USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1011 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 94 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 98 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 48 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.00753) USER MOD Set 3.1: A 40 ASN : amide:sc= -0.408 K(o=-0.41,f=-1.5!) USER MOD Set 3.2: A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 38 LYS NZ :NH3+ 146:sc= -0.0324 (180deg=0) USER MOD Set 4.2: A 42 LYS NZ :NH3+ -166:sc= -0.678 (180deg=-0.955) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -167:sc=-0.00271 (180deg=-0.116) USER MOD Single : A 46 THR OG1 : rot 91:sc= 1.25 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 149:sc= 0.611 USER MOD Single : A 52 LYS NZ :NH3+ -148:sc= -0.266 (180deg=-1.34) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -7.78! C(o=-7.8!,f=-18!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.554) USER MOD Single : A 72 LYS NZ :NH3+ -160:sc= -4.09! (180deg=-5.58!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.072 K(o=-0.072,f=-0.64) USER MOD Single : A 97 HIS : no HD1:sc=-0.00599 X(o=-0.006,f=-0.019) USER MOD Single : A 101 TYR OH : rot 130:sc= -1.61! USER MOD Single : A 106 SER OG : rot 80:sc= -2.02 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= -0.507 K(o=-0.51,f=-1.4) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.298 USER MOD Single : A 117 LYS NZ :NH3+ 150:sc= -0.154 (180deg=-0.782) USER MOD Single : A 120 THR OG1 : rot 140:sc= 0.0105 USER MOD Single : A 121 SER OG : rot 180:sc= 0.352 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 ASN : amide:sc= -0.0135 X(o=-0.013,f=0) USER MOD Single : A 131 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0261) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= 0.335 K(o=0.34,f=-2.4!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 TYR OH : rot -103:sc= -2.56! USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 SER OG : rot 170:sc= -0.145 USER MOD Single : A 147 ASN : amide:sc= -0.951 K(o=-0.95,f=-3.5!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN : amide:sc= -0.582 K(o=-0.58,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 36 0.925 -0.743 0.605 1.00 63.44 N ATOM 2 CA SER A 36 1.563 -0.771 -0.707 1.00 10.45 C ATOM 3 C SER A 36 1.202 -2.047 -1.460 1.00 31.43 C ATOM 4 O SER A 36 0.583 -2.001 -2.523 1.00 33.41 O ATOM 5 CB SER A 36 3.082 -0.663 -0.561 1.00 21.44 C ATOM 6 OG SER A 36 3.504 0.689 -0.599 1.00 71.15 O ATOM 0 HA SER A 36 1.199 0.082 -1.279 1.00 10.45 H new ATOM 0 HB2 SER A 36 3.393 -1.118 0.379 1.00 21.44 H new ATOM 0 HB3 SER A 36 3.568 -1.221 -1.361 1.00 21.44 H new ATOM 0 HG SER A 36 4.478 0.730 -0.502 1.00 71.15 H new ATOM 12 N LYS A 37 1.594 -3.187 -0.901 1.00 33.33 N ATOM 13 CA LYS A 37 1.312 -4.479 -1.517 1.00 13.55 C ATOM 14 C LYS A 37 -0.186 -4.657 -1.744 1.00 61.24 C ATOM 15 O LYS A 37 -0.649 -4.710 -2.884 1.00 12.11 O ATOM 16 CB LYS A 37 1.844 -5.613 -0.638 1.00 14.14 C ATOM 17 CG LYS A 37 2.132 -6.892 -1.404 1.00 62.01 C ATOM 18 CD LYS A 37 0.914 -7.799 -1.454 1.00 41.14 C ATOM 19 CE LYS A 37 0.674 -8.485 -0.118 1.00 44.02 C ATOM 20 NZ LYS A 37 1.693 -9.536 0.156 1.00 3.45 N ATOM 0 H LYS A 37 2.108 -3.243 -0.022 1.00 33.33 H new ATOM 0 HA LYS A 37 1.815 -4.511 -2.484 1.00 13.55 H new ATOM 0 HB2 LYS A 37 2.758 -5.281 -0.145 1.00 14.14 H new ATOM 0 HB3 LYS A 37 1.117 -5.825 0.146 1.00 14.14 H new ATOM 0 HG2 LYS A 37 2.446 -6.647 -2.419 1.00 62.01 H new ATOM 0 HG3 LYS A 37 2.961 -7.420 -0.933 1.00 62.01 H new ATOM 0 HD2 LYS A 37 0.035 -7.215 -1.727 1.00 41.14 H new ATOM 0 HD3 LYS A 37 1.051 -8.551 -2.231 1.00 41.14 H new ATOM 0 HE2 LYS A 37 0.694 -7.743 0.680 1.00 44.02 H new ATOM 0 HE3 LYS A 37 -0.320 -8.932 -0.113 1.00 44.02 H new ATOM 0 HZ1 LYS A 37 1.379 -10.125 0.954 1.00 3.45 H new ATOM 0 HZ2 LYS A 37 1.813 -10.132 -0.688 1.00 3.45 H new ATOM 0 HZ3 LYS A 37 2.600 -9.086 0.394 1.00 3.45 H new ATOM 34 N LYS A 38 -0.939 -4.749 -0.654 1.00 1.44 N ATOM 35 CA LYS A 38 -2.385 -4.918 -0.733 1.00 61.44 C ATOM 36 C LYS A 38 -3.021 -3.794 -1.544 1.00 42.32 C ATOM 37 O LYS A 38 -3.987 -4.012 -2.276 1.00 51.02 O ATOM 38 CB LYS A 38 -2.993 -4.956 0.670 1.00 21.34 C ATOM 39 CG LYS A 38 -2.721 -3.703 1.485 1.00 74.31 C ATOM 40 CD LYS A 38 -3.853 -2.698 1.355 1.00 41.52 C ATOM 41 CE LYS A 38 -4.839 -2.816 2.507 1.00 42.41 C ATOM 42 NZ LYS A 38 -5.366 -1.487 2.925 1.00 44.24 N ATOM 0 H LYS A 38 -0.571 -4.709 0.297 1.00 1.44 H new ATOM 0 HA LYS A 38 -2.587 -5.864 -1.235 1.00 61.44 H new ATOM 0 HB2 LYS A 38 -4.070 -5.098 0.586 1.00 21.34 H new ATOM 0 HB3 LYS A 38 -2.598 -5.820 1.205 1.00 21.34 H new ATOM 0 HG2 LYS A 38 -2.589 -3.971 2.533 1.00 74.31 H new ATOM 0 HG3 LYS A 38 -1.788 -3.247 1.153 1.00 74.31 H new ATOM 0 HD2 LYS A 38 -3.443 -1.688 1.328 1.00 41.52 H new ATOM 0 HD3 LYS A 38 -4.374 -2.856 0.411 1.00 41.52 H new ATOM 0 HE2 LYS A 38 -5.668 -3.459 2.211 1.00 42.41 H new ATOM 0 HE3 LYS A 38 -4.351 -3.296 3.355 1.00 42.41 H new ATOM 0 HZ1 LYS A 38 -6.353 -1.587 3.236 1.00 44.24 H new ATOM 0 HZ2 LYS A 38 -4.792 -1.117 3.709 1.00 44.24 H new ATOM 0 HZ3 LYS A 38 -5.322 -0.828 2.122 1.00 44.24 H new ATOM 56 N LEU A 39 -2.472 -2.591 -1.410 1.00 75.24 N ATOM 57 CA LEU A 39 -2.985 -1.432 -2.132 1.00 54.22 C ATOM 58 C LEU A 39 -2.969 -1.676 -3.638 1.00 21.54 C ATOM 59 O LEU A 39 -4.000 -1.587 -4.302 1.00 52.12 O ATOM 60 CB LEU A 39 -2.157 -0.190 -1.797 1.00 33.13 C ATOM 61 CG LEU A 39 -2.428 0.449 -0.434 1.00 25.20 C ATOM 62 CD1 LEU A 39 -1.381 1.508 -0.124 1.00 21.30 C ATOM 63 CD2 LEU A 39 -3.825 1.050 -0.394 1.00 70.25 C ATOM 0 H LEU A 39 -1.672 -2.393 -0.808 1.00 75.24 H new ATOM 0 HA LEU A 39 -4.017 -1.269 -1.820 1.00 54.22 H new ATOM 0 HB2 LEU A 39 -1.101 -0.457 -1.847 1.00 33.13 H new ATOM 0 HB3 LEU A 39 -2.334 0.559 -2.569 1.00 33.13 H new ATOM 0 HG LEU A 39 -2.367 -0.328 0.328 1.00 25.20 H new ATOM 0 HD11 LEU A 39 -1.590 1.952 0.849 1.00 21.30 H new ATOM 0 HD12 LEU A 39 -0.392 1.049 -0.109 1.00 21.30 H new ATOM 0 HD13 LEU A 39 -1.410 2.283 -0.890 1.00 21.30 H new ATOM 0 HD21 LEU A 39 -4.000 1.500 0.583 1.00 70.25 H new ATOM 0 HD22 LEU A 39 -3.915 1.814 -1.166 1.00 70.25 H new ATOM 0 HD23 LEU A 39 -4.563 0.267 -0.570 1.00 70.25 H new ATOM 75 N ASN A 40 -1.791 -1.988 -4.168 1.00 42.14 N ATOM 76 CA ASN A 40 -1.640 -2.248 -5.596 1.00 13.54 C ATOM 77 C ASN A 40 -2.695 -3.236 -6.083 1.00 54.20 C ATOM 78 O ASN A 40 -3.352 -3.010 -7.100 1.00 3.41 O ATOM 79 CB ASN A 40 -0.241 -2.791 -5.891 1.00 60.14 C ATOM 80 CG ASN A 40 -0.146 -3.427 -7.265 1.00 11.11 C ATOM 81 OD1 ASN A 40 -0.853 -3.034 -8.193 1.00 42.13 O ATOM 82 ND2 ASN A 40 0.730 -4.415 -7.400 1.00 23.41 N ATOM 0 H ASN A 40 -0.927 -2.067 -3.631 1.00 42.14 H new ATOM 0 HA ASN A 40 -1.776 -1.307 -6.128 1.00 13.54 H new ATOM 0 HB2 ASN A 40 0.484 -1.980 -5.818 1.00 60.14 H new ATOM 0 HB3 ASN A 40 0.027 -3.527 -5.133 1.00 60.14 H new ATOM 0 HD21 ASN A 40 0.838 -4.881 -8.301 1.00 23.41 H new ATOM 0 HD22 ASN A 40 1.295 -4.708 -6.603 1.00 23.41 H new ATOM 89 N LYS A 41 -2.854 -4.333 -5.350 1.00 40.22 N ATOM 90 CA LYS A 41 -3.830 -5.356 -5.705 1.00 72.10 C ATOM 91 C LYS A 41 -5.232 -4.762 -5.796 1.00 32.21 C ATOM 92 O LYS A 41 -5.856 -4.775 -6.857 1.00 62.24 O ATOM 93 CB LYS A 41 -3.810 -6.488 -4.675 1.00 70.25 C ATOM 94 CG LYS A 41 -2.437 -7.107 -4.478 1.00 41.34 C ATOM 95 CD LYS A 41 -2.109 -8.099 -5.582 1.00 5.34 C ATOM 96 CE LYS A 41 -1.303 -7.447 -6.696 1.00 34.15 C ATOM 97 NZ LYS A 41 0.160 -7.499 -6.425 1.00 41.32 N ATOM 0 H LYS A 41 -2.319 -4.536 -4.506 1.00 40.22 H new ATOM 0 HA LYS A 41 -3.560 -5.757 -6.682 1.00 72.10 H new ATOM 0 HB2 LYS A 41 -4.167 -6.105 -3.719 1.00 70.25 H new ATOM 0 HB3 LYS A 41 -4.508 -7.265 -4.988 1.00 70.25 H new ATOM 0 HG2 LYS A 41 -1.682 -6.321 -4.458 1.00 41.34 H new ATOM 0 HG3 LYS A 41 -2.399 -7.611 -3.512 1.00 41.34 H new ATOM 0 HD2 LYS A 41 -1.547 -8.935 -5.166 1.00 5.34 H new ATOM 0 HD3 LYS A 41 -3.033 -8.508 -5.991 1.00 5.34 H new ATOM 0 HE2 LYS A 41 -1.516 -7.949 -7.640 1.00 34.15 H new ATOM 0 HE3 LYS A 41 -1.615 -6.409 -6.810 1.00 34.15 H new ATOM 0 HZ1 LYS A 41 0.674 -7.045 -7.207 1.00 41.32 H new ATOM 0 HZ2 LYS A 41 0.367 -6.998 -5.537 1.00 41.32 H new ATOM 0 HZ3 LYS A 41 0.463 -8.491 -6.341 1.00 41.32 H new ATOM 111 N LYS A 42 -5.723 -4.241 -4.677 1.00 4.35 N ATOM 112 CA LYS A 42 -7.050 -3.639 -4.630 1.00 21.05 C ATOM 113 C LYS A 42 -7.251 -2.673 -5.793 1.00 21.12 C ATOM 114 O LYS A 42 -8.353 -2.551 -6.328 1.00 63.34 O ATOM 115 CB LYS A 42 -7.253 -2.905 -3.302 1.00 42.22 C ATOM 116 CG LYS A 42 -7.678 -3.815 -2.163 1.00 11.53 C ATOM 117 CD LYS A 42 -8.682 -3.132 -1.249 1.00 52.21 C ATOM 118 CE LYS A 42 -8.094 -1.885 -0.607 1.00 44.22 C ATOM 119 NZ LYS A 42 -6.847 -2.186 0.149 1.00 21.25 N ATOM 0 H LYS A 42 -5.221 -4.224 -3.789 1.00 4.35 H new ATOM 0 HA LYS A 42 -7.787 -4.438 -4.713 1.00 21.05 H new ATOM 0 HB2 LYS A 42 -6.325 -2.403 -3.028 1.00 42.22 H new ATOM 0 HB3 LYS A 42 -8.007 -2.129 -3.437 1.00 42.22 H new ATOM 0 HG2 LYS A 42 -8.116 -4.727 -2.569 1.00 11.53 H new ATOM 0 HG3 LYS A 42 -6.802 -4.111 -1.586 1.00 11.53 H new ATOM 0 HD2 LYS A 42 -9.571 -2.864 -1.820 1.00 52.21 H new ATOM 0 HD3 LYS A 42 -9.000 -3.827 -0.472 1.00 52.21 H new ATOM 0 HE2 LYS A 42 -7.881 -1.145 -1.379 1.00 44.22 H new ATOM 0 HE3 LYS A 42 -8.828 -1.442 0.066 1.00 44.22 H new ATOM 0 HZ1 LYS A 42 -6.608 -1.379 0.760 1.00 21.25 H new ATOM 0 HZ2 LYS A 42 -6.992 -3.033 0.735 1.00 21.25 H new ATOM 0 HZ3 LYS A 42 -6.069 -2.357 -0.519 1.00 21.25 H new ATOM 133 N VAL A 43 -6.179 -1.989 -6.180 1.00 70.02 N ATOM 134 CA VAL A 43 -6.237 -1.036 -7.282 1.00 14.10 C ATOM 135 C VAL A 43 -6.469 -1.746 -8.611 1.00 51.21 C ATOM 136 O VAL A 43 -7.384 -1.401 -9.360 1.00 61.15 O ATOM 137 CB VAL A 43 -4.944 -0.205 -7.375 1.00 24.32 C ATOM 138 CG1 VAL A 43 -5.001 0.741 -8.564 1.00 44.12 C ATOM 139 CG2 VAL A 43 -4.710 0.563 -6.083 1.00 31.44 C ATOM 0 H VAL A 43 -5.260 -2.077 -5.747 1.00 70.02 H new ATOM 0 HA VAL A 43 -7.074 -0.369 -7.079 1.00 14.10 H new ATOM 0 HB VAL A 43 -4.106 -0.886 -7.523 1.00 24.32 H new ATOM 0 HG11 VAL A 43 -4.079 1.320 -8.613 1.00 44.12 H new ATOM 0 HG12 VAL A 43 -5.117 0.165 -9.482 1.00 44.12 H new ATOM 0 HG13 VAL A 43 -5.848 1.418 -8.450 1.00 44.12 H new ATOM 0 HG21 VAL A 43 -3.792 1.145 -6.167 1.00 31.44 H new ATOM 0 HG22 VAL A 43 -5.550 1.234 -5.901 1.00 31.44 H new ATOM 0 HG23 VAL A 43 -4.621 -0.139 -5.254 1.00 31.44 H new ATOM 149 N LEU A 44 -5.635 -2.739 -8.898 1.00 33.31 N ATOM 150 CA LEU A 44 -5.749 -3.500 -10.138 1.00 0.14 C ATOM 151 C LEU A 44 -7.163 -4.045 -10.314 1.00 65.03 C ATOM 152 O LEU A 44 -7.741 -3.962 -11.398 1.00 63.41 O ATOM 153 CB LEU A 44 -4.741 -4.651 -10.147 1.00 53.31 C ATOM 154 CG LEU A 44 -4.765 -5.553 -11.381 1.00 71.41 C ATOM 155 CD1 LEU A 44 -4.836 -4.720 -12.651 1.00 52.30 C ATOM 156 CD2 LEU A 44 -3.542 -6.459 -11.403 1.00 53.12 C ATOM 0 H LEU A 44 -4.872 -3.036 -8.289 1.00 33.31 H new ATOM 0 HA LEU A 44 -5.532 -2.829 -10.969 1.00 0.14 H new ATOM 0 HB2 LEU A 44 -3.740 -4.232 -10.047 1.00 53.31 H new ATOM 0 HB3 LEU A 44 -4.917 -5.269 -9.266 1.00 53.31 H new ATOM 0 HG LEU A 44 -5.656 -6.179 -11.332 1.00 71.41 H new ATOM 0 HD11 LEU A 44 -4.852 -5.380 -13.518 1.00 52.30 H new ATOM 0 HD12 LEU A 44 -5.742 -4.114 -12.639 1.00 52.30 H new ATOM 0 HD13 LEU A 44 -3.965 -4.068 -12.707 1.00 52.30 H new ATOM 0 HD21 LEU A 44 -3.576 -7.094 -12.288 1.00 53.12 H new ATOM 0 HD22 LEU A 44 -2.638 -5.850 -11.427 1.00 53.12 H new ATOM 0 HD23 LEU A 44 -3.535 -7.083 -10.509 1.00 53.12 H new ATOM 168 N LYS A 45 -7.715 -4.601 -9.241 1.00 52.33 N ATOM 169 CA LYS A 45 -9.063 -5.157 -9.275 1.00 44.32 C ATOM 170 C LYS A 45 -10.096 -4.064 -9.529 1.00 0.34 C ATOM 171 O LYS A 45 -10.945 -4.189 -10.412 1.00 63.41 O ATOM 172 CB LYS A 45 -9.374 -5.873 -7.959 1.00 53.31 C ATOM 173 CG LYS A 45 -8.312 -6.877 -7.547 1.00 10.25 C ATOM 174 CD LYS A 45 -7.996 -7.848 -8.671 1.00 72.43 C ATOM 175 CE LYS A 45 -6.968 -8.883 -8.242 1.00 21.45 C ATOM 176 NZ LYS A 45 -7.023 -10.106 -9.091 1.00 2.45 N ATOM 0 H LYS A 45 -7.250 -4.679 -8.337 1.00 52.33 H new ATOM 0 HA LYS A 45 -9.113 -5.876 -10.093 1.00 44.32 H new ATOM 0 HB2 LYS A 45 -9.486 -5.131 -7.169 1.00 53.31 H new ATOM 0 HB3 LYS A 45 -10.331 -6.387 -8.052 1.00 53.31 H new ATOM 0 HG2 LYS A 45 -7.404 -6.349 -7.256 1.00 10.25 H new ATOM 0 HG3 LYS A 45 -8.653 -7.430 -6.672 1.00 10.25 H new ATOM 0 HD2 LYS A 45 -8.910 -8.351 -8.986 1.00 72.43 H new ATOM 0 HD3 LYS A 45 -7.621 -7.298 -9.534 1.00 72.43 H new ATOM 0 HE2 LYS A 45 -5.970 -8.448 -8.297 1.00 21.45 H new ATOM 0 HE3 LYS A 45 -7.140 -9.156 -7.201 1.00 21.45 H new ATOM 0 HZ1 LYS A 45 -6.307 -10.787 -8.766 1.00 2.45 H new ATOM 0 HZ2 LYS A 45 -7.967 -10.536 -9.019 1.00 2.45 H new ATOM 0 HZ3 LYS A 45 -6.833 -9.850 -10.081 1.00 2.45 H new ATOM 190 N THR A 46 -10.018 -2.990 -8.749 1.00 13.32 N ATOM 191 CA THR A 46 -10.946 -1.875 -8.889 1.00 53.41 C ATOM 192 C THR A 46 -10.937 -1.327 -10.312 1.00 20.23 C ATOM 193 O THR A 46 -11.978 -1.247 -10.964 1.00 13.35 O ATOM 194 CB THR A 46 -10.607 -0.735 -7.910 1.00 42.33 C ATOM 195 OG1 THR A 46 -10.637 -1.220 -6.564 1.00 25.35 O ATOM 196 CG2 THR A 46 -11.588 0.418 -8.061 1.00 1.01 C ATOM 0 H THR A 46 -9.321 -2.869 -8.014 1.00 13.32 H new ATOM 0 HA THR A 46 -11.939 -2.260 -8.657 1.00 53.41 H new ATOM 0 HB THR A 46 -9.606 -0.372 -8.143 1.00 42.33 H new ATOM 0 HG1 THR A 46 -9.744 -1.535 -6.310 1.00 25.35 H new ATOM 0 HG21 THR A 46 -11.328 1.211 -7.360 1.00 1.01 H new ATOM 0 HG22 THR A 46 -11.541 0.805 -9.079 1.00 1.01 H new ATOM 0 HG23 THR A 46 -12.598 0.066 -7.853 1.00 1.01 H new ATOM 204 N VAL A 47 -9.754 -0.952 -10.789 1.00 33.20 N ATOM 205 CA VAL A 47 -9.609 -0.414 -12.136 1.00 54.21 C ATOM 206 C VAL A 47 -10.052 -1.429 -13.184 1.00 43.21 C ATOM 207 O VAL A 47 -10.596 -1.065 -14.227 1.00 4.41 O ATOM 208 CB VAL A 47 -8.154 0.001 -12.421 1.00 64.22 C ATOM 209 CG1 VAL A 47 -7.256 -1.224 -12.503 1.00 64.21 C ATOM 210 CG2 VAL A 47 -8.074 0.817 -13.702 1.00 42.23 C ATOM 0 H VAL A 47 -8.882 -1.011 -10.262 1.00 33.20 H new ATOM 0 HA VAL A 47 -10.248 0.467 -12.195 1.00 54.21 H new ATOM 0 HB VAL A 47 -7.804 0.624 -11.598 1.00 64.22 H new ATOM 0 HG11 VAL A 47 -6.232 -0.911 -12.705 1.00 64.21 H new ATOM 0 HG12 VAL A 47 -7.291 -1.764 -11.557 1.00 64.21 H new ATOM 0 HG13 VAL A 47 -7.601 -1.875 -13.306 1.00 64.21 H new ATOM 0 HG21 VAL A 47 -7.038 1.102 -13.888 1.00 42.23 H new ATOM 0 HG22 VAL A 47 -8.442 0.221 -14.537 1.00 42.23 H new ATOM 0 HG23 VAL A 47 -8.684 1.714 -13.601 1.00 42.23 H new ATOM 220 N LYS A 48 -9.815 -2.705 -12.900 1.00 73.14 N ATOM 221 CA LYS A 48 -10.190 -3.775 -13.817 1.00 35.32 C ATOM 222 C LYS A 48 -11.705 -3.840 -13.987 1.00 21.44 C ATOM 223 O LYS A 48 -12.208 -4.075 -15.086 1.00 25.03 O ATOM 224 CB LYS A 48 -9.666 -5.119 -13.306 1.00 63.23 C ATOM 225 CG LYS A 48 -8.326 -5.515 -13.903 1.00 32.41 C ATOM 226 CD LYS A 48 -7.652 -6.605 -13.086 1.00 33.01 C ATOM 227 CE LYS A 48 -8.449 -7.900 -13.119 1.00 71.24 C ATOM 228 NZ LYS A 48 -7.867 -8.933 -12.219 1.00 24.23 N ATOM 0 H LYS A 48 -9.365 -3.024 -12.042 1.00 73.14 H new ATOM 0 HA LYS A 48 -9.742 -3.562 -14.787 1.00 35.32 H new ATOM 0 HB2 LYS A 48 -9.572 -5.074 -12.221 1.00 63.23 H new ATOM 0 HB3 LYS A 48 -10.398 -5.894 -13.531 1.00 63.23 H new ATOM 0 HG2 LYS A 48 -8.471 -5.863 -14.926 1.00 32.41 H new ATOM 0 HG3 LYS A 48 -7.676 -4.641 -13.952 1.00 32.41 H new ATOM 0 HD2 LYS A 48 -6.649 -6.784 -13.473 1.00 33.01 H new ATOM 0 HD3 LYS A 48 -7.540 -6.271 -12.054 1.00 33.01 H new ATOM 0 HE2 LYS A 48 -9.479 -7.700 -12.824 1.00 71.24 H new ATOM 0 HE3 LYS A 48 -8.478 -8.282 -14.139 1.00 71.24 H new ATOM 0 HZ1 LYS A 48 -8.343 -9.843 -12.382 1.00 24.23 H new ATOM 0 HZ2 LYS A 48 -6.851 -9.033 -12.417 1.00 24.23 H new ATOM 0 HZ3 LYS A 48 -8.000 -8.645 -11.228 1.00 24.23 H new ATOM 242 N LYS A 49 -12.428 -3.630 -12.892 1.00 0.21 N ATOM 243 CA LYS A 49 -13.885 -3.661 -12.919 1.00 74.52 C ATOM 244 C LYS A 49 -14.443 -2.433 -13.632 1.00 31.44 C ATOM 245 O LYS A 49 -15.312 -2.547 -14.495 1.00 55.22 O ATOM 246 CB LYS A 49 -14.441 -3.734 -11.495 1.00 72.42 C ATOM 247 CG LYS A 49 -13.908 -4.909 -10.693 1.00 70.15 C ATOM 248 CD LYS A 49 -14.840 -6.107 -10.772 1.00 42.22 C ATOM 249 CE LYS A 49 -14.822 -6.912 -9.482 1.00 74.21 C ATOM 250 NZ LYS A 49 -15.729 -6.332 -8.454 1.00 14.45 N ATOM 0 H LYS A 49 -12.028 -3.436 -11.974 1.00 0.21 H new ATOM 0 HA LYS A 49 -14.194 -4.550 -13.469 1.00 74.52 H new ATOM 0 HB2 LYS A 49 -14.200 -2.809 -10.972 1.00 72.42 H new ATOM 0 HB3 LYS A 49 -15.528 -3.800 -11.541 1.00 72.42 H new ATOM 0 HG2 LYS A 49 -12.923 -5.188 -11.066 1.00 70.15 H new ATOM 0 HG3 LYS A 49 -13.782 -4.613 -9.652 1.00 70.15 H new ATOM 0 HD2 LYS A 49 -15.855 -5.767 -10.976 1.00 42.22 H new ATOM 0 HD3 LYS A 49 -14.544 -6.745 -11.605 1.00 42.22 H new ATOM 0 HE2 LYS A 49 -15.120 -7.940 -9.691 1.00 74.21 H new ATOM 0 HE3 LYS A 49 -13.805 -6.948 -9.091 1.00 74.21 H new ATOM 0 HZ1 LYS A 49 -15.688 -6.909 -7.590 1.00 14.45 H new ATOM 0 HZ2 LYS A 49 -15.430 -5.360 -8.236 1.00 14.45 H new ATOM 0 HZ3 LYS A 49 -16.703 -6.321 -8.817 1.00 14.45 H new ATOM 264 N ALA A 50 -13.936 -1.261 -13.265 1.00 11.02 N ATOM 265 CA ALA A 50 -14.381 -0.013 -13.872 1.00 14.35 C ATOM 266 C ALA A 50 -14.160 -0.026 -15.380 1.00 62.02 C ATOM 267 O ALA A 50 -14.995 0.459 -16.144 1.00 65.31 O ATOM 268 CB ALA A 50 -13.659 1.168 -13.240 1.00 44.14 C ATOM 0 H ALA A 50 -13.217 -1.150 -12.550 1.00 11.02 H new ATOM 0 HA ALA A 50 -15.451 0.090 -13.690 1.00 14.35 H new ATOM 0 HB1 ALA A 50 -14.001 2.094 -13.703 1.00 44.14 H new ATOM 0 HB2 ALA A 50 -13.873 1.196 -12.172 1.00 44.14 H new ATOM 0 HB3 ALA A 50 -12.585 1.062 -13.392 1.00 44.14 H new ATOM 274 N SER A 51 -13.030 -0.583 -15.803 1.00 25.42 N ATOM 275 CA SER A 51 -12.696 -0.655 -17.221 1.00 32.54 C ATOM 276 C SER A 51 -13.846 -1.263 -18.019 1.00 23.44 C ATOM 277 O SER A 51 -14.183 -0.790 -19.104 1.00 10.42 O ATOM 278 CB SER A 51 -11.425 -1.481 -17.426 1.00 21.40 C ATOM 279 OG SER A 51 -11.443 -2.143 -18.679 1.00 52.52 O ATOM 0 H SER A 51 -12.330 -0.991 -15.184 1.00 25.42 H new ATOM 0 HA SER A 51 -12.523 0.359 -17.581 1.00 32.54 H new ATOM 0 HB2 SER A 51 -10.552 -0.831 -17.367 1.00 21.40 H new ATOM 0 HB3 SER A 51 -11.331 -2.214 -16.625 1.00 21.40 H new ATOM 0 HG SER A 51 -10.527 -2.234 -19.014 1.00 52.52 H new ATOM 285 N LYS A 52 -14.444 -2.317 -17.473 1.00 12.30 N ATOM 286 CA LYS A 52 -15.557 -2.991 -18.131 1.00 30.00 C ATOM 287 C LYS A 52 -16.730 -2.037 -18.331 1.00 41.42 C ATOM 288 O LYS A 52 -17.490 -2.165 -19.291 1.00 4.32 O ATOM 289 CB LYS A 52 -16.005 -4.201 -17.308 1.00 72.24 C ATOM 290 CG LYS A 52 -16.915 -5.150 -18.069 1.00 21.40 C ATOM 291 CD LYS A 52 -17.812 -5.937 -17.128 1.00 1.00 C ATOM 292 CE LYS A 52 -19.072 -5.159 -16.779 1.00 25.24 C ATOM 293 NZ LYS A 52 -18.886 -4.320 -15.562 1.00 61.24 N ATOM 0 H LYS A 52 -14.176 -2.723 -16.576 1.00 12.30 H new ATOM 0 HA LYS A 52 -15.217 -3.330 -19.109 1.00 30.00 H new ATOM 0 HB2 LYS A 52 -15.124 -4.747 -16.971 1.00 72.24 H new ATOM 0 HB3 LYS A 52 -16.524 -3.851 -16.415 1.00 72.24 H new ATOM 0 HG2 LYS A 52 -17.529 -4.584 -18.769 1.00 21.40 H new ATOM 0 HG3 LYS A 52 -16.311 -5.839 -18.659 1.00 21.40 H new ATOM 0 HD2 LYS A 52 -18.085 -6.885 -17.592 1.00 1.00 H new ATOM 0 HD3 LYS A 52 -17.265 -6.174 -16.216 1.00 1.00 H new ATOM 0 HE2 LYS A 52 -19.351 -4.523 -17.619 1.00 25.24 H new ATOM 0 HE3 LYS A 52 -19.896 -5.855 -16.618 1.00 25.24 H new ATOM 0 HZ1 LYS A 52 -19.787 -4.249 -15.048 1.00 61.24 H new ATOM 0 HZ2 LYS A 52 -18.170 -4.756 -14.946 1.00 61.24 H new ATOM 0 HZ3 LYS A 52 -18.570 -3.369 -15.841 1.00 61.24 H new ATOM 307 N ALA A 53 -16.870 -1.079 -17.420 1.00 71.30 N ATOM 308 CA ALA A 53 -17.948 -0.101 -17.499 1.00 71.41 C ATOM 309 C ALA A 53 -17.588 1.037 -18.448 1.00 33.20 C ATOM 310 O ALA A 53 -18.386 1.948 -18.672 1.00 64.23 O ATOM 311 CB ALA A 53 -18.269 0.444 -16.115 1.00 64.13 C ATOM 0 H ALA A 53 -16.250 -0.960 -16.619 1.00 71.30 H new ATOM 0 HA ALA A 53 -18.832 -0.602 -17.894 1.00 71.41 H new ATOM 0 HB1 ALA A 53 -19.076 1.173 -16.189 1.00 64.13 H new ATOM 0 HB2 ALA A 53 -18.578 -0.374 -15.464 1.00 64.13 H new ATOM 0 HB3 ALA A 53 -17.383 0.924 -15.699 1.00 64.13 H new ATOM 317 N LYS A 54 -16.382 0.979 -19.003 1.00 13.42 N ATOM 318 CA LYS A 54 -15.916 2.005 -19.928 1.00 61.15 C ATOM 319 C LYS A 54 -15.863 3.369 -19.248 1.00 24.23 C ATOM 320 O LYS A 54 -16.401 4.350 -19.759 1.00 64.45 O ATOM 321 CB LYS A 54 -16.831 2.070 -21.153 1.00 71.23 C ATOM 322 CG LYS A 54 -16.292 1.315 -22.356 1.00 72.10 C ATOM 323 CD LYS A 54 -17.382 0.511 -23.044 1.00 34.40 C ATOM 324 CE LYS A 54 -16.837 -0.786 -23.623 1.00 34.23 C ATOM 325 NZ LYS A 54 -17.923 -1.653 -24.160 1.00 24.23 N ATOM 0 H LYS A 54 -15.710 0.232 -18.828 1.00 13.42 H new ATOM 0 HA LYS A 54 -14.908 1.739 -20.247 1.00 61.15 H new ATOM 0 HB2 LYS A 54 -17.808 1.665 -20.888 1.00 71.23 H new ATOM 0 HB3 LYS A 54 -16.983 3.114 -21.428 1.00 71.23 H new ATOM 0 HG2 LYS A 54 -15.857 2.020 -23.064 1.00 72.10 H new ATOM 0 HG3 LYS A 54 -15.491 0.647 -22.039 1.00 72.10 H new ATOM 0 HD2 LYS A 54 -18.176 0.287 -22.331 1.00 34.40 H new ATOM 0 HD3 LYS A 54 -17.828 1.107 -23.840 1.00 34.40 H new ATOM 0 HE2 LYS A 54 -16.127 -0.559 -24.418 1.00 34.23 H new ATOM 0 HE3 LYS A 54 -16.289 -1.326 -22.851 1.00 34.23 H new ATOM 0 HZ1 LYS A 54 -17.511 -2.527 -24.545 1.00 24.23 H new ATOM 0 HZ2 LYS A 54 -18.587 -1.891 -23.396 1.00 24.23 H new ATOM 0 HZ3 LYS A 54 -18.430 -1.147 -24.914 1.00 24.23 H new ATOM 339 N ASN A 55 -15.209 3.423 -18.092 1.00 31.04 N ATOM 340 CA ASN A 55 -15.085 4.667 -17.341 1.00 42.55 C ATOM 341 C ASN A 55 -13.619 5.047 -17.156 1.00 62.02 C ATOM 342 O ASN A 55 -13.269 5.786 -16.236 1.00 51.41 O ATOM 343 CB ASN A 55 -15.765 4.535 -15.977 1.00 53.25 C ATOM 344 CG ASN A 55 -15.355 3.271 -15.247 1.00 1.32 C ATOM 345 OD1 ASN A 55 -14.236 2.784 -15.407 1.00 61.23 O ATOM 346 ND2 ASN A 55 -16.262 2.734 -14.439 1.00 3.21 N ATOM 0 H ASN A 55 -14.757 2.620 -17.655 1.00 31.04 H new ATOM 0 HA ASN A 55 -15.578 5.455 -17.910 1.00 42.55 H new ATOM 0 HB2 ASN A 55 -15.516 5.402 -15.365 1.00 53.25 H new ATOM 0 HB3 ASN A 55 -16.847 4.539 -16.111 1.00 53.25 H new ATOM 0 HD21 ASN A 55 -16.043 1.883 -13.920 1.00 3.21 H new ATOM 0 HD22 ASN A 55 -17.177 3.172 -14.337 1.00 3.21 H new ATOM 353 N VAL A 56 -12.765 4.536 -18.037 1.00 61.15 N ATOM 354 CA VAL A 56 -11.337 4.822 -17.973 1.00 3.12 C ATOM 355 C VAL A 56 -10.792 5.215 -19.342 1.00 15.14 C ATOM 356 O VAL A 56 -11.317 4.797 -20.374 1.00 43.02 O ATOM 357 CB VAL A 56 -10.545 3.611 -17.446 1.00 62.52 C ATOM 358 CG1 VAL A 56 -10.602 2.462 -18.441 1.00 71.53 C ATOM 359 CG2 VAL A 56 -9.104 4.002 -17.154 1.00 52.41 C ATOM 0 H VAL A 56 -13.038 3.921 -18.804 1.00 61.15 H new ATOM 0 HA VAL A 56 -11.213 5.657 -17.283 1.00 3.12 H new ATOM 0 HB VAL A 56 -11.003 3.278 -16.515 1.00 62.52 H new ATOM 0 HG11 VAL A 56 -10.037 1.615 -18.052 1.00 71.53 H new ATOM 0 HG12 VAL A 56 -11.639 2.166 -18.596 1.00 71.53 H new ATOM 0 HG13 VAL A 56 -10.171 2.781 -19.390 1.00 71.53 H new ATOM 0 HG21 VAL A 56 -8.560 3.134 -16.783 1.00 52.41 H new ATOM 0 HG22 VAL A 56 -8.632 4.362 -18.068 1.00 52.41 H new ATOM 0 HG23 VAL A 56 -9.086 4.791 -16.402 1.00 52.41 H new ATOM 369 N LYS A 57 -9.737 6.022 -19.343 1.00 65.40 N ATOM 370 CA LYS A 57 -9.118 6.471 -20.585 1.00 11.04 C ATOM 371 C LYS A 57 -7.602 6.317 -20.524 1.00 22.10 C ATOM 372 O LYS A 57 -6.995 6.464 -19.463 1.00 15.13 O ATOM 373 CB LYS A 57 -9.482 7.932 -20.860 1.00 73.43 C ATOM 374 CG LYS A 57 -10.979 8.189 -20.899 1.00 22.54 C ATOM 375 CD LYS A 57 -11.577 7.803 -22.241 1.00 64.12 C ATOM 376 CE LYS A 57 -13.063 8.119 -22.301 1.00 33.32 C ATOM 377 NZ LYS A 57 -13.314 9.576 -22.476 1.00 11.24 N ATOM 0 H LYS A 57 -9.292 6.379 -18.497 1.00 65.40 H new ATOM 0 HA LYS A 57 -9.496 5.849 -21.396 1.00 11.04 H new ATOM 0 HB2 LYS A 57 -9.034 8.560 -20.090 1.00 73.43 H new ATOM 0 HB3 LYS A 57 -9.045 8.234 -21.812 1.00 73.43 H new ATOM 0 HG2 LYS A 57 -11.467 7.622 -20.106 1.00 22.54 H new ATOM 0 HG3 LYS A 57 -11.173 9.244 -20.703 1.00 22.54 H new ATOM 0 HD2 LYS A 57 -11.058 8.336 -23.038 1.00 64.12 H new ATOM 0 HD3 LYS A 57 -11.423 6.738 -22.416 1.00 64.12 H new ATOM 0 HE2 LYS A 57 -13.518 7.571 -23.126 1.00 33.32 H new ATOM 0 HE3 LYS A 57 -13.545 7.775 -21.386 1.00 33.32 H new ATOM 0 HZ1 LYS A 57 -14.339 9.750 -22.512 1.00 11.24 H new ATOM 0 HZ2 LYS A 57 -12.902 10.098 -21.676 1.00 11.24 H new ATOM 0 HZ3 LYS A 57 -12.876 9.900 -23.362 1.00 11.24 H new ATOM 391 N ARG A 58 -6.995 6.021 -21.669 1.00 53.40 N ATOM 392 CA ARG A 58 -5.550 5.848 -21.745 1.00 62.15 C ATOM 393 C ARG A 58 -4.960 6.688 -22.875 1.00 74.40 C ATOM 394 O ARG A 58 -5.218 6.433 -24.051 1.00 1.32 O ATOM 395 CB ARG A 58 -5.202 4.373 -21.957 1.00 52.30 C ATOM 396 CG ARG A 58 -6.036 3.424 -21.113 1.00 33.32 C ATOM 397 CD ARG A 58 -5.859 1.980 -21.558 1.00 3.43 C ATOM 398 NE ARG A 58 -7.139 1.325 -21.813 1.00 24.00 N ATOM 399 CZ ARG A 58 -7.991 0.979 -20.855 1.00 21.52 C ATOM 400 NH1 ARG A 58 -7.701 1.224 -19.585 1.00 10.35 N ATOM 401 NH2 ARG A 58 -9.136 0.385 -21.166 1.00 52.44 N ATOM 0 H ARG A 58 -7.482 5.896 -22.556 1.00 53.40 H new ATOM 0 HA ARG A 58 -5.119 6.184 -20.802 1.00 62.15 H new ATOM 0 HB2 ARG A 58 -5.337 4.124 -23.010 1.00 52.30 H new ATOM 0 HB3 ARG A 58 -4.148 4.220 -21.726 1.00 52.30 H new ATOM 0 HG2 ARG A 58 -5.751 3.521 -20.065 1.00 33.32 H new ATOM 0 HG3 ARG A 58 -7.088 3.701 -21.184 1.00 33.32 H new ATOM 0 HD2 ARG A 58 -5.251 1.951 -22.462 1.00 3.43 H new ATOM 0 HD3 ARG A 58 -5.316 1.428 -20.791 1.00 3.43 H new ATOM 0 HE ARG A 58 -7.393 1.122 -22.780 1.00 24.00 H new ATOM 0 HH11 ARG A 58 -6.821 1.679 -19.341 1.00 10.35 H new ATOM 0 HH12 ARG A 58 -8.357 0.957 -18.851 1.00 10.35 H new ATOM 0 HH21 ARG A 58 -9.363 0.194 -22.142 1.00 52.44 H new ATOM 0 HH22 ARG A 58 -9.790 0.120 -20.429 1.00 52.44 H new ATOM 415 N GLY A 59 -4.168 7.691 -22.509 1.00 20.43 N ATOM 416 CA GLY A 59 -3.555 8.553 -23.502 1.00 72.33 C ATOM 417 C GLY A 59 -3.389 9.977 -23.011 1.00 23.13 C ATOM 418 O GLY A 59 -4.210 10.476 -22.242 1.00 14.22 O ATOM 0 H GLY A 59 -3.940 7.922 -21.542 1.00 20.43 H new ATOM 0 HA2 GLY A 59 -2.580 8.150 -23.776 1.00 72.33 H new ATOM 0 HA3 GLY A 59 -4.165 8.552 -24.405 1.00 72.33 H new ATOM 422 N VAL A 60 -2.321 10.633 -23.454 1.00 1.34 N ATOM 423 CA VAL A 60 -2.049 12.009 -23.053 1.00 64.44 C ATOM 424 C VAL A 60 -3.232 12.917 -23.368 1.00 21.02 C ATOM 425 O VAL A 60 -3.565 13.812 -22.591 1.00 55.22 O ATOM 426 CB VAL A 60 -0.792 12.559 -23.755 1.00 35.14 C ATOM 427 CG1 VAL A 60 -0.923 12.429 -25.264 1.00 73.24 C ATOM 428 CG2 VAL A 60 -0.551 14.007 -23.355 1.00 22.41 C ATOM 0 H VAL A 60 -1.630 10.234 -24.090 1.00 1.34 H new ATOM 0 HA VAL A 60 -1.880 11.998 -21.976 1.00 64.44 H new ATOM 0 HB VAL A 60 0.068 11.970 -23.438 1.00 35.14 H new ATOM 0 HG11 VAL A 60 -0.026 12.823 -25.742 1.00 73.24 H new ATOM 0 HG12 VAL A 60 -1.045 11.379 -25.530 1.00 73.24 H new ATOM 0 HG13 VAL A 60 -1.792 12.992 -25.604 1.00 73.24 H new ATOM 0 HG21 VAL A 60 0.340 14.380 -23.859 1.00 22.41 H new ATOM 0 HG22 VAL A 60 -1.411 14.612 -23.643 1.00 22.41 H new ATOM 0 HG23 VAL A 60 -0.409 14.068 -22.276 1.00 22.41 H new ATOM 438 N LYS A 61 -3.864 12.681 -24.512 1.00 73.32 N ATOM 439 CA LYS A 61 -5.013 13.476 -24.931 1.00 23.34 C ATOM 440 C LYS A 61 -6.167 13.326 -23.944 1.00 63.44 C ATOM 441 O LYS A 61 -6.885 14.285 -23.666 1.00 75.14 O ATOM 442 CB LYS A 61 -5.467 13.056 -26.331 1.00 4.24 C ATOM 443 CG LYS A 61 -5.446 14.190 -27.342 1.00 30.44 C ATOM 444 CD LYS A 61 -6.281 13.859 -28.567 1.00 73.21 C ATOM 445 CE LYS A 61 -5.730 12.650 -29.308 1.00 2.40 C ATOM 446 NZ LYS A 61 -6.075 12.682 -30.756 1.00 53.51 N ATOM 0 H LYS A 61 -3.600 11.945 -25.167 1.00 73.32 H new ATOM 0 HA LYS A 61 -4.710 14.523 -24.953 1.00 23.34 H new ATOM 0 HB2 LYS A 61 -4.824 12.251 -26.687 1.00 4.24 H new ATOM 0 HB3 LYS A 61 -6.478 12.653 -26.271 1.00 4.24 H new ATOM 0 HG2 LYS A 61 -5.825 15.100 -26.877 1.00 30.44 H new ATOM 0 HG3 LYS A 61 -4.418 14.390 -27.644 1.00 30.44 H new ATOM 0 HD2 LYS A 61 -7.310 13.664 -28.265 1.00 73.21 H new ATOM 0 HD3 LYS A 61 -6.303 14.719 -29.237 1.00 73.21 H new ATOM 0 HE2 LYS A 61 -4.647 12.617 -29.194 1.00 2.40 H new ATOM 0 HE3 LYS A 61 -6.126 11.738 -28.860 1.00 2.40 H new ATOM 0 HZ1 LYS A 61 -5.682 11.841 -31.225 1.00 53.51 H new ATOM 0 HZ2 LYS A 61 -7.109 12.688 -30.866 1.00 53.51 H new ATOM 0 HZ3 LYS A 61 -5.676 13.539 -31.189 1.00 53.51 H new ATOM 460 N GLU A 62 -6.336 12.117 -23.418 1.00 73.43 N ATOM 461 CA GLU A 62 -7.403 11.843 -22.463 1.00 30.15 C ATOM 462 C GLU A 62 -7.158 12.579 -21.148 1.00 61.23 C ATOM 463 O GLU A 62 -7.987 13.374 -20.705 1.00 21.52 O ATOM 464 CB GLU A 62 -7.514 10.339 -22.205 1.00 25.24 C ATOM 465 CG GLU A 62 -7.421 9.497 -23.466 1.00 22.41 C ATOM 466 CD GLU A 62 -8.357 9.976 -24.558 1.00 35.03 C ATOM 467 OE1 GLU A 62 -9.588 9.882 -24.366 1.00 51.40 O ATOM 468 OE2 GLU A 62 -7.861 10.444 -25.603 1.00 43.22 O ATOM 0 H GLU A 62 -5.748 11.313 -23.637 1.00 73.43 H new ATOM 0 HA GLU A 62 -8.339 12.201 -22.891 1.00 30.15 H new ATOM 0 HB2 GLU A 62 -6.724 10.037 -21.518 1.00 25.24 H new ATOM 0 HB3 GLU A 62 -8.463 10.133 -21.710 1.00 25.24 H new ATOM 0 HG2 GLU A 62 -6.396 9.517 -23.837 1.00 22.41 H new ATOM 0 HG3 GLU A 62 -7.652 8.460 -23.224 1.00 22.41 H new ATOM 475 N VAL A 63 -6.013 12.307 -20.529 1.00 51.45 N ATOM 476 CA VAL A 63 -5.657 12.943 -19.267 1.00 14.15 C ATOM 477 C VAL A 63 -5.780 14.460 -19.361 1.00 64.21 C ATOM 478 O VAL A 63 -6.292 15.110 -18.450 1.00 41.21 O ATOM 479 CB VAL A 63 -4.223 12.580 -18.840 1.00 45.21 C ATOM 480 CG1 VAL A 63 -4.151 11.131 -18.385 1.00 31.35 C ATOM 481 CG2 VAL A 63 -3.247 12.838 -19.979 1.00 14.53 C ATOM 0 H VAL A 63 -5.317 11.650 -20.882 1.00 51.45 H new ATOM 0 HA VAL A 63 -6.356 12.571 -18.518 1.00 14.15 H new ATOM 0 HB VAL A 63 -3.942 13.214 -17.999 1.00 45.21 H new ATOM 0 HG11 VAL A 63 -3.130 10.893 -18.087 1.00 31.35 H new ATOM 0 HG12 VAL A 63 -4.820 10.982 -17.537 1.00 31.35 H new ATOM 0 HG13 VAL A 63 -4.452 10.477 -19.204 1.00 31.35 H new ATOM 0 HG21 VAL A 63 -2.238 12.576 -19.660 1.00 14.53 H new ATOM 0 HG22 VAL A 63 -3.524 12.231 -20.840 1.00 14.53 H new ATOM 0 HG23 VAL A 63 -3.279 13.892 -20.253 1.00 14.53 H new ATOM 491 N VAL A 64 -5.306 15.018 -20.470 1.00 44.14 N ATOM 492 CA VAL A 64 -5.363 16.459 -20.686 1.00 0.03 C ATOM 493 C VAL A 64 -6.805 16.940 -20.806 1.00 23.22 C ATOM 494 O VAL A 64 -7.178 17.967 -20.239 1.00 42.22 O ATOM 495 CB VAL A 64 -4.590 16.868 -21.953 1.00 44.33 C ATOM 496 CG1 VAL A 64 -4.793 18.346 -22.249 1.00 54.35 C ATOM 497 CG2 VAL A 64 -3.111 16.545 -21.802 1.00 42.42 C ATOM 0 H VAL A 64 -4.878 14.494 -21.233 1.00 44.14 H new ATOM 0 HA VAL A 64 -4.898 16.927 -19.819 1.00 0.03 H new ATOM 0 HB VAL A 64 -4.980 16.296 -22.795 1.00 44.33 H new ATOM 0 HG11 VAL A 64 -4.239 18.616 -23.148 1.00 54.35 H new ATOM 0 HG12 VAL A 64 -5.854 18.544 -22.403 1.00 54.35 H new ATOM 0 HG13 VAL A 64 -4.432 18.938 -21.408 1.00 54.35 H new ATOM 0 HG21 VAL A 64 -2.580 16.841 -22.707 1.00 42.42 H new ATOM 0 HG22 VAL A 64 -2.705 17.089 -20.949 1.00 42.42 H new ATOM 0 HG23 VAL A 64 -2.987 15.474 -21.642 1.00 42.42 H new ATOM 507 N LYS A 65 -7.613 16.190 -21.547 1.00 62.33 N ATOM 508 CA LYS A 65 -9.016 16.537 -21.742 1.00 24.24 C ATOM 509 C LYS A 65 -9.734 16.670 -20.402 1.00 63.45 C ATOM 510 O LYS A 65 -10.440 17.648 -20.161 1.00 3.25 O ATOM 511 CB LYS A 65 -9.710 15.478 -22.602 1.00 2.51 C ATOM 512 CG LYS A 65 -11.135 15.841 -22.980 1.00 53.51 C ATOM 513 CD LYS A 65 -11.983 14.602 -23.213 1.00 52.20 C ATOM 514 CE LYS A 65 -12.574 14.079 -21.913 1.00 22.41 C ATOM 515 NZ LYS A 65 -13.858 14.753 -21.576 1.00 2.35 N ATOM 0 H LYS A 65 -7.320 15.337 -22.023 1.00 62.33 H new ATOM 0 HA LYS A 65 -9.059 17.498 -22.255 1.00 24.24 H new ATOM 0 HB2 LYS A 65 -9.130 15.323 -23.512 1.00 2.51 H new ATOM 0 HB3 LYS A 65 -9.716 14.531 -22.063 1.00 2.51 H new ATOM 0 HG2 LYS A 65 -11.580 16.444 -22.188 1.00 53.51 H new ATOM 0 HG3 LYS A 65 -11.128 16.453 -23.882 1.00 53.51 H new ATOM 0 HD2 LYS A 65 -12.787 14.836 -23.911 1.00 52.20 H new ATOM 0 HD3 LYS A 65 -11.375 13.825 -23.676 1.00 52.20 H new ATOM 0 HE2 LYS A 65 -12.739 13.005 -21.995 1.00 22.41 H new ATOM 0 HE3 LYS A 65 -11.861 14.231 -21.103 1.00 22.41 H new ATOM 0 HZ1 LYS A 65 -14.228 14.368 -20.683 1.00 2.35 H new ATOM 0 HZ2 LYS A 65 -13.697 15.775 -21.472 1.00 2.35 H new ATOM 0 HZ3 LYS A 65 -14.547 14.587 -22.337 1.00 2.35 H new ATOM 529 N ALA A 66 -9.547 15.680 -19.535 1.00 75.35 N ATOM 530 CA ALA A 66 -10.175 15.688 -18.220 1.00 3.42 C ATOM 531 C ALA A 66 -9.560 16.760 -17.326 1.00 15.22 C ATOM 532 O ALA A 66 -10.245 17.356 -16.493 1.00 32.21 O ATOM 533 CB ALA A 66 -10.051 14.320 -17.567 1.00 71.51 C ATOM 0 H ALA A 66 -8.966 14.863 -19.720 1.00 75.35 H new ATOM 0 HA ALA A 66 -11.232 15.921 -18.351 1.00 3.42 H new ATOM 0 HB1 ALA A 66 -10.525 14.341 -16.585 1.00 71.51 H new ATOM 0 HB2 ALA A 66 -10.542 13.573 -18.191 1.00 71.51 H new ATOM 0 HB3 ALA A 66 -8.997 14.064 -17.456 1.00 71.51 H new ATOM 539 N LEU A 67 -8.266 17.001 -17.503 1.00 31.02 N ATOM 540 CA LEU A 67 -7.559 18.002 -16.711 1.00 63.52 C ATOM 541 C LEU A 67 -8.130 19.394 -16.958 1.00 4.31 C ATOM 542 O LEU A 67 -8.320 20.172 -16.023 1.00 51.40 O ATOM 543 CB LEU A 67 -6.066 17.983 -17.046 1.00 12.14 C ATOM 544 CG LEU A 67 -5.278 19.238 -16.669 1.00 54.52 C ATOM 545 CD1 LEU A 67 -3.920 18.865 -16.097 1.00 30.42 C ATOM 546 CD2 LEU A 67 -5.118 20.150 -17.877 1.00 63.54 C ATOM 0 H LEU A 67 -7.685 16.517 -18.188 1.00 31.02 H new ATOM 0 HA LEU A 67 -7.692 17.757 -15.657 1.00 63.52 H new ATOM 0 HB2 LEU A 67 -5.612 17.129 -16.544 1.00 12.14 H new ATOM 0 HB3 LEU A 67 -5.957 17.818 -18.118 1.00 12.14 H new ATOM 0 HG LEU A 67 -5.836 19.777 -15.903 1.00 54.52 H new ATOM 0 HD11 LEU A 67 -3.374 19.771 -15.835 1.00 30.42 H new ATOM 0 HD12 LEU A 67 -4.056 18.253 -15.206 1.00 30.42 H new ATOM 0 HD13 LEU A 67 -3.354 18.303 -16.840 1.00 30.42 H new ATOM 0 HD21 LEU A 67 -4.555 21.038 -17.590 1.00 63.54 H new ATOM 0 HD22 LEU A 67 -4.583 19.620 -18.665 1.00 63.54 H new ATOM 0 HD23 LEU A 67 -6.101 20.446 -18.242 1.00 63.54 H new ATOM 558 N ARG A 68 -8.402 19.701 -18.222 1.00 34.01 N ATOM 559 CA ARG A 68 -8.953 21.000 -18.591 1.00 62.53 C ATOM 560 C ARG A 68 -10.442 21.072 -18.265 1.00 63.33 C ATOM 561 O ARG A 68 -10.944 22.109 -17.833 1.00 54.34 O ATOM 562 CB ARG A 68 -8.733 21.265 -20.082 1.00 3.23 C ATOM 563 CG ARG A 68 -9.406 20.247 -20.988 1.00 11.43 C ATOM 564 CD ARG A 68 -9.208 20.591 -22.456 1.00 12.43 C ATOM 565 NE ARG A 68 -10.046 21.712 -22.873 1.00 54.12 N ATOM 566 CZ ARG A 68 -10.090 22.174 -24.118 1.00 63.30 C ATOM 567 NH1 ARG A 68 -9.347 21.613 -25.063 1.00 3.55 N ATOM 568 NH2 ARG A 68 -10.878 23.198 -24.420 1.00 62.52 N ATOM 0 H ARG A 68 -8.250 19.069 -19.008 1.00 34.01 H new ATOM 0 HA ARG A 68 -8.435 21.764 -18.012 1.00 62.53 H new ATOM 0 HB2 ARG A 68 -9.109 22.259 -20.325 1.00 3.23 H new ATOM 0 HB3 ARG A 68 -7.663 21.270 -20.287 1.00 3.23 H new ATOM 0 HG2 ARG A 68 -9.000 19.255 -20.788 1.00 11.43 H new ATOM 0 HG3 ARG A 68 -10.472 20.207 -20.763 1.00 11.43 H new ATOM 0 HD2 ARG A 68 -8.161 20.836 -22.633 1.00 12.43 H new ATOM 0 HD3 ARG A 68 -9.439 19.719 -23.067 1.00 12.43 H new ATOM 0 HE ARG A 68 -10.630 22.165 -22.170 1.00 54.12 H new ATOM 0 HH11 ARG A 68 -8.740 20.825 -24.834 1.00 3.55 H new ATOM 0 HH12 ARG A 68 -9.382 21.969 -26.018 1.00 3.55 H new ATOM 0 HH21 ARG A 68 -11.451 23.632 -23.696 1.00 62.52 H new ATOM 0 HH22 ARG A 68 -10.911 23.552 -25.376 1.00 62.52 H new ATOM 582 N LYS A 69 -11.142 19.963 -18.476 1.00 34.55 N ATOM 583 CA LYS A 69 -12.574 19.898 -18.204 1.00 4.11 C ATOM 584 C LYS A 69 -12.850 20.033 -16.710 1.00 54.20 C ATOM 585 O LYS A 69 -13.619 20.896 -16.287 1.00 24.02 O ATOM 586 CB LYS A 69 -13.153 18.581 -18.724 1.00 34.32 C ATOM 587 CG LYS A 69 -13.826 18.705 -20.080 1.00 44.21 C ATOM 588 CD LYS A 69 -12.959 19.473 -21.064 1.00 3.44 C ATOM 589 CE LYS A 69 -13.588 19.514 -22.448 1.00 22.41 C ATOM 590 NZ LYS A 69 -12.821 18.697 -23.429 1.00 40.55 N ATOM 0 H LYS A 69 -10.741 19.096 -18.835 1.00 34.55 H new ATOM 0 HA LYS A 69 -13.055 20.728 -18.721 1.00 4.11 H new ATOM 0 HB2 LYS A 69 -12.353 17.844 -18.791 1.00 34.32 H new ATOM 0 HB3 LYS A 69 -13.876 18.202 -18.002 1.00 34.32 H new ATOM 0 HG2 LYS A 69 -14.035 17.711 -20.476 1.00 44.21 H new ATOM 0 HG3 LYS A 69 -14.785 19.211 -19.967 1.00 44.21 H new ATOM 0 HD2 LYS A 69 -12.809 20.490 -20.701 1.00 3.44 H new ATOM 0 HD3 LYS A 69 -11.975 19.007 -21.124 1.00 3.44 H new ATOM 0 HE2 LYS A 69 -14.613 19.147 -22.392 1.00 22.41 H new ATOM 0 HE3 LYS A 69 -13.637 20.546 -22.794 1.00 22.41 H new ATOM 0 HZ1 LYS A 69 -13.056 19.003 -24.395 1.00 40.55 H new ATOM 0 HZ2 LYS A 69 -11.802 18.823 -23.264 1.00 40.55 H new ATOM 0 HZ3 LYS A 69 -13.069 17.694 -23.314 1.00 40.55 H new ATOM 604 N GLY A 70 -12.218 19.175 -15.915 1.00 41.13 N ATOM 605 CA GLY A 70 -12.409 19.217 -14.477 1.00 64.13 C ATOM 606 C GLY A 70 -13.133 17.993 -13.953 1.00 12.13 C ATOM 607 O GLY A 70 -13.622 17.991 -12.823 1.00 61.44 O ATOM 0 H GLY A 70 -11.577 18.452 -16.241 1.00 41.13 H new ATOM 0 HA2 GLY A 70 -11.439 19.299 -13.987 1.00 64.13 H new ATOM 0 HA3 GLY A 70 -12.975 20.111 -14.215 1.00 64.13 H new ATOM 611 N GLU A 71 -13.204 16.951 -14.775 1.00 50.23 N ATOM 612 CA GLU A 71 -13.877 15.717 -14.388 1.00 10.14 C ATOM 613 C GLU A 71 -12.869 14.592 -14.174 1.00 21.42 C ATOM 614 O GLU A 71 -13.243 13.447 -13.916 1.00 53.41 O ATOM 615 CB GLU A 71 -14.895 15.309 -15.454 1.00 74.40 C ATOM 616 CG GLU A 71 -15.420 16.476 -16.273 1.00 62.35 C ATOM 617 CD GLU A 71 -16.814 16.228 -16.817 1.00 23.54 C ATOM 618 OE1 GLU A 71 -17.318 15.096 -16.659 1.00 71.25 O ATOM 619 OE2 GLU A 71 -17.400 17.164 -17.399 1.00 23.03 O ATOM 0 H GLU A 71 -12.804 16.937 -15.713 1.00 50.23 H new ATOM 0 HA GLU A 71 -14.399 15.897 -13.448 1.00 10.14 H new ATOM 0 HB2 GLU A 71 -14.435 14.583 -16.125 1.00 74.40 H new ATOM 0 HB3 GLU A 71 -15.734 14.809 -14.970 1.00 74.40 H new ATOM 0 HG2 GLU A 71 -15.430 17.373 -15.655 1.00 62.35 H new ATOM 0 HG3 GLU A 71 -14.739 16.668 -17.102 1.00 62.35 H new ATOM 626 N LYS A 72 -11.587 14.925 -14.283 1.00 73.34 N ATOM 627 CA LYS A 72 -10.523 13.944 -14.102 1.00 12.51 C ATOM 628 C LYS A 72 -10.755 13.117 -12.841 1.00 45.43 C ATOM 629 O LYS A 72 -11.162 13.645 -11.807 1.00 63.12 O ATOM 630 CB LYS A 72 -9.165 14.645 -14.023 1.00 63.42 C ATOM 631 CG LYS A 72 -7.997 13.689 -13.851 1.00 61.31 C ATOM 632 CD LYS A 72 -7.112 13.661 -15.086 1.00 51.21 C ATOM 633 CE LYS A 72 -6.431 15.002 -15.314 1.00 54.20 C ATOM 634 NZ LYS A 72 -5.043 14.839 -15.827 1.00 2.33 N ATOM 0 H LYS A 72 -11.260 15.867 -14.496 1.00 73.34 H new ATOM 0 HA LYS A 72 -10.530 13.273 -14.961 1.00 12.51 H new ATOM 0 HB2 LYS A 72 -9.014 15.230 -14.930 1.00 63.42 H new ATOM 0 HB3 LYS A 72 -9.175 15.347 -13.189 1.00 63.42 H new ATOM 0 HG2 LYS A 72 -7.406 13.988 -12.985 1.00 61.31 H new ATOM 0 HG3 LYS A 72 -8.373 12.686 -13.649 1.00 61.31 H new ATOM 0 HD2 LYS A 72 -6.357 12.882 -14.976 1.00 51.21 H new ATOM 0 HD3 LYS A 72 -7.712 13.403 -15.959 1.00 51.21 H new ATOM 0 HE2 LYS A 72 -7.014 15.589 -16.024 1.00 54.20 H new ATOM 0 HE3 LYS A 72 -6.409 15.562 -14.379 1.00 54.20 H new ATOM 0 HZ1 LYS A 72 -4.504 15.711 -15.653 1.00 2.33 H new ATOM 0 HZ2 LYS A 72 -4.583 14.045 -15.338 1.00 2.33 H new ATOM 0 HZ3 LYS A 72 -5.071 14.647 -16.849 1.00 2.33 H new ATOM 648 N GLY A 73 -10.491 11.818 -12.935 1.00 25.43 N ATOM 649 CA GLY A 73 -10.675 10.939 -11.794 1.00 43.32 C ATOM 650 C GLY A 73 -9.366 10.589 -11.115 1.00 2.12 C ATOM 651 O GLY A 73 -8.890 11.326 -10.250 1.00 31.44 O ATOM 0 H GLY A 73 -10.153 11.358 -13.780 1.00 25.43 H new ATOM 0 HA2 GLY A 73 -11.338 11.418 -11.073 1.00 43.32 H new ATOM 0 HA3 GLY A 73 -11.168 10.023 -12.120 1.00 43.32 H new ATOM 655 N LEU A 74 -8.782 9.461 -11.505 1.00 10.32 N ATOM 656 CA LEU A 74 -7.520 9.013 -10.926 1.00 50.31 C ATOM 657 C LEU A 74 -6.465 8.811 -12.009 1.00 54.55 C ATOM 658 O LEU A 74 -6.722 8.170 -13.029 1.00 10.53 O ATOM 659 CB LEU A 74 -7.726 7.711 -10.150 1.00 1.30 C ATOM 660 CG LEU A 74 -8.474 7.833 -8.822 1.00 21.31 C ATOM 661 CD1 LEU A 74 -7.965 9.027 -8.030 1.00 54.51 C ATOM 662 CD2 LEU A 74 -9.972 7.948 -9.062 1.00 51.42 C ATOM 0 H LEU A 74 -9.162 8.840 -12.219 1.00 10.32 H new ATOM 0 HA LEU A 74 -7.168 9.785 -10.242 1.00 50.31 H new ATOM 0 HB2 LEU A 74 -8.269 7.013 -10.787 1.00 1.30 H new ATOM 0 HB3 LEU A 74 -6.749 7.269 -9.955 1.00 1.30 H new ATOM 0 HG LEU A 74 -8.289 6.931 -8.238 1.00 21.31 H new ATOM 0 HD11 LEU A 74 -8.509 9.098 -7.088 1.00 54.51 H new ATOM 0 HD12 LEU A 74 -6.902 8.902 -7.826 1.00 54.51 H new ATOM 0 HD13 LEU A 74 -8.119 9.939 -8.607 1.00 54.51 H new ATOM 0 HD21 LEU A 74 -10.488 8.034 -8.106 1.00 51.42 H new ATOM 0 HD22 LEU A 74 -10.177 8.832 -9.666 1.00 51.42 H new ATOM 0 HD23 LEU A 74 -10.326 7.060 -9.587 1.00 51.42 H new ATOM 674 N VAL A 75 -5.277 9.361 -11.781 1.00 41.30 N ATOM 675 CA VAL A 75 -4.182 9.239 -12.736 1.00 2.02 C ATOM 676 C VAL A 75 -3.353 7.988 -12.465 1.00 14.24 C ATOM 677 O VAL A 75 -2.797 7.822 -11.379 1.00 10.20 O ATOM 678 CB VAL A 75 -3.259 10.472 -12.693 1.00 33.34 C ATOM 679 CG1 VAL A 75 -2.021 10.242 -13.546 1.00 11.42 C ATOM 680 CG2 VAL A 75 -4.009 11.714 -13.150 1.00 31.14 C ATOM 0 H VAL A 75 -5.048 9.896 -10.943 1.00 41.30 H new ATOM 0 HA VAL A 75 -4.632 9.166 -13.726 1.00 2.02 H new ATOM 0 HB VAL A 75 -2.937 10.628 -11.663 1.00 33.34 H new ATOM 0 HG11 VAL A 75 -1.381 11.123 -13.503 1.00 11.42 H new ATOM 0 HG12 VAL A 75 -1.474 9.378 -13.168 1.00 11.42 H new ATOM 0 HG13 VAL A 75 -2.319 10.060 -14.578 1.00 11.42 H new ATOM 0 HG21 VAL A 75 -3.342 12.576 -13.113 1.00 31.14 H new ATOM 0 HG22 VAL A 75 -4.361 11.571 -14.171 1.00 31.14 H new ATOM 0 HG23 VAL A 75 -4.861 11.887 -12.493 1.00 31.14 H new ATOM 690 N VAL A 76 -3.275 7.110 -13.459 1.00 61.22 N ATOM 691 CA VAL A 76 -2.513 5.874 -13.329 1.00 62.31 C ATOM 692 C VAL A 76 -1.217 5.940 -14.130 1.00 1.35 C ATOM 693 O VAL A 76 -1.238 6.066 -15.354 1.00 61.13 O ATOM 694 CB VAL A 76 -3.332 4.657 -13.800 1.00 1.15 C ATOM 695 CG1 VAL A 76 -2.776 3.375 -13.199 1.00 75.31 C ATOM 696 CG2 VAL A 76 -4.800 4.832 -13.440 1.00 5.15 C ATOM 0 H VAL A 76 -3.730 7.232 -14.364 1.00 61.22 H new ATOM 0 HA VAL A 76 -2.278 5.758 -12.271 1.00 62.31 H new ATOM 0 HB VAL A 76 -3.254 4.585 -14.885 1.00 1.15 H new ATOM 0 HG11 VAL A 76 -3.367 2.526 -13.543 1.00 75.31 H new ATOM 0 HG12 VAL A 76 -1.740 3.246 -13.512 1.00 75.31 H new ATOM 0 HG13 VAL A 76 -2.822 3.433 -12.112 1.00 75.31 H new ATOM 0 HG21 VAL A 76 -5.364 3.963 -13.780 1.00 5.15 H new ATOM 0 HG22 VAL A 76 -4.900 4.930 -12.359 1.00 5.15 H new ATOM 0 HG23 VAL A 76 -5.189 5.729 -13.923 1.00 5.15 H new ATOM 706 N ILE A 77 -0.091 5.855 -13.430 1.00 23.14 N ATOM 707 CA ILE A 77 1.215 5.904 -14.076 1.00 20.24 C ATOM 708 C ILE A 77 1.872 4.528 -14.092 1.00 22.13 C ATOM 709 O ILE A 77 1.915 3.837 -13.074 1.00 3.41 O ATOM 710 CB ILE A 77 2.154 6.901 -13.372 1.00 24.35 C ATOM 711 CG1 ILE A 77 1.452 8.246 -13.176 1.00 70.02 C ATOM 712 CG2 ILE A 77 3.436 7.077 -14.173 1.00 14.44 C ATOM 713 CD1 ILE A 77 1.187 8.983 -14.470 1.00 73.44 C ATOM 0 H ILE A 77 -0.057 5.752 -12.416 1.00 23.14 H new ATOM 0 HA ILE A 77 1.048 6.236 -15.101 1.00 20.24 H new ATOM 0 HB ILE A 77 2.413 6.503 -12.391 1.00 24.35 H new ATOM 0 HG12 ILE A 77 0.506 8.081 -12.661 1.00 70.02 H new ATOM 0 HG13 ILE A 77 2.063 8.874 -12.528 1.00 70.02 H new ATOM 0 HG21 ILE A 77 4.090 7.785 -13.663 1.00 14.44 H new ATOM 0 HG22 ILE A 77 3.943 6.116 -14.265 1.00 14.44 H new ATOM 0 HG23 ILE A 77 3.195 7.456 -15.166 1.00 14.44 H new ATOM 0 HD11 ILE A 77 0.687 9.928 -14.255 1.00 73.44 H new ATOM 0 HD12 ILE A 77 2.132 9.179 -14.977 1.00 73.44 H new ATOM 0 HD13 ILE A 77 0.551 8.374 -15.112 1.00 73.44 H new ATOM 725 N ALA A 78 2.385 4.137 -15.254 1.00 32.53 N ATOM 726 CA ALA A 78 3.044 2.845 -15.402 1.00 33.22 C ATOM 727 C ALA A 78 4.537 2.954 -15.111 1.00 34.42 C ATOM 728 O ALA A 78 5.253 3.711 -15.764 1.00 72.03 O ATOM 729 CB ALA A 78 2.816 2.293 -16.801 1.00 55.33 C ATOM 0 H ALA A 78 2.357 4.696 -16.106 1.00 32.53 H new ATOM 0 HA ALA A 78 2.608 2.158 -14.677 1.00 33.22 H new ATOM 0 HB1 ALA A 78 3.314 1.328 -16.897 1.00 55.33 H new ATOM 0 HB2 ALA A 78 1.747 2.169 -16.973 1.00 55.33 H new ATOM 0 HB3 ALA A 78 3.224 2.986 -17.537 1.00 55.33 H new ATOM 735 N GLY A 79 5.000 2.192 -14.125 1.00 30.54 N ATOM 736 CA GLY A 79 6.405 2.218 -13.764 1.00 44.31 C ATOM 737 C GLY A 79 7.274 1.478 -14.762 1.00 0.22 C ATOM 738 O GLY A 79 8.497 1.442 -14.624 1.00 11.21 O ATOM 0 H GLY A 79 4.427 1.557 -13.570 1.00 30.54 H new ATOM 0 HA2 GLY A 79 6.740 3.253 -13.693 1.00 44.31 H new ATOM 0 HA3 GLY A 79 6.532 1.773 -12.777 1.00 44.31 H new ATOM 742 N ASP A 80 6.642 0.885 -15.768 1.00 71.13 N ATOM 743 CA ASP A 80 7.365 0.141 -16.793 1.00 41.02 C ATOM 744 C ASP A 80 6.986 0.629 -18.188 1.00 31.20 C ATOM 745 O ASP A 80 6.668 -0.169 -19.070 1.00 71.40 O ATOM 746 CB ASP A 80 7.076 -1.356 -16.667 1.00 2.43 C ATOM 747 CG ASP A 80 7.473 -1.909 -15.313 1.00 25.55 C ATOM 748 OD1 ASP A 80 8.689 -2.006 -15.045 1.00 22.00 O ATOM 749 OD2 ASP A 80 6.569 -2.247 -14.521 1.00 34.24 O ATOM 0 H ASP A 80 5.630 0.905 -15.896 1.00 71.13 H new ATOM 0 HA ASP A 80 8.432 0.311 -16.645 1.00 41.02 H new ATOM 0 HB2 ASP A 80 6.013 -1.533 -16.831 1.00 2.43 H new ATOM 0 HB3 ASP A 80 7.613 -1.894 -17.448 1.00 2.43 H new ATOM 754 N ILE A 81 7.021 1.943 -18.379 1.00 52.23 N ATOM 755 CA ILE A 81 6.681 2.537 -19.667 1.00 32.45 C ATOM 756 C ILE A 81 7.540 3.764 -19.950 1.00 50.10 C ATOM 757 O ILE A 81 7.905 4.503 -19.036 1.00 13.41 O ATOM 758 CB ILE A 81 5.195 2.939 -19.726 1.00 63.33 C ATOM 759 CG1 ILE A 81 4.304 1.714 -19.510 1.00 51.03 C ATOM 760 CG2 ILE A 81 4.879 3.602 -21.058 1.00 44.24 C ATOM 761 CD1 ILE A 81 4.373 0.710 -20.639 1.00 73.24 C ATOM 0 H ILE A 81 7.281 2.617 -17.659 1.00 52.23 H new ATOM 0 HA ILE A 81 6.874 1.779 -20.426 1.00 32.45 H new ATOM 0 HB ILE A 81 4.995 3.655 -18.929 1.00 63.33 H new ATOM 0 HG12 ILE A 81 4.593 1.224 -18.580 1.00 51.03 H new ATOM 0 HG13 ILE A 81 3.272 2.042 -19.389 1.00 51.03 H new ATOM 0 HG21 ILE A 81 3.826 3.880 -21.085 1.00 44.24 H new ATOM 0 HG22 ILE A 81 5.493 4.495 -21.175 1.00 44.24 H new ATOM 0 HG23 ILE A 81 5.091 2.907 -21.870 1.00 44.24 H new ATOM 0 HD11 ILE A 81 3.717 -0.132 -20.418 1.00 73.24 H new ATOM 0 HD12 ILE A 81 4.055 1.184 -21.568 1.00 73.24 H new ATOM 0 HD13 ILE A 81 5.397 0.353 -20.746 1.00 73.24 H new ATOM 773 N TRP A 82 7.858 3.975 -21.222 1.00 10.50 N ATOM 774 CA TRP A 82 8.673 5.115 -21.627 1.00 1.34 C ATOM 775 C TRP A 82 7.996 5.899 -22.745 1.00 52.22 C ATOM 776 O TRP A 82 7.078 5.415 -23.407 1.00 74.20 O ATOM 777 CB TRP A 82 10.055 4.644 -22.082 1.00 2.12 C ATOM 778 CG TRP A 82 10.066 3.232 -22.584 1.00 32.14 C ATOM 779 CD1 TRP A 82 9.319 2.720 -23.606 1.00 62.21 C ATOM 780 CD2 TRP A 82 10.860 2.151 -22.084 1.00 24.22 C ATOM 781 NE1 TRP A 82 9.602 1.385 -23.772 1.00 52.40 N ATOM 782 CE2 TRP A 82 10.545 1.012 -22.851 1.00 53.41 C ATOM 783 CE3 TRP A 82 11.809 2.034 -21.064 1.00 61.15 C ATOM 784 CZ2 TRP A 82 11.144 -0.225 -22.628 1.00 52.43 C ATOM 785 CZ3 TRP A 82 12.403 0.806 -20.844 1.00 75.55 C ATOM 786 CH2 TRP A 82 12.069 -0.310 -21.624 1.00 20.23 C ATOM 0 H TRP A 82 7.564 3.372 -21.991 1.00 10.50 H new ATOM 0 HA TRP A 82 8.786 5.773 -20.765 1.00 1.34 H new ATOM 0 HB2 TRP A 82 10.415 5.305 -22.870 1.00 2.12 H new ATOM 0 HB3 TRP A 82 10.753 4.731 -21.249 1.00 2.12 H new ATOM 0 HD1 TRP A 82 8.610 3.281 -24.197 1.00 62.21 H new ATOM 0 HE1 TRP A 82 9.178 0.772 -24.468 1.00 52.40 H new ATOM 0 HE3 TRP A 82 12.073 2.888 -20.459 1.00 61.15 H new ATOM 0 HZ2 TRP A 82 10.887 -1.087 -23.226 1.00 52.43 H new ATOM 0 HZ3 TRP A 82 13.137 0.704 -20.058 1.00 75.55 H new ATOM 0 HH2 TRP A 82 12.552 -1.256 -21.428 1.00 20.23 H new ATOM 797 N PRO A 83 8.457 7.140 -22.964 1.00 22.45 N ATOM 798 CA PRO A 83 9.549 7.727 -22.182 1.00 22.03 C ATOM 799 C PRO A 83 9.137 8.028 -20.745 1.00 31.22 C ATOM 800 O PRO A 83 7.986 7.818 -20.362 1.00 62.44 O ATOM 801 CB PRO A 83 9.864 9.024 -22.931 1.00 14.54 C ATOM 802 CG PRO A 83 8.597 9.373 -23.633 1.00 31.11 C ATOM 803 CD PRO A 83 7.948 8.064 -23.990 1.00 50.32 C ATOM 0 HA PRO A 83 10.399 7.050 -22.097 1.00 22.03 H new ATOM 0 HB2 PRO A 83 10.167 9.814 -22.244 1.00 14.54 H new ATOM 0 HB3 PRO A 83 10.683 8.885 -23.637 1.00 14.54 H new ATOM 0 HG2 PRO A 83 7.947 9.969 -22.992 1.00 31.11 H new ATOM 0 HG3 PRO A 83 8.796 9.966 -24.525 1.00 31.11 H new ATOM 0 HD2 PRO A 83 6.861 8.134 -23.964 1.00 50.32 H new ATOM 0 HD3 PRO A 83 8.222 7.740 -24.994 1.00 50.32 H new ATOM 811 N ALA A 84 10.084 8.521 -19.953 1.00 54.44 N ATOM 812 CA ALA A 84 9.817 8.853 -18.559 1.00 43.43 C ATOM 813 C ALA A 84 9.218 10.250 -18.432 1.00 71.24 C ATOM 814 O ALA A 84 9.126 10.799 -17.334 1.00 70.22 O ATOM 815 CB ALA A 84 11.094 8.749 -17.739 1.00 23.44 C ATOM 0 H ALA A 84 11.042 8.699 -20.253 1.00 54.44 H new ATOM 0 HA ALA A 84 9.090 8.138 -18.174 1.00 43.43 H new ATOM 0 HB1 ALA A 84 10.881 9.000 -16.700 1.00 23.44 H new ATOM 0 HB2 ALA A 84 11.480 7.731 -17.795 1.00 23.44 H new ATOM 0 HB3 ALA A 84 11.837 9.442 -18.134 1.00 23.44 H new ATOM 821 N ASP A 85 8.812 10.819 -19.562 1.00 2.21 N ATOM 822 CA ASP A 85 8.221 12.152 -19.577 1.00 10.21 C ATOM 823 C ASP A 85 7.160 12.288 -18.490 1.00 15.14 C ATOM 824 O ASP A 85 6.917 13.381 -17.978 1.00 34.04 O ATOM 825 CB ASP A 85 7.606 12.445 -20.946 1.00 44.54 C ATOM 826 CG ASP A 85 6.244 11.804 -21.119 1.00 14.22 C ATOM 827 OD1 ASP A 85 6.172 10.558 -21.129 1.00 31.33 O ATOM 828 OD2 ASP A 85 5.249 12.549 -21.245 1.00 33.23 O ATOM 0 H ASP A 85 8.881 10.378 -20.479 1.00 2.21 H new ATOM 0 HA ASP A 85 9.012 12.875 -19.380 1.00 10.21 H new ATOM 0 HB2 ASP A 85 7.516 13.523 -21.077 1.00 44.54 H new ATOM 0 HB3 ASP A 85 8.276 12.084 -21.726 1.00 44.54 H new ATOM 833 N VAL A 86 6.529 11.171 -18.142 1.00 71.43 N ATOM 834 CA VAL A 86 5.493 11.165 -17.116 1.00 63.40 C ATOM 835 C VAL A 86 5.968 11.872 -15.852 1.00 3.02 C ATOM 836 O VAL A 86 5.167 12.437 -15.107 1.00 3.43 O ATOM 837 CB VAL A 86 5.066 9.729 -16.758 1.00 23.30 C ATOM 838 CG1 VAL A 86 4.495 9.022 -17.977 1.00 72.44 C ATOM 839 CG2 VAL A 86 6.241 8.952 -16.183 1.00 32.24 C ATOM 0 H VAL A 86 6.717 10.258 -18.556 1.00 71.43 H new ATOM 0 HA VAL A 86 4.636 11.699 -17.528 1.00 63.40 H new ATOM 0 HB VAL A 86 4.286 9.779 -15.998 1.00 23.30 H new ATOM 0 HG11 VAL A 86 4.199 8.009 -17.705 1.00 72.44 H new ATOM 0 HG12 VAL A 86 3.625 9.569 -18.341 1.00 72.44 H new ATOM 0 HG13 VAL A 86 5.251 8.981 -18.761 1.00 72.44 H new ATOM 0 HG21 VAL A 86 5.922 7.940 -15.936 1.00 32.24 H new ATOM 0 HG22 VAL A 86 7.044 8.910 -16.919 1.00 32.24 H new ATOM 0 HG23 VAL A 86 6.600 9.449 -15.282 1.00 32.24 H new ATOM 849 N ILE A 87 7.276 11.837 -15.617 1.00 35.15 N ATOM 850 CA ILE A 87 7.857 12.476 -14.443 1.00 44.30 C ATOM 851 C ILE A 87 7.542 13.968 -14.417 1.00 10.04 C ATOM 852 O ILE A 87 7.309 14.545 -13.354 1.00 73.15 O ATOM 853 CB ILE A 87 9.385 12.285 -14.397 1.00 51.20 C ATOM 854 CG1 ILE A 87 9.734 10.796 -14.393 1.00 25.42 C ATOM 855 CG2 ILE A 87 9.968 12.975 -13.173 1.00 44.21 C ATOM 856 CD1 ILE A 87 11.169 10.511 -14.778 1.00 62.52 C ATOM 0 H ILE A 87 7.952 11.373 -16.224 1.00 35.15 H new ATOM 0 HA ILE A 87 7.412 11.998 -13.570 1.00 44.30 H new ATOM 0 HB ILE A 87 9.821 12.739 -15.287 1.00 51.20 H new ATOM 0 HG12 ILE A 87 9.545 10.389 -13.399 1.00 25.42 H new ATOM 0 HG13 ILE A 87 9.071 10.274 -15.082 1.00 25.42 H new ATOM 0 HG21 ILE A 87 11.048 12.831 -13.154 1.00 44.21 H new ATOM 0 HG22 ILE A 87 9.744 14.041 -13.215 1.00 44.21 H new ATOM 0 HG23 ILE A 87 9.529 12.548 -12.271 1.00 44.21 H new ATOM 0 HD11 ILE A 87 11.346 9.436 -14.754 1.00 62.52 H new ATOM 0 HD12 ILE A 87 11.358 10.887 -15.784 1.00 62.52 H new ATOM 0 HD13 ILE A 87 11.839 11.005 -14.074 1.00 62.52 H new ATOM 868 N SER A 88 7.535 14.587 -15.593 1.00 30.20 N ATOM 869 CA SER A 88 7.250 16.012 -15.705 1.00 52.41 C ATOM 870 C SER A 88 5.751 16.257 -15.848 1.00 53.02 C ATOM 871 O SER A 88 5.227 17.269 -15.380 1.00 65.20 O ATOM 872 CB SER A 88 7.992 16.610 -16.902 1.00 61.10 C ATOM 873 OG SER A 88 9.347 16.874 -16.582 1.00 10.22 O ATOM 0 H SER A 88 7.724 14.124 -16.482 1.00 30.20 H new ATOM 0 HA SER A 88 7.595 16.499 -14.793 1.00 52.41 H new ATOM 0 HB2 SER A 88 7.942 15.922 -17.746 1.00 61.10 H new ATOM 0 HB3 SER A 88 7.502 17.533 -17.214 1.00 61.10 H new ATOM 0 HG SER A 88 9.800 17.254 -17.364 1.00 10.22 H new ATOM 879 N HIS A 89 5.065 15.323 -16.499 1.00 35.22 N ATOM 880 CA HIS A 89 3.625 15.435 -16.704 1.00 12.31 C ATOM 881 C HIS A 89 2.870 15.202 -15.399 1.00 21.33 C ATOM 882 O HIS A 89 1.691 15.539 -15.283 1.00 64.04 O ATOM 883 CB HIS A 89 3.159 14.434 -17.762 1.00 3.51 C ATOM 884 CG HIS A 89 1.729 14.613 -18.167 1.00 54.32 C ATOM 885 ND1 HIS A 89 0.679 14.009 -17.508 1.00 54.41 N ATOM 886 CD2 HIS A 89 1.176 15.335 -19.170 1.00 41.11 C ATOM 887 CE1 HIS A 89 -0.458 14.351 -18.089 1.00 63.42 C ATOM 888 NE2 HIS A 89 -0.184 15.155 -19.100 1.00 45.12 N ATOM 0 H HIS A 89 5.483 14.480 -16.894 1.00 35.22 H new ATOM 0 HA HIS A 89 3.411 16.446 -17.052 1.00 12.31 H new ATOM 0 HB2 HIS A 89 3.792 14.529 -18.644 1.00 3.51 H new ATOM 0 HB3 HIS A 89 3.296 13.423 -17.379 1.00 3.51 H new ATOM 0 HD2 HIS A 89 1.706 15.940 -19.891 1.00 41.11 H new ATOM 0 HE1 HIS A 89 -1.444 14.028 -17.788 1.00 63.42 H new ATOM 0 HE2 HIS A 89 -0.871 15.574 -19.727 1.00 45.12 H new ATOM 896 N ILE A 90 3.557 14.622 -14.420 1.00 14.54 N ATOM 897 CA ILE A 90 2.951 14.345 -13.123 1.00 73.53 C ATOM 898 C ILE A 90 2.737 15.629 -12.330 1.00 20.14 C ATOM 899 O ILE A 90 1.626 15.950 -11.909 1.00 14.25 O ATOM 900 CB ILE A 90 3.817 13.379 -12.293 1.00 13.14 C ATOM 901 CG1 ILE A 90 3.420 11.929 -12.579 1.00 5.22 C ATOM 902 CG2 ILE A 90 3.680 13.688 -10.809 1.00 42.22 C ATOM 903 CD1 ILE A 90 2.046 11.565 -12.063 1.00 10.24 C ATOM 0 H ILE A 90 4.533 14.335 -14.500 1.00 14.54 H new ATOM 0 HA ILE A 90 1.986 13.878 -13.319 1.00 73.53 H new ATOM 0 HB ILE A 90 4.860 13.513 -12.578 1.00 13.14 H new ATOM 0 HG12 ILE A 90 3.452 11.758 -13.655 1.00 5.22 H new ATOM 0 HG13 ILE A 90 4.156 11.264 -12.128 1.00 5.22 H new ATOM 0 HG21 ILE A 90 4.298 12.997 -10.235 1.00 42.22 H new ATOM 0 HG22 ILE A 90 4.006 14.710 -10.619 1.00 42.22 H new ATOM 0 HG23 ILE A 90 2.638 13.578 -10.509 1.00 42.22 H new ATOM 0 HD11 ILE A 90 1.832 10.523 -12.301 1.00 10.24 H new ATOM 0 HD12 ILE A 90 2.015 11.704 -10.982 1.00 10.24 H new ATOM 0 HD13 ILE A 90 1.299 12.205 -12.533 1.00 10.24 H new ATOM 915 N PRO A 91 3.826 16.384 -12.121 1.00 20.41 N ATOM 916 CA PRO A 91 3.783 17.647 -11.379 1.00 22.04 C ATOM 917 C PRO A 91 3.049 18.744 -12.143 1.00 25.33 C ATOM 918 O PRO A 91 2.418 19.615 -11.545 1.00 34.33 O ATOM 919 CB PRO A 91 5.261 18.010 -11.210 1.00 72.50 C ATOM 920 CG PRO A 91 5.949 17.332 -12.344 1.00 60.41 C ATOM 921 CD PRO A 91 5.183 16.062 -12.594 1.00 31.00 C ATOM 0 HA PRO A 91 3.244 17.548 -10.437 1.00 22.04 H new ATOM 0 HB2 PRO A 91 5.410 19.089 -11.245 1.00 72.50 H new ATOM 0 HB3 PRO A 91 5.646 17.666 -10.250 1.00 72.50 H new ATOM 0 HG2 PRO A 91 5.955 17.965 -13.231 1.00 60.41 H new ATOM 0 HG3 PRO A 91 6.989 17.118 -12.098 1.00 60.41 H new ATOM 0 HD2 PRO A 91 5.187 15.791 -13.650 1.00 31.00 H new ATOM 0 HD3 PRO A 91 5.610 15.221 -12.048 1.00 31.00 H new ATOM 929 N VAL A 92 3.137 18.695 -13.468 1.00 52.13 N ATOM 930 CA VAL A 92 2.480 19.684 -14.314 1.00 75.15 C ATOM 931 C VAL A 92 0.964 19.532 -14.261 1.00 55.13 C ATOM 932 O VAL A 92 0.234 20.517 -14.137 1.00 31.32 O ATOM 933 CB VAL A 92 2.945 19.568 -15.778 1.00 50.32 C ATOM 934 CG1 VAL A 92 2.247 18.407 -16.470 1.00 44.23 C ATOM 935 CG2 VAL A 92 2.694 20.872 -16.521 1.00 74.43 C ATOM 0 H VAL A 92 3.657 17.981 -13.979 1.00 52.13 H new ATOM 0 HA VAL A 92 2.758 20.665 -13.929 1.00 75.15 H new ATOM 0 HB VAL A 92 4.017 19.372 -15.786 1.00 50.32 H new ATOM 0 HG11 VAL A 92 2.588 18.341 -17.503 1.00 44.23 H new ATOM 0 HG12 VAL A 92 2.483 17.479 -15.950 1.00 44.23 H new ATOM 0 HG13 VAL A 92 1.169 18.568 -16.454 1.00 44.23 H new ATOM 0 HG21 VAL A 92 3.028 20.773 -17.554 1.00 74.43 H new ATOM 0 HG22 VAL A 92 1.628 21.101 -16.505 1.00 74.43 H new ATOM 0 HG23 VAL A 92 3.245 21.678 -16.037 1.00 74.43 H new ATOM 945 N LEU A 93 0.495 18.293 -14.356 1.00 21.33 N ATOM 946 CA LEU A 93 -0.936 18.011 -14.318 1.00 23.53 C ATOM 947 C LEU A 93 -1.502 18.257 -12.923 1.00 74.41 C ATOM 948 O LEU A 93 -2.641 18.701 -12.775 1.00 13.44 O ATOM 949 CB LEU A 93 -1.202 16.565 -14.741 1.00 61.11 C ATOM 950 CG LEU A 93 -1.633 15.608 -13.629 1.00 3.23 C ATOM 951 CD1 LEU A 93 -3.144 15.633 -13.459 1.00 3.45 C ATOM 952 CD2 LEU A 93 -1.151 14.195 -13.924 1.00 42.41 C ATOM 0 H LEU A 93 1.085 17.467 -14.460 1.00 21.33 H new ATOM 0 HA LEU A 93 -1.433 18.685 -15.016 1.00 23.53 H new ATOM 0 HB2 LEU A 93 -1.975 16.569 -15.509 1.00 61.11 H new ATOM 0 HB3 LEU A 93 -0.297 16.170 -15.202 1.00 61.11 H new ATOM 0 HG LEU A 93 -1.177 15.938 -12.695 1.00 3.23 H new ATOM 0 HD11 LEU A 93 -3.432 14.946 -12.663 1.00 3.45 H new ATOM 0 HD12 LEU A 93 -3.464 16.642 -13.200 1.00 3.45 H new ATOM 0 HD13 LEU A 93 -3.620 15.329 -14.391 1.00 3.45 H new ATOM 0 HD21 LEU A 93 -1.467 13.528 -13.122 1.00 42.41 H new ATOM 0 HD22 LEU A 93 -1.577 13.855 -14.868 1.00 42.41 H new ATOM 0 HD23 LEU A 93 -0.063 14.189 -13.994 1.00 42.41 H new ATOM 964 N CYS A 94 -0.700 17.966 -11.905 1.00 14.52 N ATOM 965 CA CYS A 94 -1.121 18.158 -10.521 1.00 74.44 C ATOM 966 C CYS A 94 -1.073 19.633 -10.137 1.00 63.21 C ATOM 967 O CYS A 94 -2.025 20.168 -9.571 1.00 31.34 O ATOM 968 CB CYS A 94 -0.234 17.343 -9.579 1.00 42.12 C ATOM 969 SG CYS A 94 -0.357 17.831 -7.843 1.00 12.34 S ATOM 0 H CYS A 94 0.245 17.596 -12.011 1.00 14.52 H new ATOM 0 HA CYS A 94 -2.150 17.812 -10.429 1.00 74.44 H new ATOM 0 HB2 CYS A 94 -0.499 16.289 -9.669 1.00 42.12 H new ATOM 0 HB3 CYS A 94 0.803 17.439 -9.900 1.00 42.12 H new ATOM 0 HG CYS A 94 0.428 17.083 -7.125 1.00 12.34 H new ATOM 975 N GLU A 95 0.044 20.284 -10.448 1.00 60.51 N ATOM 976 CA GLU A 95 0.217 21.697 -10.132 1.00 60.45 C ATOM 977 C GLU A 95 -0.761 22.556 -10.929 1.00 64.33 C ATOM 978 O GLU A 95 -1.074 23.681 -10.541 1.00 31.04 O ATOM 979 CB GLU A 95 1.654 22.135 -10.425 1.00 14.14 C ATOM 980 CG GLU A 95 2.022 23.469 -9.798 1.00 2.14 C ATOM 981 CD GLU A 95 3.371 23.980 -10.265 1.00 1.52 C ATOM 982 OE1 GLU A 95 3.999 23.309 -11.111 1.00 55.51 O ATOM 983 OE2 GLU A 95 3.799 25.051 -9.785 1.00 24.54 O ATOM 0 H GLU A 95 0.842 19.856 -10.918 1.00 60.51 H new ATOM 0 HA GLU A 95 0.012 21.834 -9.070 1.00 60.45 H new ATOM 0 HB2 GLU A 95 2.340 21.370 -10.061 1.00 14.14 H new ATOM 0 HB3 GLU A 95 1.793 22.199 -11.504 1.00 14.14 H new ATOM 0 HG2 GLU A 95 1.255 24.204 -10.041 1.00 2.14 H new ATOM 0 HG3 GLU A 95 2.032 23.366 -8.713 1.00 2.14 H new ATOM 990 N ASP A 96 -1.238 22.017 -12.046 1.00 21.02 N ATOM 991 CA ASP A 96 -2.180 22.733 -12.898 1.00 72.11 C ATOM 992 C ASP A 96 -3.618 22.459 -12.468 1.00 10.41 C ATOM 993 O ASP A 96 -4.392 23.386 -12.226 1.00 41.44 O ATOM 994 CB ASP A 96 -1.987 22.329 -14.360 1.00 63.15 C ATOM 995 CG ASP A 96 -3.080 22.870 -15.260 1.00 74.12 C ATOM 996 OD1 ASP A 96 -3.031 24.071 -15.599 1.00 3.24 O ATOM 997 OD2 ASP A 96 -3.986 22.092 -15.627 1.00 24.24 O ATOM 0 H ASP A 96 -0.988 21.087 -12.382 1.00 21.02 H new ATOM 0 HA ASP A 96 -1.986 23.801 -12.795 1.00 72.11 H new ATOM 0 HB2 ASP A 96 -1.020 22.692 -14.709 1.00 63.15 H new ATOM 0 HB3 ASP A 96 -1.965 21.242 -14.433 1.00 63.15 H new ATOM 1002 N HIS A 97 -3.970 21.181 -12.375 1.00 64.20 N ATOM 1003 CA HIS A 97 -5.315 20.785 -11.974 1.00 51.14 C ATOM 1004 C HIS A 97 -5.302 20.138 -10.593 1.00 14.44 C ATOM 1005 O HIS A 97 -6.204 20.360 -9.785 1.00 34.43 O ATOM 1006 CB HIS A 97 -5.911 19.818 -12.998 1.00 21.34 C ATOM 1007 CG HIS A 97 -7.322 19.417 -12.693 1.00 4.52 C ATOM 1008 ND1 HIS A 97 -8.257 20.290 -12.179 1.00 12.32 N ATOM 1009 CD2 HIS A 97 -7.955 18.230 -12.834 1.00 31.40 C ATOM 1010 CE1 HIS A 97 -9.405 19.656 -12.015 1.00 44.34 C ATOM 1011 NE2 HIS A 97 -9.248 18.404 -12.406 1.00 11.30 N ATOM 0 H HIS A 97 -3.342 20.402 -12.572 1.00 64.20 H new ATOM 0 HA HIS A 97 -5.933 21.682 -11.929 1.00 51.14 H new ATOM 0 HB2 HIS A 97 -5.879 20.281 -13.984 1.00 21.34 H new ATOM 0 HB3 HIS A 97 -5.290 18.924 -13.045 1.00 21.34 H new ATOM 0 HD2 HIS A 97 -7.524 17.315 -13.213 1.00 31.40 H new ATOM 0 HE1 HIS A 97 -10.316 20.088 -11.627 1.00 44.34 H new ATOM 0 HE2 HIS A 97 -9.970 17.684 -12.392 1.00 11.30 H new ATOM 1019 N SER A 98 -4.275 19.338 -10.328 1.00 64.05 N ATOM 1020 CA SER A 98 -4.147 18.655 -9.046 1.00 51.42 C ATOM 1021 C SER A 98 -4.977 17.376 -9.027 1.00 73.41 C ATOM 1022 O SER A 98 -6.185 17.409 -8.792 1.00 73.21 O ATOM 1023 CB SER A 98 -4.585 19.578 -7.907 1.00 55.34 C ATOM 1024 OG SER A 98 -3.846 19.319 -6.727 1.00 22.50 O ATOM 0 H SER A 98 -3.518 19.146 -10.985 1.00 64.05 H new ATOM 0 HA SER A 98 -3.099 18.389 -8.906 1.00 51.42 H new ATOM 0 HB2 SER A 98 -4.448 20.618 -8.204 1.00 55.34 H new ATOM 0 HB3 SER A 98 -5.648 19.440 -7.711 1.00 55.34 H new ATOM 0 HG SER A 98 -4.144 19.923 -6.015 1.00 22.50 H new ATOM 1030 N VAL A 99 -4.320 16.247 -9.276 1.00 41.44 N ATOM 1031 CA VAL A 99 -4.995 14.955 -9.287 1.00 54.42 C ATOM 1032 C VAL A 99 -4.077 13.851 -8.775 1.00 54.12 C ATOM 1033 O VAL A 99 -2.928 13.720 -9.196 1.00 42.30 O ATOM 1034 CB VAL A 99 -5.482 14.588 -10.702 1.00 13.44 C ATOM 1035 CG1 VAL A 99 -6.460 13.425 -10.645 1.00 32.23 C ATOM 1036 CG2 VAL A 99 -6.116 15.796 -11.376 1.00 71.43 C ATOM 0 H VAL A 99 -3.320 16.202 -9.473 1.00 41.44 H new ATOM 0 HA VAL A 99 -5.857 15.043 -8.626 1.00 54.42 H new ATOM 0 HB VAL A 99 -4.622 14.279 -11.295 1.00 13.44 H new ATOM 0 HG11 VAL A 99 -6.793 13.180 -11.654 1.00 32.23 H new ATOM 0 HG12 VAL A 99 -5.969 12.558 -10.204 1.00 32.23 H new ATOM 0 HG13 VAL A 99 -7.320 13.703 -10.036 1.00 32.23 H new ATOM 0 HG21 VAL A 99 -6.455 15.520 -12.375 1.00 71.43 H new ATOM 0 HG22 VAL A 99 -6.967 16.137 -10.786 1.00 71.43 H new ATOM 0 HG23 VAL A 99 -5.382 16.598 -11.451 1.00 71.43 H new ATOM 1046 N PRO A 100 -4.595 13.035 -7.845 1.00 11.43 N ATOM 1047 CA PRO A 100 -3.839 11.926 -7.255 1.00 51.33 C ATOM 1048 C PRO A 100 -3.596 10.797 -8.251 1.00 1.04 C ATOM 1049 O PRO A 100 -4.486 10.431 -9.018 1.00 71.34 O ATOM 1050 CB PRO A 100 -4.741 11.449 -6.115 1.00 33.23 C ATOM 1051 CG PRO A 100 -6.116 11.852 -6.524 1.00 43.24 C ATOM 1052 CD PRO A 100 -5.958 13.133 -7.297 1.00 34.23 C ATOM 0 HA PRO A 100 -2.846 12.236 -6.929 1.00 51.33 H new ATOM 0 HB2 PRO A 100 -4.669 10.370 -5.979 1.00 33.23 H new ATOM 0 HB3 PRO A 100 -4.459 11.909 -5.168 1.00 33.23 H new ATOM 0 HG2 PRO A 100 -6.583 11.081 -7.137 1.00 43.24 H new ATOM 0 HG3 PRO A 100 -6.755 11.998 -5.653 1.00 43.24 H new ATOM 0 HD2 PRO A 100 -6.704 13.220 -8.087 1.00 34.23 H new ATOM 0 HD3 PRO A 100 -6.071 14.006 -6.655 1.00 34.23 H new ATOM 1060 N TYR A 101 -2.386 10.249 -8.232 1.00 32.31 N ATOM 1061 CA TYR A 101 -2.026 9.162 -9.135 1.00 24.15 C ATOM 1062 C TYR A 101 -1.469 7.972 -8.359 1.00 61.22 C ATOM 1063 O TYR A 101 -1.297 8.036 -7.141 1.00 72.35 O ATOM 1064 CB TYR A 101 -0.998 9.642 -10.160 1.00 43.53 C ATOM 1065 CG TYR A 101 -0.467 11.030 -9.881 1.00 5.24 C ATOM 1066 CD1 TYR A 101 0.409 11.261 -8.827 1.00 44.23 C ATOM 1067 CD2 TYR A 101 -0.840 12.110 -10.671 1.00 11.51 C ATOM 1068 CE1 TYR A 101 0.896 12.528 -8.568 1.00 24.41 C ATOM 1069 CE2 TYR A 101 -0.357 13.380 -10.420 1.00 2.12 C ATOM 1070 CZ TYR A 101 0.511 13.584 -9.367 1.00 34.41 C ATOM 1071 OH TYR A 101 0.995 14.846 -9.113 1.00 13.44 O ATOM 0 H TYR A 101 -1.638 10.539 -7.602 1.00 32.31 H new ATOM 0 HA TYR A 101 -2.928 8.843 -9.657 1.00 24.15 H new ATOM 0 HB2 TYR A 101 -0.164 8.941 -10.181 1.00 43.53 H new ATOM 0 HB3 TYR A 101 -1.452 9.628 -11.151 1.00 43.53 H new ATOM 0 HD1 TYR A 101 0.714 10.436 -8.200 1.00 44.23 H new ATOM 0 HD2 TYR A 101 -1.519 11.954 -11.496 1.00 11.51 H new ATOM 0 HE1 TYR A 101 1.575 12.690 -7.744 1.00 24.41 H new ATOM 0 HE2 TYR A 101 -0.657 14.208 -11.045 1.00 2.12 H new ATOM 0 HH TYR A 101 1.346 15.235 -9.941 1.00 13.44 H new ATOM 1081 N ILE A 102 -1.188 6.887 -9.074 1.00 14.41 N ATOM 1082 CA ILE A 102 -0.649 5.683 -8.454 1.00 54.14 C ATOM 1083 C ILE A 102 0.442 5.062 -9.319 1.00 24.31 C ATOM 1084 O ILE A 102 0.348 5.054 -10.546 1.00 60.24 O ATOM 1085 CB ILE A 102 -1.751 4.636 -8.207 1.00 72.33 C ATOM 1086 CG1 ILE A 102 -2.878 5.238 -7.365 1.00 22.40 C ATOM 1087 CG2 ILE A 102 -1.170 3.407 -7.524 1.00 31.10 C ATOM 1088 CD1 ILE A 102 -3.875 6.038 -8.173 1.00 42.41 C ATOM 0 H ILE A 102 -1.325 6.818 -10.082 1.00 14.41 H new ATOM 0 HA ILE A 102 -0.224 5.983 -7.496 1.00 54.14 H new ATOM 0 HB ILE A 102 -2.165 4.332 -9.168 1.00 72.33 H new ATOM 0 HG12 ILE A 102 -3.403 4.435 -6.848 1.00 22.40 H new ATOM 0 HG13 ILE A 102 -2.445 5.881 -6.599 1.00 22.40 H new ATOM 0 HG21 ILE A 102 -1.961 2.676 -7.356 1.00 31.10 H new ATOM 0 HG22 ILE A 102 -0.399 2.969 -8.158 1.00 31.10 H new ATOM 0 HG23 ILE A 102 -0.733 3.695 -6.568 1.00 31.10 H new ATOM 0 HD11 ILE A 102 -4.645 6.434 -7.511 1.00 42.41 H new ATOM 0 HD12 ILE A 102 -3.363 6.863 -8.669 1.00 42.41 H new ATOM 0 HD13 ILE A 102 -4.336 5.394 -8.922 1.00 42.41 H new ATOM 1100 N PHE A 103 1.478 4.540 -8.670 1.00 30.11 N ATOM 1101 CA PHE A 103 2.588 3.915 -9.379 1.00 24.20 C ATOM 1102 C PHE A 103 2.422 2.399 -9.422 1.00 33.43 C ATOM 1103 O PHE A 103 2.522 1.724 -8.397 1.00 30.53 O ATOM 1104 CB PHE A 103 3.916 4.275 -8.709 1.00 62.42 C ATOM 1105 CG PHE A 103 5.083 4.276 -9.655 1.00 3.44 C ATOM 1106 CD1 PHE A 103 5.039 5.009 -10.830 1.00 33.41 C ATOM 1107 CD2 PHE A 103 6.225 3.545 -9.368 1.00 50.30 C ATOM 1108 CE1 PHE A 103 6.111 5.013 -11.702 1.00 21.20 C ATOM 1109 CE2 PHE A 103 7.301 3.546 -10.236 1.00 35.01 C ATOM 1110 CZ PHE A 103 7.243 4.280 -11.405 1.00 21.52 C ATOM 0 H PHE A 103 1.572 4.538 -7.654 1.00 30.11 H new ATOM 0 HA PHE A 103 2.591 4.291 -10.402 1.00 24.20 H new ATOM 0 HB2 PHE A 103 3.828 5.261 -8.252 1.00 62.42 H new ATOM 0 HB3 PHE A 103 4.112 3.567 -7.904 1.00 62.42 H new ATOM 0 HD1 PHE A 103 4.156 5.584 -11.067 1.00 33.41 H new ATOM 0 HD2 PHE A 103 6.275 2.968 -8.456 1.00 50.30 H new ATOM 0 HE1 PHE A 103 6.064 5.589 -12.615 1.00 21.20 H new ATOM 0 HE2 PHE A 103 8.186 2.974 -10.000 1.00 35.01 H new ATOM 0 HZ PHE A 103 8.082 4.281 -12.085 1.00 21.52 H new ATOM 1120 N ILE A 104 2.166 1.871 -10.614 1.00 64.11 N ATOM 1121 CA ILE A 104 1.986 0.435 -10.791 1.00 3.31 C ATOM 1122 C ILE A 104 2.452 -0.011 -12.173 1.00 32.02 C ATOM 1123 O ILE A 104 2.502 0.772 -13.121 1.00 52.33 O ATOM 1124 CB ILE A 104 0.514 0.025 -10.600 1.00 62.10 C ATOM 1125 CG1 ILE A 104 -0.402 0.932 -11.424 1.00 62.23 C ATOM 1126 CG2 ILE A 104 0.136 0.079 -9.127 1.00 61.44 C ATOM 1127 CD1 ILE A 104 -0.830 2.184 -10.692 1.00 42.41 C ATOM 0 H ILE A 104 2.079 2.416 -11.472 1.00 64.11 H new ATOM 0 HA ILE A 104 2.593 -0.056 -10.030 1.00 3.31 H new ATOM 0 HB ILE A 104 0.389 -1.000 -10.950 1.00 62.10 H new ATOM 0 HG12 ILE A 104 0.112 1.216 -12.342 1.00 62.23 H new ATOM 0 HG13 ILE A 104 -1.289 0.370 -11.716 1.00 62.23 H new ATOM 0 HG21 ILE A 104 -0.907 -0.213 -9.008 1.00 61.44 H new ATOM 0 HG22 ILE A 104 0.771 -0.604 -8.563 1.00 61.44 H new ATOM 0 HG23 ILE A 104 0.273 1.094 -8.753 1.00 61.44 H new ATOM 0 HD11 ILE A 104 -1.477 2.779 -11.336 1.00 42.41 H new ATOM 0 HD12 ILE A 104 -1.372 1.909 -9.787 1.00 42.41 H new ATOM 0 HD13 ILE A 104 0.051 2.768 -10.424 1.00 42.41 H new ATOM 1139 N PRO A 105 2.799 -1.301 -12.292 1.00 4.01 N ATOM 1140 CA PRO A 105 3.265 -1.882 -13.555 1.00 32.03 C ATOM 1141 C PRO A 105 2.151 -1.985 -14.591 1.00 34.13 C ATOM 1142 O PRO A 105 1.101 -2.574 -14.331 1.00 64.33 O ATOM 1143 CB PRO A 105 3.747 -3.277 -13.147 1.00 52.52 C ATOM 1144 CG PRO A 105 2.974 -3.599 -11.915 1.00 71.52 C ATOM 1145 CD PRO A 105 2.765 -2.292 -11.203 1.00 55.31 C ATOM 0 HA PRO A 105 4.035 -1.271 -14.026 1.00 32.03 H new ATOM 0 HB2 PRO A 105 3.559 -4.007 -13.934 1.00 52.52 H new ATOM 0 HB3 PRO A 105 4.820 -3.285 -12.955 1.00 52.52 H new ATOM 0 HG2 PRO A 105 2.020 -4.065 -12.163 1.00 71.52 H new ATOM 0 HG3 PRO A 105 3.518 -4.303 -11.286 1.00 71.52 H new ATOM 0 HD2 PRO A 105 1.814 -2.272 -10.671 1.00 55.31 H new ATOM 0 HD3 PRO A 105 3.546 -2.106 -10.466 1.00 55.31 H new ATOM 1153 N SER A 106 2.386 -1.409 -15.765 1.00 53.12 N ATOM 1154 CA SER A 106 1.400 -1.433 -16.840 1.00 21.44 C ATOM 1155 C SER A 106 1.116 -2.865 -17.284 1.00 30.13 C ATOM 1156 O SER A 106 0.050 -3.161 -17.823 1.00 55.44 O ATOM 1157 CB SER A 106 1.891 -0.606 -18.029 1.00 73.24 C ATOM 1158 OG SER A 106 3.306 -0.596 -18.094 1.00 42.31 O ATOM 0 H SER A 106 3.251 -0.920 -15.997 1.00 53.12 H new ATOM 0 HA SER A 106 0.475 -0.998 -16.462 1.00 21.44 H new ATOM 0 HB2 SER A 106 1.484 -1.016 -18.954 1.00 73.24 H new ATOM 0 HB3 SER A 106 1.521 0.416 -17.943 1.00 73.24 H new ATOM 0 HG SER A 106 3.621 -1.430 -18.501 1.00 42.31 H new ATOM 1164 N LYS A 107 2.079 -3.751 -17.053 1.00 34.43 N ATOM 1165 CA LYS A 107 1.934 -5.153 -17.427 1.00 23.34 C ATOM 1166 C LYS A 107 0.559 -5.683 -17.032 1.00 42.15 C ATOM 1167 O LYS A 107 -0.278 -5.960 -17.891 1.00 22.11 O ATOM 1168 CB LYS A 107 3.026 -5.995 -16.762 1.00 43.31 C ATOM 1169 CG LYS A 107 4.359 -5.945 -17.489 1.00 22.04 C ATOM 1170 CD LYS A 107 5.062 -7.292 -17.457 1.00 3.34 C ATOM 1171 CE LYS A 107 6.269 -7.312 -18.382 1.00 61.42 C ATOM 1172 NZ LYS A 107 5.882 -7.599 -19.791 1.00 65.34 N ATOM 0 H LYS A 107 2.968 -3.523 -16.609 1.00 34.43 H new ATOM 0 HA LYS A 107 2.035 -5.226 -18.510 1.00 23.34 H new ATOM 0 HB2 LYS A 107 3.167 -5.649 -15.738 1.00 43.31 H new ATOM 0 HB3 LYS A 107 2.691 -7.031 -16.706 1.00 43.31 H new ATOM 0 HG2 LYS A 107 4.199 -5.641 -18.524 1.00 22.04 H new ATOM 0 HG3 LYS A 107 4.997 -5.190 -17.030 1.00 22.04 H new ATOM 0 HD2 LYS A 107 5.379 -7.514 -16.438 1.00 3.34 H new ATOM 0 HD3 LYS A 107 4.364 -8.075 -17.751 1.00 3.34 H new ATOM 0 HE2 LYS A 107 6.779 -6.350 -18.334 1.00 61.42 H new ATOM 0 HE3 LYS A 107 6.977 -8.066 -18.039 1.00 61.42 H new ATOM 0 HZ1 LYS A 107 6.732 -7.604 -20.390 1.00 65.34 H new ATOM 0 HZ2 LYS A 107 5.417 -8.528 -19.841 1.00 65.34 H new ATOM 0 HZ3 LYS A 107 5.226 -6.865 -20.127 1.00 65.34 H new ATOM 1186 N GLN A 108 0.334 -5.819 -15.730 1.00 14.03 N ATOM 1187 CA GLN A 108 -0.941 -6.315 -15.223 1.00 42.53 C ATOM 1188 C GLN A 108 -1.958 -5.184 -15.110 1.00 11.12 C ATOM 1189 O GLN A 108 -3.133 -5.359 -15.432 1.00 15.23 O ATOM 1190 CB GLN A 108 -0.747 -6.981 -13.860 1.00 75.33 C ATOM 1191 CG GLN A 108 -1.691 -8.148 -13.614 1.00 41.42 C ATOM 1192 CD GLN A 108 -1.482 -8.791 -12.258 1.00 23.32 C ATOM 1193 OE1 GLN A 108 -0.576 -8.417 -11.513 1.00 45.40 O ATOM 1194 NE2 GLN A 108 -2.321 -9.766 -11.929 1.00 72.31 N ATOM 0 H GLN A 108 1.017 -5.593 -15.007 1.00 14.03 H new ATOM 0 HA GLN A 108 -1.322 -7.053 -15.929 1.00 42.53 H new ATOM 0 HB2 GLN A 108 0.281 -7.333 -13.780 1.00 75.33 H new ATOM 0 HB3 GLN A 108 -0.891 -6.236 -13.077 1.00 75.33 H new ATOM 0 HG2 GLN A 108 -2.721 -7.800 -13.692 1.00 41.42 H new ATOM 0 HG3 GLN A 108 -1.548 -8.897 -14.393 1.00 41.42 H new ATOM 0 HE21 GLN A 108 -3.058 -10.045 -12.577 1.00 72.31 H new ATOM 0 HE22 GLN A 108 -2.228 -10.236 -11.029 1.00 72.31 H new ATOM 1203 N ASP A 109 -1.499 -4.025 -14.650 1.00 64.42 N ATOM 1204 CA ASP A 109 -2.369 -2.865 -14.495 1.00 24.33 C ATOM 1205 C ASP A 109 -3.039 -2.508 -15.818 1.00 2.44 C ATOM 1206 O ASP A 109 -4.263 -2.564 -15.941 1.00 11.53 O ATOM 1207 CB ASP A 109 -1.571 -1.669 -13.973 1.00 21.20 C ATOM 1208 CG ASP A 109 -2.444 -0.454 -13.726 1.00 63.43 C ATOM 1209 OD1 ASP A 109 -3.572 -0.627 -13.220 1.00 34.31 O ATOM 1210 OD2 ASP A 109 -1.998 0.669 -14.039 1.00 1.22 O ATOM 0 H ASP A 109 -0.529 -3.864 -14.378 1.00 64.42 H new ATOM 0 HA ASP A 109 -3.145 -3.117 -13.772 1.00 24.33 H new ATOM 0 HB2 ASP A 109 -1.070 -1.947 -13.046 1.00 21.20 H new ATOM 0 HB3 ASP A 109 -0.793 -1.413 -14.692 1.00 21.20 H new ATOM 1215 N LEU A 110 -2.229 -2.139 -16.804 1.00 52.02 N ATOM 1216 CA LEU A 110 -2.744 -1.771 -18.119 1.00 4.42 C ATOM 1217 C LEU A 110 -3.165 -3.008 -18.905 1.00 0.11 C ATOM 1218 O LEU A 110 -4.151 -2.983 -19.640 1.00 13.12 O ATOM 1219 CB LEU A 110 -1.686 -0.991 -18.902 1.00 10.43 C ATOM 1220 CG LEU A 110 -1.748 0.532 -18.780 1.00 11.33 C ATOM 1221 CD1 LEU A 110 -1.861 0.947 -17.321 1.00 21.22 C ATOM 1222 CD2 LEU A 110 -0.525 1.169 -19.424 1.00 55.30 C ATOM 0 H LEU A 110 -1.214 -2.087 -16.719 1.00 52.02 H new ATOM 0 HA LEU A 110 -3.621 -1.139 -17.975 1.00 4.42 H new ATOM 0 HB2 LEU A 110 -0.701 -1.322 -18.572 1.00 10.43 H new ATOM 0 HB3 LEU A 110 -1.775 -1.255 -19.956 1.00 10.43 H new ATOM 0 HG LEU A 110 -2.636 0.883 -19.306 1.00 11.33 H new ATOM 0 HD11 LEU A 110 -1.904 2.034 -17.254 1.00 21.22 H new ATOM 0 HD12 LEU A 110 -2.767 0.521 -16.891 1.00 21.22 H new ATOM 0 HD13 LEU A 110 -0.993 0.584 -16.771 1.00 21.22 H new ATOM 0 HD21 LEU A 110 -0.586 2.253 -19.328 1.00 55.30 H new ATOM 0 HD22 LEU A 110 0.376 0.811 -18.927 1.00 55.30 H new ATOM 0 HD23 LEU A 110 -0.488 0.900 -20.480 1.00 55.30 H new ATOM 1234 N GLY A 111 -2.411 -4.091 -18.743 1.00 20.10 N ATOM 1235 CA GLY A 111 -2.723 -5.324 -19.442 1.00 55.21 C ATOM 1236 C GLY A 111 -4.089 -5.869 -19.075 1.00 14.45 C ATOM 1237 O GLY A 111 -4.832 -6.336 -19.938 1.00 4.32 O ATOM 0 H GLY A 111 -1.590 -4.136 -18.140 1.00 20.10 H new ATOM 0 HA2 GLY A 111 -2.682 -5.149 -20.517 1.00 55.21 H new ATOM 0 HA3 GLY A 111 -1.963 -6.071 -19.211 1.00 55.21 H new ATOM 1241 N ALA A 112 -4.422 -5.810 -17.789 1.00 64.40 N ATOM 1242 CA ALA A 112 -5.707 -6.302 -17.309 1.00 54.43 C ATOM 1243 C ALA A 112 -6.785 -5.230 -17.434 1.00 33.23 C ATOM 1244 O ALA A 112 -7.810 -5.440 -18.082 1.00 41.33 O ATOM 1245 CB ALA A 112 -5.589 -6.769 -15.866 1.00 42.31 C ATOM 0 H ALA A 112 -3.819 -5.426 -17.061 1.00 64.40 H new ATOM 0 HA ALA A 112 -5.999 -7.149 -17.930 1.00 54.43 H new ATOM 0 HB1 ALA A 112 -6.557 -7.134 -15.521 1.00 42.31 H new ATOM 0 HB2 ALA A 112 -4.855 -7.572 -15.802 1.00 42.31 H new ATOM 0 HB3 ALA A 112 -5.271 -5.936 -15.239 1.00 42.31 H new ATOM 1251 N ALA A 113 -6.547 -4.082 -16.807 1.00 74.53 N ATOM 1252 CA ALA A 113 -7.498 -2.978 -16.849 1.00 63.04 C ATOM 1253 C ALA A 113 -7.691 -2.474 -18.276 1.00 21.04 C ATOM 1254 O ALA A 113 -8.662 -1.779 -18.573 1.00 24.04 O ATOM 1255 CB ALA A 113 -7.031 -1.846 -15.946 1.00 54.11 C ATOM 0 H ALA A 113 -5.704 -3.893 -16.264 1.00 74.53 H new ATOM 0 HA ALA A 113 -8.459 -3.344 -16.488 1.00 63.04 H new ATOM 0 HB1 ALA A 113 -7.750 -1.028 -15.987 1.00 54.11 H new ATOM 0 HB2 ALA A 113 -6.951 -2.208 -14.921 1.00 54.11 H new ATOM 0 HB3 ALA A 113 -6.057 -1.490 -16.283 1.00 54.11 H new ATOM 1261 N GLY A 114 -6.759 -2.829 -19.155 1.00 50.23 N ATOM 1262 CA GLY A 114 -6.845 -2.403 -20.540 1.00 13.42 C ATOM 1263 C GLY A 114 -7.218 -3.537 -21.474 1.00 25.14 C ATOM 1264 O GLY A 114 -8.039 -3.365 -22.374 1.00 0.05 O ATOM 0 H GLY A 114 -5.946 -3.404 -18.933 1.00 50.23 H new ATOM 0 HA2 GLY A 114 -7.585 -1.607 -20.627 1.00 13.42 H new ATOM 0 HA3 GLY A 114 -5.887 -1.983 -20.848 1.00 13.42 H new ATOM 1268 N ALA A 115 -6.611 -4.700 -21.261 1.00 24.15 N ATOM 1269 CA ALA A 115 -6.883 -5.867 -22.090 1.00 33.20 C ATOM 1270 C ALA A 115 -6.553 -5.590 -23.553 1.00 31.42 C ATOM 1271 O ALA A 115 -7.044 -6.274 -24.452 1.00 20.44 O ATOM 1272 CB ALA A 115 -8.338 -6.289 -21.946 1.00 11.11 C ATOM 0 H ALA A 115 -5.927 -4.859 -20.521 1.00 24.15 H new ATOM 0 HA ALA A 115 -6.244 -6.682 -21.748 1.00 33.20 H new ATOM 0 HB1 ALA A 115 -8.527 -7.162 -22.571 1.00 11.11 H new ATOM 0 HB2 ALA A 115 -8.544 -6.537 -20.905 1.00 11.11 H new ATOM 0 HB3 ALA A 115 -8.987 -5.471 -22.259 1.00 11.11 H new ATOM 1278 N THR A 116 -5.718 -4.582 -23.786 1.00 34.22 N ATOM 1279 CA THR A 116 -5.324 -4.214 -25.140 1.00 12.44 C ATOM 1280 C THR A 116 -4.080 -4.977 -25.577 1.00 64.51 C ATOM 1281 O THR A 116 -3.377 -5.565 -24.754 1.00 12.42 O ATOM 1282 CB THR A 116 -5.051 -2.702 -25.253 1.00 53.14 C ATOM 1283 OG1 THR A 116 -4.652 -2.375 -26.589 1.00 73.33 O ATOM 1284 CG2 THR A 116 -3.968 -2.273 -24.276 1.00 2.52 C ATOM 0 H THR A 116 -5.302 -4.006 -23.054 1.00 34.22 H new ATOM 0 HA THR A 116 -6.156 -4.476 -25.794 1.00 12.44 H new ATOM 0 HB THR A 116 -5.970 -2.170 -25.008 1.00 53.14 H new ATOM 0 HG1 THR A 116 -4.482 -1.412 -26.653 1.00 73.33 H new ATOM 0 HG21 THR A 116 -3.793 -1.202 -24.374 1.00 2.52 H new ATOM 0 HG22 THR A 116 -4.287 -2.497 -23.258 1.00 2.52 H new ATOM 0 HG23 THR A 116 -3.047 -2.813 -24.494 1.00 2.52 H new ATOM 1292 N LYS A 117 -3.811 -4.966 -26.878 1.00 42.42 N ATOM 1293 CA LYS A 117 -2.649 -5.656 -27.426 1.00 51.43 C ATOM 1294 C LYS A 117 -1.385 -5.292 -26.653 1.00 75.10 C ATOM 1295 O LYS A 117 -0.815 -6.126 -25.950 1.00 34.33 O ATOM 1296 CB LYS A 117 -2.473 -5.305 -28.906 1.00 30.35 C ATOM 1297 CG LYS A 117 -3.693 -5.618 -29.754 1.00 72.51 C ATOM 1298 CD LYS A 117 -3.556 -6.960 -30.455 1.00 43.40 C ATOM 1299 CE LYS A 117 -4.174 -8.082 -29.636 1.00 72.43 C ATOM 1300 NZ LYS A 117 -5.637 -7.885 -29.440 1.00 51.30 N ATOM 0 H LYS A 117 -4.383 -4.486 -27.573 1.00 42.42 H new ATOM 0 HA LYS A 117 -2.816 -6.729 -27.330 1.00 51.43 H new ATOM 0 HB2 LYS A 117 -2.242 -4.243 -28.994 1.00 30.35 H new ATOM 0 HB3 LYS A 117 -1.616 -5.851 -29.301 1.00 30.35 H new ATOM 0 HG2 LYS A 117 -4.583 -5.625 -29.124 1.00 72.51 H new ATOM 0 HG3 LYS A 117 -3.833 -4.832 -30.496 1.00 72.51 H new ATOM 0 HD2 LYS A 117 -4.038 -6.913 -31.431 1.00 43.40 H new ATOM 0 HD3 LYS A 117 -2.502 -7.174 -30.630 1.00 43.40 H new ATOM 0 HE2 LYS A 117 -4.000 -9.035 -30.136 1.00 72.43 H new ATOM 0 HE3 LYS A 117 -3.682 -8.137 -28.665 1.00 72.43 H new ATOM 0 HZ1 LYS A 117 -6.104 -8.811 -29.358 1.00 51.30 H new ATOM 0 HZ2 LYS A 117 -5.800 -7.336 -28.572 1.00 51.30 H new ATOM 0 HZ3 LYS A 117 -6.030 -7.370 -30.254 1.00 51.30 H new ATOM 1314 N ARG A 118 -0.954 -4.042 -26.787 1.00 72.21 N ATOM 1315 CA ARG A 118 0.242 -3.569 -26.101 1.00 13.15 C ATOM 1316 C ARG A 118 -0.125 -2.634 -24.951 1.00 70.34 C ATOM 1317 O ARG A 118 -1.165 -1.976 -24.962 1.00 35.10 O ATOM 1318 CB ARG A 118 1.168 -2.848 -27.082 1.00 72.52 C ATOM 1319 CG ARG A 118 1.340 -3.578 -28.404 1.00 63.42 C ATOM 1320 CD ARG A 118 2.168 -2.764 -29.386 1.00 61.32 C ATOM 1321 NE ARG A 118 1.536 -1.488 -29.708 1.00 50.34 N ATOM 1322 CZ ARG A 118 2.132 -0.528 -30.406 1.00 45.32 C ATOM 1323 NH1 ARG A 118 3.369 -0.699 -30.853 1.00 50.10 N ATOM 1324 NH2 ARG A 118 1.492 0.606 -30.659 1.00 13.52 N ATOM 0 H ARG A 118 -1.415 -3.339 -27.364 1.00 72.21 H new ATOM 0 HA ARG A 118 0.762 -4.435 -25.692 1.00 13.15 H new ATOM 0 HB2 ARG A 118 0.773 -1.851 -27.276 1.00 72.52 H new ATOM 0 HB3 ARG A 118 2.146 -2.719 -26.618 1.00 72.52 H new ATOM 0 HG2 ARG A 118 1.822 -4.540 -28.230 1.00 63.42 H new ATOM 0 HG3 ARG A 118 0.361 -3.786 -28.836 1.00 63.42 H new ATOM 0 HD2 ARG A 118 3.156 -2.583 -28.964 1.00 61.32 H new ATOM 0 HD3 ARG A 118 2.313 -3.338 -30.301 1.00 61.32 H new ATOM 0 HE ARG A 118 0.584 -1.325 -29.379 1.00 50.34 H new ATOM 0 HH11 ARG A 118 3.865 -1.569 -30.661 1.00 50.10 H new ATOM 0 HH12 ARG A 118 3.824 0.040 -31.389 1.00 50.10 H new ATOM 0 HH21 ARG A 118 0.541 0.742 -30.317 1.00 13.52 H new ATOM 0 HH22 ARG A 118 1.951 1.342 -31.195 1.00 13.52 H new ATOM 1338 N PRO A 119 0.749 -2.574 -23.936 1.00 33.05 N ATOM 1339 CA PRO A 119 0.539 -1.724 -22.760 1.00 55.41 C ATOM 1340 C PRO A 119 0.667 -0.240 -23.088 1.00 2.13 C ATOM 1341 O PRO A 119 1.475 0.153 -23.930 1.00 0.41 O ATOM 1342 CB PRO A 119 1.652 -2.159 -21.804 1.00 11.40 C ATOM 1343 CG PRO A 119 2.719 -2.704 -22.689 1.00 4.14 C ATOM 1344 CD PRO A 119 2.009 -3.331 -23.856 1.00 63.03 C ATOM 0 HA PRO A 119 -0.464 -1.838 -22.348 1.00 55.41 H new ATOM 0 HB2 PRO A 119 2.018 -1.319 -21.214 1.00 11.40 H new ATOM 0 HB3 PRO A 119 1.298 -2.912 -21.101 1.00 11.40 H new ATOM 0 HG2 PRO A 119 3.392 -1.914 -23.021 1.00 4.14 H new ATOM 0 HG3 PRO A 119 3.326 -3.439 -22.161 1.00 4.14 H new ATOM 0 HD2 PRO A 119 2.590 -3.243 -24.774 1.00 63.03 H new ATOM 0 HD3 PRO A 119 1.830 -4.394 -23.693 1.00 63.03 H new ATOM 1352 N THR A 120 -0.134 0.581 -22.416 1.00 53.44 N ATOM 1353 CA THR A 120 -0.110 2.022 -22.637 1.00 35.14 C ATOM 1354 C THR A 120 0.878 2.705 -21.699 1.00 11.24 C ATOM 1355 O THR A 120 1.671 2.044 -21.028 1.00 15.00 O ATOM 1356 CB THR A 120 -1.505 2.644 -22.436 1.00 53.00 C ATOM 1357 OG1 THR A 120 -2.498 1.613 -22.379 1.00 2.52 O ATOM 1358 CG2 THR A 120 -1.834 3.610 -23.564 1.00 73.13 C ATOM 0 H THR A 120 -0.807 0.273 -21.714 1.00 53.44 H new ATOM 0 HA THR A 120 0.205 2.179 -23.669 1.00 35.14 H new ATOM 0 HB THR A 120 -1.501 3.196 -21.496 1.00 53.00 H new ATOM 0 HG1 THR A 120 -3.158 1.832 -21.688 1.00 2.52 H new ATOM 0 HG21 THR A 120 -2.824 4.037 -23.401 1.00 73.13 H new ATOM 0 HG22 THR A 120 -1.093 4.409 -23.586 1.00 73.13 H new ATOM 0 HG23 THR A 120 -1.821 3.077 -24.515 1.00 73.13 H new ATOM 1366 N SER A 121 0.825 4.033 -21.656 1.00 22.31 N ATOM 1367 CA SER A 121 1.719 4.806 -20.802 1.00 13.15 C ATOM 1368 C SER A 121 0.931 5.572 -19.744 1.00 15.53 C ATOM 1369 O SER A 121 0.894 5.183 -18.576 1.00 43.04 O ATOM 1370 CB SER A 121 2.546 5.780 -21.642 1.00 43.14 C ATOM 1371 OG SER A 121 1.719 6.537 -22.509 1.00 34.43 O ATOM 0 H SER A 121 0.173 4.595 -22.202 1.00 22.31 H new ATOM 0 HA SER A 121 2.391 4.111 -20.298 1.00 13.15 H new ATOM 0 HB2 SER A 121 3.100 6.451 -20.986 1.00 43.14 H new ATOM 0 HB3 SER A 121 3.281 5.227 -22.227 1.00 43.14 H new ATOM 0 HG SER A 121 2.272 7.153 -23.033 1.00 34.43 H new ATOM 1377 N VAL A 122 0.300 6.666 -20.161 1.00 72.42 N ATOM 1378 CA VAL A 122 -0.489 7.487 -19.251 1.00 53.44 C ATOM 1379 C VAL A 122 -1.967 7.117 -19.317 1.00 44.04 C ATOM 1380 O VAL A 122 -2.634 7.359 -20.323 1.00 72.21 O ATOM 1381 CB VAL A 122 -0.332 8.986 -19.570 1.00 14.23 C ATOM 1382 CG1 VAL A 122 1.021 9.494 -19.096 1.00 51.10 C ATOM 1383 CG2 VAL A 122 -0.513 9.236 -21.059 1.00 71.24 C ATOM 0 H VAL A 122 0.320 7.004 -21.123 1.00 72.42 H new ATOM 0 HA VAL A 122 -0.114 7.295 -18.246 1.00 53.44 H new ATOM 0 HB VAL A 122 -1.107 9.536 -19.036 1.00 14.23 H new ATOM 0 HG11 VAL A 122 1.114 10.555 -19.330 1.00 51.10 H new ATOM 0 HG12 VAL A 122 1.106 9.351 -18.019 1.00 51.10 H new ATOM 0 HG13 VAL A 122 1.814 8.941 -19.599 1.00 51.10 H new ATOM 0 HG21 VAL A 122 -0.399 10.300 -21.266 1.00 71.24 H new ATOM 0 HG22 VAL A 122 0.238 8.675 -21.616 1.00 71.24 H new ATOM 0 HG23 VAL A 122 -1.508 8.912 -21.364 1.00 71.24 H new ATOM 1393 N VAL A 123 -2.472 6.529 -18.238 1.00 35.21 N ATOM 1394 CA VAL A 123 -3.872 6.126 -18.172 1.00 32.11 C ATOM 1395 C VAL A 123 -4.544 6.677 -16.920 1.00 12.45 C ATOM 1396 O VAL A 123 -4.079 6.452 -15.802 1.00 34.10 O ATOM 1397 CB VAL A 123 -4.016 4.593 -18.186 1.00 31.54 C ATOM 1398 CG1 VAL A 123 -2.911 3.945 -17.365 1.00 60.02 C ATOM 1399 CG2 VAL A 123 -5.386 4.182 -17.668 1.00 32.22 C ATOM 0 H VAL A 123 -1.933 6.321 -17.397 1.00 35.21 H new ATOM 0 HA VAL A 123 -4.362 6.538 -19.055 1.00 32.11 H new ATOM 0 HB VAL A 123 -3.922 4.246 -19.215 1.00 31.54 H new ATOM 0 HG11 VAL A 123 -3.029 2.862 -17.387 1.00 60.02 H new ATOM 0 HG12 VAL A 123 -1.941 4.213 -17.785 1.00 60.02 H new ATOM 0 HG13 VAL A 123 -2.970 4.296 -16.335 1.00 60.02 H new ATOM 0 HG21 VAL A 123 -5.470 3.095 -17.685 1.00 32.22 H new ATOM 0 HG22 VAL A 123 -5.511 4.540 -16.646 1.00 32.22 H new ATOM 0 HG23 VAL A 123 -6.160 4.616 -18.301 1.00 32.22 H new ATOM 1409 N PHE A 124 -5.642 7.401 -17.114 1.00 3.24 N ATOM 1410 CA PHE A 124 -6.379 7.986 -15.999 1.00 43.05 C ATOM 1411 C PHE A 124 -7.830 7.516 -16.001 1.00 33.51 C ATOM 1412 O PHE A 124 -8.469 7.443 -17.051 1.00 70.41 O ATOM 1413 CB PHE A 124 -6.326 9.513 -16.071 1.00 42.51 C ATOM 1414 CG PHE A 124 -7.513 10.123 -16.761 1.00 22.31 C ATOM 1415 CD1 PHE A 124 -7.588 10.150 -18.144 1.00 51.22 C ATOM 1416 CD2 PHE A 124 -8.554 10.667 -16.026 1.00 45.51 C ATOM 1417 CE1 PHE A 124 -8.679 10.711 -18.781 1.00 62.13 C ATOM 1418 CE2 PHE A 124 -9.647 11.229 -16.658 1.00 12.22 C ATOM 1419 CZ PHE A 124 -9.710 11.250 -18.037 1.00 72.02 C ATOM 0 H PHE A 124 -6.041 7.597 -18.032 1.00 3.24 H new ATOM 0 HA PHE A 124 -5.910 7.656 -15.072 1.00 43.05 H new ATOM 0 HB2 PHE A 124 -6.258 9.914 -15.060 1.00 42.51 H new ATOM 0 HB3 PHE A 124 -5.418 9.813 -16.594 1.00 42.51 H new ATOM 0 HD1 PHE A 124 -6.785 9.728 -18.731 1.00 51.22 H new ATOM 0 HD2 PHE A 124 -8.511 10.652 -14.947 1.00 45.51 H new ATOM 0 HE1 PHE A 124 -8.725 10.728 -19.860 1.00 62.13 H new ATOM 0 HE2 PHE A 124 -10.451 11.651 -16.074 1.00 12.22 H new ATOM 0 HZ PHE A 124 -10.564 11.687 -18.533 1.00 72.02 H new ATOM 1429 N ILE A 125 -8.344 7.197 -14.818 1.00 2.25 N ATOM 1430 CA ILE A 125 -9.719 6.734 -14.682 1.00 13.32 C ATOM 1431 C ILE A 125 -10.691 7.908 -14.625 1.00 72.14 C ATOM 1432 O ILE A 125 -10.475 8.872 -13.891 1.00 52.32 O ATOM 1433 CB ILE A 125 -9.901 5.871 -13.419 1.00 62.15 C ATOM 1434 CG1 ILE A 125 -9.355 4.461 -13.657 1.00 13.14 C ATOM 1435 CG2 ILE A 125 -11.368 5.817 -13.021 1.00 71.12 C ATOM 1436 CD1 ILE A 125 -7.889 4.435 -14.028 1.00 53.15 C ATOM 0 H ILE A 125 -7.828 7.251 -13.940 1.00 2.25 H new ATOM 0 HA ILE A 125 -9.936 6.127 -15.561 1.00 13.32 H new ATOM 0 HB ILE A 125 -9.340 6.325 -12.602 1.00 62.15 H new ATOM 0 HG12 ILE A 125 -9.504 3.866 -12.756 1.00 13.14 H new ATOM 0 HG13 ILE A 125 -9.931 3.987 -14.452 1.00 13.14 H new ATOM 0 HG21 ILE A 125 -11.480 5.204 -12.127 1.00 71.12 H new ATOM 0 HG22 ILE A 125 -11.727 6.826 -12.816 1.00 71.12 H new ATOM 0 HG23 ILE A 125 -11.950 5.383 -13.834 1.00 71.12 H new ATOM 0 HD11 ILE A 125 -7.571 3.404 -14.182 1.00 53.15 H new ATOM 0 HD12 ILE A 125 -7.736 5.003 -14.946 1.00 53.15 H new ATOM 0 HD13 ILE A 125 -7.302 4.880 -13.224 1.00 53.15 H new ATOM 1448 N VAL A 126 -11.764 7.819 -15.405 1.00 33.42 N ATOM 1449 CA VAL A 126 -12.772 8.872 -15.442 1.00 31.42 C ATOM 1450 C VAL A 126 -14.130 8.349 -14.987 1.00 20.13 C ATOM 1451 O VAL A 126 -14.957 7.915 -15.789 1.00 42.22 O ATOM 1452 CB VAL A 126 -12.911 9.466 -16.856 1.00 1.32 C ATOM 1453 CG1 VAL A 126 -12.857 10.986 -16.804 1.00 72.50 C ATOM 1454 CG2 VAL A 126 -11.828 8.917 -17.773 1.00 13.32 C ATOM 0 H VAL A 126 -11.957 7.028 -16.020 1.00 33.42 H new ATOM 0 HA VAL A 126 -12.439 9.653 -14.759 1.00 31.42 H new ATOM 0 HB VAL A 126 -13.880 9.174 -17.261 1.00 1.32 H new ATOM 0 HG11 VAL A 126 -12.957 11.388 -17.812 1.00 72.50 H new ATOM 0 HG12 VAL A 126 -13.672 11.358 -16.183 1.00 72.50 H new ATOM 0 HG13 VAL A 126 -11.904 11.302 -16.380 1.00 72.50 H new ATOM 0 HG21 VAL A 126 -11.941 9.347 -18.768 1.00 13.32 H new ATOM 0 HG22 VAL A 126 -10.847 9.177 -17.375 1.00 13.32 H new ATOM 0 HG23 VAL A 126 -11.918 7.832 -17.834 1.00 13.32 H new ATOM 1464 N PRO A 127 -14.368 8.390 -13.667 1.00 40.53 N ATOM 1465 CA PRO A 127 -15.626 7.926 -13.075 1.00 22.12 C ATOM 1466 C PRO A 127 -16.799 8.839 -13.414 1.00 43.24 C ATOM 1467 O PRO A 127 -16.636 9.843 -14.107 1.00 12.14 O ATOM 1468 CB PRO A 127 -15.342 7.957 -11.571 1.00 31.41 C ATOM 1469 CG PRO A 127 -14.269 8.977 -11.409 1.00 21.04 C ATOM 1470 CD PRO A 127 -13.428 8.895 -12.652 1.00 63.34 C ATOM 0 HA PRO A 127 -15.914 6.944 -13.449 1.00 22.12 H new ATOM 0 HB2 PRO A 127 -16.234 8.227 -11.005 1.00 31.41 H new ATOM 0 HB3 PRO A 127 -15.018 6.981 -11.209 1.00 31.41 H new ATOM 0 HG2 PRO A 127 -14.693 9.974 -11.290 1.00 21.04 H new ATOM 0 HG3 PRO A 127 -13.671 8.777 -10.520 1.00 21.04 H new ATOM 0 HD2 PRO A 127 -13.023 9.869 -12.928 1.00 63.34 H new ATOM 0 HD3 PRO A 127 -12.580 8.223 -12.520 1.00 63.34 H new ATOM 1478 N GLY A 128 -17.982 8.484 -12.922 1.00 4.03 N ATOM 1479 CA GLY A 128 -19.164 9.283 -13.184 1.00 35.12 C ATOM 1480 C GLY A 128 -18.952 10.752 -12.875 1.00 71.34 C ATOM 1481 O GLY A 128 -17.932 11.131 -12.299 1.00 75.14 O ATOM 0 H GLY A 128 -18.143 7.657 -12.347 1.00 4.03 H new ATOM 0 HA2 GLY A 128 -19.449 9.173 -14.230 1.00 35.12 H new ATOM 0 HA3 GLY A 128 -19.994 8.905 -12.586 1.00 35.12 H new ATOM 1485 N SER A 129 -19.916 11.581 -13.261 1.00 55.20 N ATOM 1486 CA SER A 129 -19.828 13.018 -13.027 1.00 62.23 C ATOM 1487 C SER A 129 -19.311 13.309 -11.622 1.00 24.43 C ATOM 1488 O SER A 129 -19.595 12.571 -10.679 1.00 15.40 O ATOM 1489 CB SER A 129 -21.196 13.674 -13.225 1.00 62.44 C ATOM 1490 OG SER A 129 -21.299 14.260 -14.511 1.00 44.32 O ATOM 0 H SER A 129 -20.767 11.283 -13.737 1.00 55.20 H new ATOM 0 HA SER A 129 -19.125 13.436 -13.748 1.00 62.23 H new ATOM 0 HB2 SER A 129 -21.982 12.929 -13.097 1.00 62.44 H new ATOM 0 HB3 SER A 129 -21.351 14.436 -12.461 1.00 62.44 H new ATOM 0 HG SER A 129 -22.183 14.671 -14.613 1.00 44.32 H new ATOM 1496 N ASN A 130 -18.548 14.389 -11.490 1.00 52.34 N ATOM 1497 CA ASN A 130 -17.990 14.779 -10.201 1.00 22.45 C ATOM 1498 C ASN A 130 -19.049 14.704 -9.105 1.00 25.14 C ATOM 1499 O ASN A 130 -18.746 14.386 -7.954 1.00 73.53 O ATOM 1500 CB ASN A 130 -17.417 16.195 -10.276 1.00 41.30 C ATOM 1501 CG ASN A 130 -16.497 16.510 -9.112 1.00 64.43 C ATOM 1502 OD1 ASN A 130 -15.282 16.328 -9.200 1.00 72.52 O ATOM 1503 ND2 ASN A 130 -17.073 16.984 -8.014 1.00 42.10 N ATOM 0 H ASN A 130 -18.302 15.010 -12.261 1.00 52.34 H new ATOM 0 HA ASN A 130 -17.188 14.083 -9.955 1.00 22.45 H new ATOM 0 HB2 ASN A 130 -16.869 16.313 -11.211 1.00 41.30 H new ATOM 0 HB3 ASN A 130 -18.236 16.915 -10.293 1.00 41.30 H new ATOM 0 HD21 ASN A 130 -16.505 17.213 -7.198 1.00 42.10 H new ATOM 0 HD22 ASN A 130 -18.084 17.119 -7.986 1.00 42.10 H new ATOM 1510 N LYS A 131 -20.292 14.999 -9.469 1.00 44.04 N ATOM 1511 CA LYS A 131 -21.397 14.964 -8.519 1.00 71.03 C ATOM 1512 C LYS A 131 -21.958 13.552 -8.390 1.00 34.44 C ATOM 1513 O LYS A 131 -22.310 13.110 -7.295 1.00 63.13 O ATOM 1514 CB LYS A 131 -22.504 15.926 -8.957 1.00 62.14 C ATOM 1515 CG LYS A 131 -22.219 17.378 -8.614 1.00 63.25 C ATOM 1516 CD LYS A 131 -22.775 18.319 -9.670 1.00 5.55 C ATOM 1517 CE LYS A 131 -22.045 19.654 -9.666 1.00 25.21 C ATOM 1518 NZ LYS A 131 -22.196 20.366 -8.367 1.00 32.43 N ATOM 0 H LYS A 131 -20.560 15.265 -10.417 1.00 44.04 H new ATOM 0 HA LYS A 131 -21.017 15.276 -7.546 1.00 71.03 H new ATOM 0 HB2 LYS A 131 -22.646 15.837 -10.034 1.00 62.14 H new ATOM 0 HB3 LYS A 131 -23.441 15.627 -8.486 1.00 62.14 H new ATOM 0 HG2 LYS A 131 -22.657 17.617 -7.645 1.00 63.25 H new ATOM 0 HG3 LYS A 131 -21.143 17.527 -8.522 1.00 63.25 H new ATOM 0 HD2 LYS A 131 -22.686 17.857 -10.653 1.00 5.55 H new ATOM 0 HD3 LYS A 131 -23.837 18.483 -9.490 1.00 5.55 H new ATOM 0 HE2 LYS A 131 -20.987 19.490 -9.869 1.00 25.21 H new ATOM 0 HE3 LYS A 131 -22.430 20.281 -10.470 1.00 25.21 H new ATOM 0 HZ1 LYS A 131 -21.772 21.313 -8.439 1.00 32.43 H new ATOM 0 HZ2 LYS A 131 -23.206 20.456 -8.136 1.00 32.43 H new ATOM 0 HZ3 LYS A 131 -21.716 19.827 -7.618 1.00 32.43 H new ATOM 1532 N LYS A 132 -22.039 12.846 -9.513 1.00 11.52 N ATOM 1533 CA LYS A 132 -22.555 11.483 -9.525 1.00 61.33 C ATOM 1534 C LYS A 132 -21.640 10.548 -8.740 1.00 72.14 C ATOM 1535 O LYS A 132 -22.020 9.425 -8.408 1.00 73.11 O ATOM 1536 CB LYS A 132 -22.699 10.983 -10.965 1.00 3.14 C ATOM 1537 CG LYS A 132 -23.852 11.622 -11.718 1.00 15.11 C ATOM 1538 CD LYS A 132 -25.186 11.013 -11.317 1.00 3.45 C ATOM 1539 CE LYS A 132 -25.616 9.925 -12.287 1.00 71.35 C ATOM 1540 NZ LYS A 132 -27.095 9.753 -12.308 1.00 32.32 N ATOM 0 H LYS A 132 -21.753 13.196 -10.427 1.00 11.52 H new ATOM 0 HA LYS A 132 -23.535 11.488 -9.049 1.00 61.33 H new ATOM 0 HB2 LYS A 132 -21.772 11.179 -11.503 1.00 3.14 H new ATOM 0 HB3 LYS A 132 -22.838 9.902 -10.953 1.00 3.14 H new ATOM 0 HG2 LYS A 132 -23.867 12.694 -11.521 1.00 15.11 H new ATOM 0 HG3 LYS A 132 -23.701 11.497 -12.790 1.00 15.11 H new ATOM 0 HD2 LYS A 132 -25.110 10.597 -10.312 1.00 3.45 H new ATOM 0 HD3 LYS A 132 -25.947 11.792 -11.282 1.00 3.45 H new ATOM 0 HE2 LYS A 132 -25.265 10.172 -13.289 1.00 71.35 H new ATOM 0 HE3 LYS A 132 -25.145 8.983 -12.008 1.00 71.35 H new ATOM 0 HZ1 LYS A 132 -27.348 9.002 -12.982 1.00 32.32 H new ATOM 0 HZ2 LYS A 132 -27.428 9.492 -11.358 1.00 32.32 H new ATOM 0 HZ3 LYS A 132 -27.544 10.645 -12.599 1.00 32.32 H new ATOM 1554 N LYS A 133 -20.433 11.019 -8.446 1.00 32.55 N ATOM 1555 CA LYS A 133 -19.464 10.227 -7.697 1.00 74.51 C ATOM 1556 C LYS A 133 -20.059 9.744 -6.378 1.00 73.21 C ATOM 1557 O LYS A 133 -19.598 8.759 -5.802 1.00 24.33 O ATOM 1558 CB LYS A 133 -18.201 11.048 -7.429 1.00 15.12 C ATOM 1559 CG LYS A 133 -16.928 10.220 -7.415 1.00 35.33 C ATOM 1560 CD LYS A 133 -15.746 11.005 -7.956 1.00 41.22 C ATOM 1561 CE LYS A 133 -14.424 10.372 -7.552 1.00 24.42 C ATOM 1562 NZ LYS A 133 -13.263 11.058 -8.185 1.00 33.34 N ATOM 0 H LYS A 133 -20.102 11.946 -8.715 1.00 32.55 H new ATOM 0 HA LYS A 133 -19.203 9.356 -8.298 1.00 74.51 H new ATOM 0 HB2 LYS A 133 -18.112 11.822 -8.191 1.00 15.12 H new ATOM 0 HB3 LYS A 133 -18.305 11.556 -6.470 1.00 15.12 H new ATOM 0 HG2 LYS A 133 -16.715 9.896 -6.396 1.00 35.33 H new ATOM 0 HG3 LYS A 133 -17.072 9.320 -8.012 1.00 35.33 H new ATOM 0 HD2 LYS A 133 -15.809 11.056 -9.043 1.00 41.22 H new ATOM 0 HD3 LYS A 133 -15.788 12.029 -7.586 1.00 41.22 H new ATOM 0 HE2 LYS A 133 -14.320 10.409 -6.468 1.00 24.42 H new ATOM 0 HE3 LYS A 133 -14.423 9.320 -7.837 1.00 24.42 H new ATOM 0 HZ1 LYS A 133 -12.381 10.596 -7.884 1.00 33.34 H new ATOM 0 HZ2 LYS A 133 -13.348 11.001 -9.220 1.00 33.34 H new ATOM 0 HZ3 LYS A 133 -13.248 12.056 -7.893 1.00 33.34 H new ATOM 1576 N ASP A 134 -21.086 10.442 -5.907 1.00 11.43 N ATOM 1577 CA ASP A 134 -21.746 10.083 -4.657 1.00 2.23 C ATOM 1578 C ASP A 134 -22.937 9.166 -4.915 1.00 62.40 C ATOM 1579 O ASP A 134 -23.886 9.129 -4.134 1.00 14.33 O ATOM 1580 CB ASP A 134 -22.206 11.341 -3.918 1.00 50.13 C ATOM 1581 CG ASP A 134 -23.090 12.225 -4.776 1.00 45.41 C ATOM 1582 OD1 ASP A 134 -23.996 11.688 -5.446 1.00 34.53 O ATOM 1583 OD2 ASP A 134 -22.875 13.455 -4.777 1.00 43.32 O ATOM 0 H ASP A 134 -21.480 11.260 -6.372 1.00 11.43 H new ATOM 0 HA ASP A 134 -21.027 9.549 -4.036 1.00 2.23 H new ATOM 0 HB2 ASP A 134 -22.749 11.052 -3.018 1.00 50.13 H new ATOM 0 HB3 ASP A 134 -21.333 11.909 -3.595 1.00 50.13 H new ATOM 1588 N GLY A 135 -22.879 8.426 -6.018 1.00 72.43 N ATOM 1589 CA GLY A 135 -23.959 7.519 -6.361 1.00 14.13 C ATOM 1590 C GLY A 135 -24.047 6.338 -5.415 1.00 64.41 C ATOM 1591 O GLY A 135 -23.369 6.303 -4.388 1.00 2.22 O ATOM 0 H GLY A 135 -22.103 8.438 -6.680 1.00 72.43 H new ATOM 0 HA2 GLY A 135 -24.904 8.062 -6.348 1.00 14.13 H new ATOM 0 HA3 GLY A 135 -23.815 7.156 -7.378 1.00 14.13 H new ATOM 1595 N LYS A 136 -24.885 5.366 -5.760 1.00 44.14 N ATOM 1596 CA LYS A 136 -25.060 4.177 -4.935 1.00 64.33 C ATOM 1597 C LYS A 136 -24.593 2.927 -5.676 1.00 1.43 C ATOM 1598 O LYS A 136 -24.629 1.824 -5.134 1.00 22.35 O ATOM 1599 CB LYS A 136 -26.527 4.024 -4.530 1.00 32.44 C ATOM 1600 CG LYS A 136 -26.756 2.969 -3.461 1.00 30.20 C ATOM 1601 CD LYS A 136 -27.536 1.784 -4.005 1.00 70.31 C ATOM 1602 CE LYS A 136 -29.036 2.033 -3.955 1.00 44.11 C ATOM 1603 NZ LYS A 136 -29.613 1.679 -2.629 1.00 21.21 N ATOM 0 H LYS A 136 -25.454 5.379 -6.606 1.00 44.14 H new ATOM 0 HA LYS A 136 -24.452 4.295 -4.038 1.00 64.33 H new ATOM 0 HB2 LYS A 136 -26.897 4.983 -4.167 1.00 32.44 H new ATOM 0 HB3 LYS A 136 -27.114 3.769 -5.412 1.00 32.44 H new ATOM 0 HG2 LYS A 136 -25.796 2.627 -3.074 1.00 30.20 H new ATOM 0 HG3 LYS A 136 -27.298 3.409 -2.624 1.00 30.20 H new ATOM 0 HD2 LYS A 136 -27.233 1.589 -5.034 1.00 70.31 H new ATOM 0 HD3 LYS A 136 -27.295 0.892 -3.427 1.00 70.31 H new ATOM 0 HE2 LYS A 136 -29.237 3.082 -4.170 1.00 44.11 H new ATOM 0 HE3 LYS A 136 -29.527 1.448 -4.733 1.00 44.11 H new ATOM 0 HZ1 LYS A 136 -30.637 1.863 -2.636 1.00 21.21 H new ATOM 0 HZ2 LYS A 136 -29.443 0.672 -2.434 1.00 21.21 H new ATOM 0 HZ3 LYS A 136 -29.163 2.255 -1.889 1.00 21.21 H new ATOM 1617 N ASN A 137 -24.154 3.110 -6.917 1.00 30.11 N ATOM 1618 CA ASN A 137 -23.679 1.997 -7.731 1.00 52.01 C ATOM 1619 C ASN A 137 -22.434 1.365 -7.116 1.00 10.41 C ATOM 1620 O ASN A 137 -22.180 1.505 -5.919 1.00 61.33 O ATOM 1621 CB ASN A 137 -23.374 2.472 -9.153 1.00 73.02 C ATOM 1622 CG ASN A 137 -24.462 3.371 -9.708 1.00 74.44 C ATOM 1623 OD1 ASN A 137 -24.596 4.525 -9.303 1.00 40.42 O ATOM 1624 ND2 ASN A 137 -25.247 2.843 -10.641 1.00 22.21 N ATOM 0 H ASN A 137 -24.117 4.018 -7.381 1.00 30.11 H new ATOM 0 HA ASN A 137 -24.466 1.244 -7.767 1.00 52.01 H new ATOM 0 HB2 ASN A 137 -22.425 3.009 -9.158 1.00 73.02 H new ATOM 0 HB3 ASN A 137 -23.254 1.606 -9.804 1.00 73.02 H new ATOM 0 HD21 ASN A 137 -25.997 3.399 -11.051 1.00 22.21 H new ATOM 0 HD22 ASN A 137 -25.100 1.881 -10.947 1.00 22.21 H new ATOM 1631 N LYS A 138 -21.660 0.671 -7.943 1.00 22.23 N ATOM 1632 CA LYS A 138 -20.440 0.019 -7.482 1.00 64.44 C ATOM 1633 C LYS A 138 -19.421 1.047 -7.002 1.00 0.32 C ATOM 1634 O LYS A 138 -18.397 0.694 -6.418 1.00 32.50 O ATOM 1635 CB LYS A 138 -19.835 -0.828 -8.605 1.00 2.12 C ATOM 1636 CG LYS A 138 -18.944 -0.039 -9.549 1.00 75.03 C ATOM 1637 CD LYS A 138 -19.724 1.044 -10.276 1.00 60.24 C ATOM 1638 CE LYS A 138 -20.806 0.450 -11.166 1.00 2.15 C ATOM 1639 NZ LYS A 138 -20.598 0.797 -12.599 1.00 31.02 N ATOM 0 H LYS A 138 -21.856 0.545 -8.936 1.00 22.23 H new ATOM 0 HA LYS A 138 -20.698 -0.629 -6.644 1.00 64.44 H new ATOM 0 HB2 LYS A 138 -19.255 -1.639 -8.165 1.00 2.12 H new ATOM 0 HB3 LYS A 138 -20.641 -1.286 -9.178 1.00 2.12 H new ATOM 0 HG2 LYS A 138 -18.128 0.414 -8.987 1.00 75.03 H new ATOM 0 HG3 LYS A 138 -18.494 -0.715 -10.276 1.00 75.03 H new ATOM 0 HD2 LYS A 138 -20.178 1.717 -9.549 1.00 60.24 H new ATOM 0 HD3 LYS A 138 -19.042 1.642 -10.880 1.00 60.24 H new ATOM 0 HE2 LYS A 138 -20.815 -0.634 -11.052 1.00 2.15 H new ATOM 0 HE3 LYS A 138 -21.782 0.812 -10.843 1.00 2.15 H new ATOM 0 HZ1 LYS A 138 -21.356 0.374 -13.172 1.00 31.02 H new ATOM 0 HZ2 LYS A 138 -20.615 1.831 -12.712 1.00 31.02 H new ATOM 0 HZ3 LYS A 138 -19.678 0.429 -12.915 1.00 31.02 H new ATOM 1653 N GLU A 139 -19.710 2.321 -7.250 1.00 71.24 N ATOM 1654 CA GLU A 139 -18.818 3.400 -6.842 1.00 34.33 C ATOM 1655 C GLU A 139 -18.402 3.238 -5.382 1.00 53.34 C ATOM 1656 O GLU A 139 -17.337 3.700 -4.976 1.00 2.30 O ATOM 1657 CB GLU A 139 -19.497 4.756 -7.043 1.00 13.21 C ATOM 1658 CG GLU A 139 -19.419 5.270 -8.470 1.00 44.45 C ATOM 1659 CD GLU A 139 -20.589 6.162 -8.835 1.00 15.44 C ATOM 1660 OE1 GLU A 139 -21.735 5.807 -8.487 1.00 54.33 O ATOM 1661 OE2 GLU A 139 -20.360 7.215 -9.467 1.00 34.34 O ATOM 0 H GLU A 139 -20.554 2.631 -7.731 1.00 71.24 H new ATOM 0 HA GLU A 139 -17.924 3.354 -7.464 1.00 34.33 H new ATOM 0 HB2 GLU A 139 -20.544 4.675 -6.752 1.00 13.21 H new ATOM 0 HB3 GLU A 139 -19.036 5.486 -6.377 1.00 13.21 H new ATOM 0 HG2 GLU A 139 -18.490 5.824 -8.602 1.00 44.45 H new ATOM 0 HG3 GLU A 139 -19.385 4.423 -9.156 1.00 44.45 H new ATOM 1668 N GLU A 140 -19.252 2.580 -4.600 1.00 70.02 N ATOM 1669 CA GLU A 140 -18.973 2.359 -3.186 1.00 51.11 C ATOM 1670 C GLU A 140 -17.588 1.749 -2.994 1.00 22.24 C ATOM 1671 O GLU A 140 -16.640 2.440 -2.622 1.00 14.42 O ATOM 1672 CB GLU A 140 -20.035 1.445 -2.571 1.00 10.44 C ATOM 1673 CG GLU A 140 -19.730 1.036 -1.140 1.00 31.44 C ATOM 1674 CD GLU A 140 -19.486 2.225 -0.231 1.00 54.24 C ATOM 1675 OE1 GLU A 140 -20.473 2.879 0.167 1.00 75.24 O ATOM 1676 OE2 GLU A 140 -18.310 2.503 0.081 1.00 62.30 O ATOM 0 H GLU A 140 -20.139 2.191 -4.921 1.00 70.02 H new ATOM 0 HA GLU A 140 -18.999 3.325 -2.681 1.00 51.11 H new ATOM 0 HB2 GLU A 140 -20.999 1.953 -2.597 1.00 10.44 H new ATOM 0 HB3 GLU A 140 -20.130 0.549 -3.184 1.00 10.44 H new ATOM 0 HG2 GLU A 140 -20.561 0.450 -0.749 1.00 31.44 H new ATOM 0 HG3 GLU A 140 -18.852 0.390 -1.130 1.00 31.44 H new ATOM 1683 N GLU A 141 -17.480 0.449 -3.249 1.00 64.32 N ATOM 1684 CA GLU A 141 -16.211 -0.255 -3.103 1.00 2.14 C ATOM 1685 C GLU A 141 -15.186 0.256 -4.111 1.00 63.00 C ATOM 1686 O GLU A 141 -14.006 0.405 -3.792 1.00 62.51 O ATOM 1687 CB GLU A 141 -16.413 -1.761 -3.283 1.00 55.22 C ATOM 1688 CG GLU A 141 -15.179 -2.584 -2.957 1.00 61.44 C ATOM 1689 CD GLU A 141 -15.227 -3.973 -3.565 1.00 1.10 C ATOM 1690 OE1 GLU A 141 -15.471 -4.079 -4.785 1.00 35.22 O ATOM 1691 OE2 GLU A 141 -15.019 -4.953 -2.820 1.00 34.43 O ATOM 0 H GLU A 141 -18.255 -0.138 -3.557 1.00 64.32 H new ATOM 0 HA GLU A 141 -15.833 -0.064 -2.098 1.00 2.14 H new ATOM 0 HB2 GLU A 141 -17.235 -2.087 -2.646 1.00 55.22 H new ATOM 0 HB3 GLU A 141 -16.709 -1.959 -4.313 1.00 55.22 H new ATOM 0 HG2 GLU A 141 -14.293 -2.063 -3.320 1.00 61.44 H new ATOM 0 HG3 GLU A 141 -15.078 -2.668 -1.875 1.00 61.44 H new ATOM 1698 N TYR A 142 -15.645 0.522 -5.329 1.00 3.33 N ATOM 1699 CA TYR A 142 -14.768 1.013 -6.385 1.00 53.44 C ATOM 1700 C TYR A 142 -14.013 2.259 -5.932 1.00 24.34 C ATOM 1701 O TYR A 142 -12.784 2.258 -5.848 1.00 13.54 O ATOM 1702 CB TYR A 142 -15.578 1.326 -7.645 1.00 34.42 C ATOM 1703 CG TYR A 142 -14.938 2.368 -8.534 1.00 34.05 C ATOM 1704 CD1 TYR A 142 -13.949 2.020 -9.445 1.00 11.01 C ATOM 1705 CD2 TYR A 142 -15.324 3.701 -8.462 1.00 41.14 C ATOM 1706 CE1 TYR A 142 -13.361 2.969 -10.258 1.00 52.41 C ATOM 1707 CE2 TYR A 142 -14.743 4.657 -9.273 1.00 24.01 C ATOM 1708 CZ TYR A 142 -13.761 4.286 -10.169 1.00 14.33 C ATOM 1709 OH TYR A 142 -13.179 5.235 -10.978 1.00 73.21 O ATOM 0 H TYR A 142 -16.619 0.406 -5.609 1.00 3.33 H new ATOM 0 HA TYR A 142 -14.042 0.232 -6.611 1.00 53.44 H new ATOM 0 HB2 TYR A 142 -15.715 0.408 -8.216 1.00 34.42 H new ATOM 0 HB3 TYR A 142 -16.570 1.670 -7.353 1.00 34.42 H new ATOM 0 HD1 TYR A 142 -13.634 0.989 -9.519 1.00 11.01 H new ATOM 0 HD2 TYR A 142 -16.091 3.995 -7.760 1.00 41.14 H new ATOM 0 HE1 TYR A 142 -12.592 2.681 -10.960 1.00 52.41 H new ATOM 0 HE2 TYR A 142 -15.056 5.689 -9.206 1.00 24.01 H new ATOM 0 HH TYR A 142 -12.532 5.756 -10.458 1.00 73.21 H new ATOM 1719 N LYS A 143 -14.756 3.320 -5.639 1.00 54.11 N ATOM 1720 CA LYS A 143 -14.160 4.573 -5.191 1.00 40.14 C ATOM 1721 C LYS A 143 -13.484 4.400 -3.835 1.00 15.02 C ATOM 1722 O LYS A 143 -12.504 5.078 -3.529 1.00 52.01 O ATOM 1723 CB LYS A 143 -15.226 5.668 -5.106 1.00 72.52 C ATOM 1724 CG LYS A 143 -14.665 7.039 -4.773 1.00 61.00 C ATOM 1725 CD LYS A 143 -15.704 7.918 -4.097 1.00 22.54 C ATOM 1726 CE LYS A 143 -15.086 9.201 -3.563 1.00 53.12 C ATOM 1727 NZ LYS A 143 -16.124 10.189 -3.158 1.00 51.32 N ATOM 0 H LYS A 143 -15.774 3.337 -5.704 1.00 54.11 H new ATOM 0 HA LYS A 143 -13.404 4.867 -5.919 1.00 40.14 H new ATOM 0 HB2 LYS A 143 -15.755 5.723 -6.057 1.00 72.52 H new ATOM 0 HB3 LYS A 143 -15.959 5.391 -4.349 1.00 72.52 H new ATOM 0 HG2 LYS A 143 -13.799 6.930 -4.120 1.00 61.00 H new ATOM 0 HG3 LYS A 143 -14.317 7.522 -5.686 1.00 61.00 H new ATOM 0 HD2 LYS A 143 -16.494 8.162 -4.808 1.00 22.54 H new ATOM 0 HD3 LYS A 143 -16.170 7.369 -3.279 1.00 22.54 H new ATOM 0 HE2 LYS A 143 -14.451 8.970 -2.708 1.00 53.12 H new ATOM 0 HE3 LYS A 143 -14.444 9.641 -4.327 1.00 53.12 H new ATOM 0 HZ1 LYS A 143 -15.663 11.050 -2.800 1.00 51.32 H new ATOM 0 HZ2 LYS A 143 -16.714 10.429 -3.980 1.00 51.32 H new ATOM 0 HZ3 LYS A 143 -16.721 9.779 -2.411 1.00 51.32 H new ATOM 1741 N GLU A 144 -14.015 3.487 -3.027 1.00 2.33 N ATOM 1742 CA GLU A 144 -13.461 3.226 -1.703 1.00 73.13 C ATOM 1743 C GLU A 144 -11.985 2.850 -1.795 1.00 52.14 C ATOM 1744 O GLU A 144 -11.138 3.451 -1.135 1.00 12.50 O ATOM 1745 CB GLU A 144 -14.242 2.106 -1.012 1.00 2.12 C ATOM 1746 CG GLU A 144 -13.611 1.638 0.289 1.00 14.43 C ATOM 1747 CD GLU A 144 -14.615 0.991 1.224 1.00 64.42 C ATOM 1748 OE1 GLU A 144 -15.811 0.944 0.871 1.00 54.43 O ATOM 1749 OE2 GLU A 144 -14.202 0.529 2.309 1.00 41.53 O ATOM 0 H GLU A 144 -14.826 2.917 -3.265 1.00 2.33 H new ATOM 0 HA GLU A 144 -13.549 4.139 -1.113 1.00 73.13 H new ATOM 0 HB2 GLU A 144 -15.256 2.452 -0.811 1.00 2.12 H new ATOM 0 HB3 GLU A 144 -14.324 1.258 -1.692 1.00 2.12 H new ATOM 0 HG2 GLU A 144 -12.815 0.927 0.067 1.00 14.43 H new ATOM 0 HG3 GLU A 144 -13.148 2.488 0.791 1.00 14.43 H new ATOM 1756 N SER A 145 -11.685 1.851 -2.619 1.00 33.21 N ATOM 1757 CA SER A 145 -10.313 1.391 -2.795 1.00 23.11 C ATOM 1758 C SER A 145 -9.483 2.430 -3.542 1.00 51.54 C ATOM 1759 O SER A 145 -8.330 2.687 -3.196 1.00 42.12 O ATOM 1760 CB SER A 145 -10.291 0.063 -3.554 1.00 22.33 C ATOM 1761 OG SER A 145 -10.824 -0.985 -2.763 1.00 23.43 O ATOM 0 H SER A 145 -12.374 1.345 -3.175 1.00 33.21 H new ATOM 0 HA SER A 145 -9.876 1.244 -1.807 1.00 23.11 H new ATOM 0 HB2 SER A 145 -10.867 0.157 -4.475 1.00 22.33 H new ATOM 0 HB3 SER A 145 -9.268 -0.178 -3.841 1.00 22.33 H new ATOM 0 HG SER A 145 -10.949 -1.783 -3.318 1.00 23.43 H new ATOM 1767 N PHE A 146 -10.079 3.026 -4.570 1.00 60.02 N ATOM 1768 CA PHE A 146 -9.396 4.037 -5.369 1.00 11.23 C ATOM 1769 C PHE A 146 -9.005 5.236 -4.509 1.00 71.03 C ATOM 1770 O PHE A 146 -7.823 5.535 -4.343 1.00 74.31 O ATOM 1771 CB PHE A 146 -10.289 4.494 -6.524 1.00 60.54 C ATOM 1772 CG PHE A 146 -10.012 3.777 -7.815 1.00 43.11 C ATOM 1773 CD1 PHE A 146 -9.275 2.604 -7.827 1.00 21.31 C ATOM 1774 CD2 PHE A 146 -10.488 4.277 -9.016 1.00 71.33 C ATOM 1775 CE1 PHE A 146 -9.018 1.943 -9.013 1.00 43.13 C ATOM 1776 CE2 PHE A 146 -10.234 3.620 -10.206 1.00 14.21 C ATOM 1777 CZ PHE A 146 -9.499 2.451 -10.204 1.00 51.21 C ATOM 0 H PHE A 146 -11.033 2.826 -4.869 1.00 60.02 H new ATOM 0 HA PHE A 146 -8.488 3.591 -5.775 1.00 11.23 H new ATOM 0 HB2 PHE A 146 -11.332 4.340 -6.249 1.00 60.54 H new ATOM 0 HB3 PHE A 146 -10.154 5.565 -6.676 1.00 60.54 H new ATOM 0 HD1 PHE A 146 -8.897 2.202 -6.899 1.00 21.31 H new ATOM 0 HD2 PHE A 146 -11.064 5.190 -9.023 1.00 71.33 H new ATOM 0 HE1 PHE A 146 -8.441 1.030 -9.009 1.00 43.13 H new ATOM 0 HE2 PHE A 146 -10.610 4.021 -11.136 1.00 14.21 H new ATOM 0 HZ PHE A 146 -9.301 1.935 -11.132 1.00 51.21 H new ATOM 1787 N ASN A 147 -10.007 5.919 -3.966 1.00 54.21 N ATOM 1788 CA ASN A 147 -9.769 7.086 -3.125 1.00 14.33 C ATOM 1789 C ASN A 147 -8.765 6.766 -2.021 1.00 74.14 C ATOM 1790 O ASN A 147 -7.820 7.519 -1.792 1.00 11.32 O ATOM 1791 CB ASN A 147 -11.083 7.573 -2.509 1.00 4.41 C ATOM 1792 CG ASN A 147 -10.901 8.830 -1.679 1.00 31.41 C ATOM 1793 OD1 ASN A 147 -10.197 8.823 -0.669 1.00 13.22 O ATOM 1794 ND2 ASN A 147 -11.537 9.915 -2.102 1.00 54.55 N ATOM 0 H ASN A 147 -10.991 5.685 -4.093 1.00 54.21 H new ATOM 0 HA ASN A 147 -9.354 7.876 -3.751 1.00 14.33 H new ATOM 0 HB2 ASN A 147 -11.804 7.766 -3.303 1.00 4.41 H new ATOM 0 HB3 ASN A 147 -11.502 6.785 -1.883 1.00 4.41 H new ATOM 0 HD21 ASN A 147 -11.453 10.790 -1.584 1.00 54.55 H new ATOM 0 HD22 ASN A 147 -12.110 9.874 -2.945 1.00 54.55 H new ATOM 1801 N GLU A 148 -8.978 5.643 -1.343 1.00 35.22 N ATOM 1802 CA GLU A 148 -8.092 5.223 -0.264 1.00 0.33 C ATOM 1803 C GLU A 148 -6.653 5.103 -0.757 1.00 71.24 C ATOM 1804 O GLU A 148 -5.740 5.710 -0.198 1.00 21.12 O ATOM 1805 CB GLU A 148 -8.557 3.887 0.318 1.00 61.53 C ATOM 1806 CG GLU A 148 -7.720 3.409 1.492 1.00 4.54 C ATOM 1807 CD GLU A 148 -7.699 4.404 2.637 1.00 54.34 C ATOM 1808 OE1 GLU A 148 -8.602 4.338 3.497 1.00 4.12 O ATOM 1809 OE2 GLU A 148 -6.780 5.249 2.671 1.00 13.30 O ATOM 0 H GLU A 148 -9.756 5.008 -1.522 1.00 35.22 H new ATOM 0 HA GLU A 148 -8.128 5.983 0.517 1.00 0.33 H new ATOM 0 HB2 GLU A 148 -9.595 3.981 0.637 1.00 61.53 H new ATOM 0 HB3 GLU A 148 -8.532 3.131 -0.466 1.00 61.53 H new ATOM 0 HG2 GLU A 148 -8.113 2.457 1.850 1.00 4.54 H new ATOM 0 HG3 GLU A 148 -6.699 3.226 1.155 1.00 4.54 H new ATOM 1816 N VAL A 149 -6.459 4.314 -1.810 1.00 3.04 N ATOM 1817 CA VAL A 149 -5.132 4.113 -2.380 1.00 10.31 C ATOM 1818 C VAL A 149 -4.541 5.429 -2.873 1.00 2.34 C ATOM 1819 O VAL A 149 -3.508 5.882 -2.379 1.00 22.12 O ATOM 1820 CB VAL A 149 -5.169 3.111 -3.548 1.00 72.54 C ATOM 1821 CG1 VAL A 149 -3.802 3.006 -4.206 1.00 63.31 C ATOM 1822 CG2 VAL A 149 -5.644 1.748 -3.066 1.00 3.22 C ATOM 0 H VAL A 149 -7.204 3.804 -2.285 1.00 3.04 H new ATOM 0 HA VAL A 149 -4.504 3.710 -1.585 1.00 10.31 H new ATOM 0 HB VAL A 149 -5.877 3.475 -4.293 1.00 72.54 H new ATOM 0 HG11 VAL A 149 -3.848 2.293 -5.029 1.00 63.31 H new ATOM 0 HG12 VAL A 149 -3.506 3.983 -4.588 1.00 63.31 H new ATOM 0 HG13 VAL A 149 -3.070 2.667 -3.473 1.00 63.31 H new ATOM 0 HG21 VAL A 149 -5.664 1.052 -3.905 1.00 3.22 H new ATOM 0 HG22 VAL A 149 -4.963 1.375 -2.301 1.00 3.22 H new ATOM 0 HG23 VAL A 149 -6.646 1.839 -2.646 1.00 3.22 H new ATOM 1832 N VAL A 150 -5.203 6.040 -3.850 1.00 13.43 N ATOM 1833 CA VAL A 150 -4.745 7.306 -4.409 1.00 44.30 C ATOM 1834 C VAL A 150 -4.412 8.306 -3.307 1.00 24.42 C ATOM 1835 O VAL A 150 -3.557 9.175 -3.479 1.00 21.12 O ATOM 1836 CB VAL A 150 -5.802 7.923 -5.344 1.00 13.15 C ATOM 1837 CG1 VAL A 150 -6.302 6.889 -6.341 1.00 31.13 C ATOM 1838 CG2 VAL A 150 -6.956 8.498 -4.536 1.00 30.03 C ATOM 0 H VAL A 150 -6.059 5.678 -4.271 1.00 13.43 H new ATOM 0 HA VAL A 150 -3.844 7.090 -4.984 1.00 44.30 H new ATOM 0 HB VAL A 150 -5.338 8.736 -5.902 1.00 13.15 H new ATOM 0 HG11 VAL A 150 -7.048 7.343 -6.993 1.00 31.13 H new ATOM 0 HG12 VAL A 150 -5.467 6.529 -6.941 1.00 31.13 H new ATOM 0 HG13 VAL A 150 -6.750 6.053 -5.804 1.00 31.13 H new ATOM 0 HG21 VAL A 150 -7.694 8.930 -5.212 1.00 30.03 H new ATOM 0 HG22 VAL A 150 -7.421 7.705 -3.950 1.00 30.03 H new ATOM 0 HG23 VAL A 150 -6.581 9.272 -3.866 1.00 30.03 H new ATOM 1848 N LYS A 151 -5.092 8.176 -2.173 1.00 31.10 N ATOM 1849 CA LYS A 151 -4.868 9.066 -1.040 1.00 34.11 C ATOM 1850 C LYS A 151 -3.532 8.766 -0.368 1.00 52.21 C ATOM 1851 O LYS A 151 -2.729 9.669 -0.135 1.00 21.41 O ATOM 1852 CB LYS A 151 -6.005 8.927 -0.024 1.00 25.00 C ATOM 1853 CG LYS A 151 -6.960 10.108 -0.015 1.00 22.24 C ATOM 1854 CD LYS A 151 -7.496 10.402 -1.405 1.00 41.45 C ATOM 1855 CE LYS A 151 -7.037 11.765 -1.903 1.00 31.43 C ATOM 1856 NZ LYS A 151 -8.120 12.782 -1.811 1.00 13.45 N ATOM 0 H LYS A 151 -5.803 7.462 -2.014 1.00 31.10 H new ATOM 0 HA LYS A 151 -4.845 10.090 -1.413 1.00 34.11 H new ATOM 0 HB2 LYS A 151 -6.566 8.018 -0.241 1.00 25.00 H new ATOM 0 HB3 LYS A 151 -5.579 8.808 0.972 1.00 25.00 H new ATOM 0 HG2 LYS A 151 -7.790 9.900 0.660 1.00 22.24 H new ATOM 0 HG3 LYS A 151 -6.447 10.989 0.372 1.00 22.24 H new ATOM 0 HD2 LYS A 151 -7.161 9.629 -2.096 1.00 41.45 H new ATOM 0 HD3 LYS A 151 -8.585 10.366 -1.391 1.00 41.45 H new ATOM 0 HE2 LYS A 151 -6.178 12.095 -1.318 1.00 31.43 H new ATOM 0 HE3 LYS A 151 -6.705 11.681 -2.938 1.00 31.43 H new ATOM 0 HZ1 LYS A 151 -7.768 13.696 -2.159 1.00 13.45 H new ATOM 0 HZ2 LYS A 151 -8.930 12.480 -2.389 1.00 13.45 H new ATOM 0 HZ3 LYS A 151 -8.420 12.881 -0.820 1.00 13.45 H new ATOM 1870 N GLU A 152 -3.301 7.493 -0.061 1.00 54.42 N ATOM 1871 CA GLU A 152 -2.061 7.076 0.583 1.00 15.51 C ATOM 1872 C GLU A 152 -0.850 7.515 -0.234 1.00 64.42 C ATOM 1873 O GLU A 152 0.090 8.108 0.296 1.00 34.13 O ATOM 1874 CB GLU A 152 -2.043 5.558 0.769 1.00 60.21 C ATOM 1875 CG GLU A 152 -1.084 5.089 1.850 1.00 33.44 C ATOM 1876 CD GLU A 152 -1.603 5.363 3.249 1.00 44.33 C ATOM 1877 OE1 GLU A 152 -2.718 5.912 3.370 1.00 31.11 O ATOM 1878 OE2 GLU A 152 -0.893 5.030 4.221 1.00 55.40 O ATOM 0 H GLU A 152 -3.956 6.734 -0.248 1.00 54.42 H new ATOM 0 HA GLU A 152 -2.010 7.555 1.561 1.00 15.51 H new ATOM 0 HB2 GLU A 152 -3.049 5.219 1.015 1.00 60.21 H new ATOM 0 HB3 GLU A 152 -1.770 5.088 -0.176 1.00 60.21 H new ATOM 0 HG2 GLU A 152 -0.907 4.020 1.735 1.00 33.44 H new ATOM 0 HG3 GLU A 152 -0.123 5.587 1.719 1.00 33.44 H new ATOM 1885 N VAL A 153 -0.878 7.217 -1.530 1.00 2.25 N ATOM 1886 CA VAL A 153 0.217 7.580 -2.421 1.00 41.13 C ATOM 1887 C VAL A 153 0.334 9.094 -2.560 1.00 62.20 C ATOM 1888 O VAL A 153 1.434 9.645 -2.539 1.00 2.14 O ATOM 1889 CB VAL A 153 0.032 6.960 -3.819 1.00 54.31 C ATOM 1890 CG1 VAL A 153 0.712 5.602 -3.896 1.00 0.13 C ATOM 1891 CG2 VAL A 153 -1.447 6.845 -4.158 1.00 41.13 C ATOM 0 H VAL A 153 -1.647 6.725 -1.985 1.00 2.25 H new ATOM 0 HA VAL A 153 1.131 7.187 -1.975 1.00 41.13 H new ATOM 0 HB VAL A 153 0.501 7.615 -4.553 1.00 54.31 H new ATOM 0 HG11 VAL A 153 0.570 5.180 -4.891 1.00 0.13 H new ATOM 0 HG12 VAL A 153 1.778 5.717 -3.699 1.00 0.13 H new ATOM 0 HG13 VAL A 153 0.276 4.934 -3.153 1.00 0.13 H new ATOM 0 HG21 VAL A 153 -1.560 6.405 -5.149 1.00 41.13 H new ATOM 0 HG22 VAL A 153 -1.941 6.212 -3.421 1.00 41.13 H new ATOM 0 HG23 VAL A 153 -1.901 7.836 -4.147 1.00 41.13 H new ATOM 1901 N GLN A 154 -0.807 9.760 -2.702 1.00 34.52 N ATOM 1902 CA GLN A 154 -0.832 11.210 -2.844 1.00 54.53 C ATOM 1903 C GLN A 154 -0.238 11.889 -1.614 1.00 72.52 C ATOM 1904 O GLN A 154 0.487 12.876 -1.728 1.00 10.35 O ATOM 1905 CB GLN A 154 -2.265 11.698 -3.068 1.00 32.54 C ATOM 1906 CG GLN A 154 -2.377 13.205 -3.230 1.00 30.14 C ATOM 1907 CD GLN A 154 -3.800 13.705 -3.073 1.00 24.31 C ATOM 1908 OE1 GLN A 154 -4.498 13.945 -4.058 1.00 63.25 O ATOM 1909 NE2 GLN A 154 -4.238 13.864 -1.830 1.00 3.24 N ATOM 0 H GLN A 154 -1.726 9.318 -2.722 1.00 34.52 H new ATOM 0 HA GLN A 154 -0.226 11.474 -3.710 1.00 54.53 H new ATOM 0 HB2 GLN A 154 -2.670 11.214 -3.957 1.00 32.54 H new ATOM 0 HB3 GLN A 154 -2.882 11.385 -2.226 1.00 32.54 H new ATOM 0 HG2 GLN A 154 -1.741 13.694 -2.492 1.00 30.14 H new ATOM 0 HG3 GLN A 154 -2.002 13.490 -4.213 1.00 30.14 H new ATOM 0 HE21 GLN A 154 -3.625 13.653 -1.042 1.00 3.24 H new ATOM 0 HE22 GLN A 154 -5.187 14.197 -1.663 1.00 3.24 H new ATOM 1918 N ALA A 155 -0.551 11.351 -0.439 1.00 50.55 N ATOM 1919 CA ALA A 155 -0.047 11.904 0.812 1.00 64.24 C ATOM 1920 C ALA A 155 1.442 11.617 0.978 1.00 71.03 C ATOM 1921 O ALA A 155 2.212 12.490 1.381 1.00 34.00 O ATOM 1922 CB ALA A 155 -0.829 11.342 1.990 1.00 41.53 C ATOM 0 H ALA A 155 -1.151 10.533 -0.328 1.00 50.55 H new ATOM 0 HA ALA A 155 -0.181 12.985 0.783 1.00 64.24 H new ATOM 0 HB1 ALA A 155 -0.442 11.763 2.918 1.00 41.53 H new ATOM 0 HB2 ALA A 155 -1.882 11.602 1.885 1.00 41.53 H new ATOM 0 HB3 ALA A 155 -0.724 10.257 2.012 1.00 41.53 H new ATOM 1928 N LEU A 156 1.841 10.389 0.665 1.00 4.24 N ATOM 1929 CA LEU A 156 3.239 9.987 0.781 1.00 72.23 C ATOM 1930 C LEU A 156 3.932 10.029 -0.578 1.00 14.45 C ATOM 1931 O LEU A 156 4.850 10.821 -0.793 1.00 33.51 O ATOM 1932 CB LEU A 156 3.338 8.580 1.372 1.00 33.35 C ATOM 1933 CG LEU A 156 3.095 7.424 0.401 1.00 41.33 C ATOM 1934 CD1 LEU A 156 4.412 6.919 -0.167 1.00 24.53 C ATOM 1935 CD2 LEU A 156 2.341 6.297 1.090 1.00 23.44 C ATOM 0 H LEU A 156 1.217 9.655 0.329 1.00 4.24 H new ATOM 0 HA LEU A 156 3.740 10.690 1.446 1.00 72.23 H new ATOM 0 HB2 LEU A 156 4.330 8.460 1.807 1.00 33.35 H new ATOM 0 HB3 LEU A 156 2.620 8.499 2.188 1.00 33.35 H new ATOM 0 HG LEU A 156 2.484 7.790 -0.424 1.00 41.33 H new ATOM 0 HD11 LEU A 156 4.220 6.096 -0.856 1.00 24.53 H new ATOM 0 HD12 LEU A 156 4.913 7.728 -0.699 1.00 24.53 H new ATOM 0 HD13 LEU A 156 5.049 6.570 0.646 1.00 24.53 H new ATOM 0 HD21 LEU A 156 2.177 5.483 0.383 1.00 23.44 H new ATOM 0 HD22 LEU A 156 2.925 5.932 1.935 1.00 23.44 H new ATOM 0 HD23 LEU A 156 1.380 6.667 1.446 1.00 23.44 H new TER 1947 LEU A 156