2.722 -7.713 1.00 0.00 C ATOM 317 C TYR A 69 5.603 3.757 -6.726 1.00 0.00 C ATOM 318 O TYR A 69 5.245 4.866 -7.139 1.00 0.00 O ATOM 319 CB TYR A 69 7.446 3.282 -8.279 1.00 0.00 C ATOM 320 CG TYR A 69 8.384 2.227 -8.878 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.655 1.022 -8.188 1.00 0.00 C ATOM 322 CD2 TYR A 69 9.041 2.541 -10.089 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.614 0.126 -8.709 1.00 0.00 C ATOM 324 CE2 TYR A 69 10.009 1.666 -10.599 1.00 0.00 C ATOM 325 CZ TYR A 69 10.296 0.471 -9.894 1.00 0.00 C ATOM 326 OH TYR A 69 11.420 -0.217 -10.223 1.00 0.00 O ATOM 0 H TYR A 69 5.297 3.324 -9.514 1.00 0.00 H new ATOM 0 HA TYR A 69 6.300 1.759 -7.225 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.206 4.016 -9.048 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.974 3.812 -7.487 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.133 0.790 -7.271 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.798 3.450 -10.618 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.822 -0.808 -8.208 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.529 1.899 -11.516 1.00 0.00 H new ATOM 0 HH TYR A 69 11.781 0.130 -11.065 1.00 0.00 H new ATOM 327 N ILE A 70 5.435 3.336 -5.488 1.00 0.00 N ATOM 328 CA ILE A 70 4.819 4.247 -4.507 1.00 0.00 C ATOM 329 C ILE A 70 5.826 4.781 -3.484 1.00 0.00 C ATOM 330 O ILE A 70 6.338 4.042 -2.640 1.00 0.00 O ATOM 331 CB ILE A 70 3.555 3.640 -3.876 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.636 3.078 -4.958 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.784 4.777 -3.193 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.745 1.938 -4.489 1.00 0.00 C ATOM 0 H ILE A 70 5.698 2.416 -5.135 1.00 0.00 H new ATOM 0 HA ILE A 70 4.483 5.128 -5.054 1.00 0.00 H new ATOM 0 HB ILE A 70 3.845 2.850 -3.183 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.007 3.883 -5.339 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.246 2.729 -5.791 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.879 4.379 -2.734 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.410 5.232 -2.425 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.514 5.530 -3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 70 1.124 1.597 -5.318 1.00 0.00 H new ATOM 0 HD12 ILE A 70 2.365 1.114 -4.136 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.107 2.286 -3.677 1.00 0.00 H new ATOM 335 N LYS A 71 5.874 6.096 -3.478 1.00 0.00 N ATOM 336 CA LYS A 71 6.763 6.969 -2.691 1.00 0.00 C ATOM 337 C LYS A 71 5.956 7.699 -1.646 1.00 0.00 C ATOM 338 O LYS A 71 4.793 8.073 -1.834 1.00 0.00 O ATOM 339 CB LYS A 71 7.346 7.922 -3.740 1.00 0.00 C ATOM 340 CG LYS A 71 8.445 8.858 -3.219 1.00 0.00 C ATOM 341 CD LYS A 71 8.596 10.048 -4.175 1.00 0.00 C ATOM 342 CE LYS A 71 7.863 11.299 -3.671 1.00 0.00 C ATOM 343 NZ LYS A 71 8.676 11.923 -2.609 1.00 0.00 N ATOM 0 H LYS A 71 5.246 6.641 -4.068 1.00 0.00 H new ATOM 0 HA LYS A 71 7.545 6.439 -2.148 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.751 7.331 -4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.537 8.527 -4.150 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.194 9.211 -2.219 1.00 0.00 H new ATOM 0 HG3 LYS A 71 9.389 8.319 -3.139 1.00 0.00 H new ATOM 0 HD2 LYS A 71 9.654 10.277 -4.302 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.209 9.774 -5.156 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.706 12.001 -4.490 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.879 11.032 -3.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 8.193 12.773 -2.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.804 11.248 -1.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.605 12.188 -2.993 1.00 0.00 H new ATOM 344 N SER A 72 6.629 7.911 -0.524 1.00 0.00 N ATOM 345 CA SER A 72 6.061 8.662 0.602 1.00 0.00 C ATOM 346 C SER A 72 6.416 10.145 0.470 1.00 0.00 C ATOM 347 O SER A 72 7.582 10.538 0.546 1.00 0.00 O ATOM 348 CB SER A 72 6.594 8.069 1.897 1.00 0.00 C ATOM 349 OG SER A 72 7.976 7.740 1.847 1.00 0.00 O ATOM 0 H SER A 72 7.578 7.573 -0.362 1.00 0.00 H new ATOM 0 HA SER A 72 4.974 8.586 0.604 1.00 0.00 H new ATOM 0 HB2 SER A 72 6.427 8.779 2.707 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.024 7.171 2.137 1.00 0.00 H new ATOM 0 HG SER A 72 8.082 6.822 1.522 1.00 0.00 H new ATOM 350 N THR A 73 5.386 10.964 0.246 1.00 0.00 N ATOM 351 CA THR A 73 5.548 12.423 0.054 1.00 0.00 C ATOM 352 C THR A 73 6.406 13.057 1.165 1.00 0.00 C ATOM 353 O THR A 73 7.394 13.718 0.851 1.00 0.00 O ATOM 354 CB THR A 73 4.179 13.131 -0.023 1.00 0.00 C ATOM 355 OG1 THR A 73 3.198 12.257 -0.584 1.00 0.00 O ATOM 356 CG2 THR A 73 4.274 14.391 -0.882 1.00 0.00 C ATOM 0 H THR A 73 4.418 10.646 0.191 1.00 0.00 H new ATOM 0 HA THR A 73 6.068 12.559 -0.894 1.00 0.00 H new ATOM 0 HB THR A 73 3.885 13.406 0.990 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.704 11.814 0.137 1.00 0.00 H new ATOM 0 HG21 THR A 73 3.299 14.877 -0.925 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.001 15.075 -0.445 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.589 14.121 -1.890 1.00 0.00 H new ATOM 357 N GLU A 74 6.141 12.679 2.412 1.00 0.00 N ATOM 358 CA GLU A 74 6.909 13.187 3.563 1.00 0.00 C ATOM 359 C GLU A 74 8.006 12.286 4.166 1.00 0.00 C ATOM 360 O GLU A 74 8.454 12.545 5.289 1.00 0.00 O ATOM 361 CB GLU A 74 5.910 13.619 4.629 1.00 0.00 C ATOM 362 CG GLU A 74 5.569 15.101 4.452 1.00 0.00 C ATOM 363 CD GLU A 74 4.660 15.599 5.574 1.00 0.00 C ATOM 364 OE1 GLU A 74 3.430 15.400 5.450 1.00 0.00 O ATOM 365 OE2 GLU A 74 5.211 16.180 6.529 1.00 0.00 O ATOM 0 H GLU A 74 5.401 12.022 2.660 1.00 0.00 H new ATOM 0 HA GLU A 74 7.503 14.011 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.004 13.017 4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.327 13.449 5.621 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.487 15.688 4.437 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.079 15.251 3.490 1.00 0.00 H new ATOM 366 N THR A 75 8.469 11.290 3.413 1.00 0.00 N ATOM 367 CA THR A 75 9.570 10.407 3.850 1.00 0.00 C ATOM 368 C THR A 75 10.469 9.744 2.775 1.00 0.00 C ATOM 369 O THR A 75 11.487 9.144 3.119 1.00 0.00 O ATOM 370 CB THR A 75 9.149 9.292 4.817 1.00 0.00 C ATOM 371 OG1 THR A 75 7.744 9.046 4.795 1.00 0.00 O ATOM 372 CG2 THR A 75 9.657 9.601 6.227 1.00 0.00 C ATOM 0 H THR A 75 8.101 11.066 2.488 1.00 0.00 H new ATOM 0 HA THR A 75 10.173 11.170 4.342 1.00 0.00 H new ATOM 0 HB THR A 75 9.613 8.365 4.479 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.574 8.103 5.000 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.353 8.804 6.906 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.745 9.672 6.214 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.235 10.547 6.566 1.00 0.00 H new ATOM 373 N GLY A 76 10.034 9.790 1.516 1.00 0.00 N ATOM 374 CA GLY A 76 10.713 9.183 0.355 1.00 0.00 C ATOM 375 C GLY A 76 10.491 7.668 0.207 1.00 0.00 C ATOM 376 O GLY A 76 9.905 7.210 -0.773 1.00 0.00 O ATOM 0 H GLY A 76 9.169 10.266 1.260 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.367 9.678 -0.552 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.783 9.375 0.435 1.00 0.00 H new ATOM 377 N GLN A 77 10.847 6.958 1.278 1.00 0.00 N ATOM 378 CA GLN A 77 10.765 5.482 1.407 1.00 0.00 C ATOM 379 C GLN A 77 9.507 4.877 0.776 1.00 0.00 C ATOM 380 O GLN A 77 8.389 5.368 0.923 1.00 0.00 O ATOM 381 CB GLN A 77 10.895 5.094 2.877 1.00 0.00 C ATOM 382 CG GLN A 77 12.345 5.236 3.328 1.00 0.00 C ATOM 383 CD GLN A 77 12.498 5.298 4.848 1.00 0.00 C ATOM 384 OE1 GLN A 77 12.293 4.339 5.578 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.912 6.446 5.333 1.00 0.00 N ATOM 0 H GLN A 77 11.216 7.402 2.119 1.00 0.00 H new ATOM 0 HA GLN A 77 11.595 5.061 0.840 1.00 0.00 H new ATOM 0 HB2 GLN A 77 10.252 5.728 3.487 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.560 4.067 3.022 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.922 4.394 2.945 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.769 6.139 2.889 1.00 0.00 H new ATOM 0 HE21 GLN A 77 13.077 7.234 4.707 1.00 0.00 H new ATOM 0 HE22 GLN A 77 13.068 6.549 6.336 1.00 0.00 H new ATOM 386 N TYR A 78 9.763 3.842 -0.008 1.00 0.00 N ATOM 387 CA TYR A 78 8.745 3.220 -0.858 1.00 0.00 C ATOM 388 C TYR A 78 7.877 2.142 -0.194 1.00 0.00 C ATOM 389 O TYR A 78 8.328 1.382 0.662 1.00 0.00 O ATOM 390 CB TYR A 78 9.443 2.670 -2.109 1.00 0.00 C ATOM 391 CG TYR A 78 9.969 3.755 -3.050 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.208 4.362 -2.743 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.193 4.179 -4.150 1.00 0.00 C ATOM 394 CE1 TYR A 78 11.645 5.460 -3.515 1.00 0.00 C ATOM 395 CE2 TYR A 78 9.632 5.265 -4.930 1.00 0.00 C ATOM 396 CZ TYR A 78 10.863 5.896 -4.598 1.00 0.00 C ATOM 397 OH TYR A 78 11.298 6.935 -5.349 1.00 0.00 O ATOM 0 H TYR A 78 10.682 3.405 -0.077 1.00 0.00 H new ATOM 0 HA TYR A 78 8.026 4.002 -1.101 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.274 2.036 -1.801 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.744 2.037 -2.655 1.00 0.00 H new ATOM 0 HD1 TYR A 78 11.812 3.991 -1.929 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.269 3.674 -4.391 1.00 0.00 H new ATOM 0 HE1 TYR A 78 12.572 5.960 -3.276 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.044 5.613 -5.766 1.00 0.00 H new ATOM 0 HH TYR A 78 10.650 7.118 -6.061 1.00 0.00 H new ATOM 398 N LEU A 79 6.605 2.180 -0.573 1.00 0.00 N ATOM 399 CA LEU A 79 5.606 1.147 -0.242 1.00 0.00 C ATOM 400 C LEU A 79 5.990 -0.135 -1.009 1.00 0.00 C ATOM 401 O LEU A 79 5.959 -0.155 -2.238 1.00 0.00 O ATOM 402 CB LEU A 79 4.214 1.585 -0.705 1.00 0.00 C ATOM 403 CG LEU A 79 3.079 0.910 0.076 1.00 0.00 C ATOM 404 CD1 LEU A 79 2.621 1.913 1.135 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.859 0.703 -0.817 1.00 0.00 C ATOM 0 H LEU A 79 6.222 2.943 -1.132 1.00 0.00 H new ATOM 0 HA LEU A 79 5.588 0.983 0.836 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.126 2.666 -0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.102 1.358 -1.765 1.00 0.00 H new ATOM 0 HG LEU A 79 3.435 -0.041 0.473 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.811 1.479 1.721 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.456 2.154 1.793 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.270 2.822 0.647 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.066 0.223 -0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.509 1.668 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.130 0.070 -1.662 1.00 0.00 H new ATOM 406 N ALA A 80 6.545 -1.073 -0.254 1.00 0.00 N ATOM 407 CA ALA A 80 7.045 -2.352 -0.802 1.00 0.00 C ATOM 408 C ALA A 80 6.377 -3.543 -0.116 1.00 0.00 C ATOM 409 O ALA A 80 6.006 -3.441 1.049 1.00 0.00 O ATOM 410 CB ALA A 80 8.537 -2.433 -0.546 1.00 0.00 C ATOM 0 H ALA A 80 6.667 -0.981 0.755 1.00 0.00 H new ATOM 0 HA ALA A 80 6.820 -2.387 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.924 -3.371 -0.944 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.036 -1.597 -1.037 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.725 -2.389 0.527 1.00 0.00 H new ATOM 411 N MET A 81 6.465 -4.693 -0.772 1.00 0.00 N ATOM 412 CA MET A 81 5.928 -5.947 -0.209 1.00 0.00 C ATOM 413 C MET A 81 7.010 -7.043 -0.188 1.00 0.00 C ATOM 414 O MET A 81 7.853 -7.117 -1.073 1.00 0.00 O ATOM 415 CB MET A 81 4.714 -6.436 -1.006 1.00 0.00 C ATOM 416 CG MET A 81 3.998 -7.513 -0.184 1.00 0.00 C ATOM 417 SD MET A 81 2.432 -8.151 -0.888 1.00 0.00 S ATOM 418 CE MET A 81 1.511 -6.687 -1.291 1.00 0.00 C ATOM 0 H MET A 81 6.899 -4.794 -1.690 1.00 0.00 H new ATOM 0 HA MET A 81 5.612 -5.739 0.813 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.038 -5.607 -1.215 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.029 -6.840 -1.968 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.681 -8.352 -0.048 1.00 0.00 H new ATOM 0 HG3 MET A 81 3.790 -7.108 0.806 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.590 -6.665 -0.709 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.108 -5.806 -1.058 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.269 -6.691 -2.354 1.00 0.00 H new ATOM 419 N ASP A 82 6.964 -7.847 0.872 1.00 0.00 N ATOM 420 CA ASP A 82 7.875 -8.984 1.040 1.00 0.00 C ATOM 421 C ASP A 82 7.135 -10.313 0.894 1.00 0.00 C ATOM 422 O ASP A 82 5.981 -10.467 1.281 1.00 0.00 O ATOM 423 CB ASP A 82 8.567 -8.927 2.404 1.00 0.00 C ATOM 424 CG ASP A 82 10.086 -9.006 2.222 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.522 -10.010 1.613 1.00 0.00 O ATOM 426 OD2 ASP A 82 10.766 -8.073 2.709 1.00 0.00 O ATOM 0 H ASP A 82 6.299 -7.732 1.637 1.00 0.00 H new ATOM 0 HA ASP A 82 8.628 -8.918 0.255 1.00 0.00 H new ATOM 0 HB2 ASP A 82 8.301 -8.003 2.918 1.00 0.00 H new ATOM 0 HB3 ASP A 82 8.224 -9.750 3.030 1.00 0.00 H new ATOM 427 N THR A 83 8.005 -11.293 0.658 1.00 0.00 N ATOM 428 CA THR A 83 7.687 -12.730 0.468 1.00 0.00 C ATOM 429 C THR A 83 6.829 -13.345 1.588 1.00 0.00 C ATOM 430 O THR A 83 6.084 -14.298 1.363 1.00 0.00 O ATOM 431 CB THR A 83 8.999 -13.527 0.430 1.00 0.00 C ATOM 432 OG1 THR A 83 9.785 -13.154 1.568 1.00 0.00 O ATOM 433 CG2 THR A 83 9.774 -13.300 -0.873 1.00 0.00 C ATOM 0 H THR A 83 9.006 -11.110 0.588 1.00 0.00 H new ATOM 0 HA THR A 83 7.117 -12.785 -0.459 1.00 0.00 H new ATOM 0 HB THR A 83 8.770 -14.592 0.465 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.628 -13.655 1.562 1.00 0.00 H new ATOM 0 HG21 THR A 83 10.695 -13.883 -0.855 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.162 -13.613 -1.719 1.00 0.00 H new ATOM 0 HG23 THR A 83 10.017 -12.242 -0.972 1.00 0.00 H new ATOM 434 N ASP A 84 7.054 -12.844 2.798 1.00 0.00 N ATOM 435 CA ASP A 84 6.321 -13.186 4.029 1.00 0.00 C ATOM 436 C ASP A 84 4.822 -12.829 4.027 1.00 0.00 C ATOM 437 O ASP A 84 4.077 -13.266 4.899 1.00 0.00 O ATOM 438 CB ASP A 84 7.015 -12.503 5.208 1.00 0.00 C ATOM 439 CG ASP A 84 8.432 -13.035 5.436 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.323 -12.535 4.720 1.00 0.00 O ATOM 441 OD2 ASP A 84 8.585 -13.907 6.314 1.00 0.00 O ATOM 0 H ASP A 84 7.787 -12.154 2.963 1.00 0.00 H new ATOM 0 HA ASP A 84 6.346 -14.273 4.108 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.057 -11.429 5.029 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.423 -12.653 6.111 1.00 0.00 H new ATOM 442 N GLY A 85 4.443 -11.956 3.092 1.00 0.00 N ATOM 443 CA GLY A 85 3.060 -11.481 2.931 1.00 0.00 C ATOM 444 C GLY A 85 2.770 -10.286 3.826 1.00 0.00 C ATOM 445 O GLY A 85 1.802 -10.294 4.578 1.00 0.00 O ATOM 0 H GLY A 85 5.092 -11.552 2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.888 -11.207 1.890 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.368 -12.289 3.167 1.00 0.00 H new ATOM 446 N LEU A 86 3.552 -9.243 3.604 1.00 0.00 N ATOM 447 CA LEU A 86 3.519 -7.999 4.407 1.00 0.00 C ATOM 448 C LEU A 86 4.329 -6.860 3.765 1.00 0.00 C ATOM 449 O LEU A 86 5.262 -7.103 3.000 1.00 0.00 O ATOM 450 CB LEU A 86 3.911 -8.310 5.859 1.00 0.00 C ATOM 451 CG LEU A 86 5.319 -8.893 5.995 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.257 -7.730 6.314 1.00 0.00 C ATOM 453 CD2 LEU A 86 5.347 -9.922 7.124 1.00 0.00 C ATOM 0 H LEU A 86 4.243 -9.221 2.854 1.00 0.00 H new ATOM 0 HA LEU A 86 2.499 -7.616 4.425 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.845 -7.396 6.449 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.192 -9.013 6.279 1.00 0.00 H new ATOM 0 HG LEU A 86 5.627 -9.394 5.077 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.276 -8.103 6.420 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.220 -7.000 5.505 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.946 -7.256 7.245 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.352 -10.334 7.216 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.064 -9.442 8.061 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.645 -10.725 6.902 1.00 0.00 H new ATOM 454 N LEU A 87 3.977 -5.648 4.176 1.00 0.00 N ATOM 455 CA LEU A 87 4.521 -4.412 3.563 1.00 0.00 C ATOM 456 C LEU A 87 5.631 -3.799 4.428 1.00 0.00 C ATOM 457 O LEU A 87 5.485 -3.628 5.637 1.00 0.00 O ATOM 458 CB LEU A 87 3.433 -3.351 3.339 1.00 0.00 C ATOM 459 CG LEU A 87 2.138 -3.853 2.686 1.00 0.00 C ATOM 460 CD1 LEU A 87 1.055 -2.774 2.690 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.350 -4.393 1.275 1.00 0.00 C ATOM 0 H LEU A 87 3.315 -5.480 4.934 1.00 0.00 H new ATOM 0 HA LEU A 87 4.930 -4.710 2.598 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.183 -2.904 4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.848 -2.558 2.717 1.00 0.00 H new ATOM 0 HG LEU A 87 1.800 -4.689 3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.152 -3.163 2.220 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.834 -2.484 3.717 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.406 -1.904 2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.397 -4.732 0.868 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.755 -3.605 0.641 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.049 -5.229 1.306 1.00 0.00 H new ATOM 462 N TYR A 88 6.687 -3.397 3.740 1.00 0.00 N ATOM 463 CA TYR A 88 7.850 -2.743 4.347 1.00 0.00 C ATOM 464 C TYR A 88 8.229 -1.460 3.617 1.00 0.00 C ATOM 465 O TYR A 88 7.982 -1.318 2.416 1.00 0.00 O ATOM 466 CB TYR A 88 9.077 -3.654 4.523 1.00 0.00 C ATOM 467 CG TYR A 88 9.665 -4.272 3.263 1.00 0.00 C ATOM 468 CD1 TYR A 88 8.842 -5.068 2.434 1.00 0.00 C ATOM 469 CD2 TYR A 88 11.001 -3.981 2.933 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.369 -5.531 1.220 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.532 -4.484 1.728 1.00 0.00 C ATOM 472 CZ TYR A 88 10.699 -5.240 0.877 1.00 0.00 C ATOM 473 OH TYR A 88 11.096 -5.531 -0.386 1.00 0.00 O ATOM 0 H TYR A 88 6.768 -3.514 2.730 1.00 0.00 H new ATOM 0 HA TYR A 88 7.523 -2.489 5.355 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.860 -3.076 5.014 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.804 -4.462 5.201 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.832 -5.313 2.728 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.611 -3.381 3.593 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.752 -6.111 0.549 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.561 -4.293 1.460 1.00 0.00 H new ATOM 0 HH TYR A 88 12.037 -5.282 -0.499 1.00 0.00 H new ATOM 474 N GLY A 89 8.890 -0.575 4.355 1.00 0.00 N ATOM 475 CA GLY A 89 9.233 0.789 3.913 1.00 0.00 C ATOM 476 C GLY A 89 10.590 0.807 3.216 1.00 0.00 C ATOM 477 O GLY A 89 11.502 1.501 3.650 1.00 0.00 O ATOM 0 H GLY A 89 9.213 -0.782 5.300 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.465 1.160 3.234 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.251 1.461 4.771 1.00 0.00 H new ATOM 478 N SER A 90 10.644 0.053 2.127 1.00 0.00 N ATOM 479 CA SER A 90 11.867 -0.138 1.326 1.00 0.00 C ATOM 480 C SER A 90 12.341 1.150 0.655 1.00 0.00 C ATOM 481 O SER A 90 11.686 1.710 -0.214 1.00 0.00 O ATOM 482 CB SER A 90 11.683 -1.261 0.306 1.00 0.00 C ATOM 483 OG SER A 90 12.791 -1.339 -0.593 1.00 0.00 O ATOM 0 H SER A 90 9.837 -0.453 1.763 1.00 0.00 H new ATOM 0 HA SER A 90 12.655 -0.431 2.020 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.568 -2.212 0.827 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.766 -1.094 -0.259 1.00 0.00 H new ATOM 0 HG SER A 90 12.600 -0.809 -1.395 1.00 0.00 H new ATOM 484 N GLN A 91 13.544 1.548 1.039 1.00 0.00 N ATOM 485 CA GLN A 91 14.244 2.752 0.570 1.00 0.00 C ATOM 486 C GLN A 91 14.386 2.805 -0.963 1.00 0.00 C ATOM 487 O GLN A 91 14.282 3.866 -1.582 1.00 0.00 O ATOM 488 CB GLN A 91 15.647 2.767 1.166 1.00 0.00 C ATOM 489 CG GLN A 91 15.700 2.884 2.703 1.00 0.00 C ATOM 490 CD GLN A 91 15.244 1.594 3.381 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.522 0.480 2.956 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.336 1.684 4.324 1.00 0.00 N ATOM 0 H GLN A 91 14.092 1.021 1.719 1.00 0.00 H new ATOM 0 HA GLN A 91 13.650 3.610 0.886 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.162 1.854 0.868 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.200 3.601 0.734 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.717 3.120 3.016 1.00 0.00 H new ATOM 0 HG3 GLN A 91 15.067 3.710 3.028 1.00 0.00 H new ATOM 0 HE21 GLN A 91 14.081 2.597 4.701 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.886 0.841 4.680 1.00 0.00 H new ATOM 493 N THR A 92 14.524 1.608 -1.537 1.00 0.00 N ATOM 494 CA THR A 92 14.731 1.420 -2.980 1.00 0.00 C ATOM 495 C THR A 92 13.515 0.744 -3.647 1.00 0.00 C ATOM 496 O THR A 92 12.856 -0.102 -3.029 1.00 0.00 O ATOM 497 CB THR A 92 16.050 0.682 -3.266 1.00 0.00 C ATOM 498 OG1 THR A 92 16.333 0.796 -4.656 1.00 0.00 O ATOM 499 CG2 THR A 92 16.035 -0.801 -2.881 1.00 0.00 C ATOM 0 H THR A 92 14.495 0.734 -1.012 1.00 0.00 H new ATOM 0 HA THR A 92 14.820 2.407 -3.434 1.00 0.00 H new ATOM 0 HB THR A 92 16.816 1.150 -2.648 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.172 0.332 -4.858 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.002 -1.247 -3.115 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.839 -0.898 -1.813 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.253 -1.314 -3.441 1.00 0.00 H new ATOM 500 N PRO A 93 13.190 1.167 -4.874 1.00 0.00 N ATOM 501 CA PRO A 93 12.109 0.573 -5.644 1.00 0.00 C ATOM 502 C PRO A 93 12.518 -0.666 -6.441 1.00 0.00 C ATOM 503 O PRO A 93 13.314 -0.659 -7.381 1.00 0.00 O ATOM 504 CB PRO A 93 11.585 1.683 -6.525 1.00 0.00 C ATOM 505 CG PRO A 93 12.831 2.516 -6.833 1.00 0.00 C ATOM 506 CD PRO A 93 13.699 2.356 -5.568 1.00 0.00 C ATOM 0 HA PRO A 93 11.338 0.187 -4.977 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.129 1.292 -7.435 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.824 2.274 -6.016 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.347 2.152 -7.721 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.579 3.561 -7.017 1.00 0.00 H new ATOM 0 HD2 PRO A 93 14.750 2.235 -5.829 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.628 3.239 -4.932 1.00 0.00 H new ATOM 507 N ASN A 94 11.988 -1.766 -5.945 1.00 0.00 N ATOM 508 CA ASN A 94 12.105 -3.089 -6.571 1.00 0.00 C ATOM 509 C ASN A 94 10.739 -3.417 -7.206 1.00 0.00 C ATOM 510 O ASN A 94 9.764 -2.677 -7.046 1.00 0.00 O ATOM 511 CB ASN A 94 12.453 -4.065 -5.445 1.00 0.00 C ATOM 512 CG ASN A 94 12.918 -5.450 -5.901 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.123 -6.341 -6.178 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.210 -5.635 -6.022 1.00 0.00 N ATOM 0 H ASN A 94 11.451 -1.777 -5.078 1.00 0.00 H new ATOM 0 HA ASN A 94 12.869 -3.141 -7.347 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.236 -3.621 -4.831 1.00 0.00 H new ATOM 0 HB3 ASN A 94 11.577 -4.186 -4.807 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.568 -6.532 -6.351 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.857 -4.882 -5.787 1.00 0.00 H new ATOM 515 N GLU A 95 10.642 -4.581 -7.836 1.00 0.00 N ATOM 516 CA GLU A 95 9.348 -5.157 -8.268 1.00 0.00 C ATOM 517 C GLU A 95 8.386 -5.303 -7.075 1.00 0.00 C ATOM 518 O GLU A 95 7.174 -5.261 -7.202 1.00 0.00 O ATOM 519 CB GLU A 95 9.551 -6.577 -8.777 1.00 0.00 C ATOM 520 CG GLU A 95 10.535 -6.686 -9.960 1.00 0.00 C ATOM 521 CD GLU A 95 11.854 -7.320 -9.512 1.00 0.00 C ATOM 522 OE1 GLU A 95 11.911 -8.564 -9.500 1.00 0.00 O ATOM 523 OE2 GLU A 95 12.750 -6.532 -9.155 1.00 0.00 O ATOM 0 H GLU A 95 11.448 -5.161 -8.067 1.00 0.00 H new ATOM 0 HA GLU A 95 8.949 -4.490 -9.032 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.914 -7.197 -7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.587 -6.984 -9.081 1.00 0.00 H new ATOM 0 HG2 GLU A 95 10.090 -7.284 -10.755 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.724 -5.696 -10.374 1.00 0.00 H new ATOM 524 N GLU A 96 9.001 -5.568 -5.925 1.00 0.00 N ATOM 525 CA GLU A 96 8.355 -5.586 -4.608 1.00 0.00 C ATOM 526 C GLU A 96 7.573 -4.292 -4.295 1.00 0.00 C ATOM 527 O GLU A 96 6.505 -4.349 -3.704 1.00 0.00 O ATOM 528 CB GLU A 96 9.451 -5.782 -3.563 1.00 0.00 C ATOM 529 CG GLU A 96 9.982 -7.220 -3.656 1.00 0.00 C ATOM 530 CD GLU A 96 10.876 -7.616 -2.470 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.082 -7.309 -2.560 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.362 -8.267 -1.535 1.00 0.00 O ATOM 0 H GLU A 96 9.997 -5.784 -5.879 1.00 0.00 H new ATOM 0 HA GLU A 96 7.625 -6.395 -4.596 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.260 -5.071 -3.729 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.058 -5.590 -2.565 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.139 -7.908 -3.712 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.547 -7.332 -4.581 1.00 0.00 H new ATOM 533 N CYS A 97 8.100 -3.173 -4.806 1.00 0.00 N ATOM 534 CA CYS A 97 7.537 -1.813 -4.646 1.00 0.00 C ATOM 535 C CYS A 97 6.665 -1.402 -5.858 1.00 0.00 C ATOM 536 O CYS A 97 5.950 -0.405 -5.815 1.00 0.00 O ATOM 537 CB CYS A 97 8.698 -0.843 -4.510 1.00 0.00 C ATOM 538 SG CYS A 97 8.178 0.913 -4.544 1.00 0.00 S ATOM 0 H CYS A 97 8.956 -3.182 -5.360 1.00 0.00 H new ATOM 0 HA CYS A 97 6.897 -1.797 -3.764 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.222 -1.042 -3.575 1.00 0.00 H new ATOM 0 HB3 CYS A 97 9.408 -1.021 -5.318 1.00 0.00 H new ATOM 0 HG CYS A 97 7.022 1.012 -5.130 1.00 0.00 H new ATOM 539 N LEU A 98 6.992 -1.974 -7.001 1.00 0.00 N ATOM 540 CA LEU A 98 6.160 -1.819 -8.196 1.00 0.00 C ATOM 541 C LEU A 98 4.877 -2.615 -8.030 1.00 0.00 C ATOM 542 O LEU A 98 4.861 -3.713 -7.495 1.00 0.00 O ATOM 543 CB LEU A 98 6.917 -2.225 -9.460 1.00 0.00 C ATOM 544 CG LEU A 98 6.297 -1.488 -10.652 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.432 0.004 -10.534 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.161 -1.768 -11.863 1.00 0.00 C ATOM 0 H LEU A 98 7.823 -2.550 -7.135 1.00 0.00 H new ATOM 0 HA LEU A 98 5.903 -0.766 -8.312 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.974 -1.974 -9.367 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.858 -3.303 -9.608 1.00 0.00 H new ATOM 0 HG LEU A 98 5.256 -1.807 -10.707 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.977 0.480 -11.403 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.929 0.344 -9.629 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.488 0.271 -10.485 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.746 -1.257 -12.732 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.173 -1.408 -11.679 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.186 -2.841 -12.052 1.00 0.00 H new ATOM 547 N PHE A 99 3.814 -1.843 -8.182 1.00 0.00 N ATOM 548 CA PHE A 99 2.447 -2.337 -8.048 1.00 0.00 C ATOM 549 C PHE A 99 1.581 -2.071 -9.276 1.00 0.00 C ATOM 550 O PHE A 99 1.962 -1.282 -10.124 1.00 0.00 O ATOM 551 CB PHE A 99 1.756 -1.673 -6.847 1.00 0.00 C ATOM 552 CG PHE A 99 2.254 -2.098 -5.464 1.00 0.00 C ATOM 553 CD1 PHE A 99 3.380 -1.447 -4.926 1.00 0.00 C ATOM 554 CD2 PHE A 99 1.518 -3.027 -4.698 1.00 0.00 C ATOM 555 CE1 PHE A 99 3.781 -1.724 -3.597 1.00 0.00 C ATOM 556 CE2 PHE A 99 1.919 -3.304 -3.369 1.00 0.00 C ATOM 557 CZ PHE A 99 3.045 -2.654 -2.831 1.00 0.00 C ATOM 0 H PHE A 99 3.872 -0.849 -8.403 1.00 0.00 H new ATOM 0 HA PHE A 99 2.539 -3.415 -7.917 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.874 -0.593 -6.937 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.688 -1.883 -6.907 1.00 0.00 H new ATOM 0 HD1 PHE A 99 3.935 -0.740 -5.524 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.657 -3.522 -5.122 1.00 0.00 H new ATOM 0 HE1 PHE A 99 4.642 -1.229 -3.173 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.363 -4.011 -2.771 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.351 -2.870 -1.818 1.00 0.00 H new ATOM 558 N LEU A 100 0.485 -2.801 -9.450 1.00 0.00 N ATOM 559 CA LEU A 100 -0.395 -2.491 -10.582 1.00 0.00 C ATOM 560 C LEU A 100 -1.668 -1.743 -10.247 1.00 0.00 C ATOM 561 O LEU A 100 -2.451 -2.180 -9.412 1.00 0.00 O ATOM 562 CB LEU A 100 -0.761 -3.729 -11.414 1.00 0.00 C ATOM 563 CG LEU A 100 0.356 -4.064 -12.406 1.00 0.00 C ATOM 564 CD1 LEU A 100 1.522 -4.737 -11.696 1.00 0.00 C ATOM 565 CD2 LEU A 100 -0.175 -5.000 -13.498 1.00 0.00 C ATOM 0 H LEU A 100 0.189 -3.576 -8.857 1.00 0.00 H new ATOM 0 HA LEU A 100 0.226 -1.813 -11.167 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.935 -4.579 -10.754 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.691 -3.549 -11.953 1.00 0.00 H new ATOM 0 HG LEU A 100 0.702 -3.133 -12.855 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.305 -4.967 -12.419 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.918 -4.068 -10.932 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.179 -5.659 -11.227 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.627 -5.233 -14.199 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.538 -5.921 -13.043 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.992 -4.512 -14.030 1.00 0.00 H new ATOM 566 N GLU A 101 -1.851 -0.680 -11.018 1.00 0.00 N ATOM 567 CA GLU A 101 -3.044 0.184 -10.966 1.00 0.00 C ATOM 568 C GLU A 101 -4.350 -0.521 -11.391 1.00 0.00 C ATOM 569 O GLU A 101 -4.862 -0.385 -12.500 1.00 0.00 O ATOM 570 CB GLU A 101 -2.811 1.452 -11.794 1.00 0.00 C ATOM 571 CG GLU A 101 -1.991 2.519 -11.069 1.00 0.00 C ATOM 572 CD GLU A 101 -1.478 3.559 -12.062 1.00 0.00 C ATOM 573 OE1 GLU A 101 -2.296 4.395 -12.510 1.00 0.00 O ATOM 574 OE2 GLU A 101 -0.275 3.479 -12.400 1.00 0.00 O ATOM 0 H GLU A 101 -1.167 -0.380 -11.713 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.186 0.449 -9.918 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.302 1.182 -12.719 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.776 1.875 -12.073 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.603 3.003 -10.309 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.151 2.054 -10.553 1.00 0.00 H new ATOM 575 N ARG A 102 -4.848 -1.293 -10.439 1.00 0.00 N ATOM 576 CA ARG A 102 -6.128 -2.007 -10.504 1.00 0.00 C ATOM 577 C ARG A 102 -7.164 -1.025 -9.942 1.00 0.00 C ATOM 578 O ARG A 102 -7.143 -0.676 -8.764 1.00 0.00 O ATOM 579 CB ARG A 102 -6.078 -3.190 -9.535 1.00 0.00 C ATOM 580 CG ARG A 102 -4.897 -4.167 -9.605 1.00 0.00 C ATOM 581 CD ARG A 102 -5.039 -5.114 -10.803 1.00 0.00 C ATOM 582 NE ARG A 102 -6.216 -5.974 -10.561 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.278 -7.290 -10.747 1.00 0.00 C ATOM 584 NH1 ARG A 102 -5.241 -7.991 -11.184 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.412 -7.930 -10.494 1.00 0.00 N ATOM 0 H ARG A 102 -4.356 -1.451 -9.559 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.350 -2.349 -11.515 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -6.110 -2.786 -8.523 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.991 -3.769 -9.677 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.964 -3.610 -9.686 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.844 -4.746 -8.683 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.163 -4.547 -11.726 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.140 -5.720 -10.920 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.061 -5.516 -10.219 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.359 -7.522 -11.389 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.326 -8.999 -11.315 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.226 -7.413 -10.160 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.470 -8.939 -10.633 1.00 0.00 H new ATOM 586 N LEU A 103 -8.100 -0.621 -10.786 1.00 0.00 N ATOM 587 CA LEU A 103 -8.997 0.492 -10.410 1.00 0.00 C ATOM 588 C LEU A 103 -10.496 0.223 -10.628 1.00 0.00 C ATOM 589 O LEU A 103 -10.987 0.121 -11.752 1.00 0.00 O ATOM 590 CB LEU A 103 -8.528 1.765 -11.123 1.00 0.00 C ATOM 591 CG LEU A 103 -9.252 3.072 -10.735 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.247 3.363 -9.237 1.00 0.00 C ATOM 593 CD2 LEU A 103 -8.644 4.238 -11.517 1.00 0.00 C ATOM 0 H LEU A 103 -8.267 -1.022 -11.709 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.920 0.614 -9.330 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.463 1.893 -10.929 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -8.641 1.617 -12.197 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.302 2.944 -11.000 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.775 4.297 -9.046 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.744 2.551 -8.707 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.218 3.449 -8.887 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.153 5.163 -11.246 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -7.584 4.323 -11.278 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -8.761 4.060 -12.586 1.00 0.00 H new ATOM 594 N GLU A 104 -11.169 0.536 -9.533 1.00 0.00 N ATOM 595 CA GLU A 104 -12.638 0.454 -9.369 1.00 0.00 C ATOM 596 C GLU A 104 -13.374 1.680 -9.951 1.00 0.00 C ATOM 597 O GLU A 104 -14.554 1.901 -9.672 1.00 0.00 O ATOM 598 CB GLU A 104 -12.945 0.368 -7.863 1.00 0.00 C ATOM 599 CG GLU A 104 -12.332 -0.858 -7.166 1.00 0.00 C ATOM 600 CD GLU A 104 -13.079 -2.152 -7.528 1.00 0.00 C ATOM 601 OE1 GLU A 104 -12.906 -2.633 -8.672 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.878 -2.586 -6.678 1.00 0.00 O ATOM 0 H GLU A 104 -10.701 0.870 -8.691 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.988 -0.424 -9.912 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.577 1.271 -7.376 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -14.026 0.349 -7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.284 -0.952 -7.450 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.358 -0.713 -6.086 1.00 0.00 H new ATOM 603 N GLU A 105 -12.700 2.363 -10.873 1.00 0.00 N ATOM 604 CA GLU A 105 -13.071 3.689 -11.427 1.00 0.00 C ATOM 605 C GLU A 105 -13.224 4.858 -10.450 1.00 0.00 C ATOM 606 O GLU A 105 -12.475 5.833 -10.522 1.00 0.00 O ATOM 607 CB GLU A 105 -14.282 3.586 -12.378 1.00 0.00 C ATOM 608 CG GLU A 105 -13.964 2.863 -13.683 1.00 0.00 C ATOM 609 CD GLU A 105 -12.941 3.623 -14.545 1.00 0.00 C ATOM 610 OE1 GLU A 105 -13.354 4.632 -15.158 1.00 0.00 O ATOM 611 OE2 GLU A 105 -11.768 3.193 -14.551 1.00 0.00 O ATOM 0 H GLU A 105 -11.838 2.002 -11.282 1.00 0.00 H new ATOM 0 HA GLU A 105 -12.176 3.966 -11.984 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.092 3.063 -11.869 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -14.643 4.589 -12.605 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -13.578 1.869 -13.459 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.884 2.727 -14.252 1.00 0.00 H new ATOM 612 N ASN A 106 -14.028 4.630 -9.421 1.00 0.00 N ATOM 613 CA ASN A 106 -14.371 5.562 -8.336 1.00 0.00 C ATOM 614 C ASN A 106 -13.273 5.805 -7.270 1.00 0.00 C ATOM 615 O ASN A 106 -13.514 5.805 -6.068 1.00 0.00 O ATOM 616 CB ASN A 106 -15.638 4.974 -7.721 1.00 0.00 C ATOM 617 CG ASN A 106 -16.858 5.245 -8.610 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.111 4.573 -9.594 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.621 6.264 -8.284 1.00 0.00 N ATOM 0 H ASN A 106 -14.494 3.730 -9.307 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.501 6.563 -8.746 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.515 3.900 -7.584 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.801 5.405 -6.733 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.432 6.497 -8.857 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.402 6.822 -7.458 1.00 0.00 H new ATOM 620 N HIS A 107 -12.052 5.978 -7.765 1.00 0.00 N ATOM 621 CA HIS A 107 -10.804 6.265 -7.006 1.00 0.00 C ATOM 622 C HIS A 107 -10.322 5.184 -6.016 1.00 0.00 C ATOM 623 O HIS A 107 -9.251 5.328 -5.432 1.00 0.00 O ATOM 624 CB HIS A 107 -10.843 7.636 -6.325 1.00 0.00 C ATOM 625 CG HIS A 107 -11.034 8.733 -7.389 1.00 0.00 C ATOM 626 ND1 HIS A 107 -12.216 9.184 -7.783 1.00 0.00 N ATOM 627 CD2 HIS A 107 -10.127 9.139 -8.267 1.00 0.00 C ATOM 628 CE1 HIS A 107 -12.050 9.842 -8.922 1.00 0.00 C ATOM 629 NE2 HIS A 107 -10.763 9.819 -9.216 1.00 0.00 N ATOM 0 H HIS A 107 -11.879 5.921 -8.769 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.051 6.262 -7.794 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.657 7.671 -5.601 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -9.918 7.806 -5.774 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -9.064 8.951 -8.220 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -12.828 10.312 -9.505 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -10.330 10.250 -10.033 1.00 0.00 H new ATOM 630 N TYR A 108 -11.143 4.151 -5.832 1.00 0.00 N ATOM 631 CA TYR A 108 -10.742 2.922 -5.120 1.00 0.00 C ATOM 632 C TYR A 108 -9.713 2.124 -5.924 1.00 0.00 C ATOM 633 O TYR A 108 -10.002 1.464 -6.925 1.00 0.00 O ATOM 634 CB TYR A 108 -11.946 2.039 -4.765 1.00 0.00 C ATOM 635 CG TYR A 108 -12.919 2.736 -3.823 1.00 0.00 C ATOM 636 CD1 TYR A 108 -12.531 2.960 -2.478 1.00 0.00 C ATOM 637 CD2 TYR A 108 -14.148 3.198 -4.336 1.00 0.00 C ATOM 638 CE1 TYR A 108 -13.405 3.681 -1.642 1.00 0.00 C ATOM 639 CE2 TYR A 108 -15.012 3.919 -3.497 1.00 0.00 C ATOM 640 CZ TYR A 108 -14.624 4.153 -2.153 1.00 0.00 C ATOM 641 OH TYR A 108 -15.450 4.819 -1.311 1.00 0.00 O ATOM 0 H TYR A 108 -12.106 4.135 -6.169 1.00 0.00 H new ATOM 0 HA TYR A 108 -10.280 3.240 -4.185 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.468 1.757 -5.679 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -11.593 1.117 -4.302 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -11.589 2.587 -2.104 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.421 3.000 -5.362 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.139 3.870 -0.613 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.956 4.289 -3.869 1.00 0.00 H new ATOM 0 HH TYR A 108 -16.258 5.091 -1.793 1.00 0.00 H new ATOM 642 N ASN A 109 -8.489 2.447 -5.551 1.00 0.00 N ATOM 643 CA ASN A 109 -7.242 1.929 -6.100 1.00 0.00 C ATOM 644 C ASN A 109 -6.733 0.718 -5.305 1.00 0.00 C ATOM 645 O ASN A 109 -6.493 0.769 -4.108 1.00 0.00 O ATOM 646 CB ASN A 109 -6.237 3.066 -6.001 1.00 0.00 C ATOM 647 CG ASN A 109 -6.246 3.989 -7.224 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.485 3.806 -8.166 1.00 0.00 O ATOM 649 ND2 ASN A 109 -7.046 5.035 -7.201 1.00 0.00 N ATOM 0 H ASN A 109 -8.325 3.124 -4.806 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.388 1.593 -7.126 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.451 3.654 -5.109 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -5.238 2.649 -5.876 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -7.036 5.702 -7.973 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.676 5.178 -6.412 1.00 0.00 H new ATOM 650 N THR A 110 -6.712 -0.392 -6.028 1.00 0.00 N ATOM 651 CA THR A 110 -6.131 -1.663 -5.554 1.00 0.00 C ATOM 652 C THR A 110 -4.837 -1.925 -6.358 1.00 0.00 C ATOM 653 O THR A 110 -4.741 -1.482 -7.498 1.00 0.00 O ATOM 654 CB THR A 110 -7.155 -2.799 -5.737 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.631 -2.869 -7.079 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.370 -2.614 -4.823 1.00 0.00 C ATOM 0 H THR A 110 -7.098 -0.448 -6.970 1.00 0.00 H new ATOM 0 HA THR A 110 -5.886 -1.612 -4.493 1.00 0.00 H new ATOM 0 HB THR A 110 -6.629 -3.719 -5.480 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.503 -3.316 -7.094 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.071 -3.434 -4.979 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.045 -2.608 -3.783 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.860 -1.668 -5.056 1.00 0.00 H new ATOM 657 N TYR A 111 -3.837 -2.562 -5.764 1.00 0.00 N ATOM 658 CA TYR A 111 -2.532 -2.707 -6.442 1.00 0.00 C ATOM 659 C TYR A 111 -1.830 -4.049 -6.169 1.00 0.00 C ATOM 660 O TYR A 111 -1.433 -4.310 -5.040 1.00 0.00 O ATOM 661 CB TYR A 111 -1.562 -1.572 -6.073 1.00 0.00 C ATOM 662 CG TYR A 111 -2.046 -0.123 -6.170 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.256 0.464 -7.435 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.165 0.632 -4.977 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.619 1.820 -7.501 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.504 1.996 -5.046 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.736 2.564 -6.316 1.00 0.00 C ATOM 668 OH TYR A 111 -3.229 3.833 -6.396 1.00 0.00 O ATOM 0 H TYR A 111 -3.889 -2.982 -4.836 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.779 -2.664 -7.503 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.232 -1.741 -5.048 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.683 -1.669 -6.711 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -2.140 -0.118 -8.337 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -1.996 0.163 -4.019 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.807 2.287 -8.457 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -2.584 2.593 -4.149 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.712 3.943 -7.241 1.00 0.00 H new ATOM 669 N ILE A 112 -1.713 -4.866 -7.211 1.00 0.00 N ATOM 670 CA ILE A 112 -0.909 -6.118 -7.174 1.00 0.00 C ATOM 671 C ILE A 112 0.574 -5.724 -7.104 1.00 0.00 C ATOM 672 O ILE A 112 1.062 -5.078 -8.027 1.00 0.00 O ATOM 673 CB ILE A 112 -1.073 -6.989 -8.437 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.521 -7.351 -8.772 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.181 -8.246 -8.430 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.218 -8.332 -7.818 1.00 0.00 C ATOM 0 H ILE A 112 -2.165 -4.694 -8.109 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.253 -6.693 -6.314 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.725 -6.340 -9.241 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.105 -6.431 -8.802 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.543 -7.776 -9.775 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.345 -8.814 -9.346 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.866 -7.949 -8.370 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.432 -8.866 -7.569 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.237 -8.510 -8.160 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.671 -9.275 -7.802 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.241 -7.909 -6.814 1.00 0.00 H new ATOM 677 N SER A 113 1.297 -6.324 -6.168 1.00 0.00 N ATOM 678 CA SER A 113 2.776 -6.215 -6.114 1.00 0.00 C ATOM 679 C SER A 113 3.352 -6.949 -7.338 1.00 0.00 C ATOM 680 O SER A 113 3.054 -8.118 -7.555 1.00 0.00 O ATOM 681 CB SER A 113 3.325 -6.852 -4.838 1.00 0.00 C ATOM 682 OG SER A 113 4.758 -6.741 -4.803 1.00 0.00 O ATOM 0 H SER A 113 0.895 -6.897 -5.426 1.00 0.00 H new ATOM 0 HA SER A 113 3.062 -5.163 -6.118 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.894 -6.363 -3.964 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.033 -7.901 -4.792 1.00 0.00 H new ATOM 0 HG SER A 113 5.134 -7.509 -4.324 1.00 0.00 H new ATOM 683 N LYS A 114 4.166 -6.245 -8.120 1.00 0.00 N ATOM 684 CA LYS A 114 4.781 -6.782 -9.352 1.00 0.00 C ATOM 685 C LYS A 114 5.473 -8.130 -9.136 1.00 0.00 C ATOM 686 O LYS A 114 5.220 -9.076 -9.876 1.00 0.00 O ATOM 687 CB LYS A 114 5.804 -5.804 -9.936 1.00 0.00 C ATOM 688 CG LYS A 114 5.390 -5.297 -11.300 1.00 0.00 C ATOM 689 CD LYS A 114 5.299 -6.422 -12.337 1.00 0.00 C ATOM 690 CE LYS A 114 4.401 -5.948 -13.473 1.00 0.00 C ATOM 691 NZ LYS A 114 4.235 -7.026 -14.450 1.00 0.00 N ATOM 0 H LYS A 114 4.425 -5.278 -7.924 1.00 0.00 H new ATOM 0 HA LYS A 114 3.955 -6.924 -10.048 1.00 0.00 H new ATOM 0 HB2 LYS A 114 5.927 -4.960 -9.257 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.774 -6.296 -10.011 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.423 -4.799 -11.222 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.107 -4.550 -11.640 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.290 -6.672 -12.715 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.893 -7.326 -11.883 1.00 0.00 H new ATOM 0 HE2 LYS A 114 3.430 -5.646 -13.081 1.00 0.00 H new ATOM 0 HE3 LYS A 114 4.837 -5.072 -13.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 3.622 -6.701 -15.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.164 -7.294 -14.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.801 -7.850 -13.987 1.00 0.00 H new ATOM 692 N LYS A 115 6.266 -8.204 -8.068 1.00 0.00 N ATOM 693 CA LYS A 115 6.914 -9.473 -7.677 1.00 0.00 C ATOM 694 C LYS A 115 5.868 -10.565 -7.375 1.00 0.00 C ATOM 695 O LYS A 115 5.786 -11.577 -8.069 1.00 0.00 O ATOM 696 CB LYS A 115 7.864 -9.247 -6.491 1.00 0.00 C ATOM 697 CG LYS A 115 8.489 -10.600 -6.137 1.00 0.00 C ATOM 698 CD LYS A 115 8.785 -10.795 -4.667 1.00 0.00 C ATOM 699 CE LYS A 115 8.588 -12.276 -4.365 1.00 0.00 C ATOM 700 NZ LYS A 115 9.613 -13.131 -4.987 1.00 0.00 N ATOM 0 H LYS A 115 6.479 -7.414 -7.458 1.00 0.00 H new ATOM 0 HA LYS A 115 7.510 -9.829 -8.517 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.637 -8.524 -6.751 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.322 -8.840 -5.638 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.817 -11.392 -6.466 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.416 -10.714 -6.699 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.804 -10.486 -4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.120 -10.185 -4.056 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.604 -12.426 -3.286 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.603 -12.585 -4.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.447 -14.122 -4.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.561 -13.038 -6.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.555 -12.837 -4.660 1.00 0.00 H new ATOM 701 N HIS A 116 4.995 -10.263 -6.401 1.00 0.00 N ATOM 702 CA HIS A 116 3.961 -11.177 -5.886 1.00 0.00 C ATOM 703 C HIS A 116 2.717 -11.258 -6.777 1.00 0.00 C ATOM 704 O HIS A 116 1.653 -11.712 -6.345 1.00 0.00 O ATOM 705 CB HIS A 116 3.576 -10.708 -4.486 1.00 0.00 C ATOM 706 CG HIS A 116 4.789 -10.481 -3.600 1.00 0.00 C ATOM 707 ND1 HIS A 116 5.278 -9.301 -3.265 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.511 -11.417 -2.987 1.00 0.00 C ATOM 709 CE1 HIS A 116 6.270 -9.498 -2.414 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.428 -10.809 -2.263 1.00 0.00 N ATOM 0 H HIS A 116 4.988 -9.354 -5.938 1.00 0.00 H new ATOM 0 HA HIS A 116 4.378 -12.184 -5.870 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.004 -9.783 -4.560 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.924 -11.449 -4.023 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.370 -12.485 -3.069 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.850 -8.729 -1.927 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.136 -11.265 -1.687 1.00 0.00 H new ATOM 711 N ALA A 117 2.914 -10.968 -8.058 1.00 0.00 N ATOM 712 CA ALA A 117 1.935 -11.236 -9.128 1.00 0.00 C ATOM 713 C ALA A 117 1.619 -12.737 -9.175 1.00 0.00 C ATOM 714 O ALA A 117 0.440 -13.093 -9.132 1.00 0.00 O ATOM 715 CB ALA A 117 2.494 -10.743 -10.464 1.00 0.00 C ATOM 0 H ALA A 117 3.771 -10.532 -8.398 1.00 0.00 H new ATOM 0 HA ALA A 117 1.007 -10.701 -8.927 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.771 -10.940 -11.256 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.684 -9.671 -10.406 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.425 -11.265 -10.684 1.00 0.00 H new ATOM 716 N GLU A 118 2.631 -13.528 -8.821 1.00 0.00 N ATOM 717 CA GLU A 118 2.517 -14.997 -8.749 1.00 0.00 C ATOM 718 C GLU A 118 1.675 -15.557 -7.579 1.00 0.00 C ATOM 719 O GLU A 118 1.456 -16.755 -7.466 1.00 0.00 O ATOM 720 CB GLU A 118 3.901 -15.659 -8.860 1.00 0.00 C ATOM 721 CG GLU A 118 4.911 -15.127 -7.846 1.00 0.00 C ATOM 722 CD GLU A 118 6.305 -15.704 -8.076 1.00 0.00 C ATOM 723 OE1 GLU A 118 7.009 -15.152 -8.962 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.667 -16.653 -7.352 1.00 0.00 O ATOM 0 H GLU A 118 3.556 -13.175 -8.575 1.00 0.00 H new ATOM 0 HA GLU A 118 1.924 -15.276 -9.620 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.793 -16.735 -8.724 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.291 -15.503 -9.866 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.953 -14.040 -7.911 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.578 -15.373 -6.838 1.00 0.00 H new ATOM 725 N LYS A 119 1.288 -14.644 -6.682 1.00 0.00 N ATOM 726 CA LYS A 119 0.374 -14.906 -5.549 1.00 0.00 C ATOM 727 C LYS A 119 -0.881 -14.017 -5.526 1.00 0.00 C ATOM 728 O LYS A 119 -1.762 -14.261 -4.709 1.00 0.00 O ATOM 729 CB LYS A 119 1.186 -14.691 -4.263 1.00 0.00 C ATOM 730 CG LYS A 119 1.950 -15.970 -3.922 1.00 0.00 C ATOM 731 CD LYS A 119 3.305 -15.630 -3.282 1.00 0.00 C ATOM 732 CE LYS A 119 4.261 -15.038 -4.327 1.00 0.00 C ATOM 733 NZ LYS A 119 5.511 -14.689 -3.643 1.00 0.00 N ATOM 0 H LYS A 119 1.606 -13.676 -6.719 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.002 -15.924 -5.647 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.882 -13.863 -4.394 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.522 -14.422 -3.442 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.361 -16.582 -3.239 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.105 -16.560 -4.825 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.161 -14.919 -2.468 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.744 -16.528 -2.847 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.449 -15.758 -5.124 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.820 -14.156 -4.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.988 -13.924 -4.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.300 -14.373 -2.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.132 -15.523 -3.607 1.00 0.00 H new ATOM 734 N ASN A 120 -0.992 -13.111 -6.502 1.00 0.00 N ATOM 735 CA ASN A 120 -2.054 -12.083 -6.634 1.00 0.00 C ATOM 736 C ASN A 120 -2.126 -11.110 -5.439 1.00 0.00 C ATOM 737 O ASN A 120 -3.140 -10.450 -5.225 1.00 0.00 O ATOM 738 CB ASN A 120 -3.431 -12.739 -6.823 1.00 0.00 C ATOM 739 CG ASN A 120 -3.493 -13.694 -8.009 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.711 -13.305 -9.155 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.321 -14.962 -7.751 1.00 0.00 N ATOM 0 H ASN A 120 -0.315 -13.064 -7.264 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.784 -11.501 -7.515 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.693 -13.282 -5.915 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.181 -11.959 -6.955 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.367 -15.647 -8.506 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.141 -15.268 -6.795 1.00 0.00 H new ATOM 742 N TRP A 121 -1.001 -10.920 -4.766 1.00 0.00 N ATOM 743 CA TRP A 121 -0.982 -10.088 -3.553 1.00 0.00 C ATOM 744 C TRP A 121 -1.134 -8.600 -3.820 1.00 0.00 C ATOM 745 O TRP A 121 -0.287 -7.963 -4.458 1.00 0.00 O ATOM 746 CB TRP A 121 0.262 -10.304 -2.686 1.00 0.00 C ATOM 747 CG TRP A 121 0.325 -11.669 -2.018 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.671 -12.534 -1.879 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.439 -12.191 -1.366 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.246 -13.597 -1.197 1.00 0.00 N ATOM 751 CE2 TRP A 121 1.016 -13.423 -0.838 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.744 -11.725 -1.139 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.897 -14.205 -0.058 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.636 -12.511 -0.387 1.00 0.00 C ATOM 755 CH2 TRP A 121 3.206 -13.739 0.160 1.00 0.00 C ATOM 0 H TRP A 121 -0.099 -11.319 -5.026 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.861 -10.431 -3.007 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.150 -10.173 -3.305 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.293 -9.533 -1.916 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.672 -12.398 -2.260 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.809 -14.421 -0.984 1.00 0.00 H new ATOM 0 HE3 TRP A 121 3.060 -10.772 -1.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.571 -15.144 0.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.650 -12.175 -0.228 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.890 -14.328 0.753 1.00 0.00 H new ATOM 756 N PHE A 122 -2.236 -8.102 -3.286 1.00 0.00 N ATOM 757 CA PHE A 122 -2.497 -6.659 -3.294 1.00 0.00 C ATOM 758 C PHE A 122 -1.996 -6.028 -1.998 1.00 0.00 C ATOM 759 O PHE A 122 -1.895 -6.670 -0.952 1.00 0.00 O ATOM 760 CB PHE A 122 -3.993 -6.355 -3.394 1.00 0.00 C ATOM 761 CG PHE A 122 -4.715 -6.870 -4.635 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.194 -8.207 -4.677 1.00 0.00 C ATOM 763 CD2 PHE A 122 -5.061 -5.950 -5.642 1.00 0.00 C ATOM 764 CE1 PHE A 122 -6.053 -8.609 -5.719 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.928 -6.341 -6.689 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.415 -7.675 -6.713 1.00 0.00 C ATOM 0 H PHE A 122 -2.963 -8.664 -2.843 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.979 -6.250 -4.161 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.485 -6.774 -2.516 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.124 -5.274 -3.348 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.901 -8.912 -3.913 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.665 -4.946 -5.615 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.430 -9.620 -5.757 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.215 -5.638 -7.457 1.00 0.00 H new ATOM 0 HZ PHE A 122 -7.077 -7.981 -7.510 1.00 0.00 H new ATOM 767 N VAL A 123 -1.645 -4.762 -2.158 1.00 0.00 N ATOM 768 CA VAL A 123 -1.577 -3.785 -1.038 1.00 0.00 C ATOM 769 C VAL A 123 -2.953 -3.802 -0.348 1.00 0.00 C ATOM 770 O VAL A 123 -3.968 -3.875 -1.031 1.00 0.00 O ATOM 771 CB VAL A 123 -1.206 -2.402 -1.625 1.00 0.00 C ATOM 772 CG1 VAL A 123 -2.195 -1.929 -2.698 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.137 -1.312 -0.568 1.00 0.00 C ATOM 0 H VAL A 123 -1.395 -4.364 -3.063 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.817 -4.030 -0.296 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.221 -2.557 -2.066 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -1.885 -0.954 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.212 -2.646 -3.519 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.192 -1.851 -2.265 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.873 -0.365 -1.039 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.107 -1.217 -0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.382 -1.572 0.174 1.00 0.00 H new ATOM 774 N GLY A 124 -2.942 -3.676 0.974 1.00 0.00 N ATOM 775 CA GLY A 124 -4.174 -3.820 1.766 1.00 0.00 C ATOM 776 C GLY A 124 -3.949 -3.530 3.231 1.00 0.00 C ATOM 777 O GLY A 124 -2.844 -3.601 3.746 1.00 0.00 O ATOM 0 H GLY A 124 -2.106 -3.476 1.523 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.935 -3.144 1.377 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.560 -4.833 1.653 1.00 0.00 H new ATOM 778 N LEU A 125 -5.000 -2.947 3.759 1.00 0.00 N ATOM 779 CA LEU A 125 -4.996 -2.458 5.135 1.00 0.00 C ATOM 780 C LEU A 125 -5.468 -3.443 6.200 1.00 0.00 C ATOM 781 O LEU A 125 -6.598 -3.943 6.201 1.00 0.00 O ATOM 782 CB LEU A 125 -5.688 -1.097 5.189 1.00 0.00 C ATOM 783 CG LEU A 125 -4.622 -0.129 5.691 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.414 0.043 4.776 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.226 1.245 6.006 1.00 0.00 C ATOM 0 H LEU A 125 -5.877 -2.795 3.261 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.951 -2.335 5.420 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.056 -0.803 4.206 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.548 -1.118 5.858 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.244 -0.598 6.599 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.716 0.751 5.224 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.919 -0.919 4.642 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.742 0.420 3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.442 1.914 6.362 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.676 1.660 5.104 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.990 1.139 6.776 1.00 0.00 H new ATOM 786 N LYS A 126 -4.572 -3.605 7.160 1.00 0.00 N ATOM 787 CA LYS A 126 -4.768 -4.560 8.241 1.00 0.00 C ATOM 788 C LYS A 126 -5.692 -3.945 9.315 1.00 0.00 C ATOM 789 O LYS A 126 -5.295 -3.028 10.041 1.00 0.00 O ATOM 790 CB LYS A 126 -3.413 -4.937 8.833 1.00 0.00 C ATOM 791 CG LYS A 126 -3.338 -6.408 9.240 1.00 0.00 C ATOM 792 CD LYS A 126 -2.884 -6.563 10.700 1.00 0.00 C ATOM 793 CE LYS A 126 -3.916 -6.034 11.703 1.00 0.00 C ATOM 794 NZ LYS A 126 -3.416 -6.269 13.064 1.00 0.00 N ATOM 0 H LYS A 126 -3.696 -3.084 7.213 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.243 -5.464 7.860 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.631 -4.725 8.104 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.215 -4.312 9.704 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -4.315 -6.873 9.110 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.644 -6.934 8.584 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -2.691 -7.616 10.906 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -1.942 -6.033 10.841 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.087 -4.970 11.542 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.873 -6.536 11.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -4.220 -6.374 13.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -2.843 -7.137 13.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -2.831 -5.463 13.363 1.00 0.00 H new ATOM 795 N LYS A 127 -6.920 -4.464 9.313 1.00 0.00 N ATOM 796 CA LYS A 127 -8.126 -4.064 10.085 1.00 0.00 C ATOM 797 C LYS A 127 -8.091 -3.433 11.491 1.00 0.00 C ATOM 798 O LYS A 127 -9.084 -2.849 11.933 1.00 0.00 O ATOM 799 CB LYS A 127 -9.064 -5.277 10.101 1.00 0.00 C ATOM 800 CG LYS A 127 -10.218 -5.138 9.109 1.00 0.00 C ATOM 801 CD LYS A 127 -11.118 -3.962 9.505 1.00 0.00 C ATOM 802 CE LYS A 127 -12.507 -4.013 8.867 1.00 0.00 C ATOM 803 NZ LYS A 127 -12.414 -4.098 7.404 1.00 0.00 N ATOM 0 H LYS A 127 -7.130 -5.260 8.711 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.430 -3.174 9.534 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.494 -6.176 9.867 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -9.466 -5.408 11.106 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.826 -4.983 8.104 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.800 -6.059 9.086 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.226 -3.947 10.590 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.630 -3.030 9.220 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -13.055 -4.874 9.250 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -13.072 -3.124 9.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -13.102 -3.448 6.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.454 -3.836 7.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.620 -5.071 7.099 1.00 0.00 H new ATOM 804 N ASN A 128 -6.928 -3.437 12.115 1.00 0.00 N ATOM 805 CA ASN A 128 -6.717 -2.954 13.487 1.00 0.00 C ATOM 806 C ASN A 128 -5.869 -1.680 13.544 1.00 0.00 C ATOM 807 O ASN A 128 -6.059 -0.845 14.422 1.00 0.00 O ATOM 808 CB ASN A 128 -5.992 -4.054 14.250 1.00 0.00 C ATOM 809 CG ASN A 128 -6.865 -5.243 14.669 1.00 0.00 C ATOM 810 OD1 ASN A 128 -6.370 -6.306 15.019 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.169 -5.084 14.736 1.00 0.00 N ATOM 0 H ASN A 128 -6.074 -3.784 11.678 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.688 -2.714 13.920 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.174 -4.424 13.632 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.544 -3.620 15.144 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -8.758 -5.843 15.077 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.591 -4.202 14.447 1.00 0.00 H new ATOM 812 N GLY A 129 -5.003 -1.540 12.532 1.00 0.00 N ATOM 813 CA GLY A 129 -3.997 -0.489 12.506 1.00 0.00 C ATOM 814 C GLY A 129 -3.137 -0.564 11.235 1.00 0.00 C ATOM 815 O GLY A 129 -3.488 0.075 10.243 1.00 0.00 O ATOM 0 H GLY A 129 -4.986 -2.152 11.716 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.485 0.484 12.560 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.358 -0.574 13.385 1.00 0.00 H new ATOM 816 N SER A 130 -2.356 -1.640 11.199 1.00 0.00 N ATOM 817 CA SER A 130 -1.230 -1.837 10.262 1.00 0.00 C ATOM 818 C SER A 130 -1.606 -1.858 8.766 1.00 0.00 C ATOM 819 O SER A 130 -2.764 -1.805 8.376 1.00 0.00 O ATOM 820 CB SER A 130 -0.504 -3.134 10.668 1.00 0.00 C ATOM 821 OG SER A 130 0.600 -3.439 9.818 1.00 0.00 O ATOM 0 H SER A 130 -2.484 -2.427 11.835 1.00 0.00 H new ATOM 0 HA SER A 130 -0.584 -0.964 10.349 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.151 -3.041 11.695 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.212 -3.963 10.648 1.00 0.00 H new ATOM 0 HG SER A 130 1.413 -3.024 10.175 1.00 0.00 H new ATOM 822 N CYS A 131 -0.567 -1.777 7.932 1.00 0.00 N ATOM 823 CA CYS A 131 -0.688 -1.968 6.468 1.00 0.00 C ATOM 824 C CYS A 131 -0.284 -3.391 6.050 1.00 0.00 C ATOM 825 O CYS A 131 -0.655 -3.886 4.988 1.00 0.00 O ATOM 826 CB CYS A 131 0.253 -1.033 5.706 1.00 0.00 C ATOM 827 SG CYS A 131 -0.096 0.757 5.788 1.00 0.00 S ATOM 0 H CYS A 131 0.384 -1.578 8.242 1.00 0.00 H new ATOM 0 HA CYS A 131 -1.732 -1.766 6.230 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.265 -1.197 6.078 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.247 -1.330 4.657 1.00 0.00 H new ATOM 0 HG CYS A 131 0.989 1.396 6.110 1.00 0.00 H new ATOM 828 N LYS A 132 0.519 -4.045 6.885 1.00 0.00 N ATOM 829 CA LYS A 132 1.176 -5.307 6.539 1.00 0.00 C ATOM 830 C LYS A 132 0.247 -6.482 6.301 1.00 0.00 C ATOM 831 O LYS A 132 -0.425 -6.920 7.235 1.00 0.00 O ATOM 832 CB LYS A 132 2.210 -5.645 7.606 1.00 0.00 C ATOM 833 CG LYS A 132 3.312 -4.582 7.691 1.00 0.00 C ATOM 834 CD LYS A 132 4.364 -4.945 8.738 1.00 0.00 C ATOM 835 CE LYS A 132 3.752 -5.088 10.133 1.00 0.00 C ATOM 836 NZ LYS A 132 4.822 -5.480 11.050 1.00 0.00 N ATOM 0 H LYS A 132 0.735 -3.715 7.826 1.00 0.00 H new ATOM 0 HA LYS A 132 1.651 -5.140 5.572 1.00 0.00 H new ATOM 0 HB2 LYS A 132 1.717 -5.735 8.574 1.00 0.00 H new ATOM 0 HB3 LYS A 132 2.657 -6.614 7.385 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.789 -4.473 6.717 1.00 0.00 H new ATOM 0 HG3 LYS A 132 2.869 -3.617 7.938 1.00 0.00 H new ATOM 0 HD2 LYS A 132 4.849 -5.879 8.457 1.00 0.00 H new ATOM 0 HD3 LYS A 132 5.137 -4.177 8.757 1.00 0.00 H new ATOM 0 HE2 LYS A 132 3.301 -4.148 10.451 1.00 0.00 H new ATOM 0 HE3 LYS A 132 2.959 -5.836 10.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 4.435 -5.585 12.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 5.231 -6.385 10.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 5.562 -4.749 11.053 1.00 0.00 H new ATOM 837 N ARG A 133 0.023 -6.699 5.009 1.00 0.00 N ATOM 838 CA ARG A 133 -0.506 -7.969 4.489 1.00 0.00 C ATOM 839 C ARG A 133 -0.432 -8.202 2.968 1.00 0.00 C ATOM 840 O ARG A 133 -0.181 -7.274 2.196 1.00 0.00 O ATOM 841 CB ARG A 133 -1.939 -8.230 4.960 1.00 0.00 C ATOM 842 CG ARG A 133 -2.026 -9.684 5.420 1.00 0.00 C ATOM 843 CD ARG A 133 -1.181 -10.007 6.661 1.00 0.00 C ATOM 844 NE ARG A 133 -1.456 -11.429 6.954 1.00 0.00 N ATOM 845 CZ ARG A 133 -0.585 -12.444 6.921 1.00 0.00 C ATOM 846 NH1 ARG A 133 0.715 -12.262 6.739 1.00 0.00 N ATOM 847 NH2 ARG A 133 -1.034 -13.671 7.144 1.00 0.00 N ATOM 0 H ARG A 133 0.201 -6.002 4.286 1.00 0.00 H new ATOM 0 HA ARG A 133 0.193 -8.686 4.920 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -2.201 -7.556 5.775 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.646 -8.043 4.152 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.068 -9.924 5.632 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.710 -10.331 4.602 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.121 -9.842 6.470 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.456 -9.371 7.502 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.415 -11.662 7.210 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.086 -11.320 6.617 1.00 0.00 H new ATOM 0 HH12 ARG A 133 1.345 -13.064 6.721 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -2.024 -13.825 7.335 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -0.390 -14.461 7.124 1.00 0.00 H new ATOM 848 N GLY A 134 -0.164 -9.485 2.722 1.00 0.00 N ATOM 849 CA GLY A 134 -0.145 -10.171 1.412 1.00 0.00 C ATOM 850 C GLY A 134 -1.205 -11.280 1.242 1.00 0.00 C ATOM 851 O GLY A 134 -2.164 -11.073 0.500 1.00 0.00 O ATOM 0 H GLY A 134 0.063 -10.126 3.482 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.289 -9.428 0.627 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.843 -10.607 1.261 1.00 0.00 H new ATOM 852 N PRO A 135 -1.101 -12.446 1.924 1.00 0.00 N ATOM 853 CA PRO A 135 -1.930 -13.651 1.622 1.00 0.00 C ATOM 854 C PRO A 135 -3.350 -13.697 2.202 1.00 0.00 C ATOM 855 O PRO A 135 -4.027 -14.724 2.169 1.00 0.00 O ATOM 856 CB PRO A 135 -1.052 -14.805 2.107 1.00 0.00 C ATOM 857 CG PRO A 135 -0.448 -14.231 3.378 1.00 0.00 C ATOM 858 CD PRO A 135 -0.179 -12.764 3.031 1.00 0.00 C ATOM 0 HA PRO A 135 -2.172 -13.677 0.559 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.634 -15.706 2.303 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.288 -15.071 1.376 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.132 -14.323 4.222 1.00 0.00 H new ATOM 0 HG3 PRO A 135 0.470 -14.751 3.654 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.360 -12.118 3.890 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.859 -12.615 2.733 1.00 0.00 H new ATOM 859 N ARG A 136 -3.876 -12.496 2.350 1.00 0.00 N ATOM 860 CA ARG A 136 -5.206 -12.190 2.904 1.00 0.00 C ATOM 861 C ARG A 136 -5.905 -11.199 1.952 1.00 0.00 C ATOM 862 O ARG A 136 -7.010 -11.450 1.461 1.00 0.00 O ATOM 863 CB ARG A 136 -4.968 -11.578 4.285 1.00 0.00 C ATOM 864 CG ARG A 136 -6.226 -11.003 4.950 1.00 0.00 C ATOM 865 CD ARG A 136 -5.830 -9.771 5.762 1.00 0.00 C ATOM 866 NE ARG A 136 -7.022 -8.983 6.090 1.00 0.00 N ATOM 867 CZ ARG A 136 -7.112 -7.644 6.069 1.00 0.00 C ATOM 868 NH1 ARG A 136 -6.088 -6.896 5.679 1.00 0.00 N ATOM 869 NH2 ARG A 136 -8.192 -7.028 6.515 1.00 0.00 N ATOM 0 H ARG A 136 -3.370 -11.654 2.076 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.843 -13.069 2.999 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.543 -12.340 4.938 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.225 -10.785 4.194 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.965 -10.736 4.194 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.687 -11.750 5.597 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.322 -10.076 6.677 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.126 -9.162 5.195 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.859 -9.500 6.359 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.215 -7.337 5.389 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.173 -5.880 5.669 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -8.974 -7.571 6.882 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.244 -6.010 6.492 1.00 0.00 H new ATOM 870 N THR A 137 -5.101 -10.224 1.532 1.00 0.00 N ATOM 871 CA THR A 137 -5.457 -9.054 0.728 1.00 0.00 C ATOM 872 C THR A 137 -5.634 -9.344 -0.773 1.00 0.00 C ATOM 873 O THR A 137 -4.735 -9.163 -1.593 1.00 0.00 O ATOM 874 CB THR A 137 -4.387 -7.994 0.998 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.098 -8.614 1.126 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.770 -7.218 2.258 1.00 0.00 C ATOM 0 H THR A 137 -4.107 -10.231 1.762 1.00 0.00 H new ATOM 0 HA THR A 137 -6.445 -8.702 1.026 1.00 0.00 H new ATOM 0 HB THR A 137 -4.328 -7.295 0.163 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.967 -9.250 0.392 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.015 -6.459 2.461 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.737 -6.737 2.109 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.832 -7.904 3.103 1.00 0.00 H new ATOM 877 N HIS A 138 -6.820 -9.881 -1.038 1.00 0.00 N ATOM 878 CA HIS A 138 -7.339 -10.092 -2.404 1.00 0.00 C ATOM 879 C HIS A 138 -8.692 -9.380 -2.596 1.00 0.00 C ATOM 880 O HIS A 138 -9.282 -8.872 -1.644 1.00 0.00 O ATOM 881 CB HIS A 138 -7.447 -11.598 -2.695 1.00 0.00 C ATOM 882 CG HIS A 138 -8.566 -12.308 -1.934 1.00 0.00 C ATOM 883 ND1 HIS A 138 -8.596 -12.576 -0.635 1.00 0.00 N ATOM 884 CD2 HIS A 138 -9.771 -12.587 -2.426 1.00 0.00 C ATOM 885 CE1 HIS A 138 -9.807 -13.016 -0.317 1.00 0.00 C ATOM 886 NE2 HIS A 138 -10.534 -13.006 -1.424 1.00 0.00 N ATOM 0 H HIS A 138 -7.463 -10.189 -0.309 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.642 -9.654 -3.118 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.605 -11.739 -3.764 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.498 -12.073 -2.448 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -7.816 -12.463 0.013 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -10.074 -12.490 -3.458 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -10.138 -13.325 0.663 1.00 0.00 H new ATOM 887 N TYR A 139 -9.061 -9.170 -3.857 1.00 0.00 N ATOM 888 CA TYR A 139 -10.382 -8.618 -4.237 1.00 0.00 C ATOM 889 C TYR A 139 -11.582 -9.264 -3.530 1.00 0.00 C ATOM 890 O TYR A 139 -11.956 -10.406 -3.771 1.00 0.00 O ATOM 891 CB TYR A 139 -10.575 -8.614 -5.752 1.00 0.00 C ATOM 892 CG TYR A 139 -10.617 -7.178 -6.326 1.00 0.00 C ATOM 893 CD1 TYR A 139 -11.560 -6.239 -5.839 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.619 -6.809 -7.249 1.00 0.00 C ATOM 895 CE1 TYR A 139 -11.471 -4.900 -6.246 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.529 -5.461 -7.657 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.442 -4.520 -7.137 1.00 0.00 C ATOM 898 OH TYR A 139 -10.264 -3.211 -7.449 1.00 0.00 O ATOM 0 H TYR A 139 -8.459 -9.375 -4.655 1.00 0.00 H new ATOM 0 HA TYR A 139 -10.361 -7.589 -3.879 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.763 -9.169 -6.223 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -11.501 -9.131 -6.001 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -12.340 -6.552 -5.161 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -8.933 -7.547 -7.639 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.179 -4.169 -5.884 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.769 -5.153 -8.360 1.00 0.00 H new ATOM 0 HH TYR A 139 -10.053 -3.128 -8.402 1.00 0.00 H new ATOM 899 N GLY A 140 -12.085 -8.472 -2.582 1.00 0.00 N ATOM 900 CA GLY A 140 -13.165 -8.850 -1.646 1.00 0.00 C ATOM 901 C GLY A 140 -12.895 -8.231 -0.264 1.00 0.00 C ATOM 902 O GLY A 140 -13.812 -7.787 0.417 1.00 0.00 O ATOM 0 H GLY A 140 -11.748 -7.521 -2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -14.126 -8.506 -2.027 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.224 -9.935 -1.564 1.00 0.00 H new ATOM 903 N GLN A 141 -11.610 -8.105 0.058 1.00 0.00 N ATOM 904 CA GLN A 141 -11.152 -7.410 1.261 1.00 0.00 C ATOM 905 C GLN A 141 -11.208 -5.906 1.051 1.00 0.00 C ATOM 906 O GLN A 141 -10.498 -5.315 0.237 1.00 0.00 O ATOM 907 CB GLN A 141 -9.704 -7.768 1.602 1.00 0.00 C ATOM 908 CG GLN A 141 -9.394 -9.265 1.639 1.00 0.00 C ATOM 909 CD GLN A 141 -10.145 -10.094 2.697 1.00 0.00 C ATOM 910 OE1 GLN A 141 -11.038 -9.668 3.424 1.00 0.00 O ATOM 911 NE2 GLN A 141 -9.801 -11.348 2.748 1.00 0.00 N ATOM 0 H GLN A 141 -10.852 -8.484 -0.510 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.809 -7.719 2.074 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.048 -7.296 0.871 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.460 -7.339 2.574 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -9.615 -9.684 0.657 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.324 -9.388 1.805 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -9.059 -11.698 2.142 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.274 -11.981 3.393 1.00 0.00 H new ATOM 912 N LYS A 142 -12.053 -5.349 1.894 1.00 0.00 N ATOM 913 CA LYS A 142 -12.193 -3.905 2.173 1.00 0.00 C ATOM 914 C LYS A 142 -10.823 -3.194 2.230 1.00 0.00 C ATOM 915 O LYS A 142 -10.637 -2.106 1.699 1.00 0.00 O ATOM 916 CB LYS A 142 -12.907 -3.830 3.512 1.00 0.00 C ATOM 917 CG LYS A 142 -14.275 -4.522 3.453 1.00 0.00 C ATOM 918 CD LYS A 142 -14.980 -4.527 4.809 1.00 0.00 C ATOM 919 CE LYS A 142 -15.387 -3.127 5.285 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.028 -3.237 6.598 1.00 0.00 N ATOM 0 H LYS A 142 -12.705 -5.910 2.442 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.747 -3.398 1.383 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.293 -4.299 4.281 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.037 -2.787 3.800 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.904 -4.017 2.720 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.146 -5.548 3.109 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -15.869 -5.155 4.747 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -14.322 -4.979 5.551 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -14.511 -2.481 5.347 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -16.071 -2.670 4.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -16.307 -2.291 6.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -16.872 -3.841 6.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -15.361 -3.657 7.276 1.00 0.00 H new ATOM 921 N ALA A 143 -9.876 -3.939 2.801 1.00 0.00 N ATOM 922 CA ALA A 143 -8.430 -3.646 2.918 1.00 0.00 C ATOM 923 C ALA A 143 -7.750 -3.107 1.665 1.00 0.00 C ATOM 924 O ALA A 143 -7.015 -2.119 1.760 1.00 0.00 O ATOM 925 CB ALA A 143 -7.737 -4.922 3.383 1.00 0.00 C ATOM 0 H ALA A 143 -10.109 -4.835 3.230 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.338 -2.829 3.633 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.667 -4.740 3.480 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.142 -5.225 4.348 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.906 -5.714 2.654 1.00 0.00 H new ATOM 926 N ILE A 144 -7.985 -3.760 0.532 1.00 0.00 N ATOM 927 CA ILE A 144 -7.285 -3.437 -0.730 1.00 0.00 C ATOM 928 C ILE A 144 -7.779 -2.167 -1.443 1.00 0.00 C ATOM 929 O ILE A 144 -7.046 -1.586 -2.235 1.00 0.00 O ATOM 930 CB ILE A 144 -7.186 -4.648 -1.688 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.528 -5.101 -2.247 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.405 -5.762 -0.987 1.00 0.00 C ATOM 933 CD1 ILE A 144 -8.290 -5.902 -3.527 1.00 0.00 C ATOM 0 H ILE A 144 -8.657 -4.523 0.450 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.271 -3.194 -0.412 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.639 -4.343 -2.580 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -9.054 -5.712 -1.513 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -9.160 -4.238 -2.455 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.326 -6.624 -1.650 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.406 -5.404 -0.737 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.925 -6.053 -0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -9.246 -6.230 -3.934 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.780 -5.275 -4.259 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.673 -6.772 -3.302 1.00 0.00 H new ATOM 934 N LEU A 145 -8.962 -1.678 -1.059 1.00 0.00 N ATOM 935 CA LEU A 145 -9.604 -0.525 -1.722 1.00 0.00 C ATOM 936 C LEU A 145 -9.191 0.821 -1.120 1.00 0.00 C ATOM 937 O LEU A 145 -9.781 1.312 -0.143 1.00 0.00 O ATOM 938 CB LEU A 145 -11.130 -0.672 -1.722 1.00 0.00 C ATOM 939 CG LEU A 145 -11.613 -1.907 -2.481 1.00 0.00 C ATOM 940 CD1 LEU A 145 -12.004 -3.014 -1.504 1.00 0.00 C ATOM 941 CD2 LEU A 145 -12.828 -1.551 -3.339 1.00 0.00 C ATOM 0 H LEU A 145 -9.504 -2.063 -0.285 1.00 0.00 H new ATOM 0 HA LEU A 145 -9.248 -0.528 -2.752 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -11.484 -0.724 -0.692 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.575 0.218 -2.167 1.00 0.00 H new ATOM 0 HG LEU A 145 -10.800 -2.257 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -12.346 -3.887 -2.061 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -11.140 -3.286 -0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -12.806 -2.661 -0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -13.166 -2.437 -3.877 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -13.631 -1.187 -2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -12.554 -0.775 -4.054 1.00 0.00 H new ATOM 942 N PHE A 146 -8.098 1.348 -1.663 1.00 0.00 N ATOM 943 CA PHE A 146 -7.550 2.662 -1.263 1.00 0.00 C ATOM 944 C PHE A 146 -8.017 3.892 -2.023 1.00 0.00 C ATOM 945 O PHE A 146 -8.217 3.854 -3.239 1.00 0.00 O ATOM 946 CB PHE A 146 -6.019 2.685 -1.348 1.00 0.00 C ATOM 947 CG PHE A 146 -5.405 1.590 -0.499 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.409 1.698 0.908 1.00 0.00 C ATOM 949 CD2 PHE A 146 -4.966 0.435 -1.169 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.974 0.592 1.666 1.00 0.00 C ATOM 951 CE2 PHE A 146 -4.535 -0.668 -0.402 1.00 0.00 C ATOM 952 CZ PHE A 146 -4.535 -0.562 0.996 1.00 0.00 C ATOM 0 H PHE A 146 -7.559 0.884 -2.394 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.943 2.741 -0.249 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.708 2.562 -2.385 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -5.649 3.655 -1.018 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.737 2.606 1.392 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -4.959 0.393 -2.248 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.978 0.631 2.745 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.211 -1.579 -0.884 1.00 0.00 H new ATOM 0 HZ PHE A 146 -4.184 -1.400 1.580 1.00 0.00 H new ATOM 953 N LEU A 147 -7.956 5.011 -1.313 1.00 0.00 N ATOM 954 CA LEU A 147 -8.081 6.365 -1.883 1.00 0.00 C ATOM 955 C LEU A 147 -6.749 7.111 -1.673 1.00 0.00 C ATOM 956 O LEU A 147 -6.502 7.654 -0.592 1.00 0.00 O ATOM 957 CB LEU A 147 -9.210 7.184 -1.253 1.00 0.00 C ATOM 958 CG LEU A 147 -10.577 6.544 -1.463 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.881 5.581 -0.303 1.00 0.00 C ATOM 960 CD2 LEU A 147 -11.651 7.629 -1.479 1.00 0.00 C ATOM 0 H LEU A 147 -7.816 5.013 -0.303 1.00 0.00 H new ATOM 0 HA LEU A 147 -8.320 6.251 -2.940 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.023 7.294 -0.185 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.211 8.186 -1.681 1.00 0.00 H new ATOM 0 HG LEU A 147 -10.573 6.003 -2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.859 5.125 -0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -10.119 4.802 -0.267 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.881 6.132 0.637 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -12.629 7.171 -1.629 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -11.643 8.163 -0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -11.449 8.328 -2.290 1.00 0.00 H new ATOM 961 N PRO A 148 -5.817 6.997 -2.625 1.00 0.00 N ATOM 962 CA PRO A 148 -4.516 7.698 -2.560 1.00 0.00 C ATOM 963 C PRO A 148 -4.643 9.112 -3.142 1.00 0.00 C ATOM 964 O PRO A 148 -5.735 9.596 -3.430 1.00 0.00 O ATOM 965 CB PRO A 148 -3.603 6.782 -3.368 1.00 0.00 C ATOM 966 CG PRO A 148 -4.502 6.246 -4.468 1.00 0.00 C ATOM 967 CD PRO A 148 -5.851 6.054 -3.769 1.00 0.00 C ATOM 0 HA PRO A 148 -4.132 7.860 -1.553 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -2.752 7.327 -3.778 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.200 5.977 -2.754 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.578 6.946 -5.300 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -4.123 5.308 -4.874 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.681 6.275 -4.441 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.980 5.026 -3.431 1.00 0.00 H new