USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1086 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 137 SER OG : rot 180:sc= -0.097 USER MOD Set 1.2: A 138 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 88 SER OG : rot -175:sc= 1.02 USER MOD Set 2.2: A 110 HIS : no HD1:sc= 0.839 K(o=1.9,f=-0.54) USER MOD Set 3.1: A 19 MET CE :methyl -143:sc= -1.38 (180deg=-0.401) USER MOD Set 3.2: A 115 MET CE :methyl -121:sc= -3.21! (180deg=-3.22!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0107 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0384 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 10 GLN : amide:sc= -1.04 K(o=-1,f=-0.29) USER MOD Single : A 13 LYS NZ :NH3+ -149:sc= -0.422 (180deg=-1.48) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -2.07 K(o=-2.1,f=-5.1!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 177:sc= 1.03 USER MOD Single : A 42 SER OG : rot 160:sc= -0.0147 USER MOD Single : A 44 ASN : amide:sc= -1.75 K(o=-1.7,f=-6.4!) USER MOD Single : A 55 LYS NZ :NH3+ -153:sc= -0.0559 (180deg=-1.03) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 170:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -137:sc= -0.0301 (180deg=-1.86!) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 170:sc= 0 USER MOD Single : A 93 THR OG1 : rot 71:sc= 0.714 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 95 ASN : amide:sc= -0.053 K(o=-0.053,f=-1.9) USER MOD Single : A 97 LYS NZ :NH3+ -157:sc= -0.0551 (180deg=-0.357) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -148:sc= 0.406 USER MOD Single : A 108 GLN : amide:sc= -1.32 K(o=-1.3,f=-0.48) USER MOD Single : A 112 TYR OH : rot 96:sc= -0.807 USER MOD Single : A 113 LYS NZ :NH3+ -174:sc= 0.00732 (180deg=0.00413) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot -40:sc= 0.94 USER MOD Single : A 119 SER OG : rot 117:sc= 0.884 USER MOD Single : A 120 TYR OH : rot 143:sc= 1.64 USER MOD Single : A 126 SER OG : rot -150:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 150:sc= -2.1 USER MOD Single : A 130 GLN : amide:sc= -0.119 K(o=-0.12,f=-1.7!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.376 26.123 7.875 1.00 0.00 N ATOM 2 CA GLY A 1 -27.238 26.982 8.148 1.00 0.00 C ATOM 3 C GLY A 1 -26.043 26.211 8.672 1.00 0.00 C ATOM 4 O GLY A 1 -25.464 26.572 9.697 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.167 26.697 7.519 1.00 0.00 H new ATOM 0 H2 GLY A 1 -28.113 25.415 7.160 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.665 25.641 8.750 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.956 27.507 7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.525 27.740 8.876 1.00 0.00 H new ATOM 8 N SER A 2 -25.672 25.146 7.969 1.00 0.00 N ATOM 9 CA SER A 2 -24.541 24.319 8.373 1.00 0.00 C ATOM 10 C SER A 2 -23.805 23.773 7.154 1.00 0.00 C ATOM 11 O SER A 2 -24.319 23.811 6.036 1.00 0.00 O ATOM 12 CB SER A 2 -25.016 23.164 9.256 1.00 0.00 C ATOM 13 OG SER A 2 -25.823 23.635 10.322 1.00 0.00 O ATOM 0 H SER A 2 -26.138 24.835 7.117 1.00 0.00 H new ATOM 0 HA SER A 2 -23.852 24.942 8.943 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.581 22.452 8.655 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.154 22.630 9.657 1.00 0.00 H new ATOM 0 HG SER A 2 -26.115 22.877 10.871 1.00 0.00 H new ATOM 19 N SER A 3 -22.597 23.264 7.378 1.00 0.00 N ATOM 20 CA SER A 3 -21.787 22.713 6.298 1.00 0.00 C ATOM 21 C SER A 3 -22.091 21.232 6.093 1.00 0.00 C ATOM 22 O SER A 3 -22.529 20.820 5.020 1.00 0.00 O ATOM 23 CB SER A 3 -20.299 22.903 6.600 1.00 0.00 C ATOM 24 OG SER A 3 -19.496 22.361 5.566 1.00 0.00 O ATOM 0 H SER A 3 -22.158 23.222 8.298 1.00 0.00 H new ATOM 0 HA SER A 3 -22.035 23.248 5.381 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.081 23.965 6.716 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.052 22.422 7.546 1.00 0.00 H new ATOM 0 HG SER A 3 -18.550 22.497 5.782 1.00 0.00 H new ATOM 30 N GLY A 4 -21.854 20.436 7.131 1.00 0.00 N ATOM 31 CA GLY A 4 -22.108 19.010 7.046 1.00 0.00 C ATOM 32 C GLY A 4 -21.029 18.188 7.723 1.00 0.00 C ATOM 33 O GLY A 4 -19.844 18.507 7.628 1.00 0.00 O ATOM 0 H GLY A 4 -21.490 20.754 8.030 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.071 18.788 7.505 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.179 18.718 5.998 1.00 0.00 H new ATOM 37 N SER A 5 -21.440 17.127 8.410 1.00 0.00 N ATOM 38 CA SER A 5 -20.500 16.259 9.110 1.00 0.00 C ATOM 39 C SER A 5 -20.219 14.996 8.301 1.00 0.00 C ATOM 40 O SER A 5 -19.091 14.505 8.268 1.00 0.00 O ATOM 41 CB SER A 5 -21.050 15.884 10.488 1.00 0.00 C ATOM 42 OG SER A 5 -22.289 15.206 10.376 1.00 0.00 O ATOM 0 H SER A 5 -22.417 16.848 8.497 1.00 0.00 H new ATOM 0 HA SER A 5 -19.564 16.804 9.235 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.332 15.251 11.010 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.178 16.784 11.089 1.00 0.00 H new ATOM 0 HG SER A 5 -22.618 14.976 11.270 1.00 0.00 H new ATOM 48 N SER A 6 -21.255 14.476 7.650 1.00 0.00 N ATOM 49 CA SER A 6 -21.122 13.269 6.844 1.00 0.00 C ATOM 50 C SER A 6 -20.468 13.581 5.501 1.00 0.00 C ATOM 51 O SER A 6 -20.548 14.704 5.005 1.00 0.00 O ATOM 52 CB SER A 6 -22.492 12.626 6.619 1.00 0.00 C ATOM 53 OG SER A 6 -22.431 11.632 5.612 1.00 0.00 O ATOM 0 H SER A 6 -22.195 14.872 7.665 1.00 0.00 H new ATOM 0 HA SER A 6 -20.485 12.570 7.385 1.00 0.00 H new ATOM 0 HB2 SER A 6 -22.846 12.183 7.550 1.00 0.00 H new ATOM 0 HB3 SER A 6 -23.214 13.392 6.335 1.00 0.00 H new ATOM 0 HG SER A 6 -23.319 11.236 5.489 1.00 0.00 H new ATOM 59 N GLY A 7 -19.820 12.577 4.917 1.00 0.00 N ATOM 60 CA GLY A 7 -19.162 12.764 3.638 1.00 0.00 C ATOM 61 C GLY A 7 -17.964 11.851 3.463 1.00 0.00 C ATOM 62 O GLY A 7 -16.830 12.317 3.358 1.00 0.00 O ATOM 0 H GLY A 7 -19.739 11.638 5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -19.876 12.579 2.835 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.841 13.802 3.546 1.00 0.00 H new ATOM 66 N SER A 8 -18.216 10.546 3.435 1.00 0.00 N ATOM 67 CA SER A 8 -17.149 9.565 3.278 1.00 0.00 C ATOM 68 C SER A 8 -17.232 8.886 1.914 1.00 0.00 C ATOM 69 O SER A 8 -16.211 8.605 1.286 1.00 0.00 O ATOM 70 CB SER A 8 -17.225 8.515 4.388 1.00 0.00 C ATOM 71 OG SER A 8 -17.118 9.116 5.667 1.00 0.00 O ATOM 0 H SER A 8 -19.150 10.144 3.519 1.00 0.00 H new ATOM 0 HA SER A 8 -16.195 10.088 3.347 1.00 0.00 H new ATOM 0 HB2 SER A 8 -18.167 7.972 4.316 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.426 7.785 4.258 1.00 0.00 H new ATOM 0 HG SER A 8 -17.171 8.424 6.359 1.00 0.00 H new ATOM 77 N GLN A 9 -18.455 8.625 1.463 1.00 0.00 N ATOM 78 CA GLN A 9 -18.671 7.978 0.174 1.00 0.00 C ATOM 79 C GLN A 9 -17.906 8.697 -0.931 1.00 0.00 C ATOM 80 O GLN A 9 -17.105 8.090 -1.640 1.00 0.00 O ATOM 81 CB GLN A 9 -20.164 7.946 -0.160 1.00 0.00 C ATOM 82 CG GLN A 9 -20.466 7.393 -1.543 1.00 0.00 C ATOM 83 CD GLN A 9 -21.945 7.138 -1.760 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.783 7.572 -0.969 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.273 6.431 -2.835 1.00 0.00 N ATOM 0 H GLN A 9 -19.310 8.851 1.970 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.299 6.956 0.242 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.682 7.342 0.585 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.566 8.956 -0.086 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.108 8.094 -2.297 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.916 6.463 -1.686 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.545 6.091 -3.464 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.253 6.228 -3.032 1.00 0.00 H new ATOM 94 N GLN A 10 -18.159 9.995 -1.072 1.00 0.00 N ATOM 95 CA GLN A 10 -17.494 10.796 -2.093 1.00 0.00 C ATOM 96 C GLN A 10 -15.978 10.692 -1.964 1.00 0.00 C ATOM 97 O GLN A 10 -15.279 10.431 -2.944 1.00 0.00 O ATOM 98 CB GLN A 10 -17.927 12.259 -1.985 1.00 0.00 C ATOM 99 CG GLN A 10 -19.422 12.466 -2.166 1.00 0.00 C ATOM 100 CD GLN A 10 -19.984 11.676 -3.331 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.025 12.161 -4.463 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.420 10.451 -3.061 1.00 0.00 N ATOM 0 H GLN A 10 -18.819 10.513 -0.492 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.785 10.409 -3.070 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.630 12.646 -1.010 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.394 12.843 -2.735 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.939 12.174 -1.252 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.622 13.526 -2.321 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.367 10.089 -2.109 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.808 9.872 -3.806 1.00 0.00 H new ATOM 111 N ARG A 11 -15.476 10.898 -0.751 1.00 0.00 N ATOM 112 CA ARG A 11 -14.043 10.828 -0.495 1.00 0.00 C ATOM 113 C ARG A 11 -13.485 9.465 -0.894 1.00 0.00 C ATOM 114 O ARG A 11 -12.357 9.361 -1.377 1.00 0.00 O ATOM 115 CB ARG A 11 -13.753 11.098 0.982 1.00 0.00 C ATOM 116 CG ARG A 11 -12.282 10.979 1.346 1.00 0.00 C ATOM 117 CD ARG A 11 -12.054 11.217 2.831 1.00 0.00 C ATOM 118 NE ARG A 11 -12.360 10.033 3.629 1.00 0.00 N ATOM 119 CZ ARG A 11 -13.204 10.036 4.655 1.00 0.00 C ATOM 120 NH1 ARG A 11 -13.821 11.155 5.006 1.00 0.00 N ATOM 121 NH2 ARG A 11 -13.430 8.917 5.332 1.00 0.00 N ATOM 0 H ARG A 11 -16.041 11.115 0.070 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.554 11.592 -1.099 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.101 12.100 1.235 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.327 10.398 1.590 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.918 9.988 1.075 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -11.704 11.700 0.768 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -11.016 11.507 2.996 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.675 12.049 3.164 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.901 9.156 3.385 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.648 12.017 4.488 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -14.469 11.155 5.794 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -12.956 8.055 5.065 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.078 8.920 6.120 1.00 0.00 H new ATOM 135 N VAL A 12 -14.282 8.421 -0.686 1.00 0.00 N ATOM 136 CA VAL A 12 -13.868 7.065 -1.024 1.00 0.00 C ATOM 137 C VAL A 12 -13.553 6.940 -2.510 1.00 0.00 C ATOM 138 O VAL A 12 -12.426 6.624 -2.893 1.00 0.00 O ATOM 139 CB VAL A 12 -14.955 6.038 -0.654 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.586 4.657 -1.174 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.169 6.009 0.852 1.00 0.00 C ATOM 0 H VAL A 12 -15.217 8.489 -0.285 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.968 6.856 -0.446 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.890 6.339 -1.126 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.366 3.946 -0.903 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.488 4.691 -2.259 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.640 4.343 -0.733 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.940 5.278 1.096 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.238 5.733 1.347 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.483 6.995 1.194 1.00 0.00 H new ATOM 151 N LYS A 13 -14.555 7.192 -3.345 1.00 0.00 N ATOM 152 CA LYS A 13 -14.385 7.110 -4.791 1.00 0.00 C ATOM 153 C LYS A 13 -13.165 7.906 -5.242 1.00 0.00 C ATOM 154 O LYS A 13 -12.342 7.414 -6.014 1.00 0.00 O ATOM 155 CB LYS A 13 -15.637 7.630 -5.502 1.00 0.00 C ATOM 156 CG LYS A 13 -15.894 6.966 -6.844 1.00 0.00 C ATOM 157 CD LYS A 13 -17.381 6.814 -7.115 1.00 0.00 C ATOM 158 CE LYS A 13 -18.042 8.160 -7.371 1.00 0.00 C ATOM 159 NZ LYS A 13 -18.370 8.867 -6.102 1.00 0.00 N ATOM 0 H LYS A 13 -15.494 7.455 -3.045 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.232 6.064 -5.055 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.502 7.474 -4.857 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.540 8.705 -5.651 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.437 7.558 -7.637 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.418 5.986 -6.863 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.530 6.164 -7.978 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.859 6.329 -6.264 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.379 8.782 -7.972 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.953 8.013 -7.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.219 9.451 -6.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.548 8.169 -5.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.572 9.475 -5.827 1.00 0.00 H new ATOM 173 N ARG A 14 -13.053 9.137 -4.753 1.00 0.00 N ATOM 174 CA ARG A 14 -11.933 10.001 -5.106 1.00 0.00 C ATOM 175 C ARG A 14 -10.644 9.194 -5.232 1.00 0.00 C ATOM 176 O ARG A 14 -9.769 9.525 -6.033 1.00 0.00 O ATOM 177 CB ARG A 14 -11.758 11.100 -4.056 1.00 0.00 C ATOM 178 CG ARG A 14 -12.707 12.273 -4.239 1.00 0.00 C ATOM 179 CD ARG A 14 -12.111 13.336 -5.149 1.00 0.00 C ATOM 180 NE ARG A 14 -12.616 14.670 -4.835 1.00 0.00 N ATOM 181 CZ ARG A 14 -13.737 15.170 -5.343 1.00 0.00 C ATOM 182 NH1 ARG A 14 -14.466 14.449 -6.184 1.00 0.00 N ATOM 183 NH2 ARG A 14 -14.130 16.392 -5.010 1.00 0.00 N ATOM 0 H ARG A 14 -13.724 9.558 -4.111 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.151 10.461 -6.070 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.910 10.672 -3.065 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.732 11.465 -4.092 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -13.648 11.919 -4.660 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.937 12.711 -3.268 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.025 13.328 -5.054 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -12.342 13.096 -6.187 1.00 0.00 H new ATOM 0 HE ARG A 14 -12.078 15.249 -4.190 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -14.166 13.509 -6.442 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -15.326 14.835 -6.573 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -13.571 16.949 -4.363 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -14.991 16.775 -5.401 1.00 0.00 H new ATOM 197 N TRP A 15 -10.534 8.136 -4.437 1.00 0.00 N ATOM 198 CA TRP A 15 -9.351 7.282 -4.460 1.00 0.00 C ATOM 199 C TRP A 15 -9.237 6.546 -5.790 1.00 0.00 C ATOM 200 O TRP A 15 -8.190 6.569 -6.435 1.00 0.00 O ATOM 201 CB TRP A 15 -9.401 6.277 -3.308 1.00 0.00 C ATOM 202 CG TRP A 15 -9.727 6.903 -1.986 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.394 8.161 -1.571 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.449 6.300 -0.907 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.865 8.376 -0.298 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.516 7.250 0.131 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.046 5.051 -0.717 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.156 6.987 1.340 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.680 4.792 0.483 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.732 5.756 1.499 1.00 0.00 C ATOM 0 H TRP A 15 -11.249 7.849 -3.769 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.472 7.916 -4.342 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.146 5.514 -3.534 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.438 5.771 -3.235 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.842 8.881 -2.157 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.749 9.235 0.240 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.012 4.302 -1.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.196 7.729 2.124 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.144 3.830 0.641 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.236 5.523 2.425 1.00 0.00 H new ATOM 221 N GLY A 16 -10.322 5.892 -6.195 1.00 0.00 N ATOM 222 CA GLY A 16 -10.322 5.158 -7.446 1.00 0.00 C ATOM 223 C GLY A 16 -9.652 5.926 -8.569 1.00 0.00 C ATOM 224 O GLY A 16 -9.248 5.342 -9.575 1.00 0.00 O ATOM 0 H GLY A 16 -11.201 5.858 -5.678 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.810 4.206 -7.305 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.349 4.929 -7.729 1.00 0.00 H new ATOM 228 N PHE A 17 -9.536 7.238 -8.398 1.00 0.00 N ATOM 229 CA PHE A 17 -8.914 8.088 -9.407 1.00 0.00 C ATOM 230 C PHE A 17 -7.394 7.949 -9.373 1.00 0.00 C ATOM 231 O PHE A 17 -6.673 8.753 -9.961 1.00 0.00 O ATOM 232 CB PHE A 17 -9.308 9.550 -9.186 1.00 0.00 C ATOM 233 CG PHE A 17 -10.755 9.831 -9.474 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.712 9.689 -8.483 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.158 10.236 -10.737 1.00 0.00 C ATOM 236 CE1 PHE A 17 -13.045 9.946 -8.746 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.489 10.495 -11.005 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.433 10.350 -10.008 1.00 0.00 C ATOM 0 H PHE A 17 -9.864 7.736 -7.571 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.269 7.767 -10.386 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.091 9.824 -8.154 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.690 10.185 -9.821 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -11.414 9.374 -7.494 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.424 10.350 -11.521 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.782 9.831 -7.965 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.790 10.810 -11.993 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.474 10.552 -10.215 1.00 0.00 H new ATOM 248 N GLY A 18 -6.916 6.921 -8.679 1.00 0.00 N ATOM 249 CA GLY A 18 -5.486 6.694 -8.579 1.00 0.00 C ATOM 250 C GLY A 18 -5.001 6.668 -7.144 1.00 0.00 C ATOM 251 O GLY A 18 -5.685 7.153 -6.242 1.00 0.00 O ATOM 0 H GLY A 18 -7.493 6.241 -8.184 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.237 5.748 -9.060 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.958 7.477 -9.123 1.00 0.00 H new ATOM 255 N MET A 19 -3.818 6.101 -6.930 1.00 0.00 N ATOM 256 CA MET A 19 -3.243 6.014 -5.593 1.00 0.00 C ATOM 257 C MET A 19 -3.010 7.404 -5.009 1.00 0.00 C ATOM 258 O MET A 19 -3.314 7.657 -3.843 1.00 0.00 O ATOM 259 CB MET A 19 -1.926 5.236 -5.630 1.00 0.00 C ATOM 260 CG MET A 19 -1.388 4.885 -4.252 1.00 0.00 C ATOM 261 SD MET A 19 -0.332 3.424 -4.270 1.00 0.00 S ATOM 262 CE MET A 19 1.051 4.018 -5.242 1.00 0.00 C ATOM 0 H MET A 19 -3.239 5.695 -7.665 1.00 0.00 H new ATOM 0 HA MET A 19 -3.951 5.485 -4.955 1.00 0.00 H new ATOM 0 HB2 MET A 19 -2.072 4.318 -6.199 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.180 5.826 -6.163 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.824 5.731 -3.860 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.223 4.716 -3.572 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.421 3.214 -5.878 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.727 4.853 -5.863 1.00 0.00 H new ATOM 0 HE3 MET A 19 1.848 4.349 -4.576 1.00 0.00 H new ATOM 272 N ASP A 20 -2.470 8.300 -5.827 1.00 0.00 N ATOM 273 CA ASP A 20 -2.197 9.665 -5.393 1.00 0.00 C ATOM 274 C ASP A 20 -3.302 10.174 -4.472 1.00 0.00 C ATOM 275 O ASP A 20 -3.031 10.818 -3.460 1.00 0.00 O ATOM 276 CB ASP A 20 -2.058 10.590 -6.602 1.00 0.00 C ATOM 277 CG ASP A 20 -0.999 10.113 -7.578 1.00 0.00 C ATOM 278 OD1 ASP A 20 -1.064 8.937 -7.993 1.00 0.00 O ATOM 279 OD2 ASP A 20 -0.107 10.915 -7.924 1.00 0.00 O ATOM 0 H ASP A 20 -2.212 8.106 -6.795 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.259 9.662 -4.838 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.017 10.658 -7.116 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.807 11.594 -6.260 1.00 0.00 H new ATOM 284 N GLU A 21 -4.547 9.880 -4.833 1.00 0.00 N ATOM 285 CA GLU A 21 -5.693 10.310 -4.040 1.00 0.00 C ATOM 286 C GLU A 21 -5.764 9.540 -2.724 1.00 0.00 C ATOM 287 O GLU A 21 -6.061 10.110 -1.675 1.00 0.00 O ATOM 288 CB GLU A 21 -6.990 10.114 -4.828 1.00 0.00 C ATOM 289 CG GLU A 21 -7.071 10.962 -6.086 1.00 0.00 C ATOM 290 CD GLU A 21 -7.323 12.427 -5.787 1.00 0.00 C ATOM 291 OE1 GLU A 21 -6.770 12.933 -4.788 1.00 0.00 O ATOM 292 OE2 GLU A 21 -8.073 13.068 -6.552 1.00 0.00 O ATOM 0 H GLU A 21 -4.788 9.347 -5.668 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.569 11.369 -3.816 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.084 9.063 -5.102 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.836 10.353 -4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.141 10.864 -6.646 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.869 10.583 -6.724 1.00 0.00 H new ATOM 299 N ALA A 22 -5.488 8.242 -2.790 1.00 0.00 N ATOM 300 CA ALA A 22 -5.519 7.393 -1.605 1.00 0.00 C ATOM 301 C ALA A 22 -4.401 7.764 -0.636 1.00 0.00 C ATOM 302 O ALA A 22 -4.577 7.707 0.582 1.00 0.00 O ATOM 303 CB ALA A 22 -5.412 5.928 -2.002 1.00 0.00 C ATOM 0 H ALA A 22 -5.240 7.755 -3.651 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.471 7.552 -1.099 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.436 5.306 -1.107 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.248 5.665 -2.650 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.475 5.763 -2.533 1.00 0.00 H new ATOM 309 N LEU A 23 -3.251 8.142 -1.183 1.00 0.00 N ATOM 310 CA LEU A 23 -2.104 8.522 -0.367 1.00 0.00 C ATOM 311 C LEU A 23 -2.392 9.797 0.420 1.00 0.00 C ATOM 312 O LEU A 23 -2.243 9.833 1.641 1.00 0.00 O ATOM 313 CB LEU A 23 -0.869 8.721 -1.248 1.00 0.00 C ATOM 314 CG LEU A 23 -0.488 7.543 -2.146 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.651 7.928 -3.076 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.108 6.333 -1.305 1.00 0.00 C ATOM 0 H LEU A 23 -3.088 8.193 -2.189 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.912 7.716 0.341 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.034 9.594 -1.879 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.020 8.950 -0.603 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.353 7.280 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.909 7.078 -3.707 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.342 8.765 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.520 8.218 -2.486 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.160 5.504 -1.960 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.742 6.584 -0.670 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.954 6.043 -0.681 1.00 0.00 H new ATOM 328 N LYS A 24 -2.809 10.841 -0.289 1.00 0.00 N ATOM 329 CA LYS A 24 -3.122 12.117 0.342 1.00 0.00 C ATOM 330 C LYS A 24 -4.092 11.927 1.503 1.00 0.00 C ATOM 331 O LYS A 24 -4.068 12.682 2.475 1.00 0.00 O ATOM 332 CB LYS A 24 -3.721 13.083 -0.684 1.00 0.00 C ATOM 333 CG LYS A 24 -5.142 12.733 -1.090 1.00 0.00 C ATOM 334 CD LYS A 24 -5.943 13.976 -1.442 1.00 0.00 C ATOM 335 CE LYS A 24 -7.420 13.794 -1.127 1.00 0.00 C ATOM 336 NZ LYS A 24 -8.159 15.087 -1.169 1.00 0.00 N ATOM 0 H LYS A 24 -2.938 10.828 -1.301 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.195 12.538 0.732 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.708 14.092 -0.272 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.090 13.093 -1.573 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.121 12.058 -1.946 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.634 12.201 -0.276 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.554 14.830 -0.888 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.821 14.201 -2.501 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.861 13.100 -1.842 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.528 13.346 -0.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.162 14.921 -0.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.755 15.741 -0.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.077 15.503 -2.119 1.00 0.00 H new ATOM 350 N ASP A 25 -4.944 10.913 1.396 1.00 0.00 N ATOM 351 CA ASP A 25 -5.921 10.622 2.439 1.00 0.00 C ATOM 352 C ASP A 25 -5.402 9.542 3.383 1.00 0.00 C ATOM 353 O ASP A 25 -4.722 8.601 2.975 1.00 0.00 O ATOM 354 CB ASP A 25 -7.246 10.179 1.817 1.00 0.00 C ATOM 355 CG ASP A 25 -7.996 11.329 1.173 1.00 0.00 C ATOM 356 OD1 ASP A 25 -8.331 12.294 1.891 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.249 11.263 -0.048 1.00 0.00 O ATOM 0 H ASP A 25 -4.978 10.279 0.598 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.085 11.534 3.014 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.054 9.410 1.069 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.872 9.726 2.586 1.00 0.00 H new ATOM 362 N PRO A 26 -5.730 9.680 4.677 1.00 0.00 N ATOM 363 CA PRO A 26 -5.307 8.725 5.706 1.00 0.00 C ATOM 364 C PRO A 26 -6.008 7.378 5.571 1.00 0.00 C ATOM 365 O PRO A 26 -5.365 6.328 5.584 1.00 0.00 O ATOM 366 CB PRO A 26 -5.713 9.410 7.013 1.00 0.00 C ATOM 367 CG PRO A 26 -6.834 10.315 6.634 1.00 0.00 C ATOM 368 CD PRO A 26 -6.538 10.777 5.234 1.00 0.00 C ATOM 0 HA PRO A 26 -4.243 8.499 5.639 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -6.028 8.682 7.761 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.881 9.968 7.442 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.790 9.792 6.679 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.901 11.161 7.318 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.452 10.934 4.661 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.992 11.721 5.229 1.00 0.00 H new ATOM 376 N VAL A 27 -7.330 7.414 5.440 1.00 0.00 N ATOM 377 CA VAL A 27 -8.118 6.196 5.300 1.00 0.00 C ATOM 378 C VAL A 27 -7.745 5.442 4.028 1.00 0.00 C ATOM 379 O VAL A 27 -7.276 4.306 4.082 1.00 0.00 O ATOM 380 CB VAL A 27 -9.627 6.503 5.277 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.427 5.234 5.028 1.00 0.00 C ATOM 382 CG2 VAL A 27 -10.055 7.166 6.578 1.00 0.00 C ATOM 0 H VAL A 27 -7.878 8.274 5.428 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.894 5.574 6.167 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.827 7.196 4.459 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.491 5.471 5.015 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.139 4.805 4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.225 4.515 5.822 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.124 7.376 6.545 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.842 6.499 7.413 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.506 8.098 6.709 1.00 0.00 H new ATOM 392 N GLY A 28 -7.956 6.084 2.883 1.00 0.00 N ATOM 393 CA GLY A 28 -7.635 5.460 1.613 1.00 0.00 C ATOM 394 C GLY A 28 -6.302 4.739 1.641 1.00 0.00 C ATOM 395 O GLY A 28 -6.108 3.750 0.934 1.00 0.00 O ATOM 0 H GLY A 28 -8.343 7.025 2.812 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.422 4.753 1.350 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.617 6.221 0.832 1.00 0.00 H new ATOM 399 N ARG A 29 -5.380 5.236 2.459 1.00 0.00 N ATOM 400 CA ARG A 29 -4.057 4.634 2.574 1.00 0.00 C ATOM 401 C ARG A 29 -4.148 3.229 3.161 1.00 0.00 C ATOM 402 O ARG A 29 -3.583 2.281 2.616 1.00 0.00 O ATOM 403 CB ARG A 29 -3.151 5.505 3.447 1.00 0.00 C ATOM 404 CG ARG A 29 -2.310 6.493 2.656 1.00 0.00 C ATOM 405 CD ARG A 29 -1.295 7.196 3.543 1.00 0.00 C ATOM 406 NE ARG A 29 -0.580 6.259 4.407 1.00 0.00 N ATOM 407 CZ ARG A 29 -0.910 6.029 5.673 1.00 0.00 C ATOM 408 NH1 ARG A 29 -1.938 6.664 6.219 1.00 0.00 N ATOM 409 NH2 ARG A 29 -0.212 5.162 6.394 1.00 0.00 N ATOM 0 H ARG A 29 -5.525 6.054 3.052 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.629 4.564 1.574 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.766 6.054 4.160 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.490 4.860 4.026 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.792 5.970 1.852 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.960 7.233 2.188 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.580 7.733 2.920 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.804 7.939 4.157 1.00 0.00 H new ATOM 0 HE ARG A 29 0.216 5.754 4.017 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.477 7.331 5.667 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -2.190 6.486 7.191 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.579 4.671 5.976 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.466 4.986 7.366 1.00 0.00 H new ATOM 423 N GLU A 30 -4.862 3.103 4.276 1.00 0.00 N ATOM 424 CA GLU A 30 -5.025 1.814 4.936 1.00 0.00 C ATOM 425 C GLU A 30 -5.902 0.883 4.104 1.00 0.00 C ATOM 426 O GLU A 30 -5.587 -0.294 3.932 1.00 0.00 O ATOM 427 CB GLU A 30 -5.636 2.001 6.326 1.00 0.00 C ATOM 428 CG GLU A 30 -7.155 2.055 6.321 1.00 0.00 C ATOM 429 CD GLU A 30 -7.735 2.294 7.702 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.071 2.971 8.514 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.852 1.803 7.969 1.00 0.00 O ATOM 0 H GLU A 30 -5.336 3.878 4.740 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.039 1.361 5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.312 1.183 6.969 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.250 2.922 6.763 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.484 2.849 5.650 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.547 1.119 5.924 1.00 0.00 H new ATOM 438 N GLN A 31 -7.004 1.420 3.591 1.00 0.00 N ATOM 439 CA GLN A 31 -7.928 0.638 2.778 1.00 0.00 C ATOM 440 C GLN A 31 -7.187 -0.094 1.664 1.00 0.00 C ATOM 441 O GLN A 31 -7.204 -1.324 1.597 1.00 0.00 O ATOM 442 CB GLN A 31 -9.007 1.543 2.180 1.00 0.00 C ATOM 443 CG GLN A 31 -9.782 2.335 3.221 1.00 0.00 C ATOM 444 CD GLN A 31 -10.128 1.509 4.444 1.00 0.00 C ATOM 445 OE1 GLN A 31 -9.821 1.892 5.573 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.773 0.369 4.225 1.00 0.00 N ATOM 0 H GLN A 31 -7.279 2.393 3.724 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.402 -0.103 3.422 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.541 2.237 1.481 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.705 0.933 1.606 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.193 3.200 3.526 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.700 2.716 2.773 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -11.007 0.091 3.272 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.034 -0.228 5.010 1.00 0.00 H new ATOM 455 N PHE A 32 -6.537 0.669 0.792 1.00 0.00 N ATOM 456 CA PHE A 32 -5.791 0.092 -0.320 1.00 0.00 C ATOM 457 C PHE A 32 -4.775 -0.931 0.179 1.00 0.00 C ATOM 458 O PHE A 32 -4.589 -1.986 -0.430 1.00 0.00 O ATOM 459 CB PHE A 32 -5.077 1.193 -1.108 1.00 0.00 C ATOM 460 CG PHE A 32 -4.091 0.668 -2.112 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.511 -0.129 -3.165 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.743 0.973 -2.003 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.605 -0.613 -4.089 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.833 0.492 -2.925 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.264 -0.302 -3.970 1.00 0.00 C ATOM 0 H PHE A 32 -6.512 1.688 0.834 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.499 -0.415 -0.976 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -5.821 1.800 -1.624 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.558 1.850 -0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.558 -0.374 -3.264 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.400 1.594 -1.188 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.945 -1.234 -4.904 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.786 0.737 -2.829 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.555 -0.679 -4.692 1.00 0.00 H new ATOM 475 N LEU A 33 -4.119 -0.612 1.289 1.00 0.00 N ATOM 476 CA LEU A 33 -3.121 -1.503 1.871 1.00 0.00 C ATOM 477 C LEU A 33 -3.731 -2.860 2.205 1.00 0.00 C ATOM 478 O LEU A 33 -3.249 -3.899 1.752 1.00 0.00 O ATOM 479 CB LEU A 33 -2.522 -0.876 3.131 1.00 0.00 C ATOM 480 CG LEU A 33 -1.842 -1.841 4.103 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.377 -2.022 3.737 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.979 -1.342 5.534 1.00 0.00 C ATOM 0 H LEU A 33 -4.260 0.257 1.804 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.330 -1.652 1.136 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.793 -0.124 2.827 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.316 -0.353 3.665 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.336 -2.810 4.029 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.091 -2.712 4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.301 -2.425 2.727 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.131 -1.059 3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.489 -2.041 6.212 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.511 -0.362 5.624 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -3.035 -1.265 5.793 1.00 0.00 H new ATOM 494 N LYS A 34 -4.797 -2.845 2.999 1.00 0.00 N ATOM 495 CA LYS A 34 -5.477 -4.073 3.392 1.00 0.00 C ATOM 496 C LYS A 34 -5.491 -5.078 2.244 1.00 0.00 C ATOM 497 O LYS A 34 -4.934 -6.171 2.355 1.00 0.00 O ATOM 498 CB LYS A 34 -6.910 -3.768 3.835 1.00 0.00 C ATOM 499 CG LYS A 34 -6.993 -2.788 4.991 1.00 0.00 C ATOM 500 CD LYS A 34 -8.206 -3.058 5.865 1.00 0.00 C ATOM 501 CE LYS A 34 -8.421 -1.946 6.880 1.00 0.00 C ATOM 502 NZ LYS A 34 -9.800 -1.968 7.444 1.00 0.00 N ATOM 0 H LYS A 34 -5.209 -1.994 3.383 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.931 -4.510 4.228 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.465 -3.366 2.988 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.398 -4.699 4.123 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.087 -2.857 5.593 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.042 -1.770 4.604 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.092 -3.156 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.077 -4.007 6.385 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.697 -2.047 7.688 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.238 -0.982 6.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.906 -1.195 8.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -10.491 -1.846 6.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.967 -2.878 7.918 1.00 0.00 H new ATOM 516 N PHE A 35 -6.130 -4.701 1.141 1.00 0.00 N ATOM 517 CA PHE A 35 -6.216 -5.569 -0.027 1.00 0.00 C ATOM 518 C PHE A 35 -4.842 -6.122 -0.397 1.00 0.00 C ATOM 519 O PHE A 35 -4.672 -7.330 -0.567 1.00 0.00 O ATOM 520 CB PHE A 35 -6.807 -4.805 -1.214 1.00 0.00 C ATOM 521 CG PHE A 35 -6.845 -5.607 -2.484 1.00 0.00 C ATOM 522 CD1 PHE A 35 -5.735 -5.673 -3.310 1.00 0.00 C ATOM 523 CD2 PHE A 35 -7.991 -6.294 -2.850 1.00 0.00 C ATOM 524 CE1 PHE A 35 -5.768 -6.410 -4.479 1.00 0.00 C ATOM 525 CE2 PHE A 35 -8.030 -7.032 -4.018 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.917 -7.091 -4.833 1.00 0.00 C ATOM 0 H PHE A 35 -6.596 -3.800 1.032 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.870 -6.405 0.220 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.819 -4.487 -0.964 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.222 -3.901 -1.382 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.834 -5.143 -3.038 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.864 -6.252 -2.215 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.896 -6.454 -5.115 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.930 -7.562 -4.293 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.944 -7.668 -5.745 1.00 0.00 H new ATOM 536 N LEU A 36 -3.866 -5.229 -0.519 1.00 0.00 N ATOM 537 CA LEU A 36 -2.507 -5.626 -0.869 1.00 0.00 C ATOM 538 C LEU A 36 -2.013 -6.742 0.046 1.00 0.00 C ATOM 539 O LEU A 36 -1.641 -7.819 -0.420 1.00 0.00 O ATOM 540 CB LEU A 36 -1.565 -4.424 -0.780 1.00 0.00 C ATOM 541 CG LEU A 36 -1.316 -3.668 -2.086 1.00 0.00 C ATOM 542 CD1 LEU A 36 -2.623 -3.135 -2.651 1.00 0.00 C ATOM 543 CD2 LEU A 36 -0.327 -2.533 -1.864 1.00 0.00 C ATOM 0 H LEU A 36 -3.990 -4.226 -0.381 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.516 -5.998 -1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.970 -3.724 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.605 -4.768 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.887 -4.361 -2.809 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.426 -2.600 -3.580 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.300 -3.966 -2.847 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.081 -2.456 -1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.161 -2.006 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.729 -1.840 -1.125 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.618 -2.939 -1.504 1.00 0.00 H new ATOM 555 N GLU A 37 -2.014 -6.478 1.348 1.00 0.00 N ATOM 556 CA GLU A 37 -1.568 -7.461 2.328 1.00 0.00 C ATOM 557 C GLU A 37 -2.064 -8.857 1.962 1.00 0.00 C ATOM 558 O GLU A 37 -1.305 -9.825 1.992 1.00 0.00 O ATOM 559 CB GLU A 37 -2.060 -7.082 3.726 1.00 0.00 C ATOM 560 CG GLU A 37 -1.513 -5.756 4.225 1.00 0.00 C ATOM 561 CD GLU A 37 -2.127 -5.331 5.545 1.00 0.00 C ATOM 562 OE1 GLU A 37 -3.369 -5.388 5.667 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.367 -4.941 6.456 1.00 0.00 O ATOM 0 H GLU A 37 -2.319 -5.591 1.749 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.478 -7.469 2.326 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.149 -7.036 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.779 -7.868 4.427 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.432 -5.833 4.340 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.700 -4.986 3.477 1.00 0.00 H new ATOM 570 N SER A 38 -3.345 -8.952 1.619 1.00 0.00 N ATOM 571 CA SER A 38 -3.945 -10.229 1.252 1.00 0.00 C ATOM 572 C SER A 38 -3.195 -10.868 0.087 1.00 0.00 C ATOM 573 O SER A 38 -2.854 -12.049 0.128 1.00 0.00 O ATOM 574 CB SER A 38 -5.417 -10.037 0.881 1.00 0.00 C ATOM 575 OG SER A 38 -6.248 -10.137 2.024 1.00 0.00 O ATOM 0 H SER A 38 -3.987 -8.160 1.588 1.00 0.00 H new ATOM 0 HA SER A 38 -3.878 -10.894 2.113 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.553 -9.062 0.413 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.711 -10.787 0.147 1.00 0.00 H new ATOM 0 HG SER A 38 -7.183 -10.009 1.761 1.00 0.00 H new ATOM 581 N GLU A 39 -2.941 -10.076 -0.951 1.00 0.00 N ATOM 582 CA GLU A 39 -2.232 -10.564 -2.127 1.00 0.00 C ATOM 583 C GLU A 39 -0.722 -10.515 -1.912 1.00 0.00 C ATOM 584 O GLU A 39 0.055 -10.606 -2.863 1.00 0.00 O ATOM 585 CB GLU A 39 -2.610 -9.737 -3.358 1.00 0.00 C ATOM 586 CG GLU A 39 -2.280 -8.260 -3.223 1.00 0.00 C ATOM 587 CD GLU A 39 -2.267 -7.541 -4.558 1.00 0.00 C ATOM 588 OE1 GLU A 39 -3.105 -7.877 -5.420 1.00 0.00 O ATOM 589 OE2 GLU A 39 -1.419 -6.642 -4.740 1.00 0.00 O ATOM 0 H GLU A 39 -3.216 -9.095 -1.000 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.525 -11.601 -2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.091 -10.139 -4.228 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.678 -9.846 -3.545 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.010 -7.787 -2.567 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.306 -8.151 -2.746 1.00 0.00 H new ATOM 596 N PHE A 40 -0.314 -10.370 -0.656 1.00 0.00 N ATOM 597 CA PHE A 40 1.102 -10.307 -0.314 1.00 0.00 C ATOM 598 C PHE A 40 1.824 -9.277 -1.179 1.00 0.00 C ATOM 599 O PHE A 40 2.905 -9.542 -1.705 1.00 0.00 O ATOM 600 CB PHE A 40 1.752 -11.681 -0.488 1.00 0.00 C ATOM 601 CG PHE A 40 1.080 -12.536 -1.524 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.113 -13.181 -1.241 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.641 -12.694 -2.781 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.734 -13.968 -2.192 1.00 0.00 C ATOM 605 CE2 PHE A 40 1.024 -13.479 -3.736 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.164 -14.118 -3.441 1.00 0.00 C ATOM 0 H PHE A 40 -0.944 -10.294 0.142 1.00 0.00 H new ATOM 0 HA PHE A 40 1.186 -10.003 0.729 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.798 -11.547 -0.762 1.00 0.00 H new ATOM 0 HB3 PHE A 40 1.738 -12.204 0.468 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.563 -13.067 -0.266 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.571 -12.198 -3.017 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.664 -14.465 -1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.471 -13.593 -4.713 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.646 -14.734 -4.186 1.00 0.00 H new ATOM 616 N SER A 41 1.219 -8.103 -1.320 1.00 0.00 N ATOM 617 CA SER A 41 1.801 -7.034 -2.124 1.00 0.00 C ATOM 618 C SER A 41 2.100 -5.810 -1.265 1.00 0.00 C ATOM 619 O SER A 41 2.884 -4.943 -1.652 1.00 0.00 O ATOM 620 CB SER A 41 0.856 -6.653 -3.265 1.00 0.00 C ATOM 621 OG SER A 41 0.842 -7.650 -4.272 1.00 0.00 O ATOM 0 H SER A 41 0.326 -7.867 -0.888 1.00 0.00 H new ATOM 0 HA SER A 41 2.738 -7.398 -2.545 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.152 -6.512 -2.875 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.167 -5.701 -3.696 1.00 0.00 H new ATOM 0 HG SER A 41 0.193 -7.406 -4.965 1.00 0.00 H new ATOM 627 N SER A 42 1.469 -5.746 -0.097 1.00 0.00 N ATOM 628 CA SER A 42 1.663 -4.626 0.817 1.00 0.00 C ATOM 629 C SER A 42 3.135 -4.232 0.887 1.00 0.00 C ATOM 630 O SER A 42 3.467 -3.055 1.028 1.00 0.00 O ATOM 631 CB SER A 42 1.152 -4.985 2.213 1.00 0.00 C ATOM 632 OG SER A 42 1.693 -6.219 2.653 1.00 0.00 O ATOM 0 H SER A 42 0.819 -6.457 0.239 1.00 0.00 H new ATOM 0 HA SER A 42 1.095 -3.777 0.438 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.420 -4.196 2.916 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.064 -5.045 2.201 1.00 0.00 H new ATOM 0 HG SER A 42 1.625 -6.277 3.629 1.00 0.00 H new ATOM 638 N GLU A 43 4.013 -5.225 0.788 1.00 0.00 N ATOM 639 CA GLU A 43 5.450 -4.982 0.842 1.00 0.00 C ATOM 640 C GLU A 43 5.837 -3.807 -0.051 1.00 0.00 C ATOM 641 O GLU A 43 6.655 -2.969 0.327 1.00 0.00 O ATOM 642 CB GLU A 43 6.218 -6.235 0.415 1.00 0.00 C ATOM 643 CG GLU A 43 5.846 -6.734 -0.972 1.00 0.00 C ATOM 644 CD GLU A 43 6.386 -8.122 -1.257 1.00 0.00 C ATOM 645 OE1 GLU A 43 6.412 -8.951 -0.323 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.783 -8.378 -2.413 1.00 0.00 O ATOM 0 H GLU A 43 3.755 -6.205 0.670 1.00 0.00 H new ATOM 0 HA GLU A 43 5.712 -4.736 1.871 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.287 -6.022 0.441 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.033 -7.029 1.139 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.761 -6.743 -1.072 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.229 -6.039 -1.719 1.00 0.00 H new ATOM 653 N ASN A 44 5.242 -3.752 -1.239 1.00 0.00 N ATOM 654 CA ASN A 44 5.524 -2.681 -2.186 1.00 0.00 C ATOM 655 C ASN A 44 5.224 -1.317 -1.571 1.00 0.00 C ATOM 656 O ASN A 44 6.079 -0.431 -1.551 1.00 0.00 O ATOM 657 CB ASN A 44 4.701 -2.870 -3.462 1.00 0.00 C ATOM 658 CG ASN A 44 4.922 -4.229 -4.096 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.673 -5.055 -3.577 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.266 -4.469 -5.226 1.00 0.00 N ATOM 0 H ASN A 44 4.562 -4.437 -1.568 1.00 0.00 H new ATOM 0 HA ASN A 44 6.584 -2.721 -2.436 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.643 -2.748 -3.230 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.962 -2.091 -4.178 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.375 -5.367 -5.698 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.653 -3.756 -5.621 1.00 0.00 H new ATOM 667 N LEU A 45 4.004 -1.156 -1.070 1.00 0.00 N ATOM 668 CA LEU A 45 3.590 0.099 -0.453 1.00 0.00 C ATOM 669 C LEU A 45 4.345 0.341 0.850 1.00 0.00 C ATOM 670 O LEU A 45 5.029 1.353 1.004 1.00 0.00 O ATOM 671 CB LEU A 45 2.084 0.087 -0.187 1.00 0.00 C ATOM 672 CG LEU A 45 1.516 1.319 0.518 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.640 2.547 -0.371 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.065 1.087 0.912 1.00 0.00 C ATOM 0 H LEU A 45 3.284 -1.879 -1.079 1.00 0.00 H new ATOM 0 HA LEU A 45 3.825 0.909 -1.144 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.568 -0.031 -1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.849 -0.791 0.414 1.00 0.00 H new ATOM 0 HG LEU A 45 2.094 1.493 1.426 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.231 3.414 0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.690 2.725 -0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.088 2.383 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.322 1.974 1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.527 0.887 0.019 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.003 0.234 1.587 1.00 0.00 H new ATOM 686 N ARG A 46 4.219 -0.597 1.784 1.00 0.00 N ATOM 687 CA ARG A 46 4.891 -0.486 3.073 1.00 0.00 C ATOM 688 C ARG A 46 6.246 0.199 2.923 1.00 0.00 C ATOM 689 O ARG A 46 6.626 1.034 3.744 1.00 0.00 O ATOM 690 CB ARG A 46 5.074 -1.871 3.697 1.00 0.00 C ATOM 691 CG ARG A 46 3.869 -2.343 4.495 1.00 0.00 C ATOM 692 CD ARG A 46 4.278 -3.284 5.617 1.00 0.00 C ATOM 693 NE ARG A 46 4.644 -2.560 6.832 1.00 0.00 N ATOM 694 CZ ARG A 46 5.892 -2.452 7.275 1.00 0.00 C ATOM 695 NH1 ARG A 46 6.887 -3.018 6.606 1.00 0.00 N ATOM 696 NH2 ARG A 46 6.146 -1.777 8.388 1.00 0.00 N ATOM 0 H ARG A 46 3.658 -1.442 1.672 1.00 0.00 H new ATOM 0 HA ARG A 46 4.267 0.121 3.729 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.281 -2.592 2.906 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.947 -1.854 4.349 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.348 -1.482 4.913 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.167 -2.849 3.832 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.457 -3.967 5.835 1.00 0.00 H new ATOM 0 HD3 ARG A 46 5.121 -3.893 5.290 1.00 0.00 H new ATOM 0 HE ARG A 46 3.901 -2.113 7.369 1.00 0.00 H new ATOM 0 HH11 ARG A 46 6.695 -3.538 5.749 1.00 0.00 H new ATOM 0 HH12 ARG A 46 7.844 -2.934 6.948 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.383 -1.340 8.905 1.00 0.00 H new ATOM 0 HH22 ARG A 46 7.104 -1.695 8.727 1.00 0.00 H new ATOM 710 N PHE A 47 6.972 -0.160 1.869 1.00 0.00 N ATOM 711 CA PHE A 47 8.285 0.418 1.612 1.00 0.00 C ATOM 712 C PHE A 47 8.162 1.876 1.179 1.00 0.00 C ATOM 713 O PHE A 47 8.880 2.744 1.675 1.00 0.00 O ATOM 714 CB PHE A 47 9.018 -0.385 0.535 1.00 0.00 C ATOM 715 CG PHE A 47 10.152 0.364 -0.104 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.205 0.839 0.661 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.165 0.593 -1.470 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.249 1.529 0.076 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.207 1.282 -2.062 1.00 0.00 C ATOM 720 CZ PHE A 47 12.251 1.750 -1.288 1.00 0.00 C ATOM 0 H PHE A 47 6.672 -0.849 1.179 1.00 0.00 H new ATOM 0 HA PHE A 47 8.859 0.379 2.538 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.404 -1.304 0.977 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.306 -0.677 -0.237 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.210 0.668 1.727 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.351 0.229 -2.080 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.063 1.895 0.684 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.205 1.454 -3.128 1.00 0.00 H new ATOM 0 HZ PHE A 47 13.067 2.287 -1.748 1.00 0.00 H new ATOM 730 N TRP A 48 7.249 2.136 0.251 1.00 0.00 N ATOM 731 CA TRP A 48 7.032 3.489 -0.250 1.00 0.00 C ATOM 732 C TRP A 48 6.852 4.473 0.901 1.00 0.00 C ATOM 733 O TRP A 48 7.600 5.444 1.023 1.00 0.00 O ATOM 734 CB TRP A 48 5.806 3.525 -1.165 1.00 0.00 C ATOM 735 CG TRP A 48 5.639 4.831 -1.882 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.341 5.263 -2.971 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.713 5.874 -1.559 1.00 0.00 C ATOM 738 NE1 TRP A 48 5.906 6.512 -3.345 1.00 0.00 N ATOM 739 CE2 TRP A 48 4.908 6.908 -2.495 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.737 6.033 -0.572 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.163 8.084 -2.470 1.00 0.00 C ATOM 742 CZ3 TRP A 48 2.999 7.201 -0.548 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.214 8.214 -1.492 1.00 0.00 C ATOM 0 H TRP A 48 6.647 1.429 -0.170 1.00 0.00 H new ATOM 0 HA TRP A 48 7.912 3.784 -0.821 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.885 2.723 -1.899 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.913 3.327 -0.572 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.123 4.705 -3.465 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.268 7.056 -4.129 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.563 5.257 0.159 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.328 8.866 -3.196 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.243 7.335 0.212 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.620 9.115 -1.447 1.00 0.00 H new ATOM 754 N LEU A 49 5.856 4.217 1.742 1.00 0.00 N ATOM 755 CA LEU A 49 5.579 5.081 2.885 1.00 0.00 C ATOM 756 C LEU A 49 6.802 5.200 3.788 1.00 0.00 C ATOM 757 O LEU A 49 7.160 6.293 4.223 1.00 0.00 O ATOM 758 CB LEU A 49 4.392 4.538 3.683 1.00 0.00 C ATOM 759 CG LEU A 49 3.020 4.670 3.020 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.021 3.725 3.669 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.526 6.107 3.099 1.00 0.00 C ATOM 0 H LEU A 49 5.227 3.419 1.654 1.00 0.00 H new ATOM 0 HA LEU A 49 5.332 6.073 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.572 3.483 3.892 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.360 5.052 4.644 1.00 0.00 H new ATOM 0 HG LEU A 49 3.117 4.397 1.969 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.051 3.833 3.185 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.369 2.698 3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.927 3.966 4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.549 6.182 2.622 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.444 6.407 4.144 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.231 6.763 2.587 1.00 0.00 H new ATOM 773 N ALA A 50 7.441 4.067 4.063 1.00 0.00 N ATOM 774 CA ALA A 50 8.626 4.045 4.910 1.00 0.00 C ATOM 775 C ALA A 50 9.597 5.156 4.525 1.00 0.00 C ATOM 776 O ALA A 50 10.183 5.809 5.389 1.00 0.00 O ATOM 777 CB ALA A 50 9.312 2.689 4.823 1.00 0.00 C ATOM 0 H ALA A 50 7.157 3.153 3.711 1.00 0.00 H new ATOM 0 HA ALA A 50 8.310 4.215 5.939 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.196 2.687 5.461 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.624 1.911 5.154 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.608 2.497 3.792 1.00 0.00 H new ATOM 783 N VAL A 51 9.763 5.366 3.223 1.00 0.00 N ATOM 784 CA VAL A 51 10.662 6.400 2.724 1.00 0.00 C ATOM 785 C VAL A 51 10.195 7.787 3.148 1.00 0.00 C ATOM 786 O VAL A 51 11.003 8.637 3.522 1.00 0.00 O ATOM 787 CB VAL A 51 10.771 6.354 1.188 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.715 7.438 0.688 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.232 4.980 0.727 1.00 0.00 C ATOM 0 H VAL A 51 9.287 4.834 2.495 1.00 0.00 H new ATOM 0 HA VAL A 51 11.643 6.203 3.157 1.00 0.00 H new ATOM 0 HB VAL A 51 9.784 6.541 0.765 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.780 7.391 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.337 8.416 0.987 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.705 7.285 1.118 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.303 4.966 -0.361 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.209 4.761 1.158 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.514 4.227 1.053 1.00 0.00 H new ATOM 799 N GLU A 52 8.885 8.009 3.089 1.00 0.00 N ATOM 800 CA GLU A 52 8.311 9.294 3.468 1.00 0.00 C ATOM 801 C GLU A 52 8.685 9.656 4.902 1.00 0.00 C ATOM 802 O GLU A 52 9.100 10.781 5.181 1.00 0.00 O ATOM 803 CB GLU A 52 6.788 9.261 3.320 1.00 0.00 C ATOM 804 CG GLU A 52 6.307 9.566 1.911 1.00 0.00 C ATOM 805 CD GLU A 52 6.661 10.971 1.465 1.00 0.00 C ATOM 806 OE1 GLU A 52 5.956 11.919 1.870 1.00 0.00 O ATOM 807 OE2 GLU A 52 7.645 11.123 0.710 1.00 0.00 O ATOM 0 H GLU A 52 8.202 7.316 2.783 1.00 0.00 H new ATOM 0 HA GLU A 52 8.718 10.055 2.802 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.424 8.277 3.614 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.349 9.982 4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.745 8.848 1.218 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.226 9.435 1.864 1.00 0.00 H new ATOM 814 N ASP A 53 8.535 8.695 5.807 1.00 0.00 N ATOM 815 CA ASP A 53 8.858 8.912 7.212 1.00 0.00 C ATOM 816 C ASP A 53 10.368 8.976 7.420 1.00 0.00 C ATOM 817 O ASP A 53 10.866 9.804 8.184 1.00 0.00 O ATOM 818 CB ASP A 53 8.260 7.797 8.072 1.00 0.00 C ATOM 819 CG ASP A 53 6.788 8.017 8.363 1.00 0.00 C ATOM 820 OD1 ASP A 53 6.469 8.925 9.159 1.00 0.00 O ATOM 821 OD2 ASP A 53 5.955 7.281 7.793 1.00 0.00 O ATOM 0 H ASP A 53 8.192 7.759 5.593 1.00 0.00 H new ATOM 0 HA ASP A 53 8.427 9.866 7.515 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.388 6.841 7.563 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.808 7.734 9.012 1.00 0.00 H new ATOM 826 N LEU A 54 11.092 8.097 6.736 1.00 0.00 N ATOM 827 CA LEU A 54 12.546 8.053 6.845 1.00 0.00 C ATOM 828 C LEU A 54 13.124 9.458 6.984 1.00 0.00 C ATOM 829 O LEU A 54 13.673 9.815 8.027 1.00 0.00 O ATOM 830 CB LEU A 54 13.148 7.360 5.622 1.00 0.00 C ATOM 831 CG LEU A 54 14.664 7.484 5.459 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.380 6.905 6.669 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.121 6.790 4.184 1.00 0.00 C ATOM 0 H LEU A 54 10.696 7.405 6.100 1.00 0.00 H new ATOM 0 HA LEU A 54 12.802 7.485 7.739 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.893 6.301 5.667 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.672 7.765 4.729 1.00 0.00 H new ATOM 0 HG LEU A 54 14.917 8.542 5.385 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.457 7.002 6.535 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.076 7.446 7.565 1.00 0.00 H new ATOM 0 HD13 LEU A 54 15.121 5.852 6.775 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.202 6.888 4.084 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.855 5.734 4.229 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.634 7.250 3.324 1.00 0.00 H new ATOM 845 N LYS A 55 12.996 10.252 5.926 1.00 0.00 N ATOM 846 CA LYS A 55 13.503 11.619 5.930 1.00 0.00 C ATOM 847 C LYS A 55 13.002 12.381 7.152 1.00 0.00 C ATOM 848 O LYS A 55 13.754 13.121 7.787 1.00 0.00 O ATOM 849 CB LYS A 55 13.077 12.346 4.653 1.00 0.00 C ATOM 850 CG LYS A 55 11.571 12.406 4.460 1.00 0.00 C ATOM 851 CD LYS A 55 11.205 12.758 3.028 1.00 0.00 C ATOM 852 CE LYS A 55 11.117 11.517 2.154 1.00 0.00 C ATOM 853 NZ LYS A 55 12.431 11.173 1.544 1.00 0.00 N ATOM 0 H LYS A 55 12.545 9.972 5.055 1.00 0.00 H new ATOM 0 HA LYS A 55 14.591 11.576 5.971 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.473 13.361 4.674 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.525 11.847 3.794 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.131 11.444 4.723 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.146 13.146 5.138 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.250 13.283 3.014 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.950 13.441 2.618 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.763 10.677 2.751 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.382 11.680 1.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.276 10.660 0.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.964 12.045 1.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.971 10.573 2.199 1.00 0.00 H new ATOM 867 N LYS A 56 11.727 12.196 7.479 1.00 0.00 N ATOM 868 CA LYS A 56 11.126 12.864 8.627 1.00 0.00 C ATOM 869 C LYS A 56 11.863 12.504 9.913 1.00 0.00 C ATOM 870 O LYS A 56 12.032 13.343 10.798 1.00 0.00 O ATOM 871 CB LYS A 56 9.649 12.482 8.749 1.00 0.00 C ATOM 872 CG LYS A 56 8.832 12.811 7.511 1.00 0.00 C ATOM 873 CD LYS A 56 8.674 14.311 7.329 1.00 0.00 C ATOM 874 CE LYS A 56 7.732 14.638 6.181 1.00 0.00 C ATOM 875 NZ LYS A 56 7.189 16.021 6.285 1.00 0.00 N ATOM 0 H LYS A 56 11.090 11.588 6.964 1.00 0.00 H new ATOM 0 HA LYS A 56 11.205 13.940 8.473 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.574 11.413 8.950 1.00 0.00 H new ATOM 0 HB3 LYS A 56 9.218 12.999 9.607 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.316 12.386 6.631 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.849 12.348 7.589 1.00 0.00 H new ATOM 0 HD2 LYS A 56 8.293 14.752 8.250 1.00 0.00 H new ATOM 0 HD3 LYS A 56 9.649 14.760 7.140 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.261 14.526 5.234 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.908 13.924 6.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.552 16.205 5.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.663 16.121 7.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.973 16.704 6.267 1.00 0.00 H new ATOM 889 N ARG A 57 12.300 11.252 10.009 1.00 0.00 N ATOM 890 CA ARG A 57 13.018 10.782 11.187 1.00 0.00 C ATOM 891 C ARG A 57 14.208 11.687 11.495 1.00 0.00 C ATOM 892 O ARG A 57 14.814 12.282 10.603 1.00 0.00 O ATOM 893 CB ARG A 57 13.498 9.344 10.978 1.00 0.00 C ATOM 894 CG ARG A 57 12.376 8.369 10.660 1.00 0.00 C ATOM 895 CD ARG A 57 11.651 7.924 11.920 1.00 0.00 C ATOM 896 NE ARG A 57 10.538 7.026 11.622 1.00 0.00 N ATOM 897 CZ ARG A 57 10.578 5.713 11.825 1.00 0.00 C ATOM 898 NH1 ARG A 57 11.669 5.149 12.324 1.00 0.00 N ATOM 899 NH2 ARG A 57 9.525 4.963 11.529 1.00 0.00 N ATOM 0 H ARG A 57 12.169 10.546 9.285 1.00 0.00 H new ATOM 0 HA ARG A 57 12.333 10.810 12.034 1.00 0.00 H new ATOM 0 HB2 ARG A 57 14.225 9.327 10.166 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.016 9.008 11.876 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.667 8.838 9.978 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.784 7.498 10.147 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.354 7.422 12.585 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.278 8.799 12.452 1.00 0.00 H new ATOM 0 HE ARG A 57 9.683 7.429 11.237 1.00 0.00 H new ATOM 0 HH11 ARG A 57 12.481 5.723 12.553 1.00 0.00 H new ATOM 0 HH12 ARG A 57 11.697 4.141 12.479 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.684 5.394 11.145 1.00 0.00 H new ATOM 0 HH22 ARG A 57 9.556 3.955 11.685 1.00 0.00 H new ATOM 913 N PRO A 58 14.552 11.794 12.787 1.00 0.00 N ATOM 914 CA PRO A 58 15.671 12.624 13.242 1.00 0.00 C ATOM 915 C PRO A 58 17.023 12.051 12.829 1.00 0.00 C ATOM 916 O PRO A 58 17.131 10.872 12.492 1.00 0.00 O ATOM 917 CB PRO A 58 15.528 12.608 14.766 1.00 0.00 C ATOM 918 CG PRO A 58 14.800 11.343 15.065 1.00 0.00 C ATOM 919 CD PRO A 58 13.874 11.113 13.903 1.00 0.00 C ATOM 0 HA PRO A 58 15.640 13.623 12.807 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.502 12.629 15.255 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.974 13.477 15.121 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.495 10.511 15.181 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.242 11.425 15.998 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.738 10.050 13.702 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.885 11.532 14.088 1.00 0.00 H new ATOM 927 N ILE A 59 18.050 12.893 12.857 1.00 0.00 N ATOM 928 CA ILE A 59 19.395 12.469 12.487 1.00 0.00 C ATOM 929 C ILE A 59 19.810 11.221 13.258 1.00 0.00 C ATOM 930 O ILE A 59 20.495 10.347 12.726 1.00 0.00 O ATOM 931 CB ILE A 59 20.427 13.584 12.742 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.700 13.325 11.933 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.746 13.680 14.226 1.00 0.00 C ATOM 934 CD1 ILE A 59 22.410 12.046 12.317 1.00 0.00 C ATOM 0 H ILE A 59 17.977 13.873 13.132 1.00 0.00 H new ATOM 0 HA ILE A 59 19.372 12.243 11.421 1.00 0.00 H new ATOM 0 HB ILE A 59 20.001 14.534 12.420 1.00 0.00 H new ATOM 0 HG12 ILE A 59 21.446 13.286 10.874 1.00 0.00 H new ATOM 0 HG13 ILE A 59 22.383 14.164 12.066 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.477 14.472 14.391 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.835 13.906 14.780 1.00 0.00 H new ATOM 0 HG23 ILE A 59 21.156 12.731 14.572 1.00 0.00 H new ATOM 0 HD11 ILE A 59 23.303 11.927 11.703 1.00 0.00 H new ATOM 0 HD12 ILE A 59 22.695 12.090 13.368 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.744 11.198 12.157 1.00 0.00 H new ATOM 946 N LYS A 60 19.389 11.143 14.516 1.00 0.00 N ATOM 947 CA LYS A 60 19.714 10.001 15.362 1.00 0.00 C ATOM 948 C LYS A 60 19.039 8.733 14.847 1.00 0.00 C ATOM 949 O LYS A 60 19.547 7.629 15.037 1.00 0.00 O ATOM 950 CB LYS A 60 19.283 10.270 16.806 1.00 0.00 C ATOM 951 CG LYS A 60 17.786 10.470 16.966 1.00 0.00 C ATOM 952 CD LYS A 60 17.414 10.764 18.410 1.00 0.00 C ATOM 953 CE LYS A 60 17.507 12.251 18.718 1.00 0.00 C ATOM 954 NZ LYS A 60 17.299 12.532 20.165 1.00 0.00 N ATOM 0 H LYS A 60 18.822 11.858 14.972 1.00 0.00 H new ATOM 0 HA LYS A 60 20.794 9.855 15.333 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.599 9.435 17.432 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.801 11.157 17.172 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.458 11.292 16.330 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.260 9.577 16.629 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.400 10.414 18.604 1.00 0.00 H new ATOM 0 HD3 LYS A 60 18.075 10.211 19.077 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.484 12.625 18.412 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.762 12.790 18.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 17.370 13.556 20.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 16.356 12.199 20.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.025 12.038 20.722 1.00 0.00 H new ATOM 968 N GLU A 61 17.893 8.901 14.194 1.00 0.00 N ATOM 969 CA GLU A 61 17.151 7.770 13.652 1.00 0.00 C ATOM 970 C GLU A 61 17.095 7.836 12.129 1.00 0.00 C ATOM 971 O GLU A 61 16.302 7.139 11.495 1.00 0.00 O ATOM 972 CB GLU A 61 15.732 7.741 14.225 1.00 0.00 C ATOM 973 CG GLU A 61 15.671 7.301 15.678 1.00 0.00 C ATOM 974 CD GLU A 61 14.296 6.807 16.081 1.00 0.00 C ATOM 975 OE1 GLU A 61 13.297 7.333 15.546 1.00 0.00 O ATOM 976 OE2 GLU A 61 14.217 5.895 16.931 1.00 0.00 O ATOM 0 H GLU A 61 17.459 9.809 14.028 1.00 0.00 H new ATOM 0 HA GLU A 61 17.670 6.856 13.940 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.293 8.735 14.136 1.00 0.00 H new ATOM 0 HB3 GLU A 61 15.120 7.068 13.624 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.401 6.509 15.845 1.00 0.00 H new ATOM 0 HG3 GLU A 61 15.955 8.136 16.319 1.00 0.00 H new ATOM 983 N VAL A 62 17.941 8.679 11.547 1.00 0.00 N ATOM 984 CA VAL A 62 17.990 8.837 10.098 1.00 0.00 C ATOM 985 C VAL A 62 18.766 7.698 9.447 1.00 0.00 C ATOM 986 O VAL A 62 18.252 6.968 8.600 1.00 0.00 O ATOM 987 CB VAL A 62 18.635 10.177 9.701 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.378 10.042 8.380 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.582 11.272 9.620 1.00 0.00 C ATOM 0 H VAL A 62 18.603 9.264 12.057 1.00 0.00 H new ATOM 0 HA VAL A 62 16.960 8.820 9.743 1.00 0.00 H new ATOM 0 HB VAL A 62 19.356 10.454 10.469 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.827 10.999 8.116 1.00 0.00 H new ATOM 0 HG12 VAL A 62 20.160 9.289 8.478 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.680 9.741 7.599 1.00 0.00 H new ATOM 0 HG21 VAL A 62 18.056 12.212 9.338 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.835 11.004 8.873 1.00 0.00 H new ATOM 0 HG23 VAL A 62 17.100 11.385 10.591 1.00 0.00 H new ATOM 999 N PRO A 63 20.035 7.541 9.852 1.00 0.00 N ATOM 1000 CA PRO A 63 20.911 6.491 9.321 1.00 0.00 C ATOM 1001 C PRO A 63 20.489 5.099 9.778 1.00 0.00 C ATOM 1002 O PRO A 63 20.335 4.188 8.964 1.00 0.00 O ATOM 1003 CB PRO A 63 22.283 6.850 9.896 1.00 0.00 C ATOM 1004 CG PRO A 63 21.985 7.621 11.135 1.00 0.00 C ATOM 1005 CD PRO A 63 20.713 8.374 10.859 1.00 0.00 C ATOM 0 HA PRO A 63 20.887 6.452 8.232 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.866 5.956 10.117 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.865 7.444 9.191 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.867 6.955 11.990 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.799 8.305 11.374 1.00 0.00 H new ATOM 0 HD2 PRO A 63 20.109 8.487 11.760 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.913 9.377 10.482 1.00 0.00 H new ATOM 1013 N SER A 64 20.304 4.940 11.085 1.00 0.00 N ATOM 1014 CA SER A 64 19.903 3.657 11.650 1.00 0.00 C ATOM 1015 C SER A 64 18.728 3.066 10.876 1.00 0.00 C ATOM 1016 O SER A 64 18.650 1.854 10.676 1.00 0.00 O ATOM 1017 CB SER A 64 19.528 3.820 13.124 1.00 0.00 C ATOM 1018 OG SER A 64 20.679 3.791 13.950 1.00 0.00 O ATOM 0 H SER A 64 20.425 5.684 11.772 1.00 0.00 H new ATOM 0 HA SER A 64 20.748 2.973 11.571 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.999 4.762 13.266 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.845 3.023 13.419 1.00 0.00 H new ATOM 0 HG SER A 64 20.412 3.899 14.887 1.00 0.00 H new ATOM 1024 N ARG A 65 17.817 3.932 10.444 1.00 0.00 N ATOM 1025 CA ARG A 65 16.646 3.496 9.693 1.00 0.00 C ATOM 1026 C ARG A 65 17.021 3.142 8.257 1.00 0.00 C ATOM 1027 O ARG A 65 16.601 2.111 7.732 1.00 0.00 O ATOM 1028 CB ARG A 65 15.576 4.590 9.697 1.00 0.00 C ATOM 1029 CG ARG A 65 14.195 4.093 9.301 1.00 0.00 C ATOM 1030 CD ARG A 65 13.596 3.198 10.375 1.00 0.00 C ATOM 1031 NE ARG A 65 12.734 2.165 9.808 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.944 1.385 10.537 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.907 1.521 11.856 1.00 0.00 N ATOM 1034 NH2 ARG A 65 11.189 0.467 9.948 1.00 0.00 N ATOM 0 H ARG A 65 17.867 4.939 10.601 1.00 0.00 H new ATOM 0 HA ARG A 65 16.247 2.604 10.176 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.523 5.031 10.693 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.877 5.383 9.013 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.537 4.944 9.127 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.260 3.543 8.362 1.00 0.00 H new ATOM 0 HD2 ARG A 65 14.398 2.728 10.944 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.022 3.806 11.075 1.00 0.00 H new ATOM 0 HE ARG A 65 12.739 2.035 8.796 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.486 2.226 12.312 1.00 0.00 H new ATOM 0 HH12 ARG A 65 11.299 0.921 12.414 1.00 0.00 H new ATOM 0 HH21 ARG A 65 11.215 0.359 8.934 1.00 0.00 H new ATOM 0 HH22 ARG A 65 10.583 -0.131 10.509 1.00 0.00 H new ATOM 1048 N VAL A 66 17.812 4.004 7.628 1.00 0.00 N ATOM 1049 CA VAL A 66 18.244 3.783 6.253 1.00 0.00 C ATOM 1050 C VAL A 66 18.423 2.296 5.966 1.00 0.00 C ATOM 1051 O VAL A 66 17.750 1.736 5.101 1.00 0.00 O ATOM 1052 CB VAL A 66 19.567 4.514 5.955 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.225 3.942 4.709 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.326 6.008 5.803 1.00 0.00 C ATOM 0 H VAL A 66 18.167 4.863 8.049 1.00 0.00 H new ATOM 0 HA VAL A 66 17.463 4.184 5.608 1.00 0.00 H new ATOM 0 HB VAL A 66 20.244 4.362 6.796 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.158 4.471 4.515 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.433 2.883 4.861 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.556 4.061 3.857 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.271 6.509 5.593 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.632 6.183 4.981 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.903 6.404 6.726 1.00 0.00 H new ATOM 1064 N GLN A 67 19.333 1.663 6.698 1.00 0.00 N ATOM 1065 CA GLN A 67 19.600 0.240 6.522 1.00 0.00 C ATOM 1066 C GLN A 67 18.350 -0.587 6.803 1.00 0.00 C ATOM 1067 O GLN A 67 17.969 -1.443 6.006 1.00 0.00 O ATOM 1068 CB GLN A 67 20.738 -0.205 7.442 1.00 0.00 C ATOM 1069 CG GLN A 67 20.341 -0.282 8.907 1.00 0.00 C ATOM 1070 CD GLN A 67 21.535 -0.448 9.827 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.683 -0.314 9.404 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.269 -0.743 11.095 1.00 0.00 N ATOM 0 H GLN A 67 19.898 2.112 7.419 1.00 0.00 H new ATOM 0 HA GLN A 67 19.896 0.077 5.486 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.094 -1.183 7.119 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.572 0.489 7.336 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.799 0.623 9.181 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.657 -1.119 9.051 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.302 -0.845 11.403 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.032 -0.867 11.761 1.00 0.00 H new ATOM 1081 N GLU A 68 17.717 -0.325 7.943 1.00 0.00 N ATOM 1082 CA GLU A 68 16.511 -1.048 8.329 1.00 0.00 C ATOM 1083 C GLU A 68 15.555 -1.182 7.147 1.00 0.00 C ATOM 1084 O GLU A 68 15.249 -2.290 6.706 1.00 0.00 O ATOM 1085 CB GLU A 68 15.810 -0.333 9.487 1.00 0.00 C ATOM 1086 CG GLU A 68 16.501 -0.524 10.827 1.00 0.00 C ATOM 1087 CD GLU A 68 16.731 -1.985 11.161 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.736 -2.731 11.277 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.906 -2.383 11.307 1.00 0.00 O ATOM 0 H GLU A 68 18.019 0.381 8.614 1.00 0.00 H new ATOM 0 HA GLU A 68 16.805 -2.047 8.652 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.755 0.733 9.265 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.785 -0.697 9.561 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.458 -0.003 10.816 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.898 -0.066 11.611 1.00 0.00 H new ATOM 1096 N ILE A 69 15.087 -0.046 6.640 1.00 0.00 N ATOM 1097 CA ILE A 69 14.167 -0.036 5.510 1.00 0.00 C ATOM 1098 C ILE A 69 14.675 -0.925 4.380 1.00 0.00 C ATOM 1099 O ILE A 69 13.913 -1.687 3.786 1.00 0.00 O ATOM 1100 CB ILE A 69 13.954 1.390 4.969 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.373 2.291 6.061 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.041 1.365 3.753 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.593 3.766 5.807 1.00 0.00 C ATOM 0 H ILE A 69 15.330 0.879 6.994 1.00 0.00 H new ATOM 0 HA ILE A 69 13.216 -0.423 5.875 1.00 0.00 H new ATOM 0 HB ILE A 69 14.919 1.795 4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.303 2.101 6.147 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.822 2.024 7.018 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.900 2.380 3.383 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.492 0.753 2.972 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.075 0.944 4.032 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.155 4.345 6.621 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.662 3.970 5.751 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.120 4.048 4.866 1.00 0.00 H new ATOM 1115 N TRP A 70 15.967 -0.824 4.090 1.00 0.00 N ATOM 1116 CA TRP A 70 16.578 -1.621 3.032 1.00 0.00 C ATOM 1117 C TRP A 70 16.675 -3.086 3.442 1.00 0.00 C ATOM 1118 O TRP A 70 16.818 -3.967 2.595 1.00 0.00 O ATOM 1119 CB TRP A 70 17.968 -1.079 2.695 1.00 0.00 C ATOM 1120 CG TRP A 70 18.972 -2.155 2.409 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.592 -2.960 3.321 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.471 -2.541 1.124 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.448 -3.823 2.680 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.391 -3.587 1.332 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.230 -2.106 -0.182 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.069 -4.202 0.282 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 19.903 -2.717 -1.222 1.00 0.00 C ATOM 1128 CH2 TRP A 70 20.813 -3.756 -0.986 1.00 0.00 C ATOM 0 H TRP A 70 16.612 -0.198 4.572 1.00 0.00 H new ATOM 0 HA TRP A 70 15.945 -1.552 2.147 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.894 -0.422 1.829 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.325 -0.471 3.527 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.433 -2.924 4.389 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.031 -4.526 3.134 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.530 -1.306 -0.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.772 -5.002 0.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.725 -2.388 -2.235 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.322 -4.214 -1.821 1.00 0.00 H new ATOM 1139 N GLN A 71 16.597 -3.339 4.744 1.00 0.00 N ATOM 1140 CA GLN A 71 16.677 -4.698 5.264 1.00 0.00 C ATOM 1141 C GLN A 71 15.285 -5.298 5.436 1.00 0.00 C ATOM 1142 O GLN A 71 15.143 -6.459 5.820 1.00 0.00 O ATOM 1143 CB GLN A 71 17.420 -4.713 6.601 1.00 0.00 C ATOM 1144 CG GLN A 71 18.902 -4.399 6.477 1.00 0.00 C ATOM 1145 CD GLN A 71 19.702 -4.879 7.672 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.795 -4.191 8.689 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.287 -6.066 7.555 1.00 0.00 N ATOM 0 H GLN A 71 16.478 -2.620 5.458 1.00 0.00 H new ATOM 0 HA GLN A 71 17.228 -5.303 4.544 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.958 -3.988 7.272 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.302 -5.694 7.062 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.294 -4.864 5.572 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.033 -3.323 6.365 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.184 -6.603 6.694 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.839 -6.441 8.326 1.00 0.00 H new ATOM 1156 N GLU A 72 14.262 -4.499 5.149 1.00 0.00 N ATOM 1157 CA GLU A 72 12.882 -4.952 5.274 1.00 0.00 C ATOM 1158 C GLU A 72 12.334 -5.406 3.923 1.00 0.00 C ATOM 1159 O GLU A 72 11.734 -6.475 3.811 1.00 0.00 O ATOM 1160 CB GLU A 72 12.005 -3.836 5.843 1.00 0.00 C ATOM 1161 CG GLU A 72 10.720 -4.337 6.482 1.00 0.00 C ATOM 1162 CD GLU A 72 10.885 -4.647 7.957 1.00 0.00 C ATOM 1163 OE1 GLU A 72 11.846 -4.135 8.568 1.00 0.00 O ATOM 1164 OE2 GLU A 72 10.052 -5.403 8.501 1.00 0.00 O ATOM 0 H GLU A 72 14.363 -3.536 4.829 1.00 0.00 H new ATOM 0 HA GLU A 72 12.866 -5.801 5.958 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.577 -3.279 6.585 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.755 -3.138 5.044 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.940 -3.586 6.357 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.385 -5.234 5.961 1.00 0.00 H new ATOM 1171 N PHE A 73 12.545 -4.584 2.900 1.00 0.00 N ATOM 1172 CA PHE A 73 12.072 -4.899 1.557 1.00 0.00 C ATOM 1173 C PHE A 73 13.241 -5.027 0.585 1.00 0.00 C ATOM 1174 O PHE A 73 13.234 -5.881 -0.304 1.00 0.00 O ATOM 1175 CB PHE A 73 11.104 -3.819 1.069 1.00 0.00 C ATOM 1176 CG PHE A 73 10.299 -3.193 2.171 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.885 -2.299 3.053 1.00 0.00 C ATOM 1178 CD2 PHE A 73 8.956 -3.496 2.325 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.147 -1.722 4.069 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.213 -2.922 3.339 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.809 -2.033 4.211 1.00 0.00 C ATOM 0 H PHE A 73 13.040 -3.695 2.975 1.00 0.00 H new ATOM 0 HA PHE A 73 11.550 -5.855 1.597 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.669 -3.041 0.556 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.425 -4.255 0.337 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.930 -2.050 2.945 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.484 -4.189 1.644 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.616 -1.029 4.751 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.167 -3.169 3.449 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.230 -1.582 5.003 1.00 0.00 H new ATOM 1191 N LEU A 74 14.244 -4.173 0.758 1.00 0.00 N ATOM 1192 CA LEU A 74 15.421 -4.190 -0.103 1.00 0.00 C ATOM 1193 C LEU A 74 16.427 -5.234 0.369 1.00 0.00 C ATOM 1194 O LEU A 74 17.600 -5.192 -0.001 1.00 0.00 O ATOM 1195 CB LEU A 74 16.077 -2.808 -0.130 1.00 0.00 C ATOM 1196 CG LEU A 74 15.130 -1.619 -0.298 1.00 0.00 C ATOM 1197 CD1 LEU A 74 15.905 -0.311 -0.256 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.350 -1.738 -1.598 1.00 0.00 C ATOM 0 H LEU A 74 14.265 -3.460 1.487 1.00 0.00 H new ATOM 0 HA LEU A 74 15.099 -4.453 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.635 -2.674 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.802 -2.788 -0.944 1.00 0.00 H new ATOM 0 HG LEU A 74 14.420 -1.624 0.529 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.216 0.524 -0.377 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.418 -0.222 0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.638 -0.296 -1.063 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.681 -0.883 -1.701 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.044 -1.759 -2.438 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.765 -2.657 -1.588 1.00 0.00 H new ATOM 1210 N ALA A 75 15.960 -6.171 1.187 1.00 0.00 N ATOM 1211 CA ALA A 75 16.817 -7.229 1.707 1.00 0.00 C ATOM 1212 C ALA A 75 16.362 -8.598 1.213 1.00 0.00 C ATOM 1213 O ALA A 75 15.179 -8.834 0.968 1.00 0.00 O ATOM 1214 CB ALA A 75 16.836 -7.194 3.228 1.00 0.00 C ATOM 0 H ALA A 75 14.992 -6.219 1.504 1.00 0.00 H new ATOM 0 HA ALA A 75 17.828 -7.057 1.338 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.480 -7.990 3.602 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.217 -6.230 3.565 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.824 -7.337 3.608 1.00 0.00 H new ATOM 1220 N PRO A 76 17.321 -9.522 1.061 1.00 0.00 N ATOM 1221 CA PRO A 76 17.042 -10.884 0.594 1.00 0.00 C ATOM 1222 C PRO A 76 16.278 -11.705 1.626 1.00 0.00 C ATOM 1223 O PRO A 76 15.230 -12.276 1.328 1.00 0.00 O ATOM 1224 CB PRO A 76 18.436 -11.474 0.367 1.00 0.00 C ATOM 1225 CG PRO A 76 19.328 -10.698 1.274 1.00 0.00 C ATOM 1226 CD PRO A 76 18.753 -9.310 1.333 1.00 0.00 C ATOM 0 HA PRO A 76 16.412 -10.889 -0.296 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.459 -12.538 0.604 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.744 -11.372 -0.674 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.363 -11.148 2.266 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.350 -10.681 0.895 1.00 0.00 H new ATOM 0 HD2 PRO A 76 18.913 -8.850 2.308 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.210 -8.654 0.592 1.00 0.00 H new ATOM 1234 N GLY A 77 16.810 -11.760 2.844 1.00 0.00 N ATOM 1235 CA GLY A 77 16.164 -12.514 3.902 1.00 0.00 C ATOM 1236 C GLY A 77 15.172 -11.679 4.687 1.00 0.00 C ATOM 1237 O GLY A 77 15.132 -11.741 5.915 1.00 0.00 O ATOM 0 H GLY A 77 17.677 -11.296 3.116 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.650 -13.373 3.470 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.922 -12.905 4.580 1.00 0.00 H new ATOM 1241 N ALA A 78 14.369 -10.893 3.976 1.00 0.00 N ATOM 1242 CA ALA A 78 13.372 -10.042 4.613 1.00 0.00 C ATOM 1243 C ALA A 78 11.959 -10.481 4.245 1.00 0.00 C ATOM 1244 O ALA A 78 11.726 -11.096 3.204 1.00 0.00 O ATOM 1245 CB ALA A 78 13.594 -8.588 4.224 1.00 0.00 C ATOM 0 H ALA A 78 14.390 -10.828 2.958 1.00 0.00 H new ATOM 0 HA ALA A 78 13.484 -10.139 5.693 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.842 -7.963 4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.587 -8.273 4.544 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.512 -8.484 3.142 1.00 0.00 H new ATOM 1251 N PRO A 79 10.992 -10.159 5.117 1.00 0.00 N ATOM 1252 CA PRO A 79 9.585 -10.511 4.904 1.00 0.00 C ATOM 1253 C PRO A 79 8.956 -9.719 3.764 1.00 0.00 C ATOM 1254 O PRO A 79 8.356 -10.291 2.854 1.00 0.00 O ATOM 1255 CB PRO A 79 8.924 -10.148 6.236 1.00 0.00 C ATOM 1256 CG PRO A 79 9.800 -9.095 6.820 1.00 0.00 C ATOM 1257 CD PRO A 79 11.198 -9.427 6.377 1.00 0.00 C ATOM 0 HA PRO A 79 9.464 -11.557 4.623 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.909 -9.780 6.087 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.856 -11.015 6.893 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.505 -8.105 6.472 1.00 0.00 H new ATOM 0 HG3 PRO A 79 9.727 -9.086 7.908 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.796 -8.528 6.226 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.719 -10.036 7.115 1.00 0.00 H new ATOM 1265 N SER A 80 9.096 -8.398 3.818 1.00 0.00 N ATOM 1266 CA SER A 80 8.538 -7.526 2.791 1.00 0.00 C ATOM 1267 C SER A 80 9.505 -7.379 1.620 1.00 0.00 C ATOM 1268 O SER A 80 9.387 -6.453 0.817 1.00 0.00 O ATOM 1269 CB SER A 80 8.217 -6.151 3.379 1.00 0.00 C ATOM 1270 OG SER A 80 7.536 -6.271 4.616 1.00 0.00 O ATOM 0 H SER A 80 9.592 -7.908 4.563 1.00 0.00 H new ATOM 0 HA SER A 80 7.617 -7.980 2.424 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.140 -5.589 3.522 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.605 -5.586 2.677 1.00 0.00 H new ATOM 0 HG SER A 80 7.485 -5.393 5.048 1.00 0.00 H new ATOM 1276 N ALA A 81 10.460 -8.298 1.530 1.00 0.00 N ATOM 1277 CA ALA A 81 11.446 -8.272 0.457 1.00 0.00 C ATOM 1278 C ALA A 81 10.782 -8.026 -0.893 1.00 0.00 C ATOM 1279 O ALA A 81 10.112 -8.905 -1.435 1.00 0.00 O ATOM 1280 CB ALA A 81 12.232 -9.575 0.431 1.00 0.00 C ATOM 0 H ALA A 81 10.572 -9.070 2.187 1.00 0.00 H new ATOM 0 HA ALA A 81 12.134 -7.449 0.649 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.965 -9.542 -0.375 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.746 -9.709 1.383 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.549 -10.409 0.267 1.00 0.00 H new ATOM 1286 N ILE A 82 10.972 -6.825 -1.430 1.00 0.00 N ATOM 1287 CA ILE A 82 10.391 -6.465 -2.718 1.00 0.00 C ATOM 1288 C ILE A 82 11.356 -6.764 -3.860 1.00 0.00 C ATOM 1289 O ILE A 82 12.453 -7.275 -3.640 1.00 0.00 O ATOM 1290 CB ILE A 82 10.005 -4.975 -2.764 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.219 -4.101 -2.443 1.00 0.00 C ATOM 1292 CG2 ILE A 82 8.870 -4.691 -1.791 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.121 -2.700 -3.005 1.00 0.00 C ATOM 0 H ILE A 82 11.523 -6.086 -0.994 1.00 0.00 H new ATOM 0 HA ILE A 82 9.492 -7.069 -2.838 1.00 0.00 H new ATOM 0 HB ILE A 82 9.663 -4.735 -3.771 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.338 -4.042 -1.361 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.115 -4.580 -2.837 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.609 -3.634 -1.835 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.001 -5.291 -2.061 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.186 -4.944 -0.779 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.016 -2.138 -2.739 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.033 -2.749 -4.090 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.244 -2.203 -2.592 1.00 0.00 H new ATOM 1305 N ASN A 83 10.940 -6.439 -5.079 1.00 0.00 N ATOM 1306 CA ASN A 83 11.768 -6.672 -6.257 1.00 0.00 C ATOM 1307 C ASN A 83 11.870 -5.410 -7.108 1.00 0.00 C ATOM 1308 O ASN A 83 10.877 -4.716 -7.331 1.00 0.00 O ATOM 1309 CB ASN A 83 11.194 -7.819 -7.091 1.00 0.00 C ATOM 1310 CG ASN A 83 12.106 -8.212 -8.238 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.157 -8.817 -8.030 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.705 -7.868 -9.456 1.00 0.00 N ATOM 0 H ASN A 83 10.034 -6.013 -5.277 1.00 0.00 H new ATOM 0 HA ASN A 83 12.768 -6.943 -5.920 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.029 -8.684 -6.449 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.222 -7.526 -7.487 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.276 -8.105 -10.267 1.00 0.00 H new ATOM 0 HD22 ASN A 83 10.826 -7.367 -9.581 1.00 0.00 H new ATOM 1319 N LEU A 84 13.076 -5.120 -7.583 1.00 0.00 N ATOM 1320 CA LEU A 84 13.309 -3.942 -8.411 1.00 0.00 C ATOM 1321 C LEU A 84 14.081 -4.308 -9.675 1.00 0.00 C ATOM 1322 O LEU A 84 14.561 -5.433 -9.816 1.00 0.00 O ATOM 1323 CB LEU A 84 14.077 -2.881 -7.620 1.00 0.00 C ATOM 1324 CG LEU A 84 13.353 -2.291 -6.410 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.342 -1.614 -5.474 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.280 -1.309 -6.856 1.00 0.00 C ATOM 0 H LEU A 84 13.908 -5.684 -7.409 1.00 0.00 H new ATOM 0 HA LEU A 84 12.340 -3.537 -8.704 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.015 -3.319 -7.279 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.333 -2.066 -8.297 1.00 0.00 H new ATOM 0 HG LEU A 84 12.870 -3.104 -5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 84 13.808 -1.200 -4.619 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.073 -2.344 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.855 -0.812 -6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.775 -0.899 -5.981 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.741 -0.499 -7.422 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.554 -1.824 -7.485 1.00 0.00 H new ATOM 1338 N ASP A 85 14.197 -3.351 -10.589 1.00 0.00 N ATOM 1339 CA ASP A 85 14.913 -3.572 -11.840 1.00 0.00 C ATOM 1340 C ASP A 85 16.414 -3.689 -11.593 1.00 0.00 C ATOM 1341 O ASP A 85 16.901 -3.380 -10.505 1.00 0.00 O ATOM 1342 CB ASP A 85 14.633 -2.433 -12.821 1.00 0.00 C ATOM 1343 CG ASP A 85 15.100 -2.752 -14.228 1.00 0.00 C ATOM 1344 OD1 ASP A 85 14.317 -3.355 -14.991 1.00 0.00 O ATOM 1345 OD2 ASP A 85 16.249 -2.397 -14.565 1.00 0.00 O ATOM 0 H ASP A 85 13.805 -2.415 -10.487 1.00 0.00 H new ATOM 0 HA ASP A 85 14.559 -4.508 -12.272 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.563 -2.224 -12.835 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.130 -1.527 -12.473 1.00 0.00 H new ATOM 1350 N SER A 86 17.143 -4.140 -12.610 1.00 0.00 N ATOM 1351 CA SER A 86 18.588 -4.303 -12.501 1.00 0.00 C ATOM 1352 C SER A 86 19.279 -2.949 -12.373 1.00 0.00 C ATOM 1353 O SER A 86 20.181 -2.774 -11.553 1.00 0.00 O ATOM 1354 CB SER A 86 19.130 -5.051 -13.720 1.00 0.00 C ATOM 1355 OG SER A 86 20.542 -4.947 -13.796 1.00 0.00 O ATOM 0 H SER A 86 16.757 -4.399 -13.518 1.00 0.00 H new ATOM 0 HA SER A 86 18.797 -4.885 -11.603 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.842 -6.101 -13.664 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.683 -4.646 -14.628 1.00 0.00 H new ATOM 0 HG SER A 86 20.864 -5.435 -14.583 1.00 0.00 H new ATOM 1361 N LYS A 87 18.850 -1.992 -13.189 1.00 0.00 N ATOM 1362 CA LYS A 87 19.425 -0.653 -13.167 1.00 0.00 C ATOM 1363 C LYS A 87 19.038 0.085 -11.889 1.00 0.00 C ATOM 1364 O LYS A 87 19.868 0.752 -11.271 1.00 0.00 O ATOM 1365 CB LYS A 87 18.960 0.144 -14.389 1.00 0.00 C ATOM 1366 CG LYS A 87 17.481 0.488 -14.363 1.00 0.00 C ATOM 1367 CD LYS A 87 16.959 0.810 -15.754 1.00 0.00 C ATOM 1368 CE LYS A 87 15.481 1.168 -15.726 1.00 0.00 C ATOM 1369 NZ LYS A 87 14.615 -0.036 -15.859 1.00 0.00 N ATOM 0 H LYS A 87 18.105 -2.120 -13.874 1.00 0.00 H new ATOM 0 HA LYS A 87 20.510 -0.750 -13.195 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.538 1.066 -14.453 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.175 -0.430 -15.290 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.919 -0.348 -13.947 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.316 1.341 -13.705 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.527 1.640 -16.174 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.114 -0.047 -16.409 1.00 0.00 H new ATOM 0 HE2 LYS A 87 15.249 1.680 -14.792 1.00 0.00 H new ATOM 0 HE3 LYS A 87 15.261 1.865 -16.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.834 0.169 -16.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 15.178 -0.829 -16.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 14.227 -0.289 -14.928 1.00 0.00 H new ATOM 1383 N SER A 88 17.774 -0.040 -11.498 1.00 0.00 N ATOM 1384 CA SER A 88 17.277 0.616 -10.295 1.00 0.00 C ATOM 1385 C SER A 88 17.897 0.000 -9.045 1.00 0.00 C ATOM 1386 O SER A 88 18.609 0.670 -8.296 1.00 0.00 O ATOM 1387 CB SER A 88 15.752 0.515 -10.225 1.00 0.00 C ATOM 1388 OG SER A 88 15.140 1.367 -11.179 1.00 0.00 O ATOM 0 H SER A 88 17.075 -0.590 -11.997 1.00 0.00 H new ATOM 0 HA SER A 88 17.562 1.667 -10.341 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.444 -0.515 -10.403 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.412 0.781 -9.224 1.00 0.00 H new ATOM 0 HG SER A 88 14.167 1.340 -11.065 1.00 0.00 H new ATOM 1394 N TYR A 89 17.621 -1.281 -8.825 1.00 0.00 N ATOM 1395 CA TYR A 89 18.148 -1.989 -7.665 1.00 0.00 C ATOM 1396 C TYR A 89 19.613 -1.635 -7.431 1.00 0.00 C ATOM 1397 O TYR A 89 19.997 -1.220 -6.337 1.00 0.00 O ATOM 1398 CB TYR A 89 18.000 -3.500 -7.852 1.00 0.00 C ATOM 1399 CG TYR A 89 18.144 -4.286 -6.568 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.161 -4.238 -5.587 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.263 -5.075 -6.336 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.289 -4.954 -4.412 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.399 -5.796 -5.166 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.409 -5.732 -4.207 1.00 0.00 C ATOM 1405 OH TYR A 89 18.541 -6.447 -3.038 1.00 0.00 O ATOM 0 H TYR A 89 17.035 -1.850 -9.436 1.00 0.00 H new ATOM 0 HA TYR A 89 17.574 -1.681 -6.791 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.024 -3.710 -8.289 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.749 -3.845 -8.565 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.282 -3.631 -5.746 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.041 -5.126 -7.084 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.517 -4.905 -3.659 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.275 -6.406 -5.003 1.00 0.00 H new ATOM 0 HH TYR A 89 19.386 -6.944 -3.052 1.00 0.00 H new ATOM 1415 N ASP A 90 20.428 -1.802 -8.467 1.00 0.00 N ATOM 1416 CA ASP A 90 21.852 -1.500 -8.377 1.00 0.00 C ATOM 1417 C ASP A 90 22.076 -0.115 -7.779 1.00 0.00 C ATOM 1418 O ASP A 90 22.687 0.025 -6.719 1.00 0.00 O ATOM 1419 CB ASP A 90 22.501 -1.584 -9.759 1.00 0.00 C ATOM 1420 CG ASP A 90 23.960 -1.989 -9.689 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.681 -1.465 -8.814 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.382 -2.831 -10.510 1.00 0.00 O ATOM 0 H ASP A 90 20.127 -2.145 -9.379 1.00 0.00 H new ATOM 0 HA ASP A 90 22.315 -2.238 -7.722 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.956 -2.303 -10.370 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.419 -0.617 -10.255 1.00 0.00 H new ATOM 1427 N LYS A 91 21.580 0.908 -8.466 1.00 0.00 N ATOM 1428 CA LYS A 91 21.725 2.284 -8.004 1.00 0.00 C ATOM 1429 C LYS A 91 21.419 2.392 -6.514 1.00 0.00 C ATOM 1430 O LYS A 91 22.190 2.978 -5.752 1.00 0.00 O ATOM 1431 CB LYS A 91 20.798 3.210 -8.794 1.00 0.00 C ATOM 1432 CG LYS A 91 21.160 4.680 -8.675 1.00 0.00 C ATOM 1433 CD LYS A 91 22.131 5.105 -9.764 1.00 0.00 C ATOM 1434 CE LYS A 91 22.545 6.560 -9.604 1.00 0.00 C ATOM 1435 NZ LYS A 91 21.568 7.488 -10.238 1.00 0.00 N ATOM 0 H LYS A 91 21.073 0.810 -9.346 1.00 0.00 H new ATOM 0 HA LYS A 91 22.759 2.589 -8.168 1.00 0.00 H new ATOM 0 HB2 LYS A 91 20.821 2.923 -9.845 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.774 3.067 -8.447 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.255 5.285 -8.737 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.603 4.869 -7.697 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.015 4.468 -9.733 1.00 0.00 H new ATOM 0 HD3 LYS A 91 21.669 4.962 -10.741 1.00 0.00 H new ATOM 0 HE2 LYS A 91 22.636 6.797 -8.544 1.00 0.00 H new ATOM 0 HE3 LYS A 91 23.529 6.709 -10.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 21.886 8.469 -10.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.500 7.279 -11.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 20.635 7.365 -9.796 1.00 0.00 H new ATOM 1449 N THR A 92 20.291 1.823 -6.102 1.00 0.00 N ATOM 1450 CA THR A 92 19.884 1.855 -4.703 1.00 0.00 C ATOM 1451 C THR A 92 20.915 1.168 -3.815 1.00 0.00 C ATOM 1452 O THR A 92 21.472 1.782 -2.904 1.00 0.00 O ATOM 1453 CB THR A 92 18.515 1.178 -4.501 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.517 1.847 -5.280 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.115 1.194 -3.033 1.00 0.00 C ATOM 0 H THR A 92 19.642 1.334 -6.718 1.00 0.00 H new ATOM 0 HA THR A 92 19.807 2.905 -4.420 1.00 0.00 H new ATOM 0 HB THR A 92 18.595 0.141 -4.828 1.00 0.00 H new ATOM 0 HG1 THR A 92 16.691 1.320 -5.275 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.145 0.711 -2.915 1.00 0.00 H new ATOM 0 HG22 THR A 92 18.861 0.658 -2.447 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.051 2.225 -2.684 1.00 0.00 H new ATOM 1463 N THR A 93 21.165 -0.109 -4.085 1.00 0.00 N ATOM 1464 CA THR A 93 22.129 -0.879 -3.310 1.00 0.00 C ATOM 1465 C THR A 93 23.340 -0.031 -2.938 1.00 0.00 C ATOM 1466 O THR A 93 23.790 -0.042 -1.792 1.00 0.00 O ATOM 1467 CB THR A 93 22.606 -2.123 -4.083 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.479 -2.856 -4.575 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.453 -3.021 -3.194 1.00 0.00 C ATOM 0 H THR A 93 20.713 -0.632 -4.835 1.00 0.00 H new ATOM 0 HA THR A 93 21.620 -1.198 -2.401 1.00 0.00 H new ATOM 0 HB THR A 93 23.216 -1.790 -4.922 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.054 -2.354 -5.302 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.778 -3.893 -3.762 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.326 -2.469 -2.845 1.00 0.00 H new ATOM 0 HG23 THR A 93 22.863 -3.346 -2.337 1.00 0.00 H new ATOM 1477 N HIS A 94 23.863 0.706 -3.914 1.00 0.00 N ATOM 1478 CA HIS A 94 25.022 1.562 -3.688 1.00 0.00 C ATOM 1479 C HIS A 94 24.649 2.764 -2.825 1.00 0.00 C ATOM 1480 O HIS A 94 25.332 3.077 -1.851 1.00 0.00 O ATOM 1481 CB HIS A 94 25.599 2.036 -5.022 1.00 0.00 C ATOM 1482 CG HIS A 94 26.846 2.854 -4.878 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.846 2.549 -3.979 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.252 3.970 -5.526 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.813 3.443 -4.079 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.477 4.317 -5.012 1.00 0.00 N ATOM 0 H HIS A 94 23.502 0.727 -4.868 1.00 0.00 H new ATOM 0 HA HIS A 94 25.777 0.979 -3.161 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.814 1.168 -5.645 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.846 2.625 -5.545 1.00 0.00 H new ATOM 0 HD2 HIS A 94 26.713 4.491 -6.303 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.723 3.457 -3.498 1.00 0.00 H new ATOM 0 HE2 HIS A 94 29.037 5.119 -5.303 1.00 0.00 H new ATOM 1494 N ASN A 95 23.561 3.435 -3.191 1.00 0.00 N ATOM 1495 CA ASN A 95 23.099 4.603 -2.451 1.00 0.00 C ATOM 1496 C ASN A 95 22.937 4.280 -0.969 1.00 0.00 C ATOM 1497 O ASN A 95 23.285 5.085 -0.105 1.00 0.00 O ATOM 1498 CB ASN A 95 21.770 5.102 -3.024 1.00 0.00 C ATOM 1499 CG ASN A 95 21.926 5.704 -4.407 1.00 0.00 C ATOM 1500 OD1 ASN A 95 22.979 5.582 -5.034 1.00 0.00 O ATOM 1501 ND2 ASN A 95 20.876 6.359 -4.889 1.00 0.00 N ATOM 0 H ASN A 95 22.984 3.190 -3.995 1.00 0.00 H new ATOM 0 HA ASN A 95 23.849 5.387 -2.553 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.063 4.274 -3.069 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.345 5.848 -2.352 1.00 0.00 H new ATOM 0 HD21 ASN A 95 20.922 6.786 -5.814 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.024 6.435 -4.334 1.00 0.00 H new ATOM 1508 N VAL A 96 22.408 3.095 -0.682 1.00 0.00 N ATOM 1509 CA VAL A 96 22.202 2.663 0.696 1.00 0.00 C ATOM 1510 C VAL A 96 23.422 2.973 1.557 1.00 0.00 C ATOM 1511 O VAL A 96 23.320 3.662 2.572 1.00 0.00 O ATOM 1512 CB VAL A 96 21.903 1.154 0.772 1.00 0.00 C ATOM 1513 CG1 VAL A 96 21.802 0.703 2.221 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.626 0.826 0.013 1.00 0.00 C ATOM 0 H VAL A 96 22.114 2.417 -1.385 1.00 0.00 H new ATOM 0 HA VAL A 96 21.343 3.215 1.076 1.00 0.00 H new ATOM 0 HB VAL A 96 22.726 0.613 0.304 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.590 -0.366 2.256 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.744 0.903 2.731 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.999 1.248 2.717 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.430 -0.244 0.077 1.00 0.00 H new ATOM 0 HG22 VAL A 96 19.792 1.375 0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.740 1.112 -1.033 1.00 0.00 H new ATOM 1524 N LYS A 97 24.575 2.459 1.145 1.00 0.00 N ATOM 1525 CA LYS A 97 25.817 2.681 1.876 1.00 0.00 C ATOM 1526 C LYS A 97 25.843 4.076 2.493 1.00 0.00 C ATOM 1527 O LYS A 97 26.356 4.267 3.595 1.00 0.00 O ATOM 1528 CB LYS A 97 27.020 2.499 0.948 1.00 0.00 C ATOM 1529 CG LYS A 97 27.527 1.069 0.882 1.00 0.00 C ATOM 1530 CD LYS A 97 26.712 0.232 -0.089 1.00 0.00 C ATOM 1531 CE LYS A 97 25.558 -0.469 0.612 1.00 0.00 C ATOM 1532 NZ LYS A 97 26.036 -1.526 1.546 1.00 0.00 N ATOM 0 H LYS A 97 24.676 1.885 0.308 1.00 0.00 H new ATOM 0 HA LYS A 97 25.872 1.946 2.679 1.00 0.00 H new ATOM 0 HB2 LYS A 97 26.747 2.825 -0.055 1.00 0.00 H new ATOM 0 HB3 LYS A 97 27.829 3.147 1.285 1.00 0.00 H new ATOM 0 HG2 LYS A 97 28.573 1.067 0.576 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.484 0.621 1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 97 26.323 0.869 -0.883 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.356 -0.509 -0.562 1.00 0.00 H new ATOM 0 HE2 LYS A 97 24.969 0.264 1.164 1.00 0.00 H new ATOM 0 HE3 LYS A 97 24.897 -0.914 -0.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 25.278 -2.221 1.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 26.864 -2.003 1.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 26.300 -1.093 2.454 1.00 0.00 H new ATOM 1546 N GLU A 98 25.287 5.046 1.774 1.00 0.00 N ATOM 1547 CA GLU A 98 25.247 6.423 2.253 1.00 0.00 C ATOM 1548 C GLU A 98 23.920 6.720 2.944 1.00 0.00 C ATOM 1549 O GLU A 98 22.878 6.868 2.306 1.00 0.00 O ATOM 1550 CB GLU A 98 25.459 7.396 1.091 1.00 0.00 C ATOM 1551 CG GLU A 98 26.656 7.053 0.220 1.00 0.00 C ATOM 1552 CD GLU A 98 27.241 8.269 -0.472 1.00 0.00 C ATOM 1553 OE1 GLU A 98 26.470 9.024 -1.099 1.00 0.00 O ATOM 1554 OE2 GLU A 98 28.471 8.465 -0.385 1.00 0.00 O ATOM 0 H GLU A 98 24.859 4.904 0.859 1.00 0.00 H new ATOM 0 HA GLU A 98 26.051 6.553 2.978 1.00 0.00 H new ATOM 0 HB2 GLU A 98 24.562 7.410 0.472 1.00 0.00 H new ATOM 0 HB3 GLU A 98 25.587 8.402 1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 98 27.425 6.584 0.834 1.00 0.00 H new ATOM 0 HG3 GLU A 98 26.357 6.321 -0.530 1.00 0.00 H new ATOM 1561 N PRO A 99 23.958 6.810 4.282 1.00 0.00 N ATOM 1562 CA PRO A 99 22.767 7.090 5.091 1.00 0.00 C ATOM 1563 C PRO A 99 22.268 8.519 4.912 1.00 0.00 C ATOM 1564 O PRO A 99 22.945 9.475 5.289 1.00 0.00 O ATOM 1565 CB PRO A 99 23.253 6.869 6.525 1.00 0.00 C ATOM 1566 CG PRO A 99 24.722 7.107 6.469 1.00 0.00 C ATOM 1567 CD PRO A 99 25.165 6.644 5.109 1.00 0.00 C ATOM 0 HA PRO A 99 21.925 6.458 4.810 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.767 7.556 7.218 1.00 0.00 H new ATOM 0 HB3 PRO A 99 23.029 5.859 6.868 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.952 8.162 6.616 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.237 6.556 7.256 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.995 7.241 4.732 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.500 5.607 5.127 1.00 0.00 H new ATOM 1575 N GLY A 100 21.079 8.658 4.333 1.00 0.00 N ATOM 1576 CA GLY A 100 20.510 9.975 4.115 1.00 0.00 C ATOM 1577 C GLY A 100 19.012 10.005 4.343 1.00 0.00 C ATOM 1578 O GLY A 100 18.484 9.232 5.143 1.00 0.00 O ATOM 0 H GLY A 100 20.500 7.882 4.011 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.990 10.690 4.783 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.726 10.296 3.096 1.00 0.00 H new ATOM 1582 N ARG A 101 18.325 10.899 3.640 1.00 0.00 N ATOM 1583 CA ARG A 101 16.879 11.027 3.772 1.00 0.00 C ATOM 1584 C ARG A 101 16.179 10.677 2.462 1.00 0.00 C ATOM 1585 O ARG A 101 15.104 10.078 2.461 1.00 0.00 O ATOM 1586 CB ARG A 101 16.508 12.450 4.196 1.00 0.00 C ATOM 1587 CG ARG A 101 17.126 12.871 5.519 1.00 0.00 C ATOM 1588 CD ARG A 101 17.221 14.385 5.633 1.00 0.00 C ATOM 1589 NE ARG A 101 18.364 14.918 4.896 1.00 0.00 N ATOM 1590 CZ ARG A 101 18.885 16.120 5.116 1.00 0.00 C ATOM 1591 NH1 ARG A 101 18.369 16.909 6.048 1.00 0.00 N ATOM 1592 NH2 ARG A 101 19.925 16.534 4.404 1.00 0.00 N ATOM 0 H ARG A 101 18.747 11.545 2.973 1.00 0.00 H new ATOM 0 HA ARG A 101 16.547 10.328 4.539 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.824 13.146 3.419 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.423 12.527 4.270 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.528 12.480 6.342 1.00 0.00 H new ATOM 0 HG3 ARG A 101 18.121 12.435 5.612 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.303 14.835 5.254 1.00 0.00 H new ATOM 0 HD3 ARG A 101 17.304 14.665 6.683 1.00 0.00 H new ATOM 0 HE ARG A 101 18.785 14.335 4.173 1.00 0.00 H new ATOM 0 HH11 ARG A 101 17.570 16.594 6.598 1.00 0.00 H new ATOM 0 HH12 ARG A 101 18.771 17.831 6.215 1.00 0.00 H new ATOM 0 HH21 ARG A 101 20.325 15.929 3.687 1.00 0.00 H new ATOM 0 HH22 ARG A 101 20.324 17.457 4.574 1.00 0.00 H new ATOM 1606 N TYR A 102 16.797 11.056 1.349 1.00 0.00 N ATOM 1607 CA TYR A 102 16.233 10.785 0.032 1.00 0.00 C ATOM 1608 C TYR A 102 17.050 9.727 -0.704 1.00 0.00 C ATOM 1609 O TYR A 102 16.953 9.587 -1.924 1.00 0.00 O ATOM 1610 CB TYR A 102 16.176 12.070 -0.797 1.00 0.00 C ATOM 1611 CG TYR A 102 15.279 13.133 -0.205 1.00 0.00 C ATOM 1612 CD1 TYR A 102 15.613 13.768 0.985 1.00 0.00 C ATOM 1613 CD2 TYR A 102 14.096 13.501 -0.834 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.796 14.740 1.530 1.00 0.00 C ATOM 1615 CE2 TYR A 102 13.274 14.472 -0.298 1.00 0.00 C ATOM 1616 CZ TYR A 102 13.627 15.089 0.884 1.00 0.00 C ATOM 1617 OH TYR A 102 12.810 16.056 1.423 1.00 0.00 O ATOM 0 H TYR A 102 17.688 11.552 1.332 1.00 0.00 H new ATOM 0 HA TYR A 102 15.221 10.405 0.170 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.184 12.472 -0.898 1.00 0.00 H new ATOM 0 HB3 TYR A 102 15.827 11.829 -1.801 1.00 0.00 H new ATOM 0 HD1 TYR A 102 16.527 13.497 1.493 1.00 0.00 H new ATOM 0 HD2 TYR A 102 13.815 13.019 -1.759 1.00 0.00 H new ATOM 0 HE1 TYR A 102 15.070 15.224 2.456 1.00 0.00 H new ATOM 0 HE2 TYR A 102 12.359 14.747 -0.802 1.00 0.00 H new ATOM 0 HH TYR A 102 12.029 16.184 0.845 1.00 0.00 H new ATOM 1627 N THR A 103 17.857 8.984 0.047 1.00 0.00 N ATOM 1628 CA THR A 103 18.693 7.940 -0.532 1.00 0.00 C ATOM 1629 C THR A 103 17.858 6.952 -1.339 1.00 0.00 C ATOM 1630 O THR A 103 18.318 6.413 -2.346 1.00 0.00 O ATOM 1631 CB THR A 103 19.466 7.172 0.557 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.294 8.074 1.299 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.325 6.078 -0.060 1.00 0.00 C ATOM 0 H THR A 103 17.949 9.086 1.058 1.00 0.00 H new ATOM 0 HA THR A 103 19.405 8.434 -1.193 1.00 0.00 H new ATOM 0 HB THR A 103 18.742 6.709 1.228 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.099 7.604 1.603 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.862 5.549 0.728 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.689 5.377 -0.600 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.041 6.524 -0.751 1.00 0.00 H new ATOM 1641 N PHE A 104 16.628 6.720 -0.891 1.00 0.00 N ATOM 1642 CA PHE A 104 15.729 5.796 -1.573 1.00 0.00 C ATOM 1643 C PHE A 104 14.750 6.550 -2.467 1.00 0.00 C ATOM 1644 O PHE A 104 13.717 6.013 -2.866 1.00 0.00 O ATOM 1645 CB PHE A 104 14.960 4.954 -0.553 1.00 0.00 C ATOM 1646 CG PHE A 104 15.840 4.321 0.488 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.276 5.052 1.582 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.231 2.997 0.372 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.086 4.472 2.540 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.040 2.412 1.327 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.468 3.151 2.413 1.00 0.00 C ATOM 0 H PHE A 104 16.232 7.159 -0.060 1.00 0.00 H new ATOM 0 HA PHE A 104 16.331 5.137 -2.198 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.220 5.583 -0.058 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.412 4.172 -1.079 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.980 6.085 1.687 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.899 2.415 -0.475 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.420 5.052 3.388 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.337 1.379 1.225 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.100 2.696 3.161 1.00 0.00 H new ATOM 1661 N GLU A 105 15.083 7.799 -2.777 1.00 0.00 N ATOM 1662 CA GLU A 105 14.232 8.628 -3.623 1.00 0.00 C ATOM 1663 C GLU A 105 13.901 7.912 -4.929 1.00 0.00 C ATOM 1664 O GLU A 105 12.733 7.773 -5.294 1.00 0.00 O ATOM 1665 CB GLU A 105 14.917 9.964 -3.921 1.00 0.00 C ATOM 1666 CG GLU A 105 14.014 10.970 -4.613 1.00 0.00 C ATOM 1667 CD GLU A 105 14.718 12.280 -4.908 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.581 12.686 -4.101 1.00 0.00 O ATOM 1669 OE2 GLU A 105 14.406 12.900 -5.947 1.00 0.00 O ATOM 0 H GLU A 105 15.935 8.259 -2.456 1.00 0.00 H new ATOM 0 HA GLU A 105 13.303 8.816 -3.086 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.277 10.394 -2.987 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.791 9.783 -4.546 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.646 10.541 -5.545 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.144 11.163 -3.986 1.00 0.00 H new ATOM 1676 N ASP A 106 14.936 7.461 -5.629 1.00 0.00 N ATOM 1677 CA ASP A 106 14.756 6.759 -6.894 1.00 0.00 C ATOM 1678 C ASP A 106 13.797 5.584 -6.732 1.00 0.00 C ATOM 1679 O ASP A 106 12.746 5.536 -7.371 1.00 0.00 O ATOM 1680 CB ASP A 106 16.103 6.264 -7.424 1.00 0.00 C ATOM 1681 CG ASP A 106 17.162 7.350 -7.416 1.00 0.00 C ATOM 1682 OD1 ASP A 106 16.806 8.526 -7.636 1.00 0.00 O ATOM 1683 OD2 ASP A 106 18.346 7.022 -7.192 1.00 0.00 O ATOM 0 H ASP A 106 15.909 7.569 -5.342 1.00 0.00 H new ATOM 0 HA ASP A 106 14.327 7.459 -7.611 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.443 5.425 -6.817 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.976 5.892 -8.441 1.00 0.00 H new ATOM 1688 N ALA A 107 14.167 4.638 -5.875 1.00 0.00 N ATOM 1689 CA ALA A 107 13.339 3.464 -5.629 1.00 0.00 C ATOM 1690 C ALA A 107 11.883 3.857 -5.403 1.00 0.00 C ATOM 1691 O ALA A 107 10.996 3.436 -6.144 1.00 0.00 O ATOM 1692 CB ALA A 107 13.869 2.686 -4.434 1.00 0.00 C ATOM 0 H ALA A 107 15.035 4.662 -5.340 1.00 0.00 H new ATOM 0 HA ALA A 107 13.383 2.827 -6.512 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.241 1.812 -4.262 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.891 2.365 -4.633 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.855 3.323 -3.550 1.00 0.00 H new ATOM 1698 N GLN A 108 11.646 4.665 -4.375 1.00 0.00 N ATOM 1699 CA GLN A 108 10.296 5.112 -4.051 1.00 0.00 C ATOM 1700 C GLN A 108 9.509 5.428 -5.319 1.00 0.00 C ATOM 1701 O GLN A 108 8.319 5.129 -5.411 1.00 0.00 O ATOM 1702 CB GLN A 108 10.348 6.346 -3.149 1.00 0.00 C ATOM 1703 CG GLN A 108 8.988 6.769 -2.617 1.00 0.00 C ATOM 1704 CD GLN A 108 9.081 7.891 -1.602 1.00 0.00 C ATOM 1705 OE1 GLN A 108 9.945 8.762 -1.700 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.188 7.876 -0.619 1.00 0.00 N ATOM 0 H GLN A 108 12.370 5.023 -3.753 1.00 0.00 H new ATOM 0 HA GLN A 108 9.790 4.305 -3.522 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.011 6.143 -2.308 1.00 0.00 H new ATOM 0 HB3 GLN A 108 10.785 7.175 -3.706 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.360 7.088 -3.449 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.498 5.910 -2.159 1.00 0.00 H new ATOM 0 HE21 GLN A 108 7.489 7.134 -0.576 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.201 8.606 0.093 1.00 0.00 H new ATOM 1715 N GLU A 109 10.181 6.033 -6.292 1.00 0.00 N ATOM 1716 CA GLU A 109 9.543 6.390 -7.554 1.00 0.00 C ATOM 1717 C GLU A 109 9.282 5.148 -8.401 1.00 0.00 C ATOM 1718 O GLU A 109 8.230 5.020 -9.028 1.00 0.00 O ATOM 1719 CB GLU A 109 10.415 7.377 -8.331 1.00 0.00 C ATOM 1720 CG GLU A 109 10.087 7.443 -9.814 1.00 0.00 C ATOM 1721 CD GLU A 109 10.908 8.486 -10.547 1.00 0.00 C ATOM 1722 OE1 GLU A 109 10.924 9.651 -10.097 1.00 0.00 O ATOM 1723 OE2 GLU A 109 11.534 8.138 -11.570 1.00 0.00 O ATOM 0 H GLU A 109 11.167 6.287 -6.231 1.00 0.00 H new ATOM 0 HA GLU A 109 8.587 6.862 -7.328 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.299 8.370 -7.897 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.461 7.097 -8.211 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.262 6.466 -10.265 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.027 7.667 -9.938 1.00 0.00 H new ATOM 1730 N HIS A 110 10.248 4.235 -8.416 1.00 0.00 N ATOM 1731 CA HIS A 110 10.123 3.003 -9.186 1.00 0.00 C ATOM 1732 C HIS A 110 8.891 2.214 -8.754 1.00 0.00 C ATOM 1733 O HIS A 110 8.062 1.837 -9.583 1.00 0.00 O ATOM 1734 CB HIS A 110 11.377 2.143 -9.020 1.00 0.00 C ATOM 1735 CG HIS A 110 11.491 1.047 -10.034 1.00 0.00 C ATOM 1736 ND1 HIS A 110 12.168 1.193 -11.227 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.011 -0.218 -10.028 1.00 0.00 C ATOM 1738 CE1 HIS A 110 12.098 0.065 -11.911 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.402 -0.808 -11.205 1.00 0.00 N ATOM 0 H HIS A 110 11.125 4.325 -7.904 1.00 0.00 H new ATOM 0 HA HIS A 110 10.011 3.271 -10.237 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.257 2.782 -9.088 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.377 1.705 -8.022 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.429 -0.678 -9.244 1.00 0.00 H new ATOM 0 HE1 HIS A 110 12.535 -0.113 -12.882 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.190 -1.765 -11.488 1.00 0.00 H new ATOM 1747 N ILE A 111 8.778 1.968 -7.454 1.00 0.00 N ATOM 1748 CA ILE A 111 7.647 1.224 -6.913 1.00 0.00 C ATOM 1749 C ILE A 111 6.334 1.956 -7.171 1.00 0.00 C ATOM 1750 O ILE A 111 5.332 1.344 -7.540 1.00 0.00 O ATOM 1751 CB ILE A 111 7.801 0.988 -5.399 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.060 0.167 -5.114 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.569 0.287 -4.844 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.160 -1.094 -5.944 1.00 0.00 C ATOM 0 H ILE A 111 9.456 2.273 -6.755 1.00 0.00 H new ATOM 0 HA ILE A 111 7.630 0.261 -7.423 1.00 0.00 H new ATOM 0 HB ILE A 111 7.900 1.954 -4.904 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.938 0.786 -5.301 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.078 -0.101 -4.058 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.693 0.127 -3.773 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.689 0.905 -5.019 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.442 -0.674 -5.342 1.00 0.00 H new ATOM 0 HD11 ILE A 111 10.077 -1.626 -5.689 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.301 -1.733 -5.739 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.174 -0.833 -7.002 1.00 0.00 H new ATOM 1766 N TYR A 112 6.348 3.270 -6.976 1.00 0.00 N ATOM 1767 CA TYR A 112 5.158 4.086 -7.186 1.00 0.00 C ATOM 1768 C TYR A 112 4.593 3.874 -8.587 1.00 0.00 C ATOM 1769 O TYR A 112 3.434 3.491 -8.751 1.00 0.00 O ATOM 1770 CB TYR A 112 5.485 5.566 -6.976 1.00 0.00 C ATOM 1771 CG TYR A 112 4.378 6.499 -7.412 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.145 6.750 -8.758 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.565 7.128 -6.477 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.135 7.603 -9.161 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.552 7.981 -6.871 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.342 8.216 -8.214 1.00 0.00 C ATOM 1777 OH TYR A 112 1.334 9.064 -8.612 1.00 0.00 O ATOM 0 H TYR A 112 7.170 3.793 -6.673 1.00 0.00 H new ATOM 0 HA TYR A 112 4.406 3.780 -6.459 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.697 5.736 -5.921 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.393 5.811 -7.527 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.764 6.271 -9.502 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.728 6.947 -5.425 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.968 7.788 -10.212 1.00 0.00 H new ATOM 0 HE2 TYR A 112 1.928 8.461 -6.132 1.00 0.00 H new ATOM 0 HH TYR A 112 0.488 8.572 -8.648 1.00 0.00 H new ATOM 1787 N LYS A 113 5.420 4.124 -9.596 1.00 0.00 N ATOM 1788 CA LYS A 113 5.006 3.960 -10.985 1.00 0.00 C ATOM 1789 C LYS A 113 4.494 2.545 -11.235 1.00 0.00 C ATOM 1790 O LYS A 113 3.826 2.284 -12.237 1.00 0.00 O ATOM 1791 CB LYS A 113 6.173 4.265 -11.926 1.00 0.00 C ATOM 1792 CG LYS A 113 6.771 5.647 -11.726 1.00 0.00 C ATOM 1793 CD LYS A 113 8.045 5.826 -12.533 1.00 0.00 C ATOM 1794 CE LYS A 113 9.129 4.857 -12.087 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.435 5.146 -12.740 1.00 0.00 N ATOM 0 H LYS A 113 6.382 4.441 -9.478 1.00 0.00 H new ATOM 0 HA LYS A 113 4.196 4.662 -11.182 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.952 3.517 -11.780 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.831 4.172 -12.957 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.044 6.405 -12.019 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.984 5.802 -10.668 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.831 5.673 -13.591 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.404 6.850 -12.426 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.244 4.914 -11.005 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.823 3.837 -12.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.120 4.405 -12.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.310 5.167 -13.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.789 6.068 -12.415 1.00 0.00 H new ATOM 1809 N LEU A 114 4.809 1.636 -10.319 1.00 0.00 N ATOM 1810 CA LEU A 114 4.379 0.247 -10.440 1.00 0.00 C ATOM 1811 C LEU A 114 3.035 0.031 -9.752 1.00 0.00 C ATOM 1812 O LEU A 114 2.009 -0.137 -10.411 1.00 0.00 O ATOM 1813 CB LEU A 114 5.430 -0.687 -9.838 1.00 0.00 C ATOM 1814 CG LEU A 114 4.922 -2.046 -9.355 1.00 0.00 C ATOM 1815 CD1 LEU A 114 5.055 -3.088 -10.455 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.675 -2.486 -8.108 1.00 0.00 C ATOM 0 H LEU A 114 5.360 1.835 -9.484 1.00 0.00 H new ATOM 0 HA LEU A 114 4.264 0.019 -11.500 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.207 -0.856 -10.584 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.901 -0.178 -8.997 1.00 0.00 H new ATOM 0 HG LEU A 114 3.866 -1.947 -9.102 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.689 -4.048 -10.093 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.469 -2.780 -11.321 1.00 0.00 H new ATOM 0 HD13 LEU A 114 6.103 -3.184 -10.741 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.300 -3.455 -7.779 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.738 -2.567 -8.334 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.527 -1.752 -7.316 1.00 0.00 H new ATOM 1828 N MET A 115 3.049 0.038 -8.423 1.00 0.00 N ATOM 1829 CA MET A 115 1.830 -0.153 -7.646 1.00 0.00 C ATOM 1830 C MET A 115 0.663 0.606 -8.269 1.00 0.00 C ATOM 1831 O MET A 115 -0.447 0.083 -8.373 1.00 0.00 O ATOM 1832 CB MET A 115 2.042 0.309 -6.203 1.00 0.00 C ATOM 1833 CG MET A 115 3.220 -0.364 -5.516 1.00 0.00 C ATOM 1834 SD MET A 115 3.509 0.270 -3.853 1.00 0.00 S ATOM 1835 CE MET A 115 3.585 2.031 -4.171 1.00 0.00 C ATOM 0 H MET A 115 3.890 0.174 -7.862 1.00 0.00 H new ATOM 0 HA MET A 115 1.591 -1.216 -7.648 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.195 1.388 -6.194 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.136 0.111 -5.630 1.00 0.00 H new ATOM 0 HG2 MET A 115 3.041 -1.438 -5.465 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.118 -0.219 -6.117 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.552 2.418 -3.849 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.459 2.214 -5.238 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.791 2.535 -3.620 1.00 0.00 H new ATOM 1845 N LYS A 116 0.920 1.843 -8.681 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.109 2.674 -9.295 1.00 0.00 C ATOM 1847 C LYS A 116 -0.952 1.863 -10.273 1.00 0.00 C ATOM 1848 O LYS A 116 -2.181 1.938 -10.257 1.00 0.00 O ATOM 1849 CB LYS A 116 0.531 3.861 -10.019 1.00 0.00 C ATOM 1850 CG LYS A 116 1.383 3.459 -11.211 1.00 0.00 C ATOM 1851 CD LYS A 116 1.927 4.675 -11.943 1.00 0.00 C ATOM 1852 CE LYS A 116 0.883 5.282 -12.868 1.00 0.00 C ATOM 1853 NZ LYS A 116 1.503 5.895 -14.075 1.00 0.00 N ATOM 0 H LYS A 116 1.832 2.292 -8.601 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.760 3.046 -8.504 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.255 4.537 -10.356 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.148 4.417 -9.313 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.211 2.836 -10.874 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.789 2.856 -11.897 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.251 5.422 -11.219 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.806 4.390 -12.522 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.176 4.511 -13.174 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.314 6.039 -12.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.760 6.298 -14.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.158 6.648 -13.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.025 5.168 -14.605 1.00 0.00 H new ATOM 1867 N SER A 117 -0.285 1.089 -11.122 1.00 0.00 N ATOM 1868 CA SER A 117 -0.974 0.265 -12.109 1.00 0.00 C ATOM 1869 C SER A 117 -0.707 -1.216 -11.862 1.00 0.00 C ATOM 1870 O SER A 117 -0.918 -2.052 -12.741 1.00 0.00 O ATOM 1871 CB SER A 117 -0.529 0.646 -13.522 1.00 0.00 C ATOM 1872 OG SER A 117 -1.260 -0.075 -14.499 1.00 0.00 O ATOM 0 H SER A 117 0.732 1.015 -11.147 1.00 0.00 H new ATOM 0 HA SER A 117 -2.045 0.444 -12.012 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.669 1.716 -13.675 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.536 0.444 -13.638 1.00 0.00 H new ATOM 0 HG SER A 117 -1.377 -1.002 -14.202 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.241 -1.534 -10.659 1.00 0.00 N ATOM 1879 CA ASP A 118 0.055 -2.915 -10.294 1.00 0.00 C ATOM 1880 C ASP A 118 -1.094 -3.524 -9.496 1.00 0.00 C ATOM 1881 O ASP A 118 -1.748 -4.463 -9.949 1.00 0.00 O ATOM 1882 CB ASP A 118 1.349 -2.984 -9.482 1.00 0.00 C ATOM 1883 CG ASP A 118 2.099 -4.284 -9.699 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.804 -4.398 -10.723 1.00 0.00 O ATOM 1885 OD2 ASP A 118 1.981 -5.187 -8.845 1.00 0.00 O ATOM 0 H ASP A 118 -0.060 -0.854 -9.920 1.00 0.00 H new ATOM 0 HA ASP A 118 0.180 -3.489 -11.212 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.991 -2.147 -9.756 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.116 -2.874 -8.423 1.00 0.00 H new ATOM 1890 N SER A 119 -1.333 -2.983 -8.305 1.00 0.00 N ATOM 1891 CA SER A 119 -2.400 -3.477 -7.442 1.00 0.00 C ATOM 1892 C SER A 119 -3.652 -2.616 -7.580 1.00 0.00 C ATOM 1893 O SER A 119 -4.745 -3.126 -7.827 1.00 0.00 O ATOM 1894 CB SER A 119 -1.937 -3.494 -5.984 1.00 0.00 C ATOM 1895 OG SER A 119 -2.560 -4.543 -5.263 1.00 0.00 O ATOM 0 H SER A 119 -0.803 -2.203 -7.916 1.00 0.00 H new ATOM 0 HA SER A 119 -2.643 -4.494 -7.751 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.854 -3.614 -5.944 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.169 -2.538 -5.514 1.00 0.00 H new ATOM 0 HG SER A 119 -1.880 -5.179 -4.957 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.484 -1.308 -7.418 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.600 -0.376 -7.522 1.00 0.00 C ATOM 1903 C TYR A 120 -5.624 -0.863 -8.543 1.00 0.00 C ATOM 1904 O TYR A 120 -6.822 -0.939 -8.271 1.00 0.00 O ATOM 1905 CB TYR A 120 -4.096 1.014 -7.913 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.776 2.138 -7.163 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -4.482 2.387 -5.829 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.712 2.950 -7.791 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -5.101 3.412 -5.140 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.336 3.979 -7.110 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.027 4.205 -5.785 1.00 0.00 C ATOM 1912 OH TYR A 120 -6.646 5.228 -5.103 1.00 0.00 O ATOM 0 H TYR A 120 -2.586 -0.870 -7.214 1.00 0.00 H new ATOM 0 HA TYR A 120 -5.084 -0.319 -6.547 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.022 1.066 -7.733 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -4.247 1.159 -8.983 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -3.757 1.769 -5.321 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.956 2.775 -8.828 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -4.861 3.591 -4.102 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -7.061 4.602 -7.613 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.767 5.994 -5.702 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.142 -1.202 -9.748 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.997 -1.689 -10.834 1.00 0.00 C ATOM 1924 C PRO A 121 -6.953 -2.784 -10.373 1.00 0.00 C ATOM 1925 O PRO A 121 -8.172 -2.636 -10.465 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.996 -2.246 -11.850 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.738 -1.489 -11.597 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.724 -1.136 -10.142 1.00 0.00 C ATOM 0 HA PRO A 121 -6.638 -0.902 -11.233 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.848 -3.317 -11.713 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.347 -2.101 -12.872 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.867 -2.091 -11.856 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.699 -0.590 -12.212 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.117 -1.835 -9.567 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.309 -0.142 -9.976 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.393 -3.882 -9.876 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.197 -5.001 -9.401 1.00 0.00 C ATOM 1938 C ARG A 122 -7.969 -4.621 -8.141 1.00 0.00 C ATOM 1939 O ARG A 122 -9.151 -4.935 -8.006 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.306 -6.213 -9.120 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.806 -6.906 -10.377 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.835 -8.028 -10.045 1.00 0.00 C ATOM 1943 NE ARG A 122 -5.528 -9.259 -9.674 1.00 0.00 N ATOM 1944 CZ ARG A 122 -5.853 -9.572 -8.424 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -5.549 -8.747 -7.431 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -6.483 -10.710 -8.166 1.00 0.00 N ATOM 0 H ARG A 122 -5.386 -4.020 -9.792 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.914 -5.258 -10.181 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.449 -5.894 -8.526 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.862 -6.930 -8.517 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.653 -7.309 -10.933 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -5.316 -6.179 -11.024 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.193 -8.218 -10.905 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -4.187 -7.716 -9.226 1.00 0.00 H new ATOM 0 HE ARG A 122 -5.776 -9.914 -10.415 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -5.065 -7.871 -7.626 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -5.799 -8.989 -6.472 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.719 -11.346 -8.927 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -6.732 -10.949 -7.206 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.291 -3.943 -7.220 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.912 -3.520 -5.970 1.00 0.00 C ATOM 1962 C PHE A 123 -9.268 -2.870 -6.230 1.00 0.00 C ATOM 1963 O PHE A 123 -10.264 -3.209 -5.589 1.00 0.00 O ATOM 1964 CB PHE A 123 -6.999 -2.544 -5.227 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.722 -1.697 -4.219 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.176 -2.246 -3.031 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -7.947 -0.351 -4.459 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.841 -1.470 -2.100 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.611 0.431 -3.532 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.059 -0.129 -2.352 1.00 0.00 C ATOM 0 H PHE A 123 -6.312 -3.675 -7.316 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.065 -4.404 -5.351 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.214 -3.106 -4.721 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -6.509 -1.894 -5.952 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.008 -3.294 -2.830 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.600 0.092 -5.381 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.189 -1.911 -1.178 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.779 1.479 -3.731 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.579 0.480 -1.627 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.298 -1.934 -7.172 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.530 -1.236 -7.517 1.00 0.00 C ATOM 1982 C ILE A 124 -11.624 -2.219 -7.921 1.00 0.00 C ATOM 1983 O ILE A 124 -12.776 -2.086 -7.508 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.308 -0.232 -8.663 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.281 0.825 -8.252 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.623 0.423 -9.056 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.640 1.534 -9.425 1.00 0.00 C ATOM 0 H ILE A 124 -8.483 -1.641 -7.710 1.00 0.00 H new ATOM 0 HA ILE A 124 -10.844 -0.692 -6.626 1.00 0.00 H new ATOM 0 HB ILE A 124 -9.921 -0.770 -9.528 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -9.767 1.563 -7.613 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.502 0.350 -7.655 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.449 1.130 -9.867 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.326 -0.342 -9.386 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.037 0.951 -8.197 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.923 2.269 -9.058 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.125 0.807 -10.053 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -9.409 2.038 -10.010 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.254 -3.206 -8.731 1.00 0.00 N ATOM 2000 CA ARG A 125 -12.203 -4.212 -9.192 1.00 0.00 C ATOM 2001 C ARG A 125 -12.766 -5.007 -8.017 1.00 0.00 C ATOM 2002 O ARG A 125 -13.960 -5.300 -7.968 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.532 -5.159 -10.187 1.00 0.00 C ATOM 2004 CG ARG A 125 -11.670 -4.719 -11.635 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.948 -3.404 -11.889 1.00 0.00 C ATOM 2006 NE ARG A 125 -10.749 -3.155 -13.314 1.00 0.00 N ATOM 2007 CZ ARG A 125 -9.704 -3.607 -14.000 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -8.770 -4.327 -13.395 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -9.594 -3.338 -15.295 1.00 0.00 N ATOM 0 H ARG A 125 -10.304 -3.330 -9.081 1.00 0.00 H new ATOM 0 HA ARG A 125 -13.026 -3.698 -9.689 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.473 -5.241 -9.940 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.963 -6.154 -10.076 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -11.266 -5.490 -12.291 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -12.725 -4.610 -11.884 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.522 -2.586 -11.455 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.982 -3.418 -11.385 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.450 -2.604 -13.810 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -8.852 -4.536 -12.400 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -7.969 -4.672 -13.924 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -10.311 -2.785 -15.764 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -8.792 -3.685 -15.822 1.00 0.00 H new ATOM 2023 N SER A 126 -11.897 -5.352 -7.072 1.00 0.00 N ATOM 2024 CA SER A 126 -12.305 -6.117 -5.900 1.00 0.00 C ATOM 2025 C SER A 126 -13.372 -5.368 -5.108 1.00 0.00 C ATOM 2026 O SER A 126 -13.274 -4.158 -4.903 1.00 0.00 O ATOM 2027 CB SER A 126 -11.098 -6.404 -5.006 1.00 0.00 C ATOM 2028 OG SER A 126 -11.479 -7.138 -3.855 1.00 0.00 O ATOM 0 H SER A 126 -10.906 -5.114 -7.095 1.00 0.00 H new ATOM 0 HA SER A 126 -12.727 -7.062 -6.242 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.351 -6.964 -5.568 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.633 -5.465 -4.705 1.00 0.00 H new ATOM 0 HG SER A 126 -10.881 -6.915 -3.112 1.00 0.00 H new ATOM 2034 N SER A 127 -14.392 -6.096 -4.665 1.00 0.00 N ATOM 2035 CA SER A 127 -15.480 -5.501 -3.898 1.00 0.00 C ATOM 2036 C SER A 127 -14.940 -4.721 -2.703 1.00 0.00 C ATOM 2037 O SER A 127 -15.486 -3.684 -2.327 1.00 0.00 O ATOM 2038 CB SER A 127 -16.447 -6.585 -3.418 1.00 0.00 C ATOM 2039 OG SER A 127 -17.560 -6.017 -2.750 1.00 0.00 O ATOM 0 H SER A 127 -14.488 -7.099 -4.824 1.00 0.00 H new ATOM 0 HA SER A 127 -16.014 -4.810 -4.550 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.791 -7.173 -4.269 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.927 -7.269 -2.748 1.00 0.00 H new ATOM 0 HG SER A 127 -18.163 -6.731 -2.455 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.863 -5.228 -2.112 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.247 -4.579 -0.961 1.00 0.00 C ATOM 2047 C ALA A 128 -13.320 -3.060 -1.083 1.00 0.00 C ATOM 2048 O ALA A 128 -13.605 -2.363 -0.109 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.801 -5.029 -0.813 1.00 0.00 C ATOM 0 H ALA A 128 -13.399 -6.086 -2.411 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.801 -4.873 -0.070 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.353 -4.537 0.050 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.769 -6.109 -0.672 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.244 -4.764 -1.711 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.061 -2.555 -2.284 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.095 -1.118 -2.532 1.00 0.00 C ATOM 2057 C TYR A 129 -14.521 -0.583 -2.443 1.00 0.00 C ATOM 2058 O TYR A 129 -14.783 0.404 -1.757 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.504 -0.803 -3.907 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.990 0.506 -4.489 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -12.352 1.702 -4.186 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -14.086 0.545 -5.342 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.792 2.900 -4.715 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -14.533 1.738 -5.876 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.883 2.913 -5.559 1.00 0.00 C ATOM 2066 OH TYR A 129 -14.324 4.104 -6.089 1.00 0.00 O ATOM 0 H TYR A 129 -12.825 -3.119 -3.101 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.495 -0.628 -1.765 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.417 -0.775 -3.828 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.753 -1.611 -4.594 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.497 1.695 -3.526 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.597 -0.373 -5.592 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -12.285 3.821 -4.469 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -15.386 1.751 -6.538 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.730 3.941 -6.966 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.438 -1.244 -3.142 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.838 -0.836 -3.142 1.00 0.00 C ATOM 2078 C GLN A 130 -17.417 -0.874 -1.732 1.00 0.00 C ATOM 2079 O GLN A 130 -18.203 -0.008 -1.350 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.655 -1.741 -4.066 1.00 0.00 C ATOM 2081 CG GLN A 130 -17.119 -1.801 -5.488 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.658 -0.687 -6.363 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.741 -0.156 -6.114 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.904 -0.327 -7.395 1.00 0.00 N ATOM 0 H GLN A 130 -15.237 -2.064 -3.715 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.891 0.189 -3.509 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.674 -2.749 -3.651 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.686 -1.387 -4.090 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -16.031 -1.745 -5.464 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -17.379 -2.763 -5.930 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -16.013 -0.795 -7.563 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.216 0.417 -8.019 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.022 -1.884 -0.963 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.504 -2.035 0.405 1.00 0.00 C ATOM 2095 C GLU A 131 -17.697 -0.674 1.067 1.00 0.00 C ATOM 2096 O GLU A 131 -18.714 -0.425 1.717 1.00 0.00 O ATOM 2097 CB GLU A 131 -16.525 -2.878 1.224 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.371 -4.301 0.714 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.463 -5.223 1.220 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -18.546 -5.258 0.598 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -17.236 -5.910 2.238 1.00 0.00 O ATOM 0 H GLU A 131 -16.370 -2.609 -1.264 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.468 -2.543 0.369 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.549 -2.392 1.220 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.862 -2.907 2.260 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.381 -4.296 -0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.400 -4.690 1.022 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.715 0.204 0.898 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.775 1.541 1.479 1.00 0.00 C ATOM 2110 C LEU A 132 -17.854 2.381 0.802 1.00 0.00 C ATOM 2111 O LEU A 132 -18.692 2.989 1.469 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.418 2.235 1.353 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.243 1.543 2.044 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -14.696 0.892 3.342 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.612 0.512 1.120 1.00 0.00 C ATOM 0 H LEU A 132 -15.867 0.014 0.363 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.028 1.441 2.535 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.182 2.337 0.294 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.509 3.243 1.758 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.491 2.296 2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -13.847 0.404 3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -15.100 1.653 4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.466 0.151 3.128 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.777 0.030 1.629 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.355 -0.238 0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.251 1.005 0.218 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.829 2.408 -0.525 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.806 3.172 -1.294 1.00 0.00 C ATOM 2129 C LEU A 133 -20.228 2.812 -0.876 1.00 0.00 C ATOM 2130 O LEU A 133 -20.990 3.668 -0.429 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.621 2.915 -2.790 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.563 3.767 -3.492 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.324 3.264 -4.907 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.983 5.230 -3.508 1.00 0.00 C ATOM 0 H LEU A 133 -17.143 1.910 -1.092 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.644 4.231 -1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.364 1.865 -2.929 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.577 3.077 -3.287 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.629 3.683 -2.937 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.568 3.883 -5.390 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.979 2.231 -4.872 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -18.253 3.317 -5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.219 5.822 -4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.929 5.331 -4.040 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.102 5.586 -2.485 1.00 0.00 H new ATOM 2146 N SER A 134 -20.578 1.538 -1.024 1.00 0.00 N ATOM 2147 CA SER A 134 -21.909 1.064 -0.664 1.00 0.00 C ATOM 2148 C SER A 134 -22.236 1.411 0.785 1.00 0.00 C ATOM 2149 O SER A 134 -23.340 1.856 1.095 1.00 0.00 O ATOM 2150 CB SER A 134 -22.010 -0.448 -0.873 1.00 0.00 C ATOM 2151 OG SER A 134 -23.311 -0.920 -0.570 1.00 0.00 O ATOM 0 H SER A 134 -19.958 0.816 -1.391 1.00 0.00 H new ATOM 0 HA SER A 134 -22.631 1.562 -1.311 1.00 0.00 H new ATOM 0 HB2 SER A 134 -21.763 -0.693 -1.906 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.280 -0.955 -0.242 1.00 0.00 H new ATOM 0 HG SER A 134 -23.349 -1.889 -0.713 1.00 0.00 H new ATOM 2157 N GLY A 135 -21.265 1.204 1.670 1.00 0.00 N ATOM 2158 CA GLY A 135 -21.468 1.499 3.077 1.00 0.00 C ATOM 2159 C GLY A 135 -20.928 0.410 3.982 1.00 0.00 C ATOM 2160 O GLY A 135 -21.137 -0.780 3.749 1.00 0.00 O ATOM 0 H GLY A 135 -20.342 0.837 1.438 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -20.982 2.444 3.321 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -22.533 1.630 3.267 1.00 0.00 H new ATOM 2164 N PRO A 136 -20.213 0.817 5.041 1.00 0.00 N ATOM 2165 CA PRO A 136 -19.625 -0.118 6.005 1.00 0.00 C ATOM 2166 C PRO A 136 -20.681 -0.810 6.860 1.00 0.00 C ATOM 2167 O PRO A 136 -20.525 -1.971 7.238 1.00 0.00 O ATOM 2168 CB PRO A 136 -18.738 0.778 6.873 1.00 0.00 C ATOM 2169 CG PRO A 136 -19.349 2.133 6.767 1.00 0.00 C ATOM 2170 CD PRO A 136 -19.923 2.220 5.380 1.00 0.00 C ATOM 0 HA PRO A 136 -19.085 -0.926 5.511 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -18.718 0.433 7.907 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -17.708 0.779 6.517 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.125 2.271 7.520 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.604 2.911 6.931 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -20.824 2.833 5.356 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -19.216 2.664 4.680 1.00 0.00 H new ATOM 2178 N SER A 137 -21.757 -0.090 7.161 1.00 0.00 N ATOM 2179 CA SER A 137 -22.838 -0.634 7.974 1.00 0.00 C ATOM 2180 C SER A 137 -23.886 -1.316 7.099 1.00 0.00 C ATOM 2181 O SER A 137 -24.311 -2.436 7.380 1.00 0.00 O ATOM 2182 CB SER A 137 -23.491 0.476 8.801 1.00 0.00 C ATOM 2183 OG SER A 137 -24.133 1.423 7.965 1.00 0.00 O ATOM 0 H SER A 137 -21.903 0.872 6.854 1.00 0.00 H new ATOM 0 HA SER A 137 -22.413 -1.378 8.648 1.00 0.00 H new ATOM 0 HB2 SER A 137 -24.217 0.042 9.489 1.00 0.00 H new ATOM 0 HB3 SER A 137 -22.735 0.975 9.408 1.00 0.00 H new ATOM 0 HG SER A 137 -24.544 2.121 8.517 1.00 0.00 H new ATOM 2189 N SER A 138 -24.298 -0.630 6.037 1.00 0.00 N ATOM 2190 CA SER A 138 -25.299 -1.167 5.122 1.00 0.00 C ATOM 2191 C SER A 138 -24.641 -1.995 4.023 1.00 0.00 C ATOM 2192 O SER A 138 -23.434 -1.906 3.800 1.00 0.00 O ATOM 2193 CB SER A 138 -26.114 -0.031 4.502 1.00 0.00 C ATOM 2194 OG SER A 138 -26.955 0.579 5.466 1.00 0.00 O ATOM 0 H SER A 138 -23.954 0.298 5.789 1.00 0.00 H new ATOM 0 HA SER A 138 -25.966 -1.815 5.691 1.00 0.00 H new ATOM 0 HB2 SER A 138 -25.441 0.714 4.078 1.00 0.00 H new ATOM 0 HB3 SER A 138 -26.718 -0.418 3.681 1.00 0.00 H new ATOM 0 HG SER A 138 -27.464 1.303 5.045 1.00 0.00 H new ATOM 2200 N GLY A 139 -25.445 -2.803 3.338 1.00 0.00 N ATOM 2201 CA GLY A 139 -24.925 -3.636 2.270 1.00 0.00 C ATOM 2202 C GLY A 139 -25.425 -3.209 0.904 1.00 0.00 C ATOM 2203 O GLY A 139 -26.611 -3.338 0.602 1.00 0.00 O ATOM 0 H GLY A 139 -26.447 -2.895 3.504 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -23.836 -3.599 2.282 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -25.211 -4.672 2.450 1.00 0.00 H new TER 2207 GLY A 139