USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1027 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 105 ASN : amide:sc= 1.21 K(o=1.3,f=0.31) USER MOD Set 1.2: A 110 THR OG1 : rot -62:sc= 0.119 USER MOD Set 2.1: A 1 MET CE :methyl -140:sc= -0.362 (180deg=-1.18) USER MOD Set 2.2: A 85 MET CE :methyl 140:sc= -0.828 (180deg=-1.65) USER MOD Set 2.3: A 91 MET CE :methyl 179:sc= -4.16! (180deg=-3.98!) USER MOD Set 3.1: A 73 THR OG1 : rot -73:sc= 1.78 USER MOD Set 3.2: A 75 THR OG1 : rot -68:sc= 0.919 USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 60 HIS : no HD1:sc= 0.0838 K(o=0.084,f=-5.1!) USER MOD Set 5.1: A 47 LYS NZ :NH3+ -146:sc= 0.504 (180deg=-0.3) USER MOD Set 5.2: A 64 THR OG1 : rot 87:sc= 0.378 USER MOD Set 5.3: A 69 CYS SG : rot 65:sc= -0.83! USER MOD Single : A 1 MET N :NH3+ -169:sc= 0.00742 (180deg=-0.528) USER MOD Single : A 2 ASN : amide:sc= -0.551 X(o=-0.55,f=-0.46) USER MOD Single : A 4 SER OG : rot -1:sc= 1.2 USER MOD Single : A 6 LYS NZ :NH3+ -177:sc= 1.3 (180deg=1.21) USER MOD Single : A 7 TYR OH : rot -165:sc= -0.47 USER MOD Single : A 8 GLN : amide:sc=-0.00418 K(o=-0.0042,f=-0.85) USER MOD Single : A 10 GLN : amide:sc= -1.27 X(o=-1.3,f=-0.84) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -1.78! C(o=-1.8!,f=-6.1!) USER MOD Single : A 14 ASN : amide:sc= -0.358 X(o=-0.36,f=-0.46) USER MOD Single : A 19 MET CE :methyl -175:sc= 0 (180deg=-0.0198) USER MOD Single : A 20 LYS NZ :NH3+ -165:sc=-0.00829 (180deg=-0.167) USER MOD Single : A 22 MET CE :methyl -141:sc= -0.192 (180deg=-0.757) USER MOD Single : A 30 GLN : amide:sc= -0.0191 K(o=-0.019,f=-1.3!) USER MOD Single : A 31 LYS NZ :NH3+ 152:sc= 1.27 (180deg=0.503) USER MOD Single : A 33 LYS NZ :NH3+ 170:sc= 1.32 (180deg=1.07) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 179:sc= -2.15! USER MOD Single : A 43 HIS : no HD1:sc= -1.6! C(o=-1.6!,f=-3.4!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 134:sc= 1.27 (180deg=0.85) USER MOD Single : A 53 THR OG1 : rot 78:sc= 0.617 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= 0.485 K(o=0.49,f=-6.4!) USER MOD Single : A 74 MET CE :methyl 170:sc= -0.419 (180deg=-0.843) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -142:sc= 0.173 (180deg=-1.27!) USER MOD Single : A 84 LYS NZ :NH3+ 151:sc= -0.541 (180deg=-1.56) USER MOD Single : A 89 ASN : amide:sc= -0.183 K(o=-0.18,f=-1.3!) USER MOD Single : A 90 LYS NZ :NH3+ -171:sc= 1.12 (180deg=0.959) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0449 USER MOD Single : A 96 LYS NZ :NH3+ 152:sc= 1.08 (180deg=0.379) USER MOD Single : A 99 LYS NZ :NH3+ 173:sc= 0.867 (180deg=0.757) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 70:sc= 0.635 USER MOD Single : A 108 THR OG1 : rot 35:sc= 1.12 USER MOD Single : A 111 ASN : amide:sc= -0.903 K(o=-0.9,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -1.32 USER MOD Single : A 113 MET CE :methyl -175:sc= -0.311 (180deg=-0.338) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot -44:sc= 0.666 USER MOD Single : A 121 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0272) USER MOD Single : A 124 SER OG : rot 180:sc= -0.36 USER MOD Single : A 125 LYS NZ :NH3+ -177:sc= 1.22 (180deg=1.06) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.473 -13.944 0.512 1.00 0.00 N ATOM 2 CA MET A 1 9.972 -12.594 0.859 1.00 0.00 C ATOM 3 C MET A 1 9.307 -12.580 2.235 1.00 0.00 C ATOM 4 O MET A 1 8.533 -11.674 2.555 1.00 0.00 O ATOM 5 CB MET A 1 8.990 -12.076 -0.205 1.00 0.00 C ATOM 6 CG MET A 1 7.798 -12.985 -0.460 1.00 0.00 C ATOM 7 SD MET A 1 8.227 -14.460 -1.407 1.00 0.00 S ATOM 8 CE MET A 1 8.835 -13.721 -2.925 1.00 0.00 C ATOM 0 H1 MET A 1 11.077 -13.884 -0.333 1.00 0.00 H new ATOM 0 H2 MET A 1 11.026 -14.324 1.307 1.00 0.00 H new ATOM 0 H3 MET A 1 9.668 -14.574 0.318 1.00 0.00 H new ATOM 0 HA MET A 1 10.836 -11.930 0.889 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.624 -11.096 0.103 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.530 -11.935 -1.141 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.366 -13.286 0.495 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.030 -12.427 -0.995 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.487 -14.304 -3.778 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.463 -12.700 -3.007 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.925 -13.710 -2.913 1.00 0.00 H new ATOM 20 N ASN A 2 9.595 -13.589 3.049 1.00 0.00 N ATOM 21 CA ASN A 2 9.148 -13.594 4.435 1.00 0.00 C ATOM 22 C ASN A 2 10.199 -12.894 5.298 1.00 0.00 C ATOM 23 O ASN A 2 11.334 -13.350 5.406 1.00 0.00 O ATOM 24 CB ASN A 2 8.888 -15.028 4.932 1.00 0.00 C ATOM 25 CG ASN A 2 10.124 -15.916 4.932 1.00 0.00 C ATOM 26 OD1 ASN A 2 10.461 -16.530 3.920 1.00 0.00 O ATOM 27 ND2 ASN A 2 10.789 -16.006 6.073 1.00 0.00 N ATOM 0 H ASN A 2 10.134 -14.410 2.774 1.00 0.00 H new ATOM 0 HA ASN A 2 8.203 -13.056 4.509 1.00 0.00 H new ATOM 0 HB2 ASN A 2 8.485 -14.984 5.944 1.00 0.00 H new ATOM 0 HB3 ASN A 2 8.124 -15.486 4.304 1.00 0.00 H new ATOM 0 HD21 ASN A 2 11.615 -16.601 6.136 1.00 0.00 H new ATOM 0 HD22 ASN A 2 10.476 -15.480 6.889 1.00 0.00 H new ATOM 34 N PHE A 3 9.845 -11.749 5.856 1.00 0.00 N ATOM 35 CA PHE A 3 10.776 -10.995 6.689 1.00 0.00 C ATOM 36 C PHE A 3 10.100 -10.526 7.968 1.00 0.00 C ATOM 37 O PHE A 3 10.681 -10.652 9.046 1.00 0.00 O ATOM 38 CB PHE A 3 11.354 -9.804 5.920 1.00 0.00 C ATOM 39 CG PHE A 3 12.428 -10.181 4.934 1.00 0.00 C ATOM 40 CD1 PHE A 3 12.104 -10.591 3.651 1.00 0.00 C ATOM 41 CD2 PHE A 3 13.765 -10.126 5.296 1.00 0.00 C ATOM 42 CE1 PHE A 3 13.091 -10.939 2.747 1.00 0.00 C ATOM 43 CE2 PHE A 3 14.757 -10.473 4.397 1.00 0.00 C ATOM 44 CZ PHE A 3 14.419 -10.878 3.122 1.00 0.00 C ATOM 0 H PHE A 3 8.926 -11.320 5.750 1.00 0.00 H new ATOM 0 HA PHE A 3 11.597 -11.659 6.959 1.00 0.00 H new ATOM 0 HB2 PHE A 3 10.547 -9.300 5.389 1.00 0.00 H new ATOM 0 HB3 PHE A 3 11.763 -9.087 6.632 1.00 0.00 H new ATOM 0 HD1 PHE A 3 11.067 -10.639 3.353 1.00 0.00 H new ATOM 0 HD2 PHE A 3 14.035 -9.808 6.292 1.00 0.00 H new ATOM 0 HE1 PHE A 3 12.824 -11.258 1.750 1.00 0.00 H new ATOM 0 HE2 PHE A 3 15.795 -10.427 4.693 1.00 0.00 H new ATOM 0 HZ PHE A 3 15.192 -11.147 2.418 1.00 0.00 H new ATOM 54 N SER A 4 8.884 -9.989 7.832 1.00 0.00 N ATOM 55 CA SER A 4 8.034 -9.599 8.960 1.00 0.00 C ATOM 56 C SER A 4 8.698 -8.558 9.878 1.00 0.00 C ATOM 57 O SER A 4 9.670 -8.836 10.583 1.00 0.00 O ATOM 58 CB SER A 4 7.584 -10.839 9.752 1.00 0.00 C ATOM 59 OG SER A 4 8.656 -11.458 10.443 1.00 0.00 O ATOM 0 H SER A 4 8.457 -9.811 6.923 1.00 0.00 H new ATOM 0 HA SER A 4 7.152 -9.114 8.541 1.00 0.00 H new ATOM 0 HB2 SER A 4 6.813 -10.550 10.467 1.00 0.00 H new ATOM 0 HB3 SER A 4 7.132 -11.558 9.069 1.00 0.00 H new ATOM 0 HG SER A 4 9.486 -10.969 10.265 1.00 0.00 H new ATOM 65 N GLY A 5 8.137 -7.361 9.874 1.00 0.00 N ATOM 66 CA GLY A 5 8.676 -6.269 10.648 1.00 0.00 C ATOM 67 C GLY A 5 8.045 -4.962 10.234 1.00 0.00 C ATOM 68 O GLY A 5 7.042 -4.961 9.524 1.00 0.00 O ATOM 0 H GLY A 5 7.302 -7.125 9.337 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.498 -6.445 11.709 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.756 -6.217 10.511 1.00 0.00 H new ATOM 72 N LYS A 6 8.615 -3.854 10.661 1.00 0.00 N ATOM 73 CA LYS A 6 8.084 -2.553 10.304 1.00 0.00 C ATOM 74 C LYS A 6 8.822 -2.018 9.070 1.00 0.00 C ATOM 75 O LYS A 6 10.042 -2.155 8.957 1.00 0.00 O ATOM 76 CB LYS A 6 8.249 -1.583 11.479 1.00 0.00 C ATOM 77 CG LYS A 6 7.374 -0.347 11.415 1.00 0.00 C ATOM 78 CD LYS A 6 5.914 -0.676 11.604 1.00 0.00 C ATOM 79 CE LYS A 6 5.395 -0.130 12.902 1.00 0.00 C ATOM 80 NZ LYS A 6 5.835 -0.928 14.079 1.00 0.00 N ATOM 0 H LYS A 6 9.444 -3.827 11.254 1.00 0.00 H new ATOM 0 HA LYS A 6 7.023 -2.647 10.072 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.032 -2.116 12.404 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.292 -1.270 11.529 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.688 0.360 12.183 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.513 0.146 10.453 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.336 -0.264 10.777 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.777 -1.757 11.581 1.00 0.00 H new ATOM 0 HE2 LYS A 6 5.733 0.899 13.019 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.306 -0.106 12.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 5.407 -0.537 14.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 5.534 -1.916 13.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.871 -0.888 14.157 1.00 0.00 H new ATOM 94 N TYR A 7 8.078 -1.420 8.153 1.00 0.00 N ATOM 95 CA TYR A 7 8.630 -0.837 6.937 1.00 0.00 C ATOM 96 C TYR A 7 8.083 0.573 6.742 1.00 0.00 C ATOM 97 O TYR A 7 6.890 0.761 6.528 1.00 0.00 O ATOM 98 CB TYR A 7 8.261 -1.681 5.716 1.00 0.00 C ATOM 99 CG TYR A 7 8.711 -3.117 5.801 1.00 0.00 C ATOM 100 CD1 TYR A 7 8.034 -4.019 6.602 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.797 -3.571 5.073 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.424 -5.338 6.682 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.195 -4.888 5.146 1.00 0.00 C ATOM 104 CZ TYR A 7 9.505 -5.768 5.952 1.00 0.00 C ATOM 105 OH TYR A 7 9.897 -7.084 6.028 1.00 0.00 O ATOM 0 H TYR A 7 7.066 -1.324 8.231 1.00 0.00 H new ATOM 0 HA TYR A 7 9.715 -0.807 7.039 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.179 -1.658 5.585 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.699 -1.226 4.828 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.183 -3.683 7.176 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.339 -2.884 4.440 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.884 -6.028 7.313 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.045 -5.230 4.574 1.00 0.00 H new ATOM 0 HH TYR A 7 10.798 -7.179 5.654 1.00 0.00 H new ATOM 115 N GLN A 8 8.949 1.561 6.803 1.00 0.00 N ATOM 116 CA GLN A 8 8.527 2.936 6.634 1.00 0.00 C ATOM 117 C GLN A 8 8.831 3.376 5.204 1.00 0.00 C ATOM 118 O GLN A 8 9.935 3.162 4.705 1.00 0.00 O ATOM 119 CB GLN A 8 9.212 3.825 7.685 1.00 0.00 C ATOM 120 CG GLN A 8 10.341 4.696 7.165 1.00 0.00 C ATOM 121 CD GLN A 8 10.879 5.638 8.224 1.00 0.00 C ATOM 122 OE1 GLN A 8 10.141 6.097 9.097 1.00 0.00 O ATOM 123 NE2 GLN A 8 12.169 5.925 8.161 1.00 0.00 N ATOM 0 H GLN A 8 9.948 1.439 6.968 1.00 0.00 H new ATOM 0 HA GLN A 8 7.453 3.031 6.791 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.458 4.469 8.138 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.604 3.186 8.477 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.149 4.061 6.803 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.986 5.276 6.313 1.00 0.00 H new ATOM 0 HE21 GLN A 8 12.745 5.523 7.421 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.587 6.548 8.852 1.00 0.00 H new ATOM 132 N VAL A 9 7.835 3.936 4.532 1.00 0.00 N ATOM 133 CA VAL A 9 7.967 4.291 3.124 1.00 0.00 C ATOM 134 C VAL A 9 9.059 5.334 2.927 1.00 0.00 C ATOM 135 O VAL A 9 9.185 6.268 3.719 1.00 0.00 O ATOM 136 CB VAL A 9 6.644 4.826 2.545 1.00 0.00 C ATOM 137 CG1 VAL A 9 6.748 5.005 1.038 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.491 3.909 2.902 1.00 0.00 C ATOM 0 H VAL A 9 6.925 4.155 4.939 1.00 0.00 H new ATOM 0 HA VAL A 9 8.236 3.379 2.592 1.00 0.00 H new ATOM 0 HB VAL A 9 6.449 5.802 2.989 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.802 5.384 0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.544 5.714 0.810 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.973 4.045 0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.567 4.307 2.483 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.677 2.915 2.494 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.399 3.845 3.986 1.00 0.00 H new ATOM 148 N GLN A 10 9.852 5.162 1.881 1.00 0.00 N ATOM 149 CA GLN A 10 10.903 6.108 1.572 1.00 0.00 C ATOM 150 C GLN A 10 10.652 6.790 0.248 1.00 0.00 C ATOM 151 O GLN A 10 10.478 7.997 0.187 1.00 0.00 O ATOM 152 CB GLN A 10 12.282 5.450 1.585 1.00 0.00 C ATOM 153 CG GLN A 10 12.355 4.116 0.911 1.00 0.00 C ATOM 154 CD GLN A 10 13.674 3.888 0.193 1.00 0.00 C ATOM 155 OE1 GLN A 10 13.730 3.188 -0.817 1.00 0.00 O ATOM 156 NE2 GLN A 10 14.747 4.464 0.717 1.00 0.00 N ATOM 0 H GLN A 10 9.785 4.376 1.235 1.00 0.00 H new ATOM 0 HA GLN A 10 10.891 6.865 2.356 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.993 6.122 1.104 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.603 5.335 2.620 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.211 3.331 1.653 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.538 4.031 0.195 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.660 5.038 1.556 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.660 4.334 0.281 1.00 0.00 H new ATOM 165 N SER A 11 10.621 6.017 -0.805 1.00 0.00 N ATOM 166 CA SER A 11 10.361 6.558 -2.113 1.00 0.00 C ATOM 167 C SER A 11 8.900 6.382 -2.442 1.00 0.00 C ATOM 168 O SER A 11 8.229 5.533 -1.872 1.00 0.00 O ATOM 169 CB SER A 11 11.205 5.868 -3.159 1.00 0.00 C ATOM 170 OG SER A 11 12.564 5.780 -2.758 1.00 0.00 O ATOM 0 H SER A 11 10.773 5.009 -0.783 1.00 0.00 H new ATOM 0 HA SER A 11 10.617 7.617 -2.111 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.813 4.867 -3.342 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.137 6.414 -4.100 1.00 0.00 H new ATOM 0 HG SER A 11 13.082 5.327 -3.456 1.00 0.00 H new ATOM 176 N GLN A 12 8.403 7.224 -3.306 1.00 0.00 N ATOM 177 CA GLN A 12 7.069 7.065 -3.860 1.00 0.00 C ATOM 178 C GLN A 12 7.051 7.686 -5.247 1.00 0.00 C ATOM 179 O GLN A 12 7.863 8.560 -5.544 1.00 0.00 O ATOM 180 CB GLN A 12 5.964 7.713 -2.998 1.00 0.00 C ATOM 181 CG GLN A 12 6.207 7.732 -1.493 1.00 0.00 C ATOM 182 CD GLN A 12 6.919 9.001 -1.063 1.00 0.00 C ATOM 183 OE1 GLN A 12 8.144 9.070 -1.042 1.00 0.00 O ATOM 184 NE2 GLN A 12 6.147 10.021 -0.720 1.00 0.00 N ATOM 0 H GLN A 12 8.904 8.042 -3.651 1.00 0.00 H new ATOM 0 HA GLN A 12 6.852 5.997 -3.891 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.825 8.740 -3.335 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.029 7.186 -3.187 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.255 7.652 -0.968 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.802 6.865 -1.208 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.132 9.925 -0.750 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.567 10.902 -0.426 1.00 0.00 H new ATOM 193 N GLU A 13 6.133 7.243 -6.085 1.00 0.00 N ATOM 194 CA GLU A 13 6.007 7.784 -7.427 1.00 0.00 C ATOM 195 C GLU A 13 4.578 8.144 -7.740 1.00 0.00 C ATOM 196 O GLU A 13 3.640 7.559 -7.197 1.00 0.00 O ATOM 197 CB GLU A 13 6.473 6.811 -8.487 1.00 0.00 C ATOM 198 CG GLU A 13 7.959 6.552 -8.473 1.00 0.00 C ATOM 199 CD GLU A 13 8.759 7.714 -9.014 1.00 0.00 C ATOM 200 OE1 GLU A 13 8.853 7.842 -10.252 1.00 0.00 O ATOM 201 OE2 GLU A 13 9.303 8.499 -8.211 1.00 0.00 O ATOM 0 H GLU A 13 5.462 6.508 -5.860 1.00 0.00 H new ATOM 0 HA GLU A 13 6.640 8.672 -7.445 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.949 5.865 -8.353 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.191 7.195 -9.467 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.277 6.341 -7.452 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.174 5.662 -9.064 1.00 0.00 H new ATOM 208 N ASN A 14 4.448 9.115 -8.626 1.00 0.00 N ATOM 209 CA ASN A 14 3.175 9.538 -9.171 1.00 0.00 C ATOM 210 C ASN A 14 2.151 9.784 -8.069 1.00 0.00 C ATOM 211 O ASN A 14 0.982 9.426 -8.196 1.00 0.00 O ATOM 212 CB ASN A 14 2.626 8.540 -10.199 1.00 0.00 C ATOM 213 CG ASN A 14 3.541 8.342 -11.392 1.00 0.00 C ATOM 214 OD1 ASN A 14 4.442 7.501 -11.373 1.00 0.00 O ATOM 215 ND2 ASN A 14 3.306 9.106 -12.449 1.00 0.00 N ATOM 0 H ASN A 14 5.241 9.641 -8.993 1.00 0.00 H new ATOM 0 HA ASN A 14 3.356 10.480 -9.689 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.464 7.579 -9.711 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.654 8.888 -10.549 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.881 9.009 -13.286 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.550 9.791 -12.425 1.00 0.00 H new ATOM 222 N PHE A 15 2.601 10.395 -6.987 1.00 0.00 N ATOM 223 CA PHE A 15 1.705 10.780 -5.910 1.00 0.00 C ATOM 224 C PHE A 15 0.800 11.899 -6.391 1.00 0.00 C ATOM 225 O PHE A 15 -0.379 11.971 -6.040 1.00 0.00 O ATOM 226 CB PHE A 15 2.524 11.236 -4.697 1.00 0.00 C ATOM 227 CG PHE A 15 1.704 11.824 -3.576 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.352 13.166 -3.579 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.287 11.032 -2.521 1.00 0.00 C ATOM 230 CE1 PHE A 15 0.602 13.702 -2.551 1.00 0.00 C ATOM 231 CE2 PHE A 15 0.538 11.562 -1.489 1.00 0.00 C ATOM 232 CZ PHE A 15 0.193 12.899 -1.505 1.00 0.00 C ATOM 0 H PHE A 15 3.580 10.635 -6.831 1.00 0.00 H new ATOM 0 HA PHE A 15 1.092 9.929 -5.615 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.085 10.384 -4.312 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.253 11.977 -5.024 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.668 13.799 -4.395 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.551 9.985 -2.504 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.336 14.749 -2.565 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.223 10.932 -0.671 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.396 13.316 -0.701 1.00 0.00 H new ATOM 242 N GLU A 16 1.373 12.754 -7.220 1.00 0.00 N ATOM 243 CA GLU A 16 0.692 13.928 -7.730 1.00 0.00 C ATOM 244 C GLU A 16 -0.537 13.547 -8.526 1.00 0.00 C ATOM 245 O GLU A 16 -1.617 13.964 -8.191 1.00 0.00 O ATOM 246 CB GLU A 16 1.642 14.757 -8.590 1.00 0.00 C ATOM 247 CG GLU A 16 3.095 14.412 -8.350 1.00 0.00 C ATOM 248 CD GLU A 16 4.059 15.470 -8.845 1.00 0.00 C ATOM 249 OE1 GLU A 16 4.036 15.779 -10.051 1.00 0.00 O ATOM 250 OE2 GLU A 16 4.851 15.991 -8.030 1.00 0.00 O ATOM 0 H GLU A 16 2.329 12.651 -7.559 1.00 0.00 H new ATOM 0 HA GLU A 16 0.369 14.526 -6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.404 14.600 -9.642 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.485 15.815 -8.382 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.252 14.260 -7.282 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.322 13.467 -8.843 1.00 0.00 H new ATOM 257 N PRO A 17 -0.404 12.732 -9.571 1.00 0.00 N ATOM 258 CA PRO A 17 -1.536 12.383 -10.427 1.00 0.00 C ATOM 259 C PRO A 17 -2.681 11.806 -9.635 1.00 0.00 C ATOM 260 O PRO A 17 -3.847 12.125 -9.869 1.00 0.00 O ATOM 261 CB PRO A 17 -1.000 11.313 -11.358 1.00 0.00 C ATOM 262 CG PRO A 17 0.331 10.927 -10.812 1.00 0.00 C ATOM 263 CD PRO A 17 0.826 12.067 -9.979 1.00 0.00 C ATOM 0 HA PRO A 17 -1.918 13.264 -10.943 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.671 10.455 -11.394 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.910 11.691 -12.377 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.250 10.021 -10.212 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.029 10.712 -11.621 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.401 11.720 -9.121 1.00 0.00 H new ATOM 0 HD3 PRO A 17 1.474 12.732 -10.549 1.00 0.00 H new ATOM 271 N PHE A 18 -2.331 10.963 -8.683 1.00 0.00 N ATOM 272 CA PHE A 18 -3.333 10.316 -7.862 1.00 0.00 C ATOM 273 C PHE A 18 -4.068 11.336 -6.999 1.00 0.00 C ATOM 274 O PHE A 18 -5.294 11.394 -7.016 1.00 0.00 O ATOM 275 CB PHE A 18 -2.699 9.246 -6.971 1.00 0.00 C ATOM 276 CG PHE A 18 -3.723 8.332 -6.376 1.00 0.00 C ATOM 277 CD1 PHE A 18 -4.576 7.631 -7.206 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.857 8.194 -5.007 1.00 0.00 C ATOM 279 CE1 PHE A 18 -5.545 6.806 -6.691 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.830 7.366 -4.477 1.00 0.00 C ATOM 281 CZ PHE A 18 -5.677 6.670 -5.322 1.00 0.00 C ATOM 0 H PHE A 18 -1.368 10.712 -8.461 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.050 9.838 -8.529 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.988 8.662 -7.556 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -2.135 9.727 -6.172 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.479 7.733 -8.277 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -3.197 8.737 -4.346 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.203 6.264 -7.354 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.929 7.263 -3.406 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.439 6.023 -4.913 1.00 0.00 H new ATOM 291 N MET A 19 -3.322 12.158 -6.273 1.00 0.00 N ATOM 292 CA MET A 19 -3.922 13.206 -5.451 1.00 0.00 C ATOM 293 C MET A 19 -4.517 14.308 -6.308 1.00 0.00 C ATOM 294 O MET A 19 -5.508 14.915 -5.932 1.00 0.00 O ATOM 295 CB MET A 19 -2.901 13.778 -4.473 1.00 0.00 C ATOM 296 CG MET A 19 -2.940 13.114 -3.105 1.00 0.00 C ATOM 297 SD MET A 19 -2.723 11.323 -3.184 1.00 0.00 S ATOM 298 CE MET A 19 -2.992 10.872 -1.471 1.00 0.00 C ATOM 0 H MET A 19 -2.303 12.122 -6.235 1.00 0.00 H new ATOM 0 HA MET A 19 -4.732 12.754 -4.879 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.902 13.666 -4.895 1.00 0.00 H new ATOM 0 HB3 MET A 19 -3.080 14.847 -4.356 1.00 0.00 H new ATOM 0 HG2 MET A 19 -2.158 13.542 -2.477 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.893 13.338 -2.625 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.804 9.806 -1.342 1.00 0.00 H new ATOM 0 HE2 MET A 19 -2.314 11.440 -0.834 1.00 0.00 H new ATOM 0 HE3 MET A 19 -4.022 11.095 -1.193 1.00 0.00 H new ATOM 308 N LYS A 20 -3.920 14.563 -7.460 1.00 0.00 N ATOM 309 CA LYS A 20 -4.423 15.572 -8.375 1.00 0.00 C ATOM 310 C LYS A 20 -5.826 15.210 -8.785 1.00 0.00 C ATOM 311 O LYS A 20 -6.751 16.011 -8.643 1.00 0.00 O ATOM 312 CB LYS A 20 -3.536 15.659 -9.601 1.00 0.00 C ATOM 313 CG LYS A 20 -2.535 16.779 -9.523 1.00 0.00 C ATOM 314 CD LYS A 20 -1.319 16.461 -10.337 1.00 0.00 C ATOM 315 CE LYS A 20 -0.404 17.645 -10.408 1.00 0.00 C ATOM 316 NZ LYS A 20 -0.946 18.725 -11.270 1.00 0.00 N ATOM 0 H LYS A 20 -3.081 14.082 -7.785 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.423 16.542 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.007 14.714 -9.728 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -4.159 15.797 -10.485 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.988 17.703 -9.882 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.250 16.947 -8.484 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.792 15.614 -9.897 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.616 16.164 -11.343 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.238 18.034 -9.403 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.566 17.329 -10.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.189 19.402 -11.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.316 18.314 -12.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.713 19.217 -10.769 1.00 0.00 H new ATOM 330 N ALA A 21 -5.983 13.945 -9.175 1.00 0.00 N ATOM 331 CA ALA A 21 -7.273 13.404 -9.559 1.00 0.00 C ATOM 332 C ALA A 21 -8.163 13.247 -8.340 1.00 0.00 C ATOM 333 O ALA A 21 -9.383 13.114 -8.437 1.00 0.00 O ATOM 334 CB ALA A 21 -7.101 12.082 -10.269 1.00 0.00 C ATOM 0 H ALA A 21 -5.217 13.273 -9.231 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.752 14.101 -10.247 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.078 11.690 -10.550 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.497 12.226 -11.165 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.604 11.375 -9.605 1.00 0.00 H new ATOM 340 N MET A 22 -7.514 13.255 -7.194 1.00 0.00 N ATOM 341 CA MET A 22 -8.183 13.219 -5.901 1.00 0.00 C ATOM 342 C MET A 22 -8.683 14.610 -5.535 1.00 0.00 C ATOM 343 O MET A 22 -9.395 14.795 -4.546 1.00 0.00 O ATOM 344 CB MET A 22 -7.213 12.683 -4.846 1.00 0.00 C ATOM 345 CG MET A 22 -7.309 11.183 -4.662 1.00 0.00 C ATOM 346 SD MET A 22 -8.913 10.656 -4.026 1.00 0.00 S ATOM 347 CE MET A 22 -8.949 11.496 -2.443 1.00 0.00 C ATOM 0 H MET A 22 -6.497 13.287 -7.129 1.00 0.00 H new ATOM 0 HA MET A 22 -9.046 12.555 -5.948 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.194 12.944 -5.131 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.413 13.174 -3.894 1.00 0.00 H new ATOM 0 HG2 MET A 22 -7.123 10.692 -5.617 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.527 10.855 -3.978 1.00 0.00 H new ATOM 0 HE1 MET A 22 -9.398 10.843 -1.695 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.932 11.748 -2.142 1.00 0.00 H new ATOM 0 HE3 MET A 22 -9.539 12.408 -2.529 1.00 0.00 H new ATOM 357 N GLY A 23 -8.288 15.578 -6.347 1.00 0.00 N ATOM 358 CA GLY A 23 -8.757 16.943 -6.200 1.00 0.00 C ATOM 359 C GLY A 23 -7.710 17.845 -5.586 1.00 0.00 C ATOM 360 O GLY A 23 -7.994 18.983 -5.218 1.00 0.00 O ATOM 0 H GLY A 23 -7.638 15.439 -7.121 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.043 17.334 -7.176 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.652 16.953 -5.578 1.00 0.00 H new ATOM 364 N LEU A 24 -6.494 17.337 -5.482 1.00 0.00 N ATOM 365 CA LEU A 24 -5.432 18.052 -4.786 1.00 0.00 C ATOM 366 C LEU A 24 -4.674 18.961 -5.737 1.00 0.00 C ATOM 367 O LEU A 24 -4.257 18.555 -6.821 1.00 0.00 O ATOM 368 CB LEU A 24 -4.477 17.073 -4.098 1.00 0.00 C ATOM 369 CG LEU A 24 -3.703 17.650 -2.923 1.00 0.00 C ATOM 370 CD1 LEU A 24 -4.660 18.011 -1.804 1.00 0.00 C ATOM 371 CD2 LEU A 24 -2.648 16.676 -2.420 1.00 0.00 C ATOM 0 H LEU A 24 -6.216 16.435 -5.869 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.894 18.674 -4.019 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.050 16.214 -3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.765 16.703 -4.836 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.189 18.549 -3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.100 18.424 -0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.376 18.751 -2.162 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.194 17.118 -1.479 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.114 17.120 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.130 15.753 -2.097 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.944 16.456 -3.222 1.00 0.00 H new ATOM 383 N PRO A 25 -4.510 20.212 -5.319 1.00 0.00 N ATOM 384 CA PRO A 25 -3.747 21.208 -6.054 1.00 0.00 C ATOM 385 C PRO A 25 -2.261 20.898 -6.031 1.00 0.00 C ATOM 386 O PRO A 25 -1.761 20.327 -5.073 1.00 0.00 O ATOM 387 CB PRO A 25 -4.004 22.513 -5.306 1.00 0.00 C ATOM 388 CG PRO A 25 -4.685 22.160 -4.033 1.00 0.00 C ATOM 389 CD PRO A 25 -5.071 20.726 -4.073 1.00 0.00 C ATOM 0 HA PRO A 25 -4.043 21.243 -7.102 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -3.068 23.035 -5.110 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -4.624 23.183 -5.902 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -4.024 22.348 -3.187 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.568 22.784 -3.893 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.675 20.188 -3.212 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -6.155 20.609 -4.052 1.00 0.00 H new ATOM 397 N GLU A 26 -1.570 21.312 -7.089 1.00 0.00 N ATOM 398 CA GLU A 26 -0.156 21.035 -7.288 1.00 0.00 C ATOM 399 C GLU A 26 0.690 21.445 -6.084 1.00 0.00 C ATOM 400 O GLU A 26 1.671 20.782 -5.754 1.00 0.00 O ATOM 401 CB GLU A 26 0.309 21.763 -8.539 1.00 0.00 C ATOM 402 CG GLU A 26 1.782 21.610 -8.828 1.00 0.00 C ATOM 403 CD GLU A 26 2.158 22.135 -10.195 1.00 0.00 C ATOM 404 OE1 GLU A 26 1.714 23.244 -10.559 1.00 0.00 O ATOM 405 OE2 GLU A 26 2.863 21.420 -10.934 1.00 0.00 O ATOM 0 H GLU A 26 -1.986 21.858 -7.843 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.027 19.959 -7.405 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.258 21.394 -9.393 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.078 22.823 -8.437 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.356 22.140 -8.068 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.056 20.557 -8.758 1.00 0.00 H new ATOM 412 N ASP A 27 0.313 22.537 -5.438 1.00 0.00 N ATOM 413 CA ASP A 27 1.013 22.995 -4.244 1.00 0.00 C ATOM 414 C ASP A 27 0.863 21.988 -3.116 1.00 0.00 C ATOM 415 O ASP A 27 1.847 21.571 -2.511 1.00 0.00 O ATOM 416 CB ASP A 27 0.479 24.354 -3.799 1.00 0.00 C ATOM 417 CG ASP A 27 0.988 24.771 -2.432 1.00 0.00 C ATOM 418 OD1 ASP A 27 2.107 25.318 -2.349 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.260 24.569 -1.437 1.00 0.00 O ATOM 0 H ASP A 27 -0.473 23.124 -5.719 1.00 0.00 H new ATOM 0 HA ASP A 27 2.071 23.094 -4.489 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.764 25.108 -4.533 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.610 24.322 -3.781 1.00 0.00 H new ATOM 424 N LEU A 28 -0.367 21.553 -2.878 1.00 0.00 N ATOM 425 CA LEU A 28 -0.634 20.569 -1.840 1.00 0.00 C ATOM 426 C LEU A 28 -0.114 19.211 -2.277 1.00 0.00 C ATOM 427 O LEU A 28 0.297 18.396 -1.460 1.00 0.00 O ATOM 428 CB LEU A 28 -2.123 20.490 -1.537 1.00 0.00 C ATOM 429 CG LEU A 28 -2.657 21.612 -0.665 1.00 0.00 C ATOM 430 CD1 LEU A 28 -4.156 21.485 -0.503 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.971 21.594 0.687 1.00 0.00 C ATOM 0 H LEU A 28 -1.193 21.865 -3.388 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.120 20.876 -0.929 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.671 20.489 -2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.329 19.539 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.444 22.565 -1.149 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.524 22.297 0.125 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.633 21.538 -1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.392 20.529 -0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.362 22.403 1.304 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.160 20.639 1.178 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.898 21.727 0.552 1.00 0.00 H new ATOM 443 N ILE A 29 -0.140 18.998 -3.578 1.00 0.00 N ATOM 444 CA ILE A 29 0.405 17.815 -4.196 1.00 0.00 C ATOM 445 C ILE A 29 1.878 17.660 -3.877 1.00 0.00 C ATOM 446 O ILE A 29 2.303 16.604 -3.433 1.00 0.00 O ATOM 447 CB ILE A 29 0.213 17.943 -5.716 1.00 0.00 C ATOM 448 CG1 ILE A 29 -1.171 17.453 -6.095 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.267 17.201 -6.481 1.00 0.00 C ATOM 450 CD1 ILE A 29 -1.307 15.960 -6.091 1.00 0.00 C ATOM 0 H ILE A 29 -0.548 19.656 -4.242 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.110 16.935 -3.812 1.00 0.00 H new ATOM 0 HB ILE A 29 0.312 18.995 -5.983 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.898 17.876 -5.402 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.420 17.828 -7.088 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.092 17.319 -7.550 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.249 17.600 -6.228 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.228 16.143 -6.222 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.324 15.687 -6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.605 15.529 -6.805 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.091 15.578 -5.093 1.00 0.00 H new ATOM 462 N GLN A 30 2.642 18.721 -4.067 1.00 0.00 N ATOM 463 CA GLN A 30 4.065 18.693 -3.780 1.00 0.00 C ATOM 464 C GLN A 30 4.334 18.602 -2.280 1.00 0.00 C ATOM 465 O GLN A 30 5.316 18.001 -1.851 1.00 0.00 O ATOM 466 CB GLN A 30 4.751 19.930 -4.363 1.00 0.00 C ATOM 467 CG GLN A 30 5.044 19.830 -5.845 1.00 0.00 C ATOM 468 CD GLN A 30 5.930 20.960 -6.332 1.00 0.00 C ATOM 469 OE1 GLN A 30 6.726 21.512 -5.569 1.00 0.00 O ATOM 470 NE2 GLN A 30 5.824 21.297 -7.607 1.00 0.00 N ATOM 0 H GLN A 30 2.300 19.615 -4.420 1.00 0.00 H new ATOM 0 HA GLN A 30 4.478 17.800 -4.249 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.119 20.801 -4.186 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.686 20.100 -3.829 1.00 0.00 H new ATOM 0 HG2 GLN A 30 5.527 18.876 -6.054 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.106 19.841 -6.400 1.00 0.00 H new ATOM 0 HE21 GLN A 30 5.153 20.817 -8.207 1.00 0.00 H new ATOM 0 HE22 GLN A 30 6.413 22.037 -7.990 1.00 0.00 H new ATOM 479 N LYS A 31 3.453 19.192 -1.488 1.00 0.00 N ATOM 480 CA LYS A 31 3.622 19.223 -0.042 1.00 0.00 C ATOM 481 C LYS A 31 3.278 17.881 0.552 1.00 0.00 C ATOM 482 O LYS A 31 3.969 17.372 1.432 1.00 0.00 O ATOM 483 CB LYS A 31 2.763 20.316 0.568 1.00 0.00 C ATOM 484 CG LYS A 31 3.392 21.670 0.382 1.00 0.00 C ATOM 485 CD LYS A 31 2.372 22.754 0.186 1.00 0.00 C ATOM 486 CE LYS A 31 1.418 22.841 1.351 1.00 0.00 C ATOM 487 NZ LYS A 31 0.489 23.993 1.214 1.00 0.00 N ATOM 0 H LYS A 31 2.610 19.658 -1.823 1.00 0.00 H new ATOM 0 HA LYS A 31 4.665 19.443 0.184 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.775 20.305 0.108 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.622 20.121 1.631 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.005 21.905 1.252 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.059 21.642 -0.480 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.878 23.711 0.058 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.812 22.565 -0.730 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.844 21.917 1.422 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.983 22.937 2.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.401 23.782 1.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.924 24.841 1.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.294 24.164 0.207 1.00 0.00 H new ATOM 501 N GLY A 32 2.207 17.315 0.037 1.00 0.00 N ATOM 502 CA GLY A 32 1.804 15.981 0.411 1.00 0.00 C ATOM 503 C GLY A 32 2.713 14.936 -0.197 1.00 0.00 C ATOM 504 O GLY A 32 2.777 13.804 0.279 1.00 0.00 O ATOM 0 H GLY A 32 1.598 17.764 -0.647 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.816 15.887 1.497 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.778 15.805 0.087 1.00 0.00 H new ATOM 508 N LYS A 33 3.431 15.327 -1.246 1.00 0.00 N ATOM 509 CA LYS A 33 4.295 14.426 -1.980 1.00 0.00 C ATOM 510 C LYS A 33 5.467 13.938 -1.117 1.00 0.00 C ATOM 511 O LYS A 33 6.146 12.967 -1.456 1.00 0.00 O ATOM 512 CB LYS A 33 4.748 15.151 -3.252 1.00 0.00 C ATOM 513 CG LYS A 33 6.201 15.043 -3.588 1.00 0.00 C ATOM 514 CD LYS A 33 6.379 15.084 -5.092 1.00 0.00 C ATOM 515 CE LYS A 33 7.237 16.251 -5.547 1.00 0.00 C ATOM 516 NZ LYS A 33 7.363 16.287 -7.027 1.00 0.00 N ATOM 0 H LYS A 33 3.426 16.281 -1.607 1.00 0.00 H new ATOM 0 HA LYS A 33 3.756 13.520 -2.259 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.172 14.763 -4.092 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.496 16.207 -3.153 1.00 0.00 H new ATOM 0 HG2 LYS A 33 6.754 15.860 -3.124 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.609 14.115 -3.188 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.834 14.151 -5.426 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.401 15.150 -5.568 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.800 17.185 -5.195 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.227 16.173 -5.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 7.808 17.182 -7.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.950 15.490 -7.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.419 16.215 -7.458 1.00 0.00 H new ATOM 530 N ASP A 34 5.668 14.589 0.023 1.00 0.00 N ATOM 531 CA ASP A 34 6.773 14.252 0.915 1.00 0.00 C ATOM 532 C ASP A 34 6.303 13.241 1.955 1.00 0.00 C ATOM 533 O ASP A 34 7.097 12.631 2.669 1.00 0.00 O ATOM 534 CB ASP A 34 7.291 15.521 1.607 1.00 0.00 C ATOM 535 CG ASP A 34 8.526 15.276 2.450 1.00 0.00 C ATOM 536 OD1 ASP A 34 9.650 15.390 1.912 1.00 0.00 O ATOM 537 OD2 ASP A 34 8.384 14.983 3.657 1.00 0.00 O ATOM 0 H ASP A 34 5.080 15.354 0.352 1.00 0.00 H new ATOM 0 HA ASP A 34 7.584 13.813 0.334 1.00 0.00 H new ATOM 0 HB2 ASP A 34 7.518 16.273 0.851 1.00 0.00 H new ATOM 0 HB3 ASP A 34 6.503 15.931 2.238 1.00 0.00 H new ATOM 542 N ILE A 35 4.996 13.069 2.022 1.00 0.00 N ATOM 543 CA ILE A 35 4.375 12.214 2.999 1.00 0.00 C ATOM 544 C ILE A 35 4.425 10.746 2.608 1.00 0.00 C ATOM 545 O ILE A 35 4.196 10.377 1.453 1.00 0.00 O ATOM 546 CB ILE A 35 2.912 12.651 3.227 1.00 0.00 C ATOM 547 CG1 ILE A 35 2.865 13.900 4.100 1.00 0.00 C ATOM 548 CG2 ILE A 35 2.085 11.543 3.828 1.00 0.00 C ATOM 549 CD1 ILE A 35 3.300 15.156 3.406 1.00 0.00 C ATOM 0 H ILE A 35 4.336 13.525 1.392 1.00 0.00 H new ATOM 0 HA ILE A 35 4.942 12.318 3.924 1.00 0.00 H new ATOM 0 HB ILE A 35 2.477 12.886 2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.847 14.035 4.466 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.499 13.743 4.973 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.062 11.890 3.973 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.085 10.684 3.157 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.509 11.253 4.789 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.236 15.995 4.099 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.329 15.045 3.064 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.652 15.342 2.550 1.00 0.00 H new ATOM 561 N LYS A 36 4.716 9.921 3.598 1.00 0.00 N ATOM 562 CA LYS A 36 4.769 8.484 3.425 1.00 0.00 C ATOM 563 C LYS A 36 3.995 7.804 4.532 1.00 0.00 C ATOM 564 O LYS A 36 2.820 7.465 4.377 1.00 0.00 O ATOM 565 CB LYS A 36 6.217 7.997 3.424 1.00 0.00 C ATOM 566 CG LYS A 36 7.040 8.579 2.296 1.00 0.00 C ATOM 567 CD LYS A 36 8.220 9.371 2.821 1.00 0.00 C ATOM 568 CE LYS A 36 8.769 10.285 1.746 1.00 0.00 C ATOM 569 NZ LYS A 36 10.008 10.988 2.171 1.00 0.00 N ATOM 0 H LYS A 36 4.923 10.232 4.547 1.00 0.00 H new ATOM 0 HA LYS A 36 4.318 8.232 2.465 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.681 8.256 4.375 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.228 6.910 3.350 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.397 7.775 1.653 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.412 9.224 1.681 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.914 9.960 3.685 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.000 8.690 3.160 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.976 9.701 0.849 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.011 11.022 1.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.342 11.600 1.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.807 11.568 3.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.743 10.289 2.401 1.00 0.00 H new ATOM 583 N GLY A 37 4.655 7.641 5.650 1.00 0.00 N ATOM 584 CA GLY A 37 4.051 6.988 6.787 1.00 0.00 C ATOM 585 C GLY A 37 4.748 5.688 7.117 1.00 0.00 C ATOM 586 O GLY A 37 5.563 5.197 6.330 1.00 0.00 O ATOM 0 H GLY A 37 5.615 7.952 5.799 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.089 7.651 7.651 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.998 6.795 6.580 1.00 0.00 H new ATOM 590 N VAL A 38 4.428 5.120 8.267 1.00 0.00 N ATOM 591 CA VAL A 38 5.073 3.899 8.707 1.00 0.00 C ATOM 592 C VAL A 38 4.143 2.705 8.533 1.00 0.00 C ATOM 593 O VAL A 38 2.981 2.740 8.946 1.00 0.00 O ATOM 594 CB VAL A 38 5.524 4.004 10.173 1.00 0.00 C ATOM 595 CG1 VAL A 38 6.328 2.782 10.578 1.00 0.00 C ATOM 596 CG2 VAL A 38 6.337 5.264 10.348 1.00 0.00 C ATOM 0 H VAL A 38 3.726 5.486 8.911 1.00 0.00 H new ATOM 0 HA VAL A 38 5.957 3.752 8.086 1.00 0.00 H new ATOM 0 HB VAL A 38 4.647 4.048 10.819 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.637 2.878 11.619 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.715 1.888 10.462 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.211 2.701 9.944 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.661 5.347 11.385 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.210 5.227 9.697 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.727 6.129 10.088 1.00 0.00 H new ATOM 606 N SER A 39 4.656 1.666 7.901 1.00 0.00 N ATOM 607 CA SER A 39 3.894 0.457 7.643 1.00 0.00 C ATOM 608 C SER A 39 4.542 -0.717 8.365 1.00 0.00 C ATOM 609 O SER A 39 5.732 -0.701 8.599 1.00 0.00 O ATOM 610 CB SER A 39 3.843 0.190 6.145 1.00 0.00 C ATOM 611 OG SER A 39 3.665 1.399 5.424 1.00 0.00 O ATOM 0 H SER A 39 5.614 1.636 7.551 1.00 0.00 H new ATOM 0 HA SER A 39 2.876 0.583 8.012 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.765 -0.297 5.826 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.026 -0.496 5.921 1.00 0.00 H new ATOM 0 HG SER A 39 3.653 1.208 4.463 1.00 0.00 H new ATOM 617 N GLU A 40 3.764 -1.698 8.774 1.00 0.00 N ATOM 618 CA GLU A 40 4.315 -2.899 9.381 1.00 0.00 C ATOM 619 C GLU A 40 3.807 -4.120 8.636 1.00 0.00 C ATOM 620 O GLU A 40 2.597 -4.301 8.487 1.00 0.00 O ATOM 621 CB GLU A 40 3.933 -2.992 10.854 1.00 0.00 C ATOM 622 CG GLU A 40 4.705 -4.070 11.593 1.00 0.00 C ATOM 623 CD GLU A 40 4.351 -4.134 13.060 1.00 0.00 C ATOM 624 OE1 GLU A 40 3.350 -4.789 13.407 1.00 0.00 O ATOM 625 OE2 GLU A 40 5.072 -3.514 13.875 1.00 0.00 O ATOM 0 H GLU A 40 2.747 -1.690 8.698 1.00 0.00 H new ATOM 0 HA GLU A 40 5.402 -2.854 9.316 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.112 -2.029 11.333 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.865 -3.195 10.936 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.504 -5.037 11.132 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.774 -3.883 11.488 1.00 0.00 H new ATOM 632 N ILE A 41 4.729 -4.942 8.159 1.00 0.00 N ATOM 633 CA ILE A 41 4.370 -6.115 7.377 1.00 0.00 C ATOM 634 C ILE A 41 4.850 -7.366 8.071 1.00 0.00 C ATOM 635 O ILE A 41 6.047 -7.591 8.206 1.00 0.00 O ATOM 636 CB ILE A 41 5.011 -6.095 5.973 1.00 0.00 C ATOM 637 CG1 ILE A 41 4.946 -4.701 5.339 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.358 -7.128 5.068 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.558 -4.117 5.268 1.00 0.00 C ATOM 0 H ILE A 41 5.732 -4.818 8.300 1.00 0.00 H new ATOM 0 HA ILE A 41 3.284 -6.104 7.280 1.00 0.00 H new ATOM 0 HB ILE A 41 6.064 -6.353 6.091 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.583 -4.025 5.909 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.358 -4.753 4.331 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.825 -7.097 4.084 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.485 -8.121 5.499 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.295 -6.908 4.972 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.602 -3.130 4.807 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.919 -4.769 4.672 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.148 -4.029 6.274 1.00 0.00 H new ATOM 651 N VAL A 42 3.918 -8.181 8.491 1.00 0.00 N ATOM 652 CA VAL A 42 4.237 -9.458 9.067 1.00 0.00 C ATOM 653 C VAL A 42 3.439 -10.536 8.338 1.00 0.00 C ATOM 654 O VAL A 42 2.263 -10.363 8.086 1.00 0.00 O ATOM 655 CB VAL A 42 3.934 -9.435 10.577 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.288 -10.713 11.018 1.00 0.00 C ATOM 657 CG2 VAL A 42 5.200 -9.178 11.369 1.00 0.00 C ATOM 0 H VAL A 42 2.920 -7.978 8.443 1.00 0.00 H new ATOM 0 HA VAL A 42 5.298 -9.681 8.952 1.00 0.00 H new ATOM 0 HB VAL A 42 3.234 -8.622 10.767 1.00 0.00 H new ATOM 0 HG11 VAL A 42 3.086 -10.668 12.088 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.352 -10.853 10.477 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.956 -11.549 10.810 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.967 -9.165 12.434 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.923 -9.968 11.165 1.00 0.00 H new ATOM 0 HG23 VAL A 42 5.622 -8.216 11.078 1.00 0.00 H new ATOM 667 N HIS A 43 4.070 -11.633 7.983 1.00 0.00 N ATOM 668 CA HIS A 43 3.433 -12.597 7.085 1.00 0.00 C ATOM 669 C HIS A 43 3.318 -13.994 7.705 1.00 0.00 C ATOM 670 O HIS A 43 4.310 -14.587 8.124 1.00 0.00 O ATOM 671 CB HIS A 43 4.169 -12.611 5.727 1.00 0.00 C ATOM 672 CG HIS A 43 4.204 -13.937 5.028 1.00 0.00 C ATOM 673 ND1 HIS A 43 5.338 -14.713 4.968 1.00 0.00 N ATOM 674 CD2 HIS A 43 3.255 -14.608 4.334 1.00 0.00 C ATOM 675 CE1 HIS A 43 5.092 -15.795 4.262 1.00 0.00 C ATOM 676 NE2 HIS A 43 3.832 -15.761 3.867 1.00 0.00 N ATOM 0 H HIS A 43 5.009 -11.886 8.291 1.00 0.00 H new ATOM 0 HA HIS A 43 2.406 -12.276 6.914 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.694 -11.884 5.068 1.00 0.00 H new ATOM 0 HB3 HIS A 43 5.194 -12.276 5.885 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.234 -14.294 4.177 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.801 -16.579 4.042 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.365 -16.475 3.307 1.00 0.00 H new ATOM 685 N GLU A 44 2.089 -14.502 7.736 1.00 0.00 N ATOM 686 CA GLU A 44 1.790 -15.821 8.286 1.00 0.00 C ATOM 687 C GLU A 44 1.184 -16.737 7.211 1.00 0.00 C ATOM 688 O GLU A 44 0.003 -16.618 6.879 1.00 0.00 O ATOM 689 CB GLU A 44 0.807 -15.650 9.444 1.00 0.00 C ATOM 690 CG GLU A 44 0.170 -16.938 9.936 1.00 0.00 C ATOM 691 CD GLU A 44 1.127 -17.819 10.706 1.00 0.00 C ATOM 692 OE1 GLU A 44 1.278 -17.607 11.926 1.00 0.00 O ATOM 693 OE2 GLU A 44 1.721 -18.737 10.103 1.00 0.00 O ATOM 0 H GLU A 44 1.270 -14.009 7.379 1.00 0.00 H new ATOM 0 HA GLU A 44 2.711 -16.285 8.639 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.328 -15.178 10.277 1.00 0.00 H new ATOM 0 HB3 GLU A 44 0.017 -14.966 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.681 -16.695 10.572 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.218 -17.493 9.082 1.00 0.00 H new ATOM 700 N GLY A 45 1.988 -17.660 6.689 1.00 0.00 N ATOM 701 CA GLY A 45 1.509 -18.597 5.681 1.00 0.00 C ATOM 702 C GLY A 45 0.972 -17.905 4.442 1.00 0.00 C ATOM 703 O GLY A 45 1.742 -17.464 3.586 1.00 0.00 O ATOM 0 H GLY A 45 2.968 -17.778 6.946 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.323 -19.263 5.395 1.00 0.00 H new ATOM 0 HA3 GLY A 45 0.725 -19.219 6.113 1.00 0.00 H new ATOM 707 N LYS A 46 -0.347 -17.824 4.343 1.00 0.00 N ATOM 708 CA LYS A 46 -0.996 -17.072 3.276 1.00 0.00 C ATOM 709 C LYS A 46 -1.299 -15.664 3.731 1.00 0.00 C ATOM 710 O LYS A 46 -1.033 -14.694 3.027 1.00 0.00 O ATOM 711 CB LYS A 46 -2.297 -17.724 2.848 1.00 0.00 C ATOM 712 CG LYS A 46 -2.153 -18.608 1.626 1.00 0.00 C ATOM 713 CD LYS A 46 -1.559 -19.967 1.951 1.00 0.00 C ATOM 714 CE LYS A 46 -2.525 -20.823 2.750 1.00 0.00 C ATOM 715 NZ LYS A 46 -2.039 -22.220 2.886 1.00 0.00 N ATOM 0 H LYS A 46 -0.993 -18.272 4.992 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.307 -17.057 2.432 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.686 -18.319 3.674 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.033 -16.947 2.641 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.131 -18.745 1.165 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.522 -18.106 0.892 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.297 -20.481 1.026 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.636 -19.836 2.516 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.663 -20.388 3.740 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.500 -20.823 2.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.725 -22.774 3.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.931 -22.643 1.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.120 -22.222 3.374 1.00 0.00 H new ATOM 729 N LYS A 47 -1.852 -15.567 4.918 1.00 0.00 N ATOM 730 CA LYS A 47 -2.296 -14.296 5.439 1.00 0.00 C ATOM 731 C LYS A 47 -1.120 -13.439 5.854 1.00 0.00 C ATOM 732 O LYS A 47 -0.217 -13.875 6.558 1.00 0.00 O ATOM 733 CB LYS A 47 -3.207 -14.492 6.639 1.00 0.00 C ATOM 734 CG LYS A 47 -3.988 -15.785 6.606 1.00 0.00 C ATOM 735 CD LYS A 47 -5.102 -15.759 7.626 1.00 0.00 C ATOM 736 CE LYS A 47 -5.782 -17.111 7.767 1.00 0.00 C ATOM 737 NZ LYS A 47 -6.412 -17.549 6.495 1.00 0.00 N ATOM 0 H LYS A 47 -2.005 -16.358 5.543 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.845 -13.794 4.643 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.606 -14.464 7.548 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.906 -13.657 6.693 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.403 -15.940 5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.322 -16.624 6.808 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.701 -15.453 8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.840 -15.011 7.336 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -5.050 -17.854 8.085 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -6.540 -17.056 8.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.279 -18.085 6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.650 -16.715 5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.749 -18.154 5.970 1.00 0.00 H new ATOM 751 N VAL A 48 -1.148 -12.214 5.403 1.00 0.00 N ATOM 752 CA VAL A 48 -0.105 -11.273 5.702 1.00 0.00 C ATOM 753 C VAL A 48 -0.711 -10.065 6.407 1.00 0.00 C ATOM 754 O VAL A 48 -1.772 -9.578 6.013 1.00 0.00 O ATOM 755 CB VAL A 48 0.635 -10.840 4.418 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.762 -9.875 4.737 1.00 0.00 C ATOM 757 CG2 VAL A 48 1.165 -12.053 3.664 1.00 0.00 C ATOM 0 H VAL A 48 -1.895 -11.841 4.818 1.00 0.00 H new ATOM 0 HA VAL A 48 0.626 -11.747 6.357 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.081 -10.324 3.778 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.266 -9.587 3.815 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.355 -8.987 5.221 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.476 -10.357 5.405 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.683 -11.724 2.763 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.858 -12.603 4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.334 -12.702 3.388 1.00 0.00 H new ATOM 767 N LYS A 49 -0.053 -9.606 7.456 1.00 0.00 N ATOM 768 CA LYS A 49 -0.528 -8.466 8.229 1.00 0.00 C ATOM 769 C LYS A 49 0.000 -7.182 7.631 1.00 0.00 C ATOM 770 O LYS A 49 1.211 -7.049 7.423 1.00 0.00 O ATOM 771 CB LYS A 49 -0.038 -8.540 9.663 1.00 0.00 C ATOM 772 CG LYS A 49 -0.452 -9.783 10.425 1.00 0.00 C ATOM 773 CD LYS A 49 0.256 -9.847 11.765 1.00 0.00 C ATOM 774 CE LYS A 49 -0.174 -8.731 12.708 1.00 0.00 C ATOM 775 NZ LYS A 49 -1.598 -8.847 13.117 1.00 0.00 N ATOM 0 H LYS A 49 0.820 -10.008 7.797 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.618 -8.486 8.208 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.050 -8.480 9.661 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.404 -7.665 10.200 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.531 -9.780 10.577 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.215 -10.671 9.839 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.054 -10.811 12.233 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.333 -9.789 11.606 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.458 -8.747 13.596 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.016 -7.768 12.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.677 -8.705 14.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.161 -8.125 12.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.954 -9.792 12.870 1.00 0.00 H new ATOM 789 N LEU A 50 -0.886 -6.243 7.352 1.00 0.00 N ATOM 790 CA LEU A 50 -0.455 -4.958 6.835 1.00 0.00 C ATOM 791 C LEU A 50 -1.026 -3.814 7.660 1.00 0.00 C ATOM 792 O LEU A 50 -2.233 -3.564 7.660 1.00 0.00 O ATOM 793 CB LEU A 50 -0.864 -4.779 5.370 1.00 0.00 C ATOM 794 CG LEU A 50 0.279 -4.781 4.351 1.00 0.00 C ATOM 795 CD1 LEU A 50 1.017 -6.106 4.360 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.248 -4.468 2.959 1.00 0.00 C ATOM 0 H LEU A 50 -1.894 -6.343 7.473 1.00 0.00 H new ATOM 0 HA LEU A 50 0.633 -4.938 6.902 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.560 -5.576 5.107 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.406 -3.838 5.277 1.00 0.00 H new ATOM 0 HG LEU A 50 0.987 -4.003 4.636 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.823 -6.079 3.627 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.434 -6.283 5.351 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.325 -6.910 4.108 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.578 -4.474 2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.981 -5.221 2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.719 -3.485 2.961 1.00 0.00 H new ATOM 808 N THR A 51 -0.154 -3.142 8.379 1.00 0.00 N ATOM 809 CA THR A 51 -0.505 -1.920 9.064 1.00 0.00 C ATOM 810 C THR A 51 0.199 -0.754 8.383 1.00 0.00 C ATOM 811 O THR A 51 1.415 -0.691 8.390 1.00 0.00 O ATOM 812 CB THR A 51 -0.080 -1.982 10.539 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.622 -3.157 11.155 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.562 -0.753 11.272 1.00 0.00 C ATOM 0 H THR A 51 0.817 -3.428 8.504 1.00 0.00 H new ATOM 0 HA THR A 51 -1.586 -1.787 9.021 1.00 0.00 H new ATOM 0 HB THR A 51 1.008 -2.020 10.589 1.00 0.00 H new ATOM 0 HG1 THR A 51 -0.346 -3.191 12.095 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.255 -0.808 12.316 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.130 0.137 10.813 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.649 -0.699 11.216 1.00 0.00 H new ATOM 822 N ILE A 52 -0.549 0.160 7.788 1.00 0.00 N ATOM 823 CA ILE A 52 0.063 1.214 6.987 1.00 0.00 C ATOM 824 C ILE A 52 -0.436 2.592 7.403 1.00 0.00 C ATOM 825 O ILE A 52 -1.634 2.862 7.374 1.00 0.00 O ATOM 826 CB ILE A 52 -0.210 1.045 5.470 1.00 0.00 C ATOM 827 CG1 ILE A 52 0.016 -0.400 5.009 1.00 0.00 C ATOM 828 CG2 ILE A 52 0.668 1.993 4.668 1.00 0.00 C ATOM 829 CD1 ILE A 52 -1.221 -1.262 5.112 1.00 0.00 C ATOM 0 H ILE A 52 -1.567 0.197 7.841 1.00 0.00 H new ATOM 0 HA ILE A 52 1.135 1.129 7.168 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.258 1.289 5.295 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.361 -0.394 3.975 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.811 -0.845 5.608 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.466 1.864 3.605 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.451 3.022 4.956 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.717 1.774 4.867 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.991 -2.271 4.770 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.554 -1.297 6.149 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.011 -0.840 4.491 1.00 0.00 H new ATOM 841 N THR A 53 0.485 3.458 7.786 1.00 0.00 N ATOM 842 CA THR A 53 0.146 4.841 8.074 1.00 0.00 C ATOM 843 C THR A 53 0.271 5.681 6.811 1.00 0.00 C ATOM 844 O THR A 53 1.301 5.653 6.141 1.00 0.00 O ATOM 845 CB THR A 53 1.070 5.446 9.145 1.00 0.00 C ATOM 846 OG1 THR A 53 1.168 4.565 10.272 1.00 0.00 O ATOM 847 CG2 THR A 53 0.550 6.802 9.601 1.00 0.00 C ATOM 0 H THR A 53 1.472 3.229 7.905 1.00 0.00 H new ATOM 0 HA THR A 53 -0.879 4.849 8.445 1.00 0.00 H new ATOM 0 HB THR A 53 2.058 5.578 8.705 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.777 3.828 10.059 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.218 7.212 10.358 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.507 7.481 8.749 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.448 6.686 10.023 1.00 0.00 H new ATOM 855 N TYR A 54 -0.778 6.406 6.476 1.00 0.00 N ATOM 856 CA TYR A 54 -0.716 7.343 5.377 1.00 0.00 C ATOM 857 C TYR A 54 -0.774 8.759 5.917 1.00 0.00 C ATOM 858 O TYR A 54 -1.854 9.285 6.192 1.00 0.00 O ATOM 859 CB TYR A 54 -1.876 7.104 4.409 1.00 0.00 C ATOM 860 CG TYR A 54 -1.896 5.715 3.816 1.00 0.00 C ATOM 861 CD1 TYR A 54 -1.143 5.417 2.691 1.00 0.00 C ATOM 862 CD2 TYR A 54 -2.666 4.705 4.378 1.00 0.00 C ATOM 863 CE1 TYR A 54 -1.157 4.153 2.137 1.00 0.00 C ATOM 864 CE2 TYR A 54 -2.683 3.437 3.833 1.00 0.00 C ATOM 865 CZ TYR A 54 -1.927 3.166 2.713 1.00 0.00 C ATOM 866 OH TYR A 54 -1.946 1.903 2.166 1.00 0.00 O ATOM 0 H TYR A 54 -1.681 6.363 6.949 1.00 0.00 H new ATOM 0 HA TYR A 54 0.220 7.199 4.838 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -2.816 7.280 4.932 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.820 7.834 3.601 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.535 6.187 2.240 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.261 4.915 5.255 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -0.568 3.939 1.257 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.286 2.661 4.282 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.538 1.327 2.693 1.00 0.00 H new ATOM 876 N GLY A 55 0.393 9.372 6.062 1.00 0.00 N ATOM 877 CA GLY A 55 0.469 10.747 6.523 1.00 0.00 C ATOM 878 C GLY A 55 0.168 10.891 8.001 1.00 0.00 C ATOM 879 O GLY A 55 1.034 11.271 8.784 1.00 0.00 O ATOM 0 H GLY A 55 1.296 8.939 5.867 1.00 0.00 H new ATOM 0 HA2 GLY A 55 1.466 11.138 6.321 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.234 11.355 5.953 1.00 0.00 H new ATOM 883 N SER A 56 -1.056 10.572 8.377 1.00 0.00 N ATOM 884 CA SER A 56 -1.495 10.691 9.760 1.00 0.00 C ATOM 885 C SER A 56 -2.379 9.509 10.163 1.00 0.00 C ATOM 886 O SER A 56 -2.231 8.957 11.255 1.00 0.00 O ATOM 887 CB SER A 56 -2.251 12.005 9.949 1.00 0.00 C ATOM 888 OG SER A 56 -3.266 12.152 8.969 1.00 0.00 O ATOM 0 H SER A 56 -1.772 10.225 7.739 1.00 0.00 H new ATOM 0 HA SER A 56 -0.615 10.684 10.403 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.694 12.034 10.944 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.555 12.842 9.886 1.00 0.00 H new ATOM 0 HG SER A 56 -3.738 12.999 9.111 1.00 0.00 H new ATOM 894 N LYS A 57 -3.281 9.110 9.272 1.00 0.00 N ATOM 895 CA LYS A 57 -4.193 8.022 9.543 1.00 0.00 C ATOM 896 C LYS A 57 -3.514 6.689 9.274 1.00 0.00 C ATOM 897 O LYS A 57 -2.613 6.593 8.444 1.00 0.00 O ATOM 898 CB LYS A 57 -5.404 8.157 8.639 1.00 0.00 C ATOM 899 CG LYS A 57 -6.639 7.470 9.124 1.00 0.00 C ATOM 900 CD LYS A 57 -6.923 7.733 10.577 1.00 0.00 C ATOM 901 CE LYS A 57 -7.946 6.735 11.026 1.00 0.00 C ATOM 902 NZ LYS A 57 -9.320 7.111 10.601 1.00 0.00 N ATOM 0 H LYS A 57 -3.394 9.533 8.351 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.497 8.060 10.589 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.624 9.217 8.509 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -5.150 7.761 7.656 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.490 7.799 8.527 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.536 6.396 8.968 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.012 7.640 11.168 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.292 8.749 10.717 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.697 5.754 10.620 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.914 6.648 12.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.995 6.393 10.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -9.569 8.035 11.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.359 7.169 9.563 1.00 0.00 H new ATOM 916 N VAL A 58 -3.962 5.667 9.969 1.00 0.00 N ATOM 917 CA VAL A 58 -3.363 4.348 9.866 1.00 0.00 C ATOM 918 C VAL A 58 -4.401 3.320 9.448 1.00 0.00 C ATOM 919 O VAL A 58 -5.435 3.173 10.093 1.00 0.00 O ATOM 920 CB VAL A 58 -2.735 3.906 11.202 1.00 0.00 C ATOM 921 CG1 VAL A 58 -1.803 2.728 10.998 1.00 0.00 C ATOM 922 CG2 VAL A 58 -2.016 5.067 11.864 1.00 0.00 C ATOM 0 H VAL A 58 -4.747 5.722 10.618 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.579 4.411 9.111 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.536 3.583 11.867 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.372 2.435 11.955 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -2.361 1.891 10.579 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.004 3.010 10.312 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.579 4.735 12.806 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.226 5.429 11.206 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -2.725 5.872 12.057 1.00 0.00 H new ATOM 932 N ILE A 59 -4.126 2.632 8.355 1.00 0.00 N ATOM 933 CA ILE A 59 -4.985 1.564 7.889 1.00 0.00 C ATOM 934 C ILE A 59 -4.366 0.215 8.239 1.00 0.00 C ATOM 935 O ILE A 59 -3.244 -0.088 7.841 1.00 0.00 O ATOM 936 CB ILE A 59 -5.219 1.658 6.366 1.00 0.00 C ATOM 937 CG1 ILE A 59 -5.914 2.972 6.024 1.00 0.00 C ATOM 938 CG2 ILE A 59 -6.058 0.509 5.889 1.00 0.00 C ATOM 939 CD1 ILE A 59 -6.197 3.154 4.547 1.00 0.00 C ATOM 0 H ILE A 59 -3.307 2.798 7.770 1.00 0.00 H new ATOM 0 HA ILE A 59 -5.951 1.662 8.385 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.251 1.619 5.867 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.854 3.027 6.573 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.294 3.799 6.369 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.212 0.593 4.813 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.550 -0.429 6.111 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.023 0.528 6.396 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.692 4.112 4.387 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.259 3.133 3.992 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.844 2.349 4.198 1.00 0.00 H new ATOM 951 N HIS A 60 -5.094 -0.581 9.001 1.00 0.00 N ATOM 952 CA HIS A 60 -4.595 -1.872 9.453 1.00 0.00 C ATOM 953 C HIS A 60 -5.499 -2.983 8.934 1.00 0.00 C ATOM 954 O HIS A 60 -6.691 -3.006 9.239 1.00 0.00 O ATOM 955 CB HIS A 60 -4.532 -1.889 10.990 1.00 0.00 C ATOM 956 CG HIS A 60 -3.883 -3.109 11.588 1.00 0.00 C ATOM 957 ND1 HIS A 60 -3.278 -3.103 12.826 1.00 0.00 N ATOM 958 CD2 HIS A 60 -3.780 -4.380 11.134 1.00 0.00 C ATOM 959 CE1 HIS A 60 -2.837 -4.315 13.105 1.00 0.00 C ATOM 960 NE2 HIS A 60 -3.130 -5.109 12.094 1.00 0.00 N ATOM 0 H HIS A 60 -6.036 -0.357 9.322 1.00 0.00 H new ATOM 0 HA HIS A 60 -3.591 -2.036 9.063 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -3.989 -1.006 11.326 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -5.546 -1.807 11.381 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -4.144 -4.751 10.187 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.323 -4.607 14.009 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -2.909 -6.103 12.036 1.00 0.00 H new ATOM 969 N ASN A 61 -4.936 -3.896 8.146 1.00 0.00 N ATOM 970 CA ASN A 61 -5.696 -5.026 7.629 1.00 0.00 C ATOM 971 C ASN A 61 -4.802 -6.239 7.480 1.00 0.00 C ATOM 972 O ASN A 61 -3.663 -6.128 7.028 1.00 0.00 O ATOM 973 CB ASN A 61 -6.322 -4.716 6.260 1.00 0.00 C ATOM 974 CG ASN A 61 -7.463 -3.722 6.324 1.00 0.00 C ATOM 975 OD1 ASN A 61 -8.609 -4.091 6.564 1.00 0.00 O ATOM 976 ND2 ASN A 61 -7.163 -2.458 6.074 1.00 0.00 N ATOM 0 H ASN A 61 -3.959 -3.874 7.854 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.493 -5.225 8.346 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.549 -4.327 5.597 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.684 -5.644 5.817 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.897 -1.750 6.076 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.198 -2.192 5.879 1.00 0.00 H new ATOM 983 N GLU A 62 -5.301 -7.388 7.883 1.00 0.00 N ATOM 984 CA GLU A 62 -4.657 -8.635 7.541 1.00 0.00 C ATOM 985 C GLU A 62 -5.425 -9.298 6.412 1.00 0.00 C ATOM 986 O GLU A 62 -6.654 -9.230 6.363 1.00 0.00 O ATOM 987 CB GLU A 62 -4.552 -9.583 8.733 1.00 0.00 C ATOM 988 CG GLU A 62 -3.595 -9.125 9.817 1.00 0.00 C ATOM 989 CD GLU A 62 -4.182 -8.130 10.794 1.00 0.00 C ATOM 990 OE1 GLU A 62 -5.390 -7.837 10.719 1.00 0.00 O ATOM 991 OE2 GLU A 62 -3.425 -7.646 11.657 1.00 0.00 O ATOM 0 H GLU A 62 -6.147 -7.483 8.445 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.638 -8.411 7.225 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.543 -9.709 9.170 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.235 -10.563 8.376 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.249 -9.998 10.371 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.719 -8.679 9.346 1.00 0.00 H new ATOM 998 N PHE A 63 -4.708 -9.942 5.512 1.00 0.00 N ATOM 999 CA PHE A 63 -5.325 -10.506 4.328 1.00 0.00 C ATOM 1000 C PHE A 63 -4.729 -11.868 4.021 1.00 0.00 C ATOM 1001 O PHE A 63 -3.541 -12.085 4.217 1.00 0.00 O ATOM 1002 CB PHE A 63 -5.145 -9.552 3.144 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.720 -9.136 2.905 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.836 -9.943 2.205 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.271 -7.934 3.396 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.530 -9.548 1.998 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -1.965 -7.529 3.196 1.00 0.00 C ATOM 1008 CZ PHE A 63 -1.094 -8.338 2.495 1.00 0.00 C ATOM 0 H PHE A 63 -3.701 -10.087 5.578 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.392 -10.637 4.509 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.529 -10.031 2.243 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.749 -8.661 3.314 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.174 -10.893 1.817 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.948 -7.297 3.946 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.852 -10.184 1.449 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.627 -6.581 3.588 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.073 -8.024 2.336 1.00 0.00 H new ATOM 1018 N THR A 64 -5.558 -12.772 3.536 1.00 0.00 N ATOM 1019 CA THR A 64 -5.134 -14.130 3.255 1.00 0.00 C ATOM 1020 C THR A 64 -4.827 -14.282 1.767 1.00 0.00 C ATOM 1021 O THR A 64 -5.624 -13.900 0.912 1.00 0.00 O ATOM 1022 CB THR A 64 -6.231 -15.132 3.639 1.00 0.00 C ATOM 1023 OG1 THR A 64 -6.633 -14.941 5.003 1.00 0.00 O ATOM 1024 CG2 THR A 64 -5.779 -16.561 3.441 1.00 0.00 C ATOM 0 H THR A 64 -6.539 -12.587 3.327 1.00 0.00 H new ATOM 0 HA THR A 64 -4.240 -14.334 3.844 1.00 0.00 H new ATOM 0 HB THR A 64 -7.080 -14.948 2.980 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.333 -14.257 5.045 1.00 0.00 H new ATOM 0 HG21 THR A 64 -6.584 -17.240 3.724 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.522 -16.720 2.394 1.00 0.00 H new ATOM 0 HG23 THR A 64 -4.905 -16.756 4.063 1.00 0.00 H new ATOM 1032 N LEU A 65 -3.664 -14.830 1.482 1.00 0.00 N ATOM 1033 CA LEU A 65 -3.200 -15.040 0.123 1.00 0.00 C ATOM 1034 C LEU A 65 -4.092 -16.002 -0.652 1.00 0.00 C ATOM 1035 O LEU A 65 -4.304 -17.141 -0.242 1.00 0.00 O ATOM 1036 CB LEU A 65 -1.792 -15.590 0.194 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.672 -14.592 -0.054 1.00 0.00 C ATOM 1038 CD1 LEU A 65 -0.067 -14.902 -1.390 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -1.186 -13.164 -0.038 1.00 0.00 C ATOM 0 H LEU A 65 -3.006 -15.146 2.194 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.228 -14.089 -0.408 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.646 -16.033 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.701 -16.396 -0.534 1.00 0.00 H new ATOM 0 HG LEU A 65 0.071 -14.678 0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.741 -14.200 -1.595 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.328 -15.918 -1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.829 -14.814 -2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.359 -12.478 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.938 -13.039 -0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.631 -12.948 0.933 1.00 0.00 H new ATOM 1051 N GLY A 66 -4.618 -15.522 -1.772 1.00 0.00 N ATOM 1052 CA GLY A 66 -5.431 -16.349 -2.642 1.00 0.00 C ATOM 1053 C GLY A 66 -6.840 -16.467 -2.139 1.00 0.00 C ATOM 1054 O GLY A 66 -7.672 -17.161 -2.725 1.00 0.00 O ATOM 0 H GLY A 66 -4.494 -14.563 -2.096 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.437 -15.924 -3.646 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.988 -17.342 -2.719 1.00 0.00 H new ATOM 1058 N GLU A 67 -7.110 -15.769 -1.064 1.00 0.00 N ATOM 1059 CA GLU A 67 -8.359 -15.909 -0.376 1.00 0.00 C ATOM 1060 C GLU A 67 -9.047 -14.550 -0.263 1.00 0.00 C ATOM 1061 O GLU A 67 -8.387 -13.525 -0.087 1.00 0.00 O ATOM 1062 CB GLU A 67 -8.096 -16.546 0.991 1.00 0.00 C ATOM 1063 CG GLU A 67 -9.341 -16.927 1.763 1.00 0.00 C ATOM 1064 CD GLU A 67 -10.363 -17.662 0.913 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -10.284 -18.905 0.814 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -11.253 -17.003 0.336 1.00 0.00 O ATOM 0 H GLU A 67 -6.471 -15.092 -0.647 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.035 -16.560 -0.931 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.486 -17.438 0.849 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.510 -15.852 1.593 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.060 -17.555 2.608 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.798 -16.026 2.173 1.00 0.00 H new ATOM 1073 N GLU A 68 -10.369 -14.549 -0.383 1.00 0.00 N ATOM 1074 CA GLU A 68 -11.149 -13.320 -0.376 1.00 0.00 C ATOM 1075 C GLU A 68 -11.150 -12.722 1.021 1.00 0.00 C ATOM 1076 O GLU A 68 -11.719 -13.295 1.948 1.00 0.00 O ATOM 1077 CB GLU A 68 -12.584 -13.610 -0.796 1.00 0.00 C ATOM 1078 CG GLU A 68 -13.427 -12.372 -0.999 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.900 -12.701 -1.110 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -15.571 -12.795 -0.059 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -15.392 -12.888 -2.242 1.00 0.00 O ATOM 0 H GLU A 68 -10.927 -15.396 -0.487 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.702 -12.616 -1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.572 -14.185 -1.722 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -13.054 -14.237 -0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.270 -11.686 -0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.102 -11.856 -1.902 1.00 0.00 H new ATOM 1088 N CYS A 69 -10.507 -11.581 1.168 1.00 0.00 N ATOM 1089 CA CYS A 69 -10.374 -10.931 2.456 1.00 0.00 C ATOM 1090 C CYS A 69 -10.664 -9.463 2.320 1.00 0.00 C ATOM 1091 O CYS A 69 -10.460 -8.869 1.273 1.00 0.00 O ATOM 1092 CB CYS A 69 -8.977 -11.145 2.998 1.00 0.00 C ATOM 1093 SG CYS A 69 -8.432 -12.864 2.927 1.00 0.00 S ATOM 0 H CYS A 69 -10.063 -11.079 0.399 1.00 0.00 H new ATOM 0 HA CYS A 69 -11.090 -11.365 3.153 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.278 -10.527 2.434 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.941 -10.803 4.032 1.00 0.00 H new ATOM 0 HG CYS A 69 -8.338 -13.238 1.686 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.132 -8.879 3.383 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.654 -7.557 3.323 1.00 0.00 C ATOM 1101 C GLU A 70 -10.600 -6.516 3.614 1.00 0.00 C ATOM 1102 O GLU A 70 -9.765 -6.676 4.504 1.00 0.00 O ATOM 1103 CB GLU A 70 -12.758 -7.425 4.326 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.002 -8.191 3.984 1.00 0.00 C ATOM 1105 CD GLU A 70 -13.843 -9.693 4.019 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -13.268 -10.212 4.996 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -14.321 -10.367 3.087 1.00 0.00 O ATOM 0 H GLU A 70 -11.160 -9.307 4.308 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.021 -7.387 2.311 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.393 -7.763 5.296 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.013 -6.370 4.431 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.792 -7.906 4.679 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.332 -7.896 2.988 1.00 0.00 H new ATOM 1114 N LEU A 71 -10.660 -5.451 2.855 1.00 0.00 N ATOM 1115 CA LEU A 71 -9.825 -4.315 3.039 1.00 0.00 C ATOM 1116 C LEU A 71 -10.639 -3.186 3.638 1.00 0.00 C ATOM 1117 O LEU A 71 -11.590 -2.710 3.025 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.308 -3.895 1.685 1.00 0.00 C ATOM 1119 CG LEU A 71 -7.864 -4.287 1.359 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -6.910 -3.694 2.379 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.716 -5.802 1.304 1.00 0.00 C ATOM 0 H LEU A 71 -11.311 -5.358 2.075 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.997 -4.553 3.707 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.959 -4.322 0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.394 -2.811 1.607 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.613 -3.885 0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.888 -3.982 2.132 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.993 -2.607 2.366 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.162 -4.066 3.372 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.683 -6.058 1.071 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.987 -6.229 2.269 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.372 -6.204 0.532 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.276 -2.762 4.824 1.00 0.00 N ATOM 1134 CA GLU A 72 -10.978 -1.675 5.473 1.00 0.00 C ATOM 1135 C GLU A 72 -10.234 -0.381 5.200 1.00 0.00 C ATOM 1136 O GLU A 72 -9.046 -0.265 5.502 1.00 0.00 O ATOM 1137 CB GLU A 72 -11.082 -1.917 6.978 1.00 0.00 C ATOM 1138 CG GLU A 72 -11.910 -0.870 7.701 1.00 0.00 C ATOM 1139 CD GLU A 72 -11.928 -1.081 9.195 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -12.794 -1.833 9.686 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -11.074 -0.487 9.888 1.00 0.00 O ATOM 0 H GLU A 72 -9.500 -3.150 5.361 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.991 -1.612 5.075 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.521 -2.900 7.151 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -10.080 -1.936 7.406 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.511 0.120 7.482 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.931 -0.893 7.321 1.00 0.00 H new ATOM 1148 N THR A 73 -10.927 0.574 4.616 1.00 0.00 N ATOM 1149 CA THR A 73 -10.318 1.822 4.207 1.00 0.00 C ATOM 1150 C THR A 73 -10.304 2.824 5.355 1.00 0.00 C ATOM 1151 O THR A 73 -10.866 2.571 6.423 1.00 0.00 O ATOM 1152 CB THR A 73 -11.090 2.419 3.012 1.00 0.00 C ATOM 1153 OG1 THR A 73 -12.441 2.681 3.399 1.00 0.00 O ATOM 1154 CG2 THR A 73 -11.085 1.456 1.838 1.00 0.00 C ATOM 0 H THR A 73 -11.924 0.508 4.412 1.00 0.00 H new ATOM 0 HA THR A 73 -9.289 1.616 3.912 1.00 0.00 H new ATOM 0 HB THR A 73 -10.602 3.346 2.711 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.927 1.834 3.485 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.634 1.895 1.005 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.057 1.261 1.532 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.560 0.520 2.133 1.00 0.00 H new ATOM 1162 N MET A 74 -9.670 3.969 5.121 1.00 0.00 N ATOM 1163 CA MET A 74 -9.565 5.023 6.129 1.00 0.00 C ATOM 1164 C MET A 74 -10.914 5.695 6.371 1.00 0.00 C ATOM 1165 O MET A 74 -11.032 6.584 7.212 1.00 0.00 O ATOM 1166 CB MET A 74 -8.523 6.066 5.710 1.00 0.00 C ATOM 1167 CG MET A 74 -8.842 6.765 4.397 1.00 0.00 C ATOM 1168 SD MET A 74 -7.561 7.935 3.899 1.00 0.00 S ATOM 1169 CE MET A 74 -6.142 6.850 3.751 1.00 0.00 C ATOM 0 H MET A 74 -9.217 4.193 4.235 1.00 0.00 H new ATOM 0 HA MET A 74 -9.245 4.559 7.062 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.437 6.815 6.497 1.00 0.00 H new ATOM 0 HB3 MET A 74 -7.551 5.580 5.624 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.969 6.017 3.614 1.00 0.00 H new ATOM 0 HG3 MET A 74 -9.792 7.292 4.492 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.319 7.389 3.281 1.00 0.00 H new ATOM 0 HE2 MET A 74 -5.837 6.513 4.742 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.406 5.987 3.140 1.00 0.00 H new ATOM 1179 N THR A 75 -11.925 5.265 5.628 1.00 0.00 N ATOM 1180 CA THR A 75 -13.256 5.829 5.748 1.00 0.00 C ATOM 1181 C THR A 75 -14.090 4.943 6.660 1.00 0.00 C ATOM 1182 O THR A 75 -15.209 5.286 7.045 1.00 0.00 O ATOM 1183 CB THR A 75 -13.951 5.933 4.373 1.00 0.00 C ATOM 1184 OG1 THR A 75 -14.470 4.655 3.983 1.00 0.00 O ATOM 1185 CG2 THR A 75 -12.976 6.410 3.314 1.00 0.00 C ATOM 0 H THR A 75 -11.844 4.523 4.933 1.00 0.00 H new ATOM 0 HA THR A 75 -13.166 6.833 6.163 1.00 0.00 H new ATOM 0 HB THR A 75 -14.766 6.651 4.462 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.727 4.042 3.801 1.00 0.00 H new ATOM 0 HG21 THR A 75 -13.486 6.476 2.353 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.592 7.392 3.589 1.00 0.00 H new ATOM 0 HG23 THR A 75 -12.148 5.705 3.237 1.00 0.00 H new ATOM 1193 N GLY A 76 -13.525 3.787 6.989 1.00 0.00 N ATOM 1194 CA GLY A 76 -14.208 2.821 7.815 1.00 0.00 C ATOM 1195 C GLY A 76 -14.936 1.783 6.990 1.00 0.00 C ATOM 1196 O GLY A 76 -15.412 0.778 7.518 1.00 0.00 O ATOM 0 H GLY A 76 -12.592 3.503 6.691 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.487 2.326 8.466 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.920 3.335 8.461 1.00 0.00 H new ATOM 1200 N GLU A 77 -15.036 2.036 5.694 1.00 0.00 N ATOM 1201 CA GLU A 77 -15.675 1.125 4.785 1.00 0.00 C ATOM 1202 C GLU A 77 -14.721 0.018 4.388 1.00 0.00 C ATOM 1203 O GLU A 77 -13.590 0.266 3.961 1.00 0.00 O ATOM 1204 CB GLU A 77 -16.151 1.884 3.558 1.00 0.00 C ATOM 1205 CG GLU A 77 -16.778 0.987 2.532 1.00 0.00 C ATOM 1206 CD GLU A 77 -16.594 1.492 1.126 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -16.984 2.642 0.838 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -16.062 0.732 0.296 1.00 0.00 O ATOM 0 H GLU A 77 -14.673 2.881 5.253 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.534 0.671 5.278 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -16.873 2.642 3.862 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.307 2.408 3.110 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.345 -0.010 2.615 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.843 0.891 2.742 1.00 0.00 H new ATOM 1215 N LYS A 78 -15.186 -1.194 4.554 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.405 -2.367 4.297 1.00 0.00 C ATOM 1217 C LYS A 78 -14.928 -3.091 3.058 1.00 0.00 C ATOM 1218 O LYS A 78 -16.137 -3.258 2.889 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.498 -3.230 5.529 1.00 0.00 C ATOM 1220 CG LYS A 78 -13.671 -4.491 5.498 1.00 0.00 C ATOM 1221 CD LYS A 78 -13.863 -5.249 6.789 1.00 0.00 C ATOM 1222 CE LYS A 78 -12.590 -5.942 7.249 1.00 0.00 C ATOM 1223 NZ LYS A 78 -12.721 -6.477 8.629 1.00 0.00 N ATOM 0 H LYS A 78 -16.133 -1.392 4.877 1.00 0.00 H new ATOM 0 HA LYS A 78 -13.364 -2.117 4.093 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -14.194 -2.637 6.391 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.542 -3.504 5.683 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.966 -5.112 4.652 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.618 -4.245 5.361 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.199 -4.561 7.565 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.650 -5.991 6.658 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.352 -6.756 6.565 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.758 -5.238 7.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.833 -6.942 8.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.923 -5.697 9.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.498 -7.167 8.661 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.022 -3.490 2.186 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.389 -4.157 0.947 1.00 0.00 C ATOM 1239 C VAL A 79 -13.585 -5.441 0.754 1.00 0.00 C ATOM 1240 O VAL A 79 -12.357 -5.435 0.822 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.193 -3.222 -0.265 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -12.785 -2.675 -0.322 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -14.533 -3.955 -1.534 1.00 0.00 C ATOM 0 H VAL A 79 -13.018 -3.363 2.313 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.445 -4.418 1.017 1.00 0.00 H new ATOM 0 HB VAL A 79 -14.866 -2.372 -0.154 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -12.684 -2.021 -1.188 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.577 -2.109 0.586 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.077 -3.500 -0.406 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.393 -3.291 -2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -13.881 -4.822 -1.639 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -15.572 -4.284 -1.497 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.286 -6.548 0.545 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.634 -7.823 0.291 1.00 0.00 C ATOM 1255 C LYS A 80 -12.903 -7.805 -1.032 1.00 0.00 C ATOM 1256 O LYS A 80 -13.433 -7.423 -2.077 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.629 -8.970 0.318 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.673 -8.858 -0.747 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.766 -9.899 -0.592 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.402 -9.879 0.790 1.00 0.00 C ATOM 1261 NZ LYS A 80 -16.663 -10.742 1.753 1.00 0.00 N ATOM 0 H LYS A 80 -15.305 -6.587 0.547 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.909 -7.979 1.090 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.094 -9.912 0.198 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.114 -9.001 1.294 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.115 -7.862 -0.716 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.205 -8.969 -1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.536 -9.727 -1.344 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.350 -10.888 -0.782 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.426 -8.855 1.164 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -18.436 -10.217 0.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.340 -11.222 2.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -16.112 -11.452 1.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -16.020 -10.155 2.322 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.672 -8.207 -0.947 1.00 0.00 N ATOM 1276 CA ALA A 81 -10.786 -8.250 -2.071 1.00 0.00 C ATOM 1277 C ALA A 81 -9.937 -9.520 -2.024 1.00 0.00 C ATOM 1278 O ALA A 81 -9.604 -10.016 -0.950 1.00 0.00 O ATOM 1279 CB ALA A 81 -9.920 -7.020 -2.018 1.00 0.00 C ATOM 0 H ALA A 81 -11.245 -8.521 -0.075 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.348 -8.268 -3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.232 -7.023 -2.863 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.548 -6.130 -2.064 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.352 -7.015 -1.088 1.00 0.00 H new ATOM 1285 N VAL A 82 -9.606 -10.066 -3.181 1.00 0.00 N ATOM 1286 CA VAL A 82 -8.790 -11.269 -3.233 1.00 0.00 C ATOM 1287 C VAL A 82 -7.348 -10.920 -3.581 1.00 0.00 C ATOM 1288 O VAL A 82 -7.058 -10.474 -4.694 1.00 0.00 O ATOM 1289 CB VAL A 82 -9.345 -12.282 -4.246 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -8.515 -13.545 -4.247 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -10.760 -12.638 -3.879 1.00 0.00 C ATOM 0 H VAL A 82 -9.886 -9.700 -4.091 1.00 0.00 H new ATOM 0 HA VAL A 82 -8.818 -11.729 -2.245 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.312 -11.829 -5.237 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.925 -14.249 -4.971 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.487 -13.304 -4.517 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.534 -13.994 -3.254 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.153 -13.357 -4.598 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.778 -13.077 -2.881 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.376 -11.739 -3.891 1.00 0.00 H new ATOM 1301 N VAL A 83 -6.456 -11.108 -2.621 1.00 0.00 N ATOM 1302 CA VAL A 83 -5.057 -10.754 -2.798 1.00 0.00 C ATOM 1303 C VAL A 83 -4.164 -11.988 -2.856 1.00 0.00 C ATOM 1304 O VAL A 83 -4.185 -12.840 -1.969 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.573 -9.822 -1.674 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.756 -10.478 -0.332 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -3.126 -9.423 -1.892 1.00 0.00 C ATOM 0 H VAL A 83 -6.678 -11.505 -1.708 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.985 -10.231 -3.751 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.176 -8.914 -1.694 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.409 -9.805 0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.812 -10.701 -0.177 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.180 -11.403 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.805 -8.764 -1.085 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.500 -10.315 -1.903 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.032 -8.903 -2.845 1.00 0.00 H new ATOM 1317 N LYS A 84 -3.416 -12.103 -3.933 1.00 0.00 N ATOM 1318 CA LYS A 84 -2.401 -13.130 -4.046 1.00 0.00 C ATOM 1319 C LYS A 84 -1.213 -12.573 -4.805 1.00 0.00 C ATOM 1320 O LYS A 84 -1.328 -11.527 -5.443 1.00 0.00 O ATOM 1321 CB LYS A 84 -2.917 -14.388 -4.712 1.00 0.00 C ATOM 1322 CG LYS A 84 -2.265 -15.625 -4.141 1.00 0.00 C ATOM 1323 CD LYS A 84 -1.970 -16.671 -5.212 1.00 0.00 C ATOM 1324 CE LYS A 84 -3.240 -17.276 -5.806 1.00 0.00 C ATOM 1325 NZ LYS A 84 -3.898 -16.387 -6.807 1.00 0.00 N ATOM 0 H LYS A 84 -3.492 -11.494 -4.748 1.00 0.00 H new ATOM 0 HA LYS A 84 -2.100 -13.417 -3.039 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.997 -14.452 -4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.727 -14.337 -5.784 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.336 -15.346 -3.643 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.916 -16.059 -3.382 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.382 -16.215 -6.008 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -1.360 -17.465 -4.781 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.996 -18.227 -6.279 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.944 -17.491 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -4.408 -16.967 -7.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -4.569 -15.757 -6.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.176 -15.817 -7.293 1.00 0.00 H new ATOM 1339 N MET A 85 -0.076 -13.256 -4.749 1.00 0.00 N ATOM 1340 CA MET A 85 1.157 -12.680 -5.238 1.00 0.00 C ATOM 1341 C MET A 85 1.205 -12.805 -6.735 1.00 0.00 C ATOM 1342 O MET A 85 0.932 -13.867 -7.296 1.00 0.00 O ATOM 1343 CB MET A 85 2.394 -13.377 -4.647 1.00 0.00 C ATOM 1344 CG MET A 85 2.176 -14.034 -3.307 1.00 0.00 C ATOM 1345 SD MET A 85 3.591 -15.012 -2.769 1.00 0.00 S ATOM 1346 CE MET A 85 4.904 -13.795 -2.849 1.00 0.00 C ATOM 0 H MET A 85 0.012 -14.200 -4.373 1.00 0.00 H new ATOM 0 HA MET A 85 1.175 -11.634 -4.932 1.00 0.00 H new ATOM 0 HB2 MET A 85 2.739 -14.132 -5.353 1.00 0.00 H new ATOM 0 HB3 MET A 85 3.194 -12.643 -4.549 1.00 0.00 H new ATOM 0 HG2 MET A 85 1.966 -13.267 -2.562 1.00 0.00 H new ATOM 0 HG3 MET A 85 1.296 -14.675 -3.361 1.00 0.00 H new ATOM 0 HE1 MET A 85 5.567 -13.918 -1.992 1.00 0.00 H new ATOM 0 HE2 MET A 85 5.472 -13.932 -3.769 1.00 0.00 H new ATOM 0 HE3 MET A 85 4.473 -12.794 -2.834 1.00 0.00 H new ATOM 1356 N GLU A 86 1.547 -11.714 -7.373 1.00 0.00 N ATOM 1357 CA GLU A 86 1.676 -11.696 -8.799 1.00 0.00 C ATOM 1358 C GLU A 86 3.125 -11.974 -9.105 1.00 0.00 C ATOM 1359 O GLU A 86 4.000 -11.577 -8.333 1.00 0.00 O ATOM 1360 CB GLU A 86 1.232 -10.357 -9.358 1.00 0.00 C ATOM 1361 CG GLU A 86 0.791 -10.442 -10.803 1.00 0.00 C ATOM 1362 CD GLU A 86 0.328 -9.117 -11.361 1.00 0.00 C ATOM 1363 OE1 GLU A 86 1.173 -8.356 -11.876 1.00 0.00 O ATOM 1364 OE2 GLU A 86 -0.889 -8.839 -11.300 1.00 0.00 O ATOM 0 H GLU A 86 1.742 -10.822 -6.918 1.00 0.00 H new ATOM 0 HA GLU A 86 1.040 -12.449 -9.265 1.00 0.00 H new ATOM 0 HB2 GLU A 86 0.411 -9.971 -8.754 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.052 -9.644 -9.274 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.618 -10.815 -11.407 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -0.018 -11.168 -10.887 1.00 0.00 H new ATOM 1371 N GLY A 87 3.366 -12.683 -10.190 1.00 0.00 N ATOM 1372 CA GLY A 87 4.670 -13.273 -10.421 1.00 0.00 C ATOM 1373 C GLY A 87 5.771 -12.278 -10.624 1.00 0.00 C ATOM 1374 O GLY A 87 6.150 -11.948 -11.746 1.00 0.00 O ATOM 0 H GLY A 87 2.680 -12.864 -10.923 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.923 -13.909 -9.573 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.613 -13.918 -11.298 1.00 0.00 H new ATOM 1378 N ASP A 88 6.262 -11.815 -9.513 1.00 0.00 N ATOM 1379 CA ASP A 88 7.397 -10.939 -9.454 1.00 0.00 C ATOM 1380 C ASP A 88 8.009 -11.010 -8.063 1.00 0.00 C ATOM 1381 O ASP A 88 9.050 -11.634 -7.863 1.00 0.00 O ATOM 1382 CB ASP A 88 6.983 -9.503 -9.767 1.00 0.00 C ATOM 1383 CG ASP A 88 8.119 -8.680 -10.337 1.00 0.00 C ATOM 1384 OD1 ASP A 88 9.166 -8.557 -9.672 1.00 0.00 O ATOM 1385 OD2 ASP A 88 7.971 -8.159 -11.462 1.00 0.00 O ATOM 0 H ASP A 88 5.874 -12.042 -8.597 1.00 0.00 H new ATOM 0 HA ASP A 88 8.130 -11.254 -10.197 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.156 -9.514 -10.477 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.616 -9.028 -8.857 1.00 0.00 H new ATOM 1390 N ASN A 89 7.318 -10.411 -7.092 1.00 0.00 N ATOM 1391 CA ASN A 89 7.874 -10.252 -5.742 1.00 0.00 C ATOM 1392 C ASN A 89 6.824 -10.244 -4.627 1.00 0.00 C ATOM 1393 O ASN A 89 7.100 -10.666 -3.511 1.00 0.00 O ATOM 1394 CB ASN A 89 8.724 -8.992 -5.673 1.00 0.00 C ATOM 1395 CG ASN A 89 10.169 -9.238 -6.068 1.00 0.00 C ATOM 1396 OD1 ASN A 89 10.716 -10.316 -5.834 1.00 0.00 O ATOM 1397 ND2 ASN A 89 10.798 -8.246 -6.675 1.00 0.00 N ATOM 0 H ASN A 89 6.379 -10.030 -7.211 1.00 0.00 H new ATOM 0 HA ASN A 89 8.489 -11.134 -5.565 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.296 -8.234 -6.329 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.692 -8.592 -4.660 1.00 0.00 H new ATOM 0 HD21 ASN A 89 11.769 -8.360 -6.966 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.312 -7.367 -6.852 1.00 0.00 H new ATOM 1404 N LYS A 90 5.673 -9.660 -4.894 1.00 0.00 N ATOM 1405 CA LYS A 90 4.596 -9.558 -3.912 1.00 0.00 C ATOM 1406 C LYS A 90 3.218 -9.546 -4.567 1.00 0.00 C ATOM 1407 O LYS A 90 3.090 -9.720 -5.779 1.00 0.00 O ATOM 1408 CB LYS A 90 4.767 -8.458 -2.871 1.00 0.00 C ATOM 1409 CG LYS A 90 5.012 -9.018 -1.483 1.00 0.00 C ATOM 1410 CD LYS A 90 4.922 -7.940 -0.409 1.00 0.00 C ATOM 1411 CE LYS A 90 3.491 -7.477 -0.165 1.00 0.00 C ATOM 1412 NZ LYS A 90 2.676 -8.500 0.548 1.00 0.00 N ATOM 0 H LYS A 90 5.451 -9.240 -5.797 1.00 0.00 H new ATOM 0 HA LYS A 90 4.671 -10.476 -3.330 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.602 -7.817 -3.155 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.875 -7.832 -2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.282 -9.800 -1.274 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.997 -9.483 -1.448 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.340 -8.323 0.522 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.531 -7.086 -0.704 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.505 -6.556 0.418 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.020 -7.242 -1.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.679 -8.205 0.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.763 -9.415 0.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.016 -8.595 1.526 1.00 0.00 H new ATOM 1426 N MET A 91 2.190 -9.359 -3.749 1.00 0.00 N ATOM 1427 CA MET A 91 0.824 -9.730 -4.095 1.00 0.00 C ATOM 1428 C MET A 91 0.023 -8.508 -4.507 1.00 0.00 C ATOM 1429 O MET A 91 0.302 -7.390 -4.075 1.00 0.00 O ATOM 1430 CB MET A 91 0.096 -10.330 -2.886 1.00 0.00 C ATOM 1431 CG MET A 91 0.798 -11.488 -2.218 1.00 0.00 C ATOM 1432 SD MET A 91 1.973 -10.951 -0.953 1.00 0.00 S ATOM 1433 CE MET A 91 2.503 -12.516 -0.258 1.00 0.00 C ATOM 0 H MET A 91 2.281 -8.943 -2.822 1.00 0.00 H new ATOM 0 HA MET A 91 0.894 -10.451 -4.909 1.00 0.00 H new ATOM 0 HB2 MET A 91 -0.055 -9.543 -2.147 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.892 -10.661 -3.206 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.056 -12.145 -1.764 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.324 -12.074 -2.972 1.00 0.00 H new ATOM 0 HE1 MET A 91 3.243 -12.336 0.522 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.644 -13.034 0.169 1.00 0.00 H new ATOM 0 HE3 MET A 91 2.945 -13.131 -1.042 1.00 0.00 H new ATOM 1443 N VAL A 92 -0.960 -8.741 -5.358 1.00 0.00 N ATOM 1444 CA VAL A 92 -1.829 -7.690 -5.852 1.00 0.00 C ATOM 1445 C VAL A 92 -3.241 -7.899 -5.325 1.00 0.00 C ATOM 1446 O VAL A 92 -3.737 -9.028 -5.290 1.00 0.00 O ATOM 1447 CB VAL A 92 -1.844 -7.667 -7.397 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -2.876 -6.684 -7.932 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -0.465 -7.324 -7.931 1.00 0.00 C ATOM 0 H VAL A 92 -1.178 -9.667 -5.726 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.446 -6.733 -5.498 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.123 -8.663 -7.742 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.858 -6.695 -9.022 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.868 -6.971 -7.583 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.642 -5.681 -7.575 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.490 -7.311 -9.021 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.166 -6.342 -7.563 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.252 -8.072 -7.593 1.00 0.00 H new ATOM 1459 N THR A 93 -3.871 -6.818 -4.899 1.00 0.00 N ATOM 1460 CA THR A 93 -5.222 -6.878 -4.392 1.00 0.00 C ATOM 1461 C THR A 93 -6.062 -5.775 -5.024 1.00 0.00 C ATOM 1462 O THR A 93 -5.711 -4.594 -4.970 1.00 0.00 O ATOM 1463 CB THR A 93 -5.259 -6.773 -2.845 1.00 0.00 C ATOM 1464 OG1 THR A 93 -6.613 -6.743 -2.382 1.00 0.00 O ATOM 1465 CG2 THR A 93 -4.521 -5.535 -2.348 1.00 0.00 C ATOM 0 H THR A 93 -3.461 -5.884 -4.896 1.00 0.00 H new ATOM 0 HA THR A 93 -5.641 -7.847 -4.661 1.00 0.00 H new ATOM 0 HB THR A 93 -4.755 -7.653 -2.445 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.623 -6.678 -1.404 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.568 -5.496 -1.260 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.479 -5.581 -2.664 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.987 -4.642 -2.764 1.00 0.00 H new ATOM 1473 N THR A 94 -7.141 -6.169 -5.668 1.00 0.00 N ATOM 1474 CA THR A 94 -8.040 -5.220 -6.283 1.00 0.00 C ATOM 1475 C THR A 94 -9.216 -4.926 -5.372 1.00 0.00 C ATOM 1476 O THR A 94 -9.930 -5.833 -4.948 1.00 0.00 O ATOM 1477 CB THR A 94 -8.540 -5.739 -7.638 1.00 0.00 C ATOM 1478 OG1 THR A 94 -8.569 -7.175 -7.638 1.00 0.00 O ATOM 1479 CG2 THR A 94 -7.666 -5.231 -8.761 1.00 0.00 C ATOM 0 H THR A 94 -7.416 -7.145 -5.778 1.00 0.00 H new ATOM 0 HA THR A 94 -7.487 -4.295 -6.449 1.00 0.00 H new ATOM 0 HB THR A 94 -9.552 -5.367 -7.798 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.891 -7.496 -8.506 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.038 -5.611 -9.712 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.686 -4.141 -8.773 1.00 0.00 H new ATOM 0 HG23 THR A 94 -6.643 -5.574 -8.609 1.00 0.00 H new ATOM 1487 N PHE A 95 -9.419 -3.653 -5.085 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.474 -3.237 -4.177 1.00 0.00 C ATOM 1489 C PHE A 95 -10.858 -1.808 -4.503 1.00 0.00 C ATOM 1490 O PHE A 95 -10.041 -1.063 -5.034 1.00 0.00 O ATOM 1491 CB PHE A 95 -10.037 -3.373 -2.703 1.00 0.00 C ATOM 1492 CG PHE A 95 -9.197 -2.242 -2.159 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -8.077 -1.790 -2.830 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -9.526 -1.649 -0.950 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -7.304 -0.768 -2.313 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -8.760 -0.626 -0.428 1.00 0.00 C ATOM 1497 CZ PHE A 95 -7.646 -0.185 -1.110 1.00 0.00 C ATOM 0 H PHE A 95 -8.866 -2.887 -5.469 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.339 -3.887 -4.308 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.931 -3.466 -2.086 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.477 -4.302 -2.594 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.802 -2.242 -3.772 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.395 -1.993 -0.408 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -6.432 -0.425 -2.850 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -9.033 -0.172 0.513 1.00 0.00 H new ATOM 0 HZ PHE A 95 -7.043 0.614 -0.704 1.00 0.00 H new ATOM 1507 N LYS A 96 -12.107 -1.443 -4.241 1.00 0.00 N ATOM 1508 CA LYS A 96 -12.615 -0.114 -4.575 1.00 0.00 C ATOM 1509 C LYS A 96 -12.707 0.060 -6.090 1.00 0.00 C ATOM 1510 O LYS A 96 -13.000 1.146 -6.592 1.00 0.00 O ATOM 1511 CB LYS A 96 -11.747 0.974 -3.979 1.00 0.00 C ATOM 1512 CG LYS A 96 -11.658 0.895 -2.474 1.00 0.00 C ATOM 1513 CD LYS A 96 -13.035 0.871 -1.817 1.00 0.00 C ATOM 1514 CE LYS A 96 -13.850 2.106 -2.177 1.00 0.00 C ATOM 1515 NZ LYS A 96 -15.293 1.940 -1.854 1.00 0.00 N ATOM 0 H LYS A 96 -12.793 -2.052 -3.795 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.613 -0.025 -4.146 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -10.745 0.905 -4.401 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.146 1.947 -4.264 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -11.106 -0.001 -2.191 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -11.093 1.749 -2.100 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.572 -0.024 -2.130 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.921 0.812 -0.735 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.456 2.969 -1.640 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.739 2.315 -3.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.714 2.870 -1.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.782 1.504 -2.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.394 1.329 -1.018 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.454 -1.029 -6.808 1.00 0.00 N ATOM 1530 CA GLY A 97 -12.345 -0.973 -8.251 1.00 0.00 C ATOM 1531 C GLY A 97 -10.926 -0.652 -8.688 1.00 0.00 C ATOM 1532 O GLY A 97 -10.615 -0.635 -9.881 1.00 0.00 O ATOM 0 H GLY A 97 -12.321 -1.958 -6.409 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.651 -1.928 -8.678 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -13.027 -0.217 -8.640 1.00 0.00 H new ATOM 1536 N ILE A 98 -10.057 -0.408 -7.713 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.696 0.008 -7.987 1.00 0.00 C ATOM 1538 C ILE A 98 -7.768 -1.185 -7.827 1.00 0.00 C ATOM 1539 O ILE A 98 -8.034 -2.088 -7.032 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.243 1.201 -7.093 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -7.758 0.752 -5.709 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -9.378 2.197 -6.934 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -6.267 0.505 -5.634 1.00 0.00 C ATOM 0 H ILE A 98 -10.278 -0.493 -6.721 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.651 0.370 -9.014 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.400 1.671 -7.599 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.028 1.512 -4.976 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.283 -0.162 -5.429 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.049 3.026 -6.307 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.669 2.576 -7.914 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.231 1.705 -6.467 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.001 0.191 -4.625 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -5.992 -0.277 -6.342 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.733 1.423 -5.881 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.701 -1.202 -8.591 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.814 -2.346 -8.605 1.00 0.00 C ATOM 1557 C LYS A 99 -4.532 -2.023 -7.848 1.00 0.00 C ATOM 1558 O LYS A 99 -3.789 -1.131 -8.239 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.478 -2.749 -10.047 1.00 0.00 C ATOM 1560 CG LYS A 99 -6.640 -2.685 -11.031 1.00 0.00 C ATOM 1561 CD LYS A 99 -6.813 -1.291 -11.603 1.00 0.00 C ATOM 1562 CE LYS A 99 -7.921 -1.238 -12.645 1.00 0.00 C ATOM 1563 NZ LYS A 99 -9.232 -1.713 -12.115 1.00 0.00 N ATOM 0 H LYS A 99 -6.425 -0.440 -9.210 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.319 -3.180 -8.117 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.680 -2.102 -10.411 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.085 -3.766 -10.040 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.470 -3.393 -11.842 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.559 -2.990 -10.530 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.039 -0.593 -10.797 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.876 -0.964 -12.053 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -8.028 -0.214 -13.004 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.638 -1.848 -13.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -9.974 -1.546 -12.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -9.174 -2.730 -11.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -9.463 -1.194 -11.244 1.00 0.00 H new ATOM 1577 N SER A 100 -4.272 -2.737 -6.764 1.00 0.00 N ATOM 1578 CA SER A 100 -3.126 -2.428 -5.924 1.00 0.00 C ATOM 1579 C SER A 100 -2.108 -3.566 -5.933 1.00 0.00 C ATOM 1580 O SER A 100 -2.393 -4.671 -5.480 1.00 0.00 O ATOM 1581 CB SER A 100 -3.600 -2.149 -4.499 1.00 0.00 C ATOM 1582 OG SER A 100 -2.557 -1.619 -3.700 1.00 0.00 O ATOM 0 H SER A 100 -4.833 -3.528 -6.447 1.00 0.00 H new ATOM 0 HA SER A 100 -2.632 -1.542 -6.323 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.434 -1.448 -4.523 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.971 -3.071 -4.051 1.00 0.00 H new ATOM 0 HG SER A 100 -2.892 -1.450 -2.795 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.922 -3.279 -6.441 1.00 0.00 N ATOM 1589 CA VAL A 101 0.163 -4.244 -6.490 1.00 0.00 C ATOM 1590 C VAL A 101 1.182 -3.938 -5.397 1.00 0.00 C ATOM 1591 O VAL A 101 1.481 -2.783 -5.113 1.00 0.00 O ATOM 1592 CB VAL A 101 0.848 -4.297 -7.885 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.220 -3.312 -8.843 1.00 0.00 C ATOM 1594 CG2 VAL A 101 2.347 -4.098 -7.782 1.00 0.00 C ATOM 0 H VAL A 101 -0.684 -2.368 -6.832 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.267 -5.230 -6.316 1.00 0.00 H new ATOM 0 HB VAL A 101 0.686 -5.296 -8.289 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.721 -3.374 -9.809 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.837 -3.548 -8.967 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.322 -2.302 -8.445 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.789 -4.142 -8.777 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.555 -3.126 -7.335 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.776 -4.883 -7.160 1.00 0.00 H new ATOM 1604 N THR A 102 1.667 -4.978 -4.759 1.00 0.00 N ATOM 1605 CA THR A 102 2.728 -4.857 -3.787 1.00 0.00 C ATOM 1606 C THR A 102 3.833 -5.786 -4.215 1.00 0.00 C ATOM 1607 O THR A 102 3.541 -6.876 -4.684 1.00 0.00 O ATOM 1608 CB THR A 102 2.291 -5.238 -2.367 1.00 0.00 C ATOM 1609 OG1 THR A 102 0.865 -5.202 -2.257 1.00 0.00 O ATOM 1610 CG2 THR A 102 2.897 -4.283 -1.349 1.00 0.00 C ATOM 0 H THR A 102 1.336 -5.933 -4.900 1.00 0.00 H new ATOM 0 HA THR A 102 3.042 -3.814 -3.752 1.00 0.00 H new ATOM 0 HB THR A 102 2.643 -6.250 -2.165 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.478 -5.938 -2.775 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.576 -4.568 -0.347 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.984 -4.329 -1.409 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.565 -3.267 -1.561 1.00 0.00 H new ATOM 1618 N GLU A 103 5.067 -5.334 -4.123 1.00 0.00 N ATOM 1619 CA GLU A 103 6.221 -6.095 -4.550 1.00 0.00 C ATOM 1620 C GLU A 103 7.275 -6.111 -3.432 1.00 0.00 C ATOM 1621 O GLU A 103 7.495 -5.097 -2.779 1.00 0.00 O ATOM 1622 CB GLU A 103 6.751 -5.441 -5.822 1.00 0.00 C ATOM 1623 CG GLU A 103 7.970 -6.076 -6.394 1.00 0.00 C ATOM 1624 CD GLU A 103 8.484 -5.355 -7.620 1.00 0.00 C ATOM 1625 OE1 GLU A 103 7.679 -5.030 -8.512 1.00 0.00 O ATOM 1626 OE2 GLU A 103 9.699 -5.081 -7.678 1.00 0.00 O ATOM 0 H GLU A 103 5.298 -4.416 -3.744 1.00 0.00 H new ATOM 0 HA GLU A 103 5.962 -7.133 -4.758 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.964 -5.456 -6.576 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.970 -4.394 -5.611 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.753 -6.098 -5.636 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.748 -7.111 -6.653 1.00 0.00 H new ATOM 1633 N PHE A 104 7.891 -7.267 -3.178 1.00 0.00 N ATOM 1634 CA PHE A 104 8.873 -7.375 -2.093 1.00 0.00 C ATOM 1635 C PHE A 104 10.306 -7.456 -2.624 1.00 0.00 C ATOM 1636 O PHE A 104 10.693 -8.464 -3.207 1.00 0.00 O ATOM 1637 CB PHE A 104 8.586 -8.617 -1.253 1.00 0.00 C ATOM 1638 CG PHE A 104 8.873 -8.421 0.210 1.00 0.00 C ATOM 1639 CD1 PHE A 104 10.176 -8.410 0.679 1.00 0.00 C ATOM 1640 CD2 PHE A 104 7.840 -8.243 1.115 1.00 0.00 C ATOM 1641 CE1 PHE A 104 10.441 -8.224 2.021 1.00 0.00 C ATOM 1642 CE2 PHE A 104 8.101 -8.059 2.459 1.00 0.00 C ATOM 1643 CZ PHE A 104 9.404 -8.049 2.912 1.00 0.00 C ATOM 0 H PHE A 104 7.732 -8.130 -3.698 1.00 0.00 H new ATOM 0 HA PHE A 104 8.783 -6.475 -1.485 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.540 -8.898 -1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 104 9.186 -9.447 -1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 104 10.994 -8.548 -0.013 1.00 0.00 H new ATOM 0 HD2 PHE A 104 6.818 -8.248 0.766 1.00 0.00 H new ATOM 0 HE1 PHE A 104 11.462 -8.216 2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 104 7.286 -7.923 3.154 1.00 0.00 H new ATOM 0 HZ PHE A 104 9.611 -7.904 3.962 1.00 0.00 H new ATOM 1653 N ASN A 105 11.093 -6.406 -2.413 1.00 0.00 N ATOM 1654 CA ASN A 105 12.496 -6.410 -2.830 1.00 0.00 C ATOM 1655 C ASN A 105 13.431 -6.346 -1.630 1.00 0.00 C ATOM 1656 O ASN A 105 13.682 -5.267 -1.092 1.00 0.00 O ATOM 1657 CB ASN A 105 12.799 -5.237 -3.764 1.00 0.00 C ATOM 1658 CG ASN A 105 12.266 -5.448 -5.165 1.00 0.00 C ATOM 1659 OD1 ASN A 105 12.936 -6.028 -6.017 1.00 0.00 O ATOM 1660 ND2 ASN A 105 11.062 -4.969 -5.416 1.00 0.00 N ATOM 0 H ASN A 105 10.788 -5.545 -1.959 1.00 0.00 H new ATOM 0 HA ASN A 105 12.665 -7.346 -3.363 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.366 -4.327 -3.349 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.877 -5.084 -3.810 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.655 -5.074 -6.345 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.539 -4.494 -4.681 1.00 0.00 H new ATOM 1667 N GLY A 106 13.962 -7.495 -1.236 1.00 0.00 N ATOM 1668 CA GLY A 106 14.909 -7.546 -0.134 1.00 0.00 C ATOM 1669 C GLY A 106 14.342 -7.017 1.171 1.00 0.00 C ATOM 1670 O GLY A 106 13.503 -7.658 1.797 1.00 0.00 O ATOM 0 H GLY A 106 13.754 -8.399 -1.661 1.00 0.00 H new ATOM 0 HA2 GLY A 106 15.233 -8.577 0.010 1.00 0.00 H new ATOM 0 HA3 GLY A 106 15.794 -6.968 -0.398 1.00 0.00 H new ATOM 1674 N ASP A 107 14.812 -5.843 1.576 1.00 0.00 N ATOM 1675 CA ASP A 107 14.359 -5.212 2.815 1.00 0.00 C ATOM 1676 C ASP A 107 13.455 -4.023 2.513 1.00 0.00 C ATOM 1677 O ASP A 107 12.965 -3.347 3.418 1.00 0.00 O ATOM 1678 CB ASP A 107 15.558 -4.753 3.651 1.00 0.00 C ATOM 1679 CG ASP A 107 16.267 -3.547 3.060 1.00 0.00 C ATOM 1680 OD1 ASP A 107 16.944 -3.691 2.019 1.00 0.00 O ATOM 1681 OD2 ASP A 107 16.167 -2.450 3.647 1.00 0.00 O ATOM 0 H ASP A 107 15.510 -5.305 1.063 1.00 0.00 H new ATOM 0 HA ASP A 107 13.792 -5.949 3.383 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.220 -4.511 4.659 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.267 -5.576 3.742 1.00 0.00 H new ATOM 1686 N THR A 108 13.240 -3.777 1.233 1.00 0.00 N ATOM 1687 CA THR A 108 12.379 -2.702 0.789 1.00 0.00 C ATOM 1688 C THR A 108 11.103 -3.263 0.159 1.00 0.00 C ATOM 1689 O THR A 108 11.082 -4.397 -0.323 1.00 0.00 O ATOM 1690 CB THR A 108 13.093 -1.816 -0.243 1.00 0.00 C ATOM 1691 OG1 THR A 108 13.970 -2.599 -1.067 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.872 -0.724 0.449 1.00 0.00 C ATOM 0 H THR A 108 13.658 -4.317 0.475 1.00 0.00 H new ATOM 0 HA THR A 108 12.125 -2.102 1.663 1.00 0.00 H new ATOM 0 HB THR A 108 12.335 -1.360 -0.880 1.00 0.00 H new ATOM 0 HG1 THR A 108 13.576 -3.484 -1.215 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.372 -0.105 -0.296 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.191 -0.107 1.035 1.00 0.00 H new ATOM 0 HG23 THR A 108 14.616 -1.170 1.109 1.00 0.00 H new ATOM 1700 N ILE A 109 10.046 -2.473 0.160 1.00 0.00 N ATOM 1701 CA ILE A 109 8.787 -2.885 -0.443 1.00 0.00 C ATOM 1702 C ILE A 109 8.398 -1.937 -1.567 1.00 0.00 C ATOM 1703 O ILE A 109 8.555 -0.733 -1.449 1.00 0.00 O ATOM 1704 CB ILE A 109 7.650 -2.923 0.593 1.00 0.00 C ATOM 1705 CG1 ILE A 109 8.091 -3.698 1.830 1.00 0.00 C ATOM 1706 CG2 ILE A 109 6.404 -3.553 -0.011 1.00 0.00 C ATOM 1707 CD1 ILE A 109 6.996 -3.878 2.854 1.00 0.00 C ATOM 0 H ILE A 109 10.032 -1.540 0.572 1.00 0.00 H new ATOM 0 HA ILE A 109 8.935 -3.889 -0.840 1.00 0.00 H new ATOM 0 HB ILE A 109 7.412 -1.901 0.888 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.455 -4.679 1.523 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.929 -3.178 2.294 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.609 -3.573 0.734 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.081 -2.967 -0.872 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.629 -4.571 -0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.383 -4.438 3.706 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.648 -2.901 3.190 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.166 -4.425 2.407 1.00 0.00 H new ATOM 1719 N THR A 110 7.898 -2.484 -2.651 1.00 0.00 N ATOM 1720 CA THR A 110 7.478 -1.687 -3.783 1.00 0.00 C ATOM 1721 C THR A 110 5.956 -1.746 -3.943 1.00 0.00 C ATOM 1722 O THR A 110 5.394 -2.779 -4.278 1.00 0.00 O ATOM 1723 CB THR A 110 8.174 -2.180 -5.060 1.00 0.00 C ATOM 1724 OG1 THR A 110 9.010 -3.304 -4.752 1.00 0.00 O ATOM 1725 CG2 THR A 110 9.025 -1.068 -5.644 1.00 0.00 C ATOM 0 H THR A 110 7.771 -3.489 -2.774 1.00 0.00 H new ATOM 0 HA THR A 110 7.763 -0.650 -3.608 1.00 0.00 H new ATOM 0 HB THR A 110 7.416 -2.477 -5.786 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.708 -3.030 -4.121 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.516 -1.423 -6.550 1.00 0.00 H new ATOM 0 HG22 THR A 110 8.392 -0.214 -5.886 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.779 -0.766 -4.917 1.00 0.00 H new ATOM 1733 N ASN A 111 5.302 -0.631 -3.684 1.00 0.00 N ATOM 1734 CA ASN A 111 3.847 -0.550 -3.696 1.00 0.00 C ATOM 1735 C ASN A 111 3.374 0.154 -4.958 1.00 0.00 C ATOM 1736 O ASN A 111 3.705 1.314 -5.168 1.00 0.00 O ATOM 1737 CB ASN A 111 3.364 0.252 -2.481 1.00 0.00 C ATOM 1738 CG ASN A 111 1.875 0.099 -2.241 1.00 0.00 C ATOM 1739 OD1 ASN A 111 1.070 0.885 -2.734 1.00 0.00 O ATOM 1740 ND2 ASN A 111 1.499 -0.912 -1.473 1.00 0.00 N ATOM 0 H ASN A 111 5.763 0.250 -3.458 1.00 0.00 H new ATOM 0 HA ASN A 111 3.442 -1.561 -3.664 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.907 -0.075 -1.594 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.599 1.306 -2.628 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.510 -1.060 -1.272 1.00 0.00 H new ATOM 0 HD22 ASN A 111 2.198 -1.543 -1.082 1.00 0.00 H new ATOM 1747 N THR A 112 2.621 -0.527 -5.801 1.00 0.00 N ATOM 1748 CA THR A 112 2.098 0.106 -6.996 1.00 0.00 C ATOM 1749 C THR A 112 0.570 0.123 -6.950 1.00 0.00 C ATOM 1750 O THR A 112 -0.070 -0.915 -7.008 1.00 0.00 O ATOM 1751 CB THR A 112 2.564 -0.631 -8.267 1.00 0.00 C ATOM 1752 OG1 THR A 112 3.974 -0.897 -8.199 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.259 0.191 -9.503 1.00 0.00 C ATOM 0 H THR A 112 2.360 -1.506 -5.683 1.00 0.00 H new ATOM 0 HA THR A 112 2.478 1.127 -7.030 1.00 0.00 H new ATOM 0 HB THR A 112 2.024 -1.575 -8.331 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.258 -1.367 -9.011 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.596 -0.346 -10.390 1.00 0.00 H new ATOM 0 HG22 THR A 112 1.185 0.364 -9.569 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.777 1.148 -9.440 1.00 0.00 H new ATOM 1761 N MET A 113 -0.012 1.294 -6.863 1.00 0.00 N ATOM 1762 CA MET A 113 -1.456 1.421 -6.853 1.00 0.00 C ATOM 1763 C MET A 113 -1.931 1.891 -8.208 1.00 0.00 C ATOM 1764 O MET A 113 -1.300 2.728 -8.833 1.00 0.00 O ATOM 1765 CB MET A 113 -1.927 2.423 -5.809 1.00 0.00 C ATOM 1766 CG MET A 113 -3.436 2.451 -5.689 1.00 0.00 C ATOM 1767 SD MET A 113 -4.036 3.808 -4.663 1.00 0.00 S ATOM 1768 CE MET A 113 -3.306 3.396 -3.081 1.00 0.00 C ATOM 0 H MET A 113 0.491 2.179 -6.798 1.00 0.00 H new ATOM 0 HA MET A 113 -1.869 0.442 -6.611 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.491 2.171 -4.842 1.00 0.00 H new ATOM 0 HB3 MET A 113 -1.566 3.417 -6.072 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.873 2.535 -6.684 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.779 1.506 -5.269 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.660 4.096 -2.324 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.593 2.382 -2.801 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.220 3.459 -3.154 1.00 0.00 H new ATOM 1778 N THR A 114 -3.017 1.335 -8.680 1.00 0.00 N ATOM 1779 CA THR A 114 -3.551 1.738 -9.957 1.00 0.00 C ATOM 1780 C THR A 114 -5.028 2.113 -9.859 1.00 0.00 C ATOM 1781 O THR A 114 -5.854 1.294 -9.450 1.00 0.00 O ATOM 1782 CB THR A 114 -3.396 0.614 -10.978 1.00 0.00 C ATOM 1783 OG1 THR A 114 -2.153 -0.075 -10.771 1.00 0.00 O ATOM 1784 CG2 THR A 114 -3.429 1.183 -12.375 1.00 0.00 C ATOM 0 H THR A 114 -3.547 0.606 -8.203 1.00 0.00 H new ATOM 0 HA THR A 114 -2.987 2.614 -10.277 1.00 0.00 H new ATOM 0 HB THR A 114 -4.219 -0.089 -10.853 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.064 -0.795 -11.430 1.00 0.00 H new ATOM 0 HG21 THR A 114 -3.318 0.376 -13.099 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.380 1.690 -12.539 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.613 1.895 -12.497 1.00 0.00 H new ATOM 1792 N LEU A 115 -5.362 3.340 -10.227 1.00 0.00 N ATOM 1793 CA LEU A 115 -6.753 3.731 -10.358 1.00 0.00 C ATOM 1794 C LEU A 115 -7.023 4.088 -11.810 1.00 0.00 C ATOM 1795 O LEU A 115 -6.662 5.165 -12.256 1.00 0.00 O ATOM 1796 CB LEU A 115 -7.066 4.938 -9.475 1.00 0.00 C ATOM 1797 CG LEU A 115 -8.465 4.927 -8.843 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -8.883 6.324 -8.447 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -9.489 4.330 -9.784 1.00 0.00 C ATOM 0 H LEU A 115 -4.691 4.078 -10.439 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.386 2.901 -10.042 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.323 4.991 -8.679 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.959 5.844 -10.071 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.416 4.305 -7.949 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.877 6.294 -8.001 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.173 6.725 -7.724 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.901 6.963 -9.330 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.469 4.337 -9.307 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.528 4.919 -10.701 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.209 3.304 -10.023 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.723 3.211 -12.511 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.976 3.399 -13.929 1.00 0.00 C ATOM 1813 C GLY A 116 -6.742 3.807 -14.720 1.00 0.00 C ATOM 1814 O GLY A 116 -5.978 2.955 -15.174 1.00 0.00 O ATOM 0 H GLY A 116 -8.127 2.360 -12.119 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.374 2.473 -14.344 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.746 4.161 -14.054 1.00 0.00 H new ATOM 1818 N ASP A 117 -6.553 5.113 -14.875 1.00 0.00 N ATOM 1819 CA ASP A 117 -5.421 5.648 -15.621 1.00 0.00 C ATOM 1820 C ASP A 117 -4.276 6.042 -14.687 1.00 0.00 C ATOM 1821 O ASP A 117 -3.105 5.875 -15.032 1.00 0.00 O ATOM 1822 CB ASP A 117 -5.851 6.863 -16.439 1.00 0.00 C ATOM 1823 CG ASP A 117 -4.721 7.445 -17.267 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -4.537 7.001 -18.420 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -4.019 8.352 -16.777 1.00 0.00 O ATOM 0 H ASP A 117 -7.174 5.825 -14.491 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.067 4.864 -16.291 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.670 6.579 -17.100 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -6.235 7.630 -15.767 1.00 0.00 H new ATOM 1830 N ILE A 118 -4.615 6.542 -13.500 1.00 0.00 N ATOM 1831 CA ILE A 118 -3.601 7.036 -12.570 1.00 0.00 C ATOM 1832 C ILE A 118 -2.890 5.901 -11.869 1.00 0.00 C ATOM 1833 O ILE A 118 -3.522 4.966 -11.373 1.00 0.00 O ATOM 1834 CB ILE A 118 -4.165 7.974 -11.498 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -5.504 7.467 -11.023 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -4.304 9.360 -12.038 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -6.126 8.300 -9.968 1.00 0.00 C ATOM 0 H ILE A 118 -5.574 6.616 -13.162 1.00 0.00 H new ATOM 0 HA ILE A 118 -2.904 7.598 -13.192 1.00 0.00 H new ATOM 0 HB ILE A 118 -3.474 7.997 -10.656 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.182 7.412 -11.874 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -5.383 6.452 -10.645 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.706 10.014 -11.264 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.327 9.728 -12.352 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.980 9.351 -12.893 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -7.085 7.868 -9.682 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -5.470 8.336 -9.098 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.282 9.310 -10.347 1.00 0.00 H new ATOM 1849 N VAL A 119 -1.581 5.976 -11.832 1.00 0.00 N ATOM 1850 CA VAL A 119 -0.803 5.019 -11.089 1.00 0.00 C ATOM 1851 C VAL A 119 -0.150 5.708 -9.890 1.00 0.00 C ATOM 1852 O VAL A 119 0.205 6.882 -9.954 1.00 0.00 O ATOM 1853 CB VAL A 119 0.254 4.317 -11.972 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.551 5.104 -12.031 1.00 0.00 C ATOM 1855 CG2 VAL A 119 0.484 2.894 -11.492 1.00 0.00 C ATOM 0 H VAL A 119 -1.033 6.692 -12.309 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.476 4.239 -10.731 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.132 4.274 -12.990 1.00 0.00 H new ATOM 0 HG11 VAL A 119 2.268 4.577 -12.661 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.358 6.092 -12.448 1.00 0.00 H new ATOM 0 HG13 VAL A 119 1.959 5.208 -11.026 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.231 2.413 -12.124 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.837 2.910 -10.461 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.451 2.336 -11.546 1.00 0.00 H new ATOM 1865 N TYR A 120 -0.064 4.992 -8.795 1.00 0.00 N ATOM 1866 CA TYR A 120 0.541 5.487 -7.573 1.00 0.00 C ATOM 1867 C TYR A 120 1.613 4.503 -7.144 1.00 0.00 C ATOM 1868 O TYR A 120 1.417 3.308 -7.248 1.00 0.00 O ATOM 1869 CB TYR A 120 -0.525 5.623 -6.479 1.00 0.00 C ATOM 1870 CG TYR A 120 -0.015 6.240 -5.200 1.00 0.00 C ATOM 1871 CD1 TYR A 120 0.828 7.336 -5.232 1.00 0.00 C ATOM 1872 CD2 TYR A 120 -0.380 5.729 -3.961 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.296 7.910 -4.074 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.084 6.298 -2.793 1.00 0.00 C ATOM 1875 CZ TYR A 120 0.923 7.391 -2.856 1.00 0.00 C ATOM 1876 OH TYR A 120 1.388 7.969 -1.695 1.00 0.00 O ATOM 0 H TYR A 120 -0.415 4.037 -8.722 1.00 0.00 H new ATOM 0 HA TYR A 120 0.983 6.469 -7.741 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -1.347 6.229 -6.860 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.932 4.636 -6.258 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.124 7.749 -6.185 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -1.037 4.873 -3.911 1.00 0.00 H new ATOM 0 HE1 TYR A 120 1.954 8.765 -4.120 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -0.208 5.891 -1.836 1.00 0.00 H new ATOM 0 HH TYR A 120 2.344 8.164 -1.787 1.00 0.00 H new ATOM 1886 N LYS A 121 2.756 4.976 -6.715 1.00 0.00 N ATOM 1887 CA LYS A 121 3.803 4.062 -6.302 1.00 0.00 C ATOM 1888 C LYS A 121 4.421 4.492 -4.987 1.00 0.00 C ATOM 1889 O LYS A 121 4.504 5.680 -4.697 1.00 0.00 O ATOM 1890 CB LYS A 121 4.882 3.982 -7.371 1.00 0.00 C ATOM 1891 CG LYS A 121 5.264 2.570 -7.747 1.00 0.00 C ATOM 1892 CD LYS A 121 6.337 2.013 -6.836 1.00 0.00 C ATOM 1893 CE LYS A 121 6.617 0.562 -7.165 1.00 0.00 C ATOM 1894 NZ LYS A 121 7.305 0.408 -8.474 1.00 0.00 N ATOM 0 H LYS A 121 2.988 5.967 -6.641 1.00 0.00 H new ATOM 0 HA LYS A 121 3.352 3.079 -6.165 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.536 4.505 -8.263 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.770 4.507 -7.018 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.382 1.931 -7.702 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.618 2.552 -8.778 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.251 2.598 -6.942 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.021 2.101 -5.797 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.232 0.125 -6.379 1.00 0.00 H new ATOM 0 HE3 LYS A 121 5.679 0.007 -7.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 7.568 -0.589 -8.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.667 0.708 -9.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.162 0.997 -8.487 1.00 0.00 H new ATOM 1908 N ARG A 122 4.802 3.522 -4.175 1.00 0.00 N ATOM 1909 CA ARG A 122 5.614 3.776 -3.003 1.00 0.00 C ATOM 1910 C ARG A 122 6.681 2.708 -2.848 1.00 0.00 C ATOM 1911 O ARG A 122 6.476 1.565 -3.216 1.00 0.00 O ATOM 1912 CB ARG A 122 4.794 3.835 -1.713 1.00 0.00 C ATOM 1913 CG ARG A 122 3.769 4.944 -1.634 1.00 0.00 C ATOM 1914 CD ARG A 122 2.997 4.859 -0.328 1.00 0.00 C ATOM 1915 NE ARG A 122 2.333 6.115 0.012 1.00 0.00 N ATOM 1916 CZ ARG A 122 2.135 6.533 1.262 1.00 0.00 C ATOM 1917 NH1 ARG A 122 2.489 5.768 2.287 1.00 0.00 N ATOM 1918 NH2 ARG A 122 1.568 7.711 1.487 1.00 0.00 N ATOM 0 H ARG A 122 4.558 2.541 -4.310 1.00 0.00 H new ATOM 0 HA ARG A 122 6.071 4.753 -3.161 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.280 2.882 -1.588 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.481 3.940 -0.873 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.265 5.912 -1.709 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.081 4.872 -2.476 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.252 4.066 -0.401 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.679 4.583 0.476 1.00 0.00 H new ATOM 0 HE ARG A 122 2.002 6.706 -0.751 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.914 4.856 2.120 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.336 6.092 3.242 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.283 8.298 0.703 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.417 8.030 2.444 1.00 0.00 H new ATOM 1932 N VAL A 123 7.826 3.091 -2.336 1.00 0.00 N ATOM 1933 CA VAL A 123 8.842 2.139 -1.950 1.00 0.00 C ATOM 1934 C VAL A 123 9.075 2.248 -0.450 1.00 0.00 C ATOM 1935 O VAL A 123 9.473 3.302 0.036 1.00 0.00 O ATOM 1936 CB VAL A 123 10.162 2.389 -2.693 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.148 1.256 -2.449 1.00 0.00 C ATOM 1938 CG2 VAL A 123 9.887 2.571 -4.174 1.00 0.00 C ATOM 0 H VAL A 123 8.080 4.066 -2.175 1.00 0.00 H new ATOM 0 HA VAL A 123 8.495 1.139 -2.212 1.00 0.00 H new ATOM 0 HB VAL A 123 10.618 3.302 -2.309 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.075 1.458 -2.987 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.357 1.179 -1.382 1.00 0.00 H new ATOM 0 HG13 VAL A 123 10.720 0.318 -2.803 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.826 2.748 -4.699 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.414 1.672 -4.569 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.224 3.424 -4.319 1.00 0.00 H new ATOM 1948 N SER A 124 8.828 1.180 0.282 1.00 0.00 N ATOM 1949 CA SER A 124 8.965 1.212 1.724 1.00 0.00 C ATOM 1950 C SER A 124 10.303 0.634 2.135 1.00 0.00 C ATOM 1951 O SER A 124 10.832 -0.257 1.482 1.00 0.00 O ATOM 1952 CB SER A 124 7.828 0.443 2.397 1.00 0.00 C ATOM 1953 OG SER A 124 6.570 0.814 1.852 1.00 0.00 O ATOM 0 H SER A 124 8.532 0.281 -0.097 1.00 0.00 H new ATOM 0 HA SER A 124 8.913 2.251 2.049 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.983 -0.628 2.268 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.836 0.639 3.469 1.00 0.00 H new ATOM 0 HG SER A 124 5.859 0.308 2.297 1.00 0.00 H new ATOM 1959 N LYS A 125 10.841 1.158 3.211 1.00 0.00 N ATOM 1960 CA LYS A 125 12.160 0.791 3.671 1.00 0.00 C ATOM 1961 C LYS A 125 12.082 0.180 5.053 1.00 0.00 C ATOM 1962 O LYS A 125 11.283 0.598 5.888 1.00 0.00 O ATOM 1963 CB LYS A 125 13.034 2.045 3.721 1.00 0.00 C ATOM 1964 CG LYS A 125 14.267 1.981 2.847 1.00 0.00 C ATOM 1965 CD LYS A 125 15.152 0.830 3.244 1.00 0.00 C ATOM 1966 CE LYS A 125 16.443 0.807 2.446 1.00 0.00 C ATOM 1967 NZ LYS A 125 17.389 -0.209 2.971 1.00 0.00 N ATOM 0 H LYS A 125 10.375 1.853 3.794 1.00 0.00 H new ATOM 0 HA LYS A 125 12.589 0.060 2.986 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.434 2.904 3.420 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.343 2.217 4.752 1.00 0.00 H new ATOM 0 HG2 LYS A 125 13.972 1.874 1.803 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.822 2.915 2.927 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.383 0.900 4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.617 -0.108 3.095 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.222 0.594 1.400 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.910 1.791 2.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.280 -0.163 2.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 17.579 -0.020 3.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.972 -1.156 2.870 1.00 0.00 H new ATOM 1981 N ARG A 126 12.909 -0.814 5.279 1.00 0.00 N ATOM 1982 CA ARG A 126 13.012 -1.442 6.573 1.00 0.00 C ATOM 1983 C ARG A 126 13.565 -0.452 7.585 1.00 0.00 C ATOM 1984 O ARG A 126 14.577 0.203 7.324 1.00 0.00 O ATOM 1985 CB ARG A 126 13.949 -2.634 6.482 1.00 0.00 C ATOM 1986 CG ARG A 126 13.334 -3.945 6.913 1.00 0.00 C ATOM 1987 CD ARG A 126 14.425 -4.936 7.252 1.00 0.00 C ATOM 1988 NE ARG A 126 15.239 -4.464 8.377 1.00 0.00 N ATOM 1989 CZ ARG A 126 16.054 -5.232 9.096 1.00 0.00 C ATOM 1990 NH1 ARG A 126 16.267 -6.496 8.748 1.00 0.00 N ATOM 1991 NH2 ARG A 126 16.690 -4.720 10.141 1.00 0.00 N ATOM 0 H ARG A 126 13.528 -1.209 4.571 1.00 0.00 H new ATOM 0 HA ARG A 126 12.022 -1.771 6.890 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.296 -2.730 5.453 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.827 -2.439 7.098 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.691 -3.788 7.779 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.705 -4.341 6.116 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.980 -5.900 7.501 1.00 0.00 H new ATOM 0 HD3 ARG A 126 15.061 -5.093 6.381 1.00 0.00 H new ATOM 0 HE ARG A 126 15.176 -3.477 8.626 1.00 0.00 H new ATOM 0 HH11 ARG A 126 15.805 -6.883 7.925 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.893 -7.079 9.303 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.554 -3.741 10.391 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.315 -5.306 10.694 1.00 0.00 H new ATOM 2005 N ILE A 127 12.923 -0.345 8.733 1.00 0.00 N ATOM 2006 CA ILE A 127 13.397 0.551 9.773 1.00 0.00 C ATOM 2007 C ILE A 127 14.198 -0.212 10.816 1.00 0.00 C ATOM 2008 O ILE A 127 13.584 -0.860 11.683 1.00 0.00 O ATOM 2009 CB ILE A 127 12.254 1.322 10.460 1.00 0.00 C ATOM 2010 CG1 ILE A 127 10.968 0.500 10.458 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.063 2.675 9.811 1.00 0.00 C ATOM 2012 CD1 ILE A 127 9.828 1.184 9.780 1.00 0.00 C ATOM 2013 OXT ILE A 127 15.445 -0.171 10.753 1.00 0.00 O ATOM 0 H ILE A 127 12.077 -0.863 8.969 1.00 0.00 H new ATOM 0 HA ILE A 127 14.038 1.283 9.281 1.00 0.00 H new ATOM 0 HB ILE A 127 12.524 1.494 11.502 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.156 -0.453 9.964 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.687 0.276 11.487 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.252 3.206 10.309 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.983 3.254 9.898 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.817 2.542 8.758 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.947 0.544 9.815 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.614 2.124 10.288 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.090 1.384 8.741 1.00 0.00 H new TER 2025 ILE A 127