USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 749 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 127 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 81 THR OG1 : rot -149:sc= 0.00808 USER MOD Set 2.2: A 107 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -132:sc= -0.261 (180deg=-1.79!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 155:sc= -0.0778 (180deg=-0.523) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc=-0.00556 K(o=-0.0056,f=-3!) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 48:sc= 0.046 USER MOD Single : A 75 GLN : amide:sc= -0.32 X(o=-0.32,f=-0.11) USER MOD Single : A 84 GLN : amide:sc= -2 K(o=-2,f=-1.5) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -0.01 K(o=-0.01,f=-0.66) USER MOD Single : A 101 SER OG : rot -94:sc= 0.624 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.33 K(o=-0.33,f=-1.7) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 180:sc=-0.00179 USER MOD Single : A 121 ASN : amide:sc= -1.38 X(o=-1.4,f=-0.89) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 35:sc= 1.14 USER MOD Single : A 125 HIS : no HD1:sc= -2.59 X(o=-2.6,f=-2.7) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0.0667 USER MOD Single : A 135 LYS NZ :NH3+ 174:sc= 1.08 (180deg=1.06) USER MOD Single : A 142 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 169 THR OG1 : rot -82:sc= 0.879 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N TYR A 40 72.000 -26.706 -9.857 1.00 74.41 N ATOM 22 CA TYR A 40 71.786 -25.358 -9.343 1.00 15.52 C ATOM 23 C TYR A 40 70.297 -25.059 -9.205 1.00 60.21 C ATOM 24 O TYR A 40 69.493 -25.449 -10.052 1.00 33.01 O ATOM 25 CB TYR A 40 72.443 -24.329 -10.263 1.00 4.23 C ATOM 26 CG TYR A 40 71.740 -24.168 -11.592 1.00 12.22 C ATOM 27 CD1 TYR A 40 70.827 -23.141 -11.798 1.00 55.41 C ATOM 28 CD2 TYR A 40 71.988 -25.045 -12.641 1.00 11.34 C ATOM 29 CE1 TYR A 40 70.182 -22.992 -13.010 1.00 51.33 C ATOM 30 CE2 TYR A 40 71.348 -24.902 -13.857 1.00 32.21 C ATOM 31 CZ TYR A 40 70.446 -23.874 -14.037 1.00 33.35 C ATOM 32 OH TYR A 40 69.806 -23.730 -15.246 1.00 61.23 O ATOM 0 HA TYR A 40 72.243 -25.295 -8.356 1.00 15.52 H new ATOM 0 HB2 TYR A 40 72.468 -23.365 -9.756 1.00 4.23 H new ATOM 0 HB3 TYR A 40 73.477 -24.622 -10.442 1.00 4.23 H new ATOM 0 HD1 TYR A 40 70.618 -22.448 -10.997 1.00 55.41 H new ATOM 0 HD2 TYR A 40 72.693 -25.852 -12.503 1.00 11.34 H new ATOM 0 HE1 TYR A 40 69.474 -22.189 -13.153 1.00 51.33 H new ATOM 0 HE2 TYR A 40 71.553 -25.592 -14.663 1.00 32.21 H new ATOM 0 HH TYR A 40 70.106 -24.432 -15.860 1.00 61.23 H new ATOM 41 N ARG A 41 69.937 -24.362 -8.132 1.00 21.12 N ATOM 42 CA ARG A 41 68.545 -24.009 -7.882 1.00 24.15 C ATOM 43 C ARG A 41 68.311 -22.520 -8.120 1.00 1.23 C ATOM 44 O ARG A 41 69.236 -21.712 -8.030 1.00 10.30 O ATOM 45 CB ARG A 41 68.154 -24.376 -6.449 1.00 62.23 C ATOM 46 CG ARG A 41 67.675 -25.810 -6.297 1.00 31.04 C ATOM 47 CD ARG A 41 68.830 -26.795 -6.381 1.00 33.12 C ATOM 48 NE ARG A 41 68.573 -28.008 -5.611 1.00 10.31 N ATOM 49 CZ ARG A 41 67.761 -28.979 -6.017 1.00 71.11 C ATOM 50 NH1 ARG A 41 67.132 -28.877 -7.179 1.00 53.23 N ATOM 51 NH2 ARG A 41 67.578 -30.053 -5.260 1.00 72.34 N ATOM 0 H ARG A 41 70.590 -24.031 -7.422 1.00 21.12 H new ATOM 0 HA ARG A 41 67.922 -24.572 -8.577 1.00 24.15 H new ATOM 0 HB2 ARG A 41 69.012 -24.217 -5.795 1.00 62.23 H new ATOM 0 HB3 ARG A 41 67.367 -23.701 -6.112 1.00 62.23 H new ATOM 0 HG2 ARG A 41 67.166 -25.925 -5.340 1.00 31.04 H new ATOM 0 HG3 ARG A 41 66.946 -26.036 -7.075 1.00 31.04 H new ATOM 0 HD2 ARG A 41 69.006 -27.058 -7.424 1.00 33.12 H new ATOM 0 HD3 ARG A 41 69.739 -26.319 -6.014 1.00 33.12 H new ATOM 0 HE ARG A 41 69.042 -28.117 -4.712 1.00 10.31 H new ATOM 0 HH11 ARG A 41 67.271 -28.053 -7.763 1.00 53.23 H new ATOM 0 HH12 ARG A 41 66.509 -29.623 -7.489 1.00 53.23 H new ATOM 0 HH21 ARG A 41 68.061 -30.134 -4.365 1.00 72.34 H new ATOM 0 HH22 ARG A 41 66.955 -30.797 -5.573 1.00 72.34 H new ATOM 62 N LYS A 42 67.067 -22.163 -8.423 1.00 33.53 N ATOM 63 CA LYS A 42 66.709 -20.772 -8.672 1.00 54.43 C ATOM 64 C LYS A 42 65.520 -20.354 -7.815 1.00 43.21 C ATOM 65 O LYS A 42 64.371 -20.656 -8.139 1.00 42.21 O ATOM 66 CB LYS A 42 66.382 -20.566 -10.153 1.00 50.52 C ATOM 67 CG LYS A 42 67.611 -20.396 -11.030 1.00 65.15 C ATOM 68 CD LYS A 42 67.232 -20.226 -12.492 1.00 71.44 C ATOM 69 CE LYS A 42 66.766 -18.808 -12.786 1.00 71.41 C ATOM 70 NZ LYS A 42 65.305 -18.643 -12.548 1.00 74.11 N ATOM 0 H LYS A 42 66.290 -22.819 -8.502 1.00 33.53 H new ATOM 0 HA LYS A 42 67.563 -20.150 -8.404 1.00 54.43 H new ATOM 0 HB2 LYS A 42 65.806 -21.419 -10.511 1.00 50.52 H new ATOM 0 HB3 LYS A 42 65.747 -19.686 -10.257 1.00 50.52 H new ATOM 0 HG2 LYS A 42 68.180 -19.528 -10.697 1.00 65.15 H new ATOM 0 HG3 LYS A 42 68.261 -21.264 -10.920 1.00 65.15 H new ATOM 0 HD2 LYS A 42 68.089 -20.466 -13.121 1.00 71.44 H new ATOM 0 HD3 LYS A 42 66.441 -20.931 -12.748 1.00 71.44 H new ATOM 0 HE2 LYS A 42 67.317 -18.107 -12.159 1.00 71.41 H new ATOM 0 HE3 LYS A 42 66.996 -18.558 -13.822 1.00 71.41 H new ATOM 0 HZ1 LYS A 42 64.873 -18.162 -13.363 1.00 74.11 H new ATOM 0 HZ2 LYS A 42 64.866 -19.578 -12.424 1.00 74.11 H new ATOM 0 HZ3 LYS A 42 65.155 -18.074 -11.691 1.00 74.11 H new ATOM 80 N LYS A 43 65.801 -19.656 -6.720 1.00 73.50 N ATOM 81 CA LYS A 43 64.755 -19.193 -5.817 1.00 23.40 C ATOM 82 C LYS A 43 64.587 -17.679 -5.908 1.00 14.44 C ATOM 83 O LYS A 43 65.519 -16.963 -6.269 1.00 72.42 O ATOM 84 CB LYS A 43 65.082 -19.594 -4.377 1.00 4.42 C ATOM 85 CG LYS A 43 65.170 -21.097 -4.169 1.00 61.33 C ATOM 86 CD LYS A 43 65.587 -21.440 -2.750 1.00 21.54 C ATOM 87 CE LYS A 43 64.525 -21.026 -1.742 1.00 15.24 C ATOM 88 NZ LYS A 43 64.819 -21.551 -0.379 1.00 34.44 N ATOM 0 H LYS A 43 66.746 -19.398 -6.436 1.00 73.50 H new ATOM 0 HA LYS A 43 63.818 -19.663 -6.116 1.00 23.40 H new ATOM 0 HB2 LYS A 43 66.030 -19.140 -4.088 1.00 4.42 H new ATOM 0 HB3 LYS A 43 64.319 -19.188 -3.713 1.00 4.42 H new ATOM 0 HG2 LYS A 43 64.204 -21.552 -4.385 1.00 61.33 H new ATOM 0 HG3 LYS A 43 65.887 -21.521 -4.872 1.00 61.33 H new ATOM 0 HD2 LYS A 43 65.767 -22.512 -2.671 1.00 21.54 H new ATOM 0 HD3 LYS A 43 66.527 -20.941 -2.515 1.00 21.54 H new ATOM 0 HE2 LYS A 43 64.462 -19.938 -1.707 1.00 15.24 H new ATOM 0 HE3 LYS A 43 63.552 -21.391 -2.070 1.00 15.24 H new ATOM 0 HZ1 LYS A 43 64.073 -21.247 0.278 1.00 34.44 H new ATOM 0 HZ2 LYS A 43 64.854 -22.590 -0.407 1.00 34.44 H new ATOM 0 HZ3 LYS A 43 65.736 -21.183 -0.055 1.00 34.44 H new ATOM 98 N GLY A 44 63.392 -17.200 -5.578 1.00 45.12 N ATOM 99 CA GLY A 44 63.125 -15.774 -5.628 1.00 63.13 C ATOM 100 C GLY A 44 61.673 -15.466 -5.939 1.00 73.24 C ATOM 101 O GLY A 44 61.355 -14.964 -7.017 1.00 12.30 O ATOM 0 H GLY A 44 62.604 -17.773 -5.277 1.00 45.12 H new ATOM 0 HA2 GLY A 44 63.392 -15.324 -4.672 1.00 63.13 H new ATOM 0 HA3 GLY A 44 63.761 -15.315 -6.385 1.00 63.13 H new ATOM 105 N LYS A 45 60.791 -15.770 -4.994 1.00 3.31 N ATOM 106 CA LYS A 45 59.365 -15.523 -5.172 1.00 4.33 C ATOM 107 C LYS A 45 58.949 -14.221 -4.495 1.00 23.24 C ATOM 108 O LYS A 45 59.711 -13.640 -3.723 1.00 33.11 O ATOM 109 CB LYS A 45 58.551 -16.688 -4.604 1.00 44.31 C ATOM 110 CG LYS A 45 58.443 -17.872 -5.548 1.00 40.33 C ATOM 111 CD LYS A 45 59.639 -18.800 -5.419 1.00 14.02 C ATOM 112 CE LYS A 45 59.567 -19.629 -4.145 1.00 64.25 C ATOM 113 NZ LYS A 45 58.696 -20.826 -4.311 1.00 22.55 N ATOM 0 H LYS A 45 61.038 -16.188 -4.097 1.00 3.31 H new ATOM 0 HA LYS A 45 59.167 -15.435 -6.240 1.00 4.33 H new ATOM 0 HB2 LYS A 45 59.008 -17.018 -3.671 1.00 44.31 H new ATOM 0 HB3 LYS A 45 57.549 -16.335 -4.361 1.00 44.31 H new ATOM 0 HG2 LYS A 45 57.528 -18.425 -5.336 1.00 40.33 H new ATOM 0 HG3 LYS A 45 58.368 -17.514 -6.575 1.00 40.33 H new ATOM 0 HD2 LYS A 45 59.682 -19.463 -6.283 1.00 14.02 H new ATOM 0 HD3 LYS A 45 60.558 -18.214 -5.421 1.00 14.02 H new ATOM 0 HE2 LYS A 45 60.570 -19.946 -3.861 1.00 64.25 H new ATOM 0 HE3 LYS A 45 59.186 -19.012 -3.331 1.00 64.25 H new ATOM 0 HZ1 LYS A 45 58.673 -21.365 -3.422 1.00 22.55 H new ATOM 0 HZ2 LYS A 45 57.732 -20.523 -4.557 1.00 22.55 H new ATOM 0 HZ3 LYS A 45 59.074 -21.428 -5.070 1.00 22.55 H new ATOM 123 N GLY A 46 57.733 -13.769 -4.787 1.00 74.40 N ATOM 124 CA GLY A 46 57.238 -12.539 -4.197 1.00 43.21 C ATOM 125 C GLY A 46 55.761 -12.323 -4.463 1.00 31.01 C ATOM 126 O GLY A 46 55.325 -12.305 -5.614 1.00 12.25 O ATOM 0 H GLY A 46 57.082 -14.232 -5.421 1.00 74.40 H new ATOM 0 HA2 GLY A 46 57.411 -12.560 -3.121 1.00 43.21 H new ATOM 0 HA3 GLY A 46 57.803 -11.696 -4.594 1.00 43.21 H new ATOM 130 N LYS A 47 54.987 -12.159 -3.395 1.00 22.14 N ATOM 131 CA LYS A 47 53.550 -11.944 -3.517 1.00 30.42 C ATOM 132 C LYS A 47 53.074 -10.880 -2.532 1.00 71.34 C ATOM 133 O LYS A 47 53.759 -10.572 -1.558 1.00 65.14 O ATOM 134 CB LYS A 47 52.794 -13.252 -3.274 1.00 74.45 C ATOM 135 CG LYS A 47 53.162 -13.934 -1.967 1.00 64.15 C ATOM 136 CD LYS A 47 54.331 -14.887 -2.145 1.00 22.42 C ATOM 137 CE LYS A 47 54.297 -16.008 -1.117 1.00 21.32 C ATOM 138 NZ LYS A 47 53.117 -16.896 -1.304 1.00 3.41 N ATOM 0 H LYS A 47 55.331 -12.171 -2.435 1.00 22.14 H new ATOM 0 HA LYS A 47 53.345 -11.596 -4.530 1.00 30.42 H new ATOM 0 HB2 LYS A 47 51.723 -13.049 -3.279 1.00 74.45 H new ATOM 0 HB3 LYS A 47 52.993 -13.936 -4.099 1.00 74.45 H new ATOM 0 HG2 LYS A 47 53.416 -13.181 -1.221 1.00 64.15 H new ATOM 0 HG3 LYS A 47 52.300 -14.481 -1.586 1.00 64.15 H new ATOM 0 HD2 LYS A 47 54.306 -15.311 -3.149 1.00 22.42 H new ATOM 0 HD3 LYS A 47 55.268 -14.337 -2.054 1.00 22.42 H new ATOM 0 HE2 LYS A 47 55.211 -16.598 -1.192 1.00 21.32 H new ATOM 0 HE3 LYS A 47 54.275 -15.581 -0.114 1.00 21.32 H new ATOM 0 HZ1 LYS A 47 53.324 -17.836 -0.911 1.00 3.41 H new ATOM 0 HZ2 LYS A 47 52.295 -16.489 -0.814 1.00 3.41 H new ATOM 0 HZ3 LYS A 47 52.906 -16.984 -2.319 1.00 3.41 H new ATOM 148 N GLY A 48 51.896 -10.323 -2.794 1.00 24.42 N ATOM 149 CA GLY A 48 51.348 -9.301 -1.921 1.00 60.42 C ATOM 150 C GLY A 48 50.402 -8.364 -2.646 1.00 55.34 C ATOM 151 O GLY A 48 50.809 -7.641 -3.557 1.00 41.15 O ATOM 0 H GLY A 48 51.311 -10.561 -3.595 1.00 24.42 H new ATOM 0 HA2 GLY A 48 50.820 -9.778 -1.095 1.00 60.42 H new ATOM 0 HA3 GLY A 48 52.164 -8.724 -1.486 1.00 60.42 H new ATOM 155 N THR A 49 49.136 -8.377 -2.245 1.00 64.11 N ATOM 156 CA THR A 49 48.129 -7.524 -2.865 1.00 1.54 C ATOM 157 C THR A 49 47.519 -6.565 -1.849 1.00 74.33 C ATOM 158 O THR A 49 47.382 -6.897 -0.671 1.00 23.42 O ATOM 159 CB THR A 49 47.003 -8.359 -3.504 1.00 53.14 C ATOM 160 OG1 THR A 49 46.131 -7.509 -4.258 1.00 50.42 O ATOM 161 CG2 THR A 49 46.206 -9.098 -2.441 1.00 13.54 C ATOM 0 H THR A 49 48.782 -8.969 -1.493 1.00 64.11 H new ATOM 0 HA THR A 49 48.635 -6.952 -3.643 1.00 1.54 H new ATOM 0 HB THR A 49 47.458 -9.094 -4.169 1.00 53.14 H new ATOM 0 HG1 THR A 49 45.419 -8.047 -4.663 1.00 50.42 H new ATOM 0 HG21 THR A 49 45.417 -9.680 -2.917 1.00 13.54 H new ATOM 0 HG22 THR A 49 46.867 -9.766 -1.889 1.00 13.54 H new ATOM 0 HG23 THR A 49 45.761 -8.378 -1.754 1.00 13.54 H new ATOM 169 N THR A 50 47.154 -5.373 -2.312 1.00 14.53 N ATOM 170 CA THR A 50 46.560 -4.365 -1.443 1.00 52.41 C ATOM 171 C THR A 50 45.528 -3.532 -2.194 1.00 53.44 C ATOM 172 O THR A 50 45.752 -3.128 -3.335 1.00 51.10 O ATOM 173 CB THR A 50 47.631 -3.427 -0.856 1.00 53.21 C ATOM 174 OG1 THR A 50 47.017 -2.462 0.005 1.00 30.14 O ATOM 175 CG2 THR A 50 48.392 -2.715 -1.963 1.00 74.30 C ATOM 0 H THR A 50 47.260 -5.083 -3.284 1.00 14.53 H new ATOM 0 HA THR A 50 46.070 -4.899 -0.629 1.00 52.41 H new ATOM 0 HB THR A 50 48.336 -4.029 -0.282 1.00 53.21 H new ATOM 0 HG1 THR A 50 47.704 -1.870 0.376 1.00 30.14 H new ATOM 0 HG21 THR A 50 49.143 -2.058 -1.524 1.00 74.30 H new ATOM 0 HG22 THR A 50 48.882 -3.452 -2.600 1.00 74.30 H new ATOM 0 HG23 THR A 50 47.697 -2.124 -2.560 1.00 74.30 H new ATOM 183 N VAL A 51 44.394 -3.277 -1.547 1.00 74.12 N ATOM 184 CA VAL A 51 43.328 -2.491 -2.155 1.00 25.42 C ATOM 185 C VAL A 51 42.628 -1.621 -1.115 1.00 60.44 C ATOM 186 O VAL A 51 42.335 -2.070 -0.009 1.00 34.14 O ATOM 187 CB VAL A 51 42.285 -3.392 -2.839 1.00 40.12 C ATOM 188 CG1 VAL A 51 42.910 -4.142 -4.006 1.00 44.42 C ATOM 189 CG2 VAL A 51 41.677 -4.362 -1.836 1.00 73.41 C ATOM 0 H VAL A 51 44.191 -3.604 -0.602 1.00 74.12 H new ATOM 0 HA VAL A 51 43.793 -1.854 -2.907 1.00 25.42 H new ATOM 0 HB VAL A 51 41.486 -2.761 -3.229 1.00 40.12 H new ATOM 0 HG11 VAL A 51 42.157 -4.774 -4.477 1.00 44.42 H new ATOM 0 HG12 VAL A 51 43.292 -3.427 -4.735 1.00 44.42 H new ATOM 0 HG13 VAL A 51 43.729 -4.763 -3.643 1.00 44.42 H new ATOM 0 HG21 VAL A 51 40.942 -4.991 -2.338 1.00 73.41 H new ATOM 0 HG22 VAL A 51 42.463 -4.989 -1.414 1.00 73.41 H new ATOM 0 HG23 VAL A 51 41.191 -3.802 -1.037 1.00 73.41 H new ATOM 199 N GLY A 52 42.361 -0.370 -1.482 1.00 33.53 N ATOM 200 CA GLY A 52 41.698 0.544 -0.570 1.00 52.24 C ATOM 201 C GLY A 52 40.300 0.907 -1.030 1.00 72.54 C ATOM 202 O GLY A 52 39.814 0.383 -2.032 1.00 24.41 O ATOM 0 H GLY A 52 42.592 0.026 -2.393 1.00 33.53 H new ATOM 0 HA2 GLY A 52 41.646 0.091 0.420 1.00 52.24 H new ATOM 0 HA3 GLY A 52 42.293 1.452 -0.474 1.00 52.24 H new ATOM 206 N MET A 53 39.652 1.807 -0.296 1.00 14.33 N ATOM 207 CA MET A 53 38.301 2.239 -0.635 1.00 14.55 C ATOM 208 C MET A 53 38.297 3.042 -1.931 1.00 51.21 C ATOM 209 O MET A 53 38.741 4.189 -1.964 1.00 3.53 O ATOM 210 CB MET A 53 37.712 3.077 0.501 1.00 72.14 C ATOM 211 CG MET A 53 37.785 2.398 1.859 1.00 20.30 C ATOM 212 SD MET A 53 36.716 3.178 3.083 1.00 3.32 S ATOM 213 CE MET A 53 35.821 1.757 3.706 1.00 3.22 C ATOM 0 H MET A 53 40.041 2.251 0.536 1.00 14.33 H new ATOM 0 HA MET A 53 37.686 1.350 -0.778 1.00 14.55 H new ATOM 0 HB2 MET A 53 38.241 4.029 0.551 1.00 72.14 H new ATOM 0 HB3 MET A 53 36.670 3.303 0.272 1.00 72.14 H new ATOM 0 HG2 MET A 53 37.505 1.350 1.753 1.00 20.30 H new ATOM 0 HG3 MET A 53 38.815 2.418 2.216 1.00 20.30 H new ATOM 0 HE1 MET A 53 35.118 2.078 4.474 1.00 3.22 H new ATOM 0 HE2 MET A 53 35.276 1.284 2.889 1.00 3.22 H new ATOM 0 HE3 MET A 53 36.525 1.043 4.134 1.00 3.22 H new ATOM 221 N GLY A 54 37.792 2.430 -2.999 1.00 65.11 N ATOM 222 CA GLY A 54 37.740 3.104 -4.283 1.00 44.33 C ATOM 223 C GLY A 54 36.395 2.950 -4.965 1.00 2.13 C ATOM 224 O GLY A 54 35.377 3.430 -4.463 1.00 33.01 O ATOM 0 H GLY A 54 37.419 1.481 -2.997 1.00 65.11 H new ATOM 0 HA2 GLY A 54 37.953 4.164 -4.142 1.00 44.33 H new ATOM 0 HA3 GLY A 54 38.520 2.705 -4.931 1.00 44.33 H new ATOM 266 N ARG A 58 29.852 -4.752 -5.364 1.00 4.35 N ATOM 267 CA ARG A 58 29.489 -6.157 -5.213 1.00 63.43 C ATOM 268 C ARG A 58 27.975 -6.323 -5.139 1.00 1.42 C ATOM 269 O ARG A 58 27.245 -5.359 -4.904 1.00 21.42 O ATOM 270 CB ARG A 58 30.140 -6.741 -3.958 1.00 50.43 C ATOM 271 CG ARG A 58 31.554 -7.248 -4.185 1.00 31.53 C ATOM 272 CD ARG A 58 32.108 -7.929 -2.942 1.00 52.51 C ATOM 273 NE ARG A 58 33.568 -7.939 -2.929 1.00 11.54 N ATOM 274 CZ ARG A 58 34.305 -8.737 -3.693 1.00 51.15 C ATOM 275 NH1 ARG A 58 33.721 -9.585 -4.528 1.00 74.01 N ATOM 276 NH2 ARG A 58 35.630 -8.687 -3.624 1.00 4.25 N ATOM 0 HA ARG A 58 29.853 -6.697 -6.087 1.00 63.43 H new ATOM 0 HB2 ARG A 58 30.157 -5.978 -3.180 1.00 50.43 H new ATOM 0 HB3 ARG A 58 29.524 -7.561 -3.588 1.00 50.43 H new ATOM 0 HG2 ARG A 58 31.561 -7.950 -5.019 1.00 31.53 H new ATOM 0 HG3 ARG A 58 32.200 -6.415 -4.464 1.00 31.53 H new ATOM 0 HD2 ARG A 58 31.741 -7.416 -2.053 1.00 52.51 H new ATOM 0 HD3 ARG A 58 31.738 -8.953 -2.894 1.00 52.51 H new ATOM 0 HE ARG A 58 34.049 -7.298 -2.298 1.00 11.54 H new ATOM 0 HH11 ARG A 58 32.703 -9.626 -4.585 1.00 74.01 H new ATOM 0 HH12 ARG A 58 34.289 -10.197 -5.114 1.00 74.01 H new ATOM 0 HH21 ARG A 58 36.083 -8.035 -2.984 1.00 4.25 H new ATOM 0 HH22 ARG A 58 36.195 -9.301 -4.211 1.00 4.25 H new ATOM 287 N ARG A 59 27.509 -7.551 -5.342 1.00 4.14 N ATOM 288 CA ARG A 59 26.080 -7.843 -5.299 1.00 53.11 C ATOM 289 C ARG A 59 25.837 -9.328 -5.046 1.00 43.54 C ATOM 290 O ARG A 59 26.751 -10.145 -5.154 1.00 54.44 O ATOM 291 CB ARG A 59 25.413 -7.421 -6.609 1.00 73.13 C ATOM 292 CG ARG A 59 26.042 -8.048 -7.843 1.00 11.43 C ATOM 293 CD ARG A 59 27.184 -7.200 -8.379 1.00 55.01 C ATOM 294 NE ARG A 59 27.466 -7.485 -9.783 1.00 11.42 N ATOM 295 CZ ARG A 59 28.136 -6.662 -10.581 1.00 20.32 C ATOM 296 NH1 ARG A 59 28.591 -5.507 -10.114 1.00 73.21 N ATOM 297 NH2 ARG A 59 28.352 -6.992 -11.847 1.00 75.43 N ATOM 0 H ARG A 59 28.099 -8.360 -5.538 1.00 4.14 H new ATOM 0 HA ARG A 59 25.642 -7.276 -4.478 1.00 53.11 H new ATOM 0 HB2 ARG A 59 24.358 -7.691 -6.573 1.00 73.13 H new ATOM 0 HB3 ARG A 59 25.462 -6.336 -6.698 1.00 73.13 H new ATOM 0 HG2 ARG A 59 26.411 -9.044 -7.598 1.00 11.43 H new ATOM 0 HG3 ARG A 59 25.284 -8.170 -8.617 1.00 11.43 H new ATOM 0 HD2 ARG A 59 26.936 -6.145 -8.266 1.00 55.01 H new ATOM 0 HD3 ARG A 59 28.080 -7.382 -7.785 1.00 55.01 H new ATOM 0 HE ARG A 59 27.129 -8.366 -10.173 1.00 11.42 H new ATOM 0 HH11 ARG A 59 28.426 -5.250 -9.141 1.00 73.21 H new ATOM 0 HH12 ARG A 59 29.106 -4.876 -10.728 1.00 73.21 H new ATOM 0 HH21 ARG A 59 28.003 -7.879 -12.209 1.00 75.43 H new ATOM 0 HH22 ARG A 59 28.867 -6.358 -12.458 1.00 75.43 H new ATOM 308 N PHE A 60 24.598 -9.669 -4.708 1.00 1.01 N ATOM 309 CA PHE A 60 24.233 -11.055 -4.438 1.00 53.04 C ATOM 310 C PHE A 60 22.722 -11.201 -4.289 1.00 30.15 C ATOM 311 O PHE A 60 21.999 -10.209 -4.188 1.00 0.32 O ATOM 312 CB PHE A 60 24.933 -11.551 -3.171 1.00 2.12 C ATOM 313 CG PHE A 60 25.169 -13.034 -3.158 1.00 12.10 C ATOM 314 CD1 PHE A 60 26.186 -13.594 -3.916 1.00 20.14 C ATOM 315 CD2 PHE A 60 24.375 -13.869 -2.389 1.00 5.33 C ATOM 316 CE1 PHE A 60 26.404 -14.959 -3.906 1.00 74.22 C ATOM 317 CE2 PHE A 60 24.589 -15.235 -2.375 1.00 32.30 C ATOM 318 CZ PHE A 60 25.607 -15.780 -3.134 1.00 65.13 C ATOM 0 H PHE A 60 23.830 -9.005 -4.614 1.00 1.01 H new ATOM 0 HA PHE A 60 24.556 -11.661 -5.284 1.00 53.04 H new ATOM 0 HB2 PHE A 60 25.889 -11.038 -3.069 1.00 2.12 H new ATOM 0 HB3 PHE A 60 24.332 -11.279 -2.303 1.00 2.12 H new ATOM 0 HD1 PHE A 60 26.815 -12.957 -4.521 1.00 20.14 H new ATOM 0 HD2 PHE A 60 23.579 -13.448 -1.793 1.00 5.33 H new ATOM 0 HE1 PHE A 60 27.198 -15.383 -4.502 1.00 74.22 H new ATOM 0 HE2 PHE A 60 23.962 -15.875 -1.772 1.00 32.30 H new ATOM 0 HZ PHE A 60 25.779 -16.846 -3.123 1.00 65.13 H new ATOM 327 N ILE A 61 22.252 -12.444 -4.276 1.00 4.42 N ATOM 328 CA ILE A 61 20.827 -12.720 -4.137 1.00 74.35 C ATOM 329 C ILE A 61 20.423 -12.807 -2.670 1.00 70.51 C ATOM 330 O ILE A 61 21.173 -13.318 -1.838 1.00 62.44 O ATOM 331 CB ILE A 61 20.437 -14.031 -4.844 1.00 53.42 C ATOM 332 CG1 ILE A 61 20.846 -13.983 -6.318 1.00 5.40 C ATOM 333 CG2 ILE A 61 18.942 -14.279 -4.712 1.00 14.15 C ATOM 334 CD1 ILE A 61 20.718 -15.315 -7.024 1.00 62.13 C ATOM 0 H ILE A 61 22.837 -13.276 -4.360 1.00 4.42 H new ATOM 0 HA ILE A 61 20.298 -11.891 -4.607 1.00 74.35 H new ATOM 0 HB ILE A 61 20.966 -14.855 -4.366 1.00 53.42 H new ATOM 0 HG12 ILE A 61 20.230 -13.247 -6.834 1.00 5.40 H new ATOM 0 HG13 ILE A 61 21.878 -13.641 -6.389 1.00 5.40 H new ATOM 0 HG21 ILE A 61 18.682 -15.209 -5.217 1.00 14.15 H new ATOM 0 HG22 ILE A 61 18.677 -14.352 -3.657 1.00 14.15 H new ATOM 0 HG23 ILE A 61 18.395 -13.454 -5.167 1.00 14.15 H new ATOM 0 HD11 ILE A 61 21.025 -15.206 -8.064 1.00 62.13 H new ATOM 0 HD12 ILE A 61 21.356 -16.050 -6.533 1.00 62.13 H new ATOM 0 HD13 ILE A 61 19.681 -15.650 -6.984 1.00 62.13 H new ATOM 345 N ASN A 62 19.233 -12.306 -2.358 1.00 61.13 N ATOM 346 CA ASN A 62 18.728 -12.329 -0.990 1.00 62.41 C ATOM 347 C ASN A 62 17.563 -13.304 -0.856 1.00 44.11 C ATOM 348 O ASN A 62 17.096 -13.870 -1.845 1.00 22.35 O ATOM 349 CB ASN A 62 18.285 -10.927 -0.565 1.00 50.03 C ATOM 350 CG ASN A 62 18.437 -10.700 0.926 1.00 24.11 C ATOM 351 OD1 ASN A 62 17.544 -11.025 1.709 1.00 30.13 O ATOM 352 ND2 ASN A 62 19.572 -10.139 1.327 1.00 14.11 N ATOM 0 H ASN A 62 18.600 -11.879 -3.034 1.00 61.13 H new ATOM 0 HA ASN A 62 19.535 -12.663 -0.337 1.00 62.41 H new ATOM 0 HB2 ASN A 62 18.872 -10.184 -1.105 1.00 50.03 H new ATOM 0 HB3 ASN A 62 17.243 -10.777 -0.848 1.00 50.03 H new ATOM 0 HD21 ASN A 62 19.731 -9.961 2.319 1.00 14.11 H new ATOM 0 HD22 ASN A 62 20.285 -9.886 0.643 1.00 14.11 H new ATOM 358 N MET A 63 17.098 -13.497 0.374 1.00 74.24 N ATOM 359 CA MET A 63 15.986 -14.403 0.638 1.00 52.22 C ATOM 360 C MET A 63 15.163 -13.922 1.829 1.00 34.33 C ATOM 361 O MET A 63 15.686 -13.269 2.733 1.00 51.23 O ATOM 362 CB MET A 63 16.505 -15.818 0.898 1.00 34.32 C ATOM 363 CG MET A 63 17.425 -15.916 2.105 1.00 44.14 C ATOM 364 SD MET A 63 19.156 -15.644 1.682 1.00 10.03 S ATOM 365 CE MET A 63 19.931 -17.016 2.535 1.00 53.31 C ATOM 0 H MET A 63 17.474 -13.038 1.204 1.00 74.24 H new ATOM 0 HA MET A 63 15.343 -14.416 -0.242 1.00 52.22 H new ATOM 0 HB2 MET A 63 15.656 -16.486 1.043 1.00 34.32 H new ATOM 0 HB3 MET A 63 17.039 -16.168 0.015 1.00 34.32 H new ATOM 0 HG2 MET A 63 17.118 -15.184 2.852 1.00 44.14 H new ATOM 0 HG3 MET A 63 17.317 -16.900 2.561 1.00 44.14 H new ATOM 0 HE1 MET A 63 21.008 -16.986 2.369 1.00 53.31 H new ATOM 0 HE2 MET A 63 19.726 -16.943 3.603 1.00 53.31 H new ATOM 0 HE3 MET A 63 19.531 -17.955 2.152 1.00 53.31 H new ATOM 373 N TYR A 64 13.877 -14.250 1.824 1.00 45.12 N ATOM 374 CA TYR A 64 12.982 -13.849 2.903 1.00 3.41 C ATOM 375 C TYR A 64 11.890 -14.892 3.121 1.00 21.21 C ATOM 376 O TYR A 64 11.872 -15.935 2.468 1.00 53.13 O ATOM 377 CB TYR A 64 12.351 -12.491 2.593 1.00 41.04 C ATOM 378 CG TYR A 64 13.332 -11.342 2.639 1.00 34.31 C ATOM 379 CD1 TYR A 64 13.859 -10.805 1.471 1.00 73.02 C ATOM 380 CD2 TYR A 64 13.733 -10.794 3.851 1.00 2.31 C ATOM 381 CE1 TYR A 64 14.757 -9.756 1.508 1.00 24.30 C ATOM 382 CE2 TYR A 64 14.630 -9.744 3.898 1.00 41.02 C ATOM 383 CZ TYR A 64 15.139 -9.229 2.725 1.00 70.33 C ATOM 384 OH TYR A 64 16.032 -8.183 2.766 1.00 62.13 O ATOM 0 H TYR A 64 13.430 -14.793 1.085 1.00 45.12 H new ATOM 0 HA TYR A 64 13.570 -13.768 3.817 1.00 3.41 H new ATOM 0 HB2 TYR A 64 11.895 -12.529 1.604 1.00 41.04 H new ATOM 0 HB3 TYR A 64 11.549 -12.301 3.306 1.00 41.04 H new ATOM 0 HD1 TYR A 64 13.561 -11.215 0.517 1.00 73.02 H new ATOM 0 HD2 TYR A 64 13.337 -11.195 4.772 1.00 2.31 H new ATOM 0 HE1 TYR A 64 15.158 -9.351 0.590 1.00 24.30 H new ATOM 0 HE2 TYR A 64 14.931 -9.329 4.849 1.00 41.02 H new ATOM 0 HH TYR A 64 16.195 -7.929 3.698 1.00 62.13 H new ATOM 393 N GLY A 65 10.979 -14.602 4.045 1.00 54.32 N ATOM 394 CA GLY A 65 9.895 -15.523 4.333 1.00 25.30 C ATOM 395 C GLY A 65 10.112 -16.287 5.624 1.00 2.14 C ATOM 396 O GLY A 65 10.873 -15.854 6.490 1.00 1.33 O ATOM 0 H GLY A 65 10.972 -13.746 4.599 1.00 54.32 H new ATOM 0 HA2 GLY A 65 8.958 -14.969 4.395 1.00 25.30 H new ATOM 0 HA3 GLY A 65 9.794 -16.229 3.509 1.00 25.30 H new ATOM 400 N PHE A 66 9.440 -17.427 5.755 1.00 23.52 N ATOM 401 CA PHE A 66 9.561 -18.252 6.952 1.00 74.44 C ATOM 402 C PHE A 66 9.101 -17.488 8.189 1.00 62.43 C ATOM 403 O PHE A 66 9.732 -17.555 9.244 1.00 44.30 O ATOM 404 CB PHE A 66 11.008 -18.715 7.132 1.00 21.14 C ATOM 405 CG PHE A 66 11.629 -19.249 5.874 1.00 54.51 C ATOM 406 CD1 PHE A 66 11.360 -20.540 5.446 1.00 20.12 C ATOM 407 CD2 PHE A 66 12.482 -18.461 5.118 1.00 50.01 C ATOM 408 CE1 PHE A 66 11.929 -21.035 4.288 1.00 73.41 C ATOM 409 CE2 PHE A 66 13.054 -18.950 3.959 1.00 42.33 C ATOM 410 CZ PHE A 66 12.778 -20.239 3.544 1.00 31.10 C ATOM 0 H PHE A 66 8.807 -17.800 5.048 1.00 23.52 H new ATOM 0 HA PHE A 66 8.920 -19.125 6.828 1.00 74.44 H new ATOM 0 HB2 PHE A 66 11.606 -17.879 7.496 1.00 21.14 H new ATOM 0 HB3 PHE A 66 11.041 -19.488 7.900 1.00 21.14 H new ATOM 0 HD1 PHE A 66 10.698 -21.167 6.025 1.00 20.12 H new ATOM 0 HD2 PHE A 66 12.702 -17.453 5.438 1.00 50.01 H new ATOM 0 HE1 PHE A 66 11.710 -22.042 3.965 1.00 73.41 H new ATOM 0 HE2 PHE A 66 13.716 -18.325 3.378 1.00 42.33 H new ATOM 0 HZ PHE A 66 13.225 -20.623 2.639 1.00 31.10 H new ATOM 419 N ASP A 67 7.999 -16.759 8.051 1.00 45.14 N ATOM 420 CA ASP A 67 7.453 -15.980 9.156 1.00 32.03 C ATOM 421 C ASP A 67 5.927 -15.979 9.119 1.00 35.05 C ATOM 422 O ASP A 67 5.291 -14.976 8.800 1.00 11.03 O ATOM 423 CB ASP A 67 7.978 -14.544 9.106 1.00 1.54 C ATOM 424 CG ASP A 67 9.442 -14.450 9.485 1.00 12.33 C ATOM 425 OD1 ASP A 67 10.225 -13.890 8.690 1.00 64.11 O ATOM 426 OD2 ASP A 67 9.806 -14.937 10.576 1.00 61.31 O ATOM 0 H ASP A 67 7.466 -16.691 7.184 1.00 45.14 H new ATOM 0 HA ASP A 67 7.776 -16.444 10.088 1.00 32.03 H new ATOM 0 HB2 ASP A 67 7.839 -14.144 8.101 1.00 1.54 H new ATOM 0 HB3 ASP A 67 7.390 -13.922 9.781 1.00 1.54 H new ATOM 430 N PRO A 68 5.326 -17.131 9.453 1.00 14.34 N ATOM 431 CA PRO A 68 3.869 -17.290 9.465 1.00 74.53 C ATOM 432 C PRO A 68 3.211 -16.505 10.594 1.00 4.12 C ATOM 433 O PRO A 68 3.804 -16.304 11.654 1.00 33.11 O ATOM 434 CB PRO A 68 3.677 -18.793 9.676 1.00 55.05 C ATOM 435 CG PRO A 68 4.917 -19.240 10.370 1.00 62.22 C ATOM 436 CD PRO A 68 6.024 -18.368 9.844 1.00 3.21 C ATOM 0 HA PRO A 68 3.410 -16.913 8.551 1.00 74.53 H new ATOM 0 HB2 PRO A 68 2.791 -18.998 10.277 1.00 55.05 H new ATOM 0 HB3 PRO A 68 3.546 -19.312 8.727 1.00 55.05 H new ATOM 0 HG2 PRO A 68 4.818 -19.136 11.451 1.00 62.22 H new ATOM 0 HG3 PRO A 68 5.120 -20.292 10.168 1.00 62.22 H new ATOM 0 HD2 PRO A 68 6.782 -18.179 10.604 1.00 3.21 H new ATOM 0 HD3 PRO A 68 6.531 -18.829 8.996 1.00 3.21 H new ATOM 441 N THR A 69 1.978 -16.064 10.361 1.00 24.24 N ATOM 442 CA THR A 69 1.239 -15.300 11.359 1.00 1.55 C ATOM 443 C THR A 69 -0.261 -15.545 11.238 1.00 15.21 C ATOM 444 O THR A 69 -0.700 -16.384 10.453 1.00 4.11 O ATOM 445 CB THR A 69 1.513 -13.790 11.229 1.00 41.05 C ATOM 446 OG1 THR A 69 1.011 -13.308 9.977 1.00 24.52 O ATOM 447 CG2 THR A 69 3.003 -13.500 11.329 1.00 1.02 C ATOM 0 H THR A 69 1.471 -16.223 9.490 1.00 24.24 H new ATOM 0 HA THR A 69 1.583 -15.640 12.336 1.00 1.55 H new ATOM 0 HB THR A 69 1.004 -13.278 12.046 1.00 41.05 H new ATOM 0 HG1 THR A 69 1.187 -12.347 9.902 1.00 24.52 H new ATOM 0 HG21 THR A 69 3.172 -12.427 11.234 1.00 1.02 H new ATOM 0 HG22 THR A 69 3.376 -13.842 12.294 1.00 1.02 H new ATOM 0 HG23 THR A 69 3.530 -14.022 10.530 1.00 1.02 H new ATOM 468 N TYR A 71 -4.194 -15.281 10.305 1.00 12.02 N ATOM 469 CA TYR A 71 -4.825 -15.118 9.001 1.00 45.40 C ATOM 470 C TYR A 71 -6.182 -14.431 9.135 1.00 52.31 C ATOM 471 O TYR A 71 -7.167 -14.856 8.530 1.00 21.23 O ATOM 472 CB TYR A 71 -4.995 -16.478 8.320 1.00 62.22 C ATOM 473 CG TYR A 71 -3.761 -17.348 8.389 1.00 71.42 C ATOM 474 CD1 TYR A 71 -2.846 -17.375 7.342 1.00 51.42 C ATOM 475 CD2 TYR A 71 -3.508 -18.142 9.499 1.00 34.35 C ATOM 476 CE1 TYR A 71 -1.717 -18.169 7.401 1.00 42.33 C ATOM 477 CE2 TYR A 71 -2.381 -18.938 9.568 1.00 74.02 C ATOM 478 CZ TYR A 71 -1.488 -18.948 8.515 1.00 62.11 C ATOM 479 OH TYR A 71 -0.365 -19.740 8.578 1.00 71.44 O ATOM 0 HA TYR A 71 -4.178 -14.490 8.388 1.00 45.40 H new ATOM 0 HB2 TYR A 71 -5.828 -17.006 8.784 1.00 62.22 H new ATOM 0 HB3 TYR A 71 -5.260 -16.321 7.275 1.00 62.22 H new ATOM 0 HD1 TYR A 71 -3.021 -16.765 6.468 1.00 51.42 H new ATOM 0 HD2 TYR A 71 -4.205 -18.137 10.324 1.00 34.35 H new ATOM 0 HE1 TYR A 71 -1.017 -18.179 6.578 1.00 42.33 H new ATOM 0 HE2 TYR A 71 -2.200 -19.549 10.440 1.00 74.02 H new ATOM 0 HH TYR A 71 -0.353 -20.224 9.430 1.00 71.44 H new ATOM 488 N SER A 72 -6.222 -13.367 9.929 1.00 1.13 N ATOM 489 CA SER A 72 -7.457 -12.622 10.146 1.00 72.25 C ATOM 490 C SER A 72 -7.218 -11.429 11.066 1.00 72.55 C ATOM 491 O SER A 72 -6.971 -11.591 12.261 1.00 62.22 O ATOM 492 CB SER A 72 -8.530 -13.534 10.744 1.00 50.23 C ATOM 493 OG SER A 72 -7.987 -14.363 11.756 1.00 13.55 O ATOM 0 H SER A 72 -5.414 -13.001 10.433 1.00 1.13 H new ATOM 0 HA SER A 72 -7.802 -12.251 9.181 1.00 72.25 H new ATOM 0 HB2 SER A 72 -9.336 -12.929 11.159 1.00 50.23 H new ATOM 0 HB3 SER A 72 -8.966 -14.151 9.959 1.00 50.23 H new ATOM 0 HG SER A 72 -7.451 -13.820 12.371 1.00 13.55 H new ATOM 498 N PHE A 73 -7.290 -10.229 10.499 1.00 40.02 N ATOM 499 CA PHE A 73 -7.080 -9.007 11.267 1.00 65.14 C ATOM 500 C PHE A 73 -7.515 -7.781 10.468 1.00 53.30 C ATOM 501 O PHE A 73 -8.049 -7.903 9.366 1.00 54.35 O ATOM 502 CB PHE A 73 -5.608 -8.875 11.663 1.00 13.31 C ATOM 503 CG PHE A 73 -4.691 -8.644 10.496 1.00 5.21 C ATOM 504 CD1 PHE A 73 -4.084 -7.413 10.309 1.00 50.13 C ATOM 505 CD2 PHE A 73 -4.437 -9.658 9.587 1.00 42.44 C ATOM 506 CE1 PHE A 73 -3.240 -7.197 9.235 1.00 30.50 C ATOM 507 CE2 PHE A 73 -3.593 -9.448 8.512 1.00 65.23 C ATOM 508 CZ PHE A 73 -2.995 -8.215 8.336 1.00 11.13 C ATOM 0 H PHE A 73 -7.492 -10.077 9.511 1.00 40.02 H new ATOM 0 HA PHE A 73 -7.688 -9.066 12.170 1.00 65.14 H new ATOM 0 HB2 PHE A 73 -5.502 -8.049 12.367 1.00 13.31 H new ATOM 0 HB3 PHE A 73 -5.298 -9.780 12.185 1.00 13.31 H new ATOM 0 HD1 PHE A 73 -4.272 -6.613 11.010 1.00 50.13 H new ATOM 0 HD2 PHE A 73 -4.903 -10.623 9.719 1.00 42.44 H new ATOM 0 HE1 PHE A 73 -2.773 -6.233 9.100 1.00 30.50 H new ATOM 0 HE2 PHE A 73 -3.401 -10.247 7.811 1.00 65.23 H new ATOM 0 HZ PHE A 73 -2.337 -8.048 7.496 1.00 11.13 H new ATOM 517 N ILE A 74 -7.283 -6.601 11.033 1.00 74.34 N ATOM 518 CA ILE A 74 -7.649 -5.354 10.374 1.00 5.22 C ATOM 519 C ILE A 74 -6.412 -4.594 9.907 1.00 2.23 C ATOM 520 O ILE A 74 -5.495 -4.343 10.689 1.00 32.12 O ATOM 521 CB ILE A 74 -8.474 -4.447 11.305 1.00 25.01 C ATOM 522 CG1 ILE A 74 -9.682 -5.207 11.854 1.00 25.34 C ATOM 523 CG2 ILE A 74 -8.920 -3.194 10.566 1.00 44.50 C ATOM 524 CD1 ILE A 74 -10.481 -4.420 12.871 1.00 33.54 C ATOM 0 H ILE A 74 -6.843 -6.483 11.946 1.00 74.34 H new ATOM 0 HA ILE A 74 -8.256 -5.621 9.509 1.00 5.22 H new ATOM 0 HB ILE A 74 -7.846 -4.146 12.144 1.00 25.01 H new ATOM 0 HG12 ILE A 74 -10.335 -5.482 11.026 1.00 25.34 H new ATOM 0 HG13 ILE A 74 -9.340 -6.135 12.312 1.00 25.34 H new ATOM 0 HG21 ILE A 74 -9.502 -2.563 11.238 1.00 44.50 H new ATOM 0 HG22 ILE A 74 -8.044 -2.645 10.220 1.00 44.50 H new ATOM 0 HG23 ILE A 74 -9.533 -3.475 9.710 1.00 44.50 H new ATOM 0 HD11 ILE A 74 -11.322 -5.021 13.217 1.00 33.54 H new ATOM 0 HD12 ILE A 74 -9.843 -4.167 13.718 1.00 33.54 H new ATOM 0 HD13 ILE A 74 -10.854 -3.505 12.411 1.00 33.54 H new ATOM 535 N GLN A 75 -6.395 -4.230 8.629 1.00 3.04 N ATOM 536 CA GLN A 75 -5.270 -3.497 8.059 1.00 60.00 C ATOM 537 C GLN A 75 -5.453 -1.994 8.240 1.00 74.31 C ATOM 538 O GLN A 75 -6.323 -1.384 7.618 1.00 11.53 O ATOM 539 CB GLN A 75 -5.118 -3.830 6.574 1.00 65.23 C ATOM 540 CG GLN A 75 -3.903 -3.185 5.928 1.00 54.03 C ATOM 541 CD GLN A 75 -2.599 -3.632 6.561 1.00 55.44 C ATOM 542 OE1 GLN A 75 -1.753 -2.810 6.914 1.00 55.45 O ATOM 543 NE2 GLN A 75 -2.430 -4.941 6.706 1.00 4.43 N ATOM 0 H GLN A 75 -7.146 -4.430 7.969 1.00 3.04 H new ATOM 0 HA GLN A 75 -4.365 -3.800 8.586 1.00 60.00 H new ATOM 0 HB2 GLN A 75 -5.050 -4.912 6.458 1.00 65.23 H new ATOM 0 HB3 GLN A 75 -6.015 -3.508 6.044 1.00 65.23 H new ATOM 0 HG2 GLN A 75 -3.889 -3.428 4.866 1.00 54.03 H new ATOM 0 HG3 GLN A 75 -3.987 -2.101 6.006 1.00 54.03 H new ATOM 0 HE21 GLN A 75 -3.158 -5.586 6.399 1.00 4.43 H new ATOM 0 HE22 GLN A 75 -1.572 -5.301 7.124 1.00 4.43 H new ATOM 550 N PHE A 76 -4.626 -1.401 9.095 1.00 14.10 N ATOM 551 CA PHE A 76 -4.696 0.032 9.358 1.00 51.42 C ATOM 552 C PHE A 76 -3.837 0.810 8.365 1.00 43.25 C ATOM 553 O PHE A 76 -2.671 0.484 8.147 1.00 64.44 O ATOM 554 CB PHE A 76 -4.242 0.332 10.788 1.00 34.40 C ATOM 555 CG PHE A 76 -3.972 1.788 11.037 1.00 5.34 C ATOM 556 CD1 PHE A 76 -2.766 2.358 10.666 1.00 74.04 C ATOM 557 CD2 PHE A 76 -4.927 2.588 11.646 1.00 51.35 C ATOM 558 CE1 PHE A 76 -2.516 3.697 10.895 1.00 61.12 C ATOM 559 CE2 PHE A 76 -4.683 3.929 11.877 1.00 13.14 C ATOM 560 CZ PHE A 76 -3.476 4.484 11.501 1.00 40.32 C ATOM 0 H PHE A 76 -3.900 -1.891 9.618 1.00 14.10 H new ATOM 0 HA PHE A 76 -5.732 0.348 9.240 1.00 51.42 H new ATOM 0 HB2 PHE A 76 -5.008 -0.012 11.484 1.00 34.40 H new ATOM 0 HB3 PHE A 76 -3.338 -0.239 11.001 1.00 34.40 H new ATOM 0 HD1 PHE A 76 -2.011 1.748 10.192 1.00 74.04 H new ATOM 0 HD2 PHE A 76 -5.872 2.159 11.943 1.00 51.35 H new ATOM 0 HE1 PHE A 76 -1.571 4.128 10.600 1.00 61.12 H new ATOM 0 HE2 PHE A 76 -5.436 4.542 12.351 1.00 13.14 H new ATOM 0 HZ PHE A 76 -3.283 5.531 11.680 1.00 40.32 H new ATOM 569 N VAL A 77 -4.425 1.840 7.765 1.00 42.25 N ATOM 570 CA VAL A 77 -3.716 2.666 6.796 1.00 64.15 C ATOM 571 C VAL A 77 -4.080 4.139 6.957 1.00 1.42 C ATOM 572 O VAL A 77 -5.182 4.472 7.394 1.00 73.03 O ATOM 573 CB VAL A 77 -4.024 2.227 5.352 1.00 63.12 C ATOM 574 CG1 VAL A 77 -5.484 2.489 5.015 1.00 41.23 C ATOM 575 CG2 VAL A 77 -3.107 2.941 4.371 1.00 72.22 C ATOM 0 H VAL A 77 -5.391 2.122 7.933 1.00 42.25 H new ATOM 0 HA VAL A 77 -2.651 2.535 6.988 1.00 64.15 H new ATOM 0 HB VAL A 77 -3.843 1.155 5.270 1.00 63.12 H new ATOM 0 HG11 VAL A 77 -5.683 2.173 3.991 1.00 41.23 H new ATOM 0 HG12 VAL A 77 -6.121 1.928 5.699 1.00 41.23 H new ATOM 0 HG13 VAL A 77 -5.695 3.554 5.113 1.00 41.23 H new ATOM 0 HG21 VAL A 77 -3.339 2.619 3.356 1.00 72.22 H new ATOM 0 HG22 VAL A 77 -3.255 4.018 4.453 1.00 72.22 H new ATOM 0 HG23 VAL A 77 -2.069 2.699 4.601 1.00 72.22 H new ATOM 585 N ASP A 78 -3.148 5.015 6.600 1.00 32.51 N ATOM 586 CA ASP A 78 -3.370 6.453 6.703 1.00 11.44 C ATOM 587 C ASP A 78 -3.469 7.088 5.320 1.00 12.42 C ATOM 588 O ASP A 78 -2.663 6.821 4.428 1.00 3.25 O ATOM 589 CB ASP A 78 -2.242 7.109 7.501 1.00 63.23 C ATOM 590 CG ASP A 78 -2.264 6.718 8.965 1.00 32.04 C ATOM 591 OD1 ASP A 78 -3.363 6.693 9.556 1.00 43.41 O ATOM 592 OD2 ASP A 78 -1.182 6.437 9.521 1.00 60.52 O ATOM 0 H ASP A 78 -2.231 4.755 6.237 1.00 32.51 H new ATOM 0 HA ASP A 78 -4.314 6.614 7.224 1.00 11.44 H new ATOM 0 HB2 ASP A 78 -1.283 6.827 7.067 1.00 63.23 H new ATOM 0 HB3 ASP A 78 -2.324 8.193 7.416 1.00 63.23 H new ATOM 596 N PRO A 79 -4.482 7.948 5.135 1.00 13.31 N ATOM 597 CA PRO A 79 -4.711 8.639 3.863 1.00 53.54 C ATOM 598 C PRO A 79 -3.639 9.684 3.569 1.00 43.51 C ATOM 599 O PRO A 79 -3.362 9.995 2.410 1.00 45.12 O ATOM 600 CB PRO A 79 -6.071 9.310 4.063 1.00 52.55 C ATOM 601 CG PRO A 79 -6.194 9.484 5.537 1.00 10.40 C ATOM 602 CD PRO A 79 -5.481 8.313 6.153 1.00 34.23 C ATOM 0 HA PRO A 79 -4.679 7.954 3.016 1.00 53.54 H new ATOM 0 HB2 PRO A 79 -6.120 10.268 3.546 1.00 52.55 H new ATOM 0 HB3 PRO A 79 -6.879 8.693 3.668 1.00 52.55 H new ATOM 0 HG2 PRO A 79 -5.747 10.425 5.857 1.00 10.40 H new ATOM 0 HG3 PRO A 79 -7.240 9.508 5.841 1.00 10.40 H new ATOM 0 HD2 PRO A 79 -5.011 8.581 7.099 1.00 34.23 H new ATOM 0 HD3 PRO A 79 -6.165 7.489 6.359 1.00 34.23 H new ATOM 607 N LEU A 80 -3.039 10.221 4.625 1.00 45.04 N ATOM 608 CA LEU A 80 -1.997 11.232 4.481 1.00 61.21 C ATOM 609 C LEU A 80 -0.953 10.795 3.458 1.00 72.11 C ATOM 610 O LEU A 80 -0.885 11.336 2.353 1.00 4.32 O ATOM 611 CB LEU A 80 -1.326 11.497 5.830 1.00 64.21 C ATOM 612 CG LEU A 80 -2.090 12.408 6.792 1.00 75.35 C ATOM 613 CD1 LEU A 80 -3.274 11.672 7.398 1.00 71.01 C ATOM 614 CD2 LEU A 80 -1.165 12.926 7.883 1.00 74.34 C ATOM 0 H LEU A 80 -3.256 9.974 5.590 1.00 45.04 H new ATOM 0 HA LEU A 80 -2.463 12.152 4.127 1.00 61.21 H new ATOM 0 HB2 LEU A 80 -1.158 10.540 6.324 1.00 64.21 H new ATOM 0 HB3 LEU A 80 -0.346 11.937 5.646 1.00 64.21 H new ATOM 0 HG LEU A 80 -2.469 13.261 6.230 1.00 75.35 H new ATOM 0 HD11 LEU A 80 -3.805 12.336 8.080 1.00 71.01 H new ATOM 0 HD12 LEU A 80 -3.949 11.352 6.604 1.00 71.01 H new ATOM 0 HD13 LEU A 80 -2.918 10.799 7.946 1.00 71.01 H new ATOM 0 HD21 LEU A 80 -1.725 13.573 8.558 1.00 74.34 H new ATOM 0 HD22 LEU A 80 -0.755 12.085 8.442 1.00 74.34 H new ATOM 0 HD23 LEU A 80 -0.351 13.492 7.431 1.00 74.34 H new ATOM 625 N THR A 81 -0.142 9.811 3.832 1.00 13.01 N ATOM 626 CA THR A 81 0.898 9.300 2.948 1.00 73.24 C ATOM 627 C THR A 81 0.623 7.853 2.553 1.00 43.10 C ATOM 628 O THR A 81 0.790 7.473 1.395 1.00 63.10 O ATOM 629 CB THR A 81 2.288 9.385 3.606 1.00 22.41 C ATOM 630 OG1 THR A 81 3.244 8.654 2.830 1.00 5.03 O ATOM 631 CG2 THR A 81 2.249 8.834 5.024 1.00 73.22 C ATOM 0 H THR A 81 -0.185 9.352 4.742 1.00 13.01 H new ATOM 0 HA THR A 81 0.888 9.926 2.055 1.00 73.24 H new ATOM 0 HB THR A 81 2.582 10.434 3.648 1.00 22.41 H new ATOM 0 HG1 THR A 81 3.936 8.290 3.421 1.00 5.03 H new ATOM 0 HG21 THR A 81 3.242 8.904 5.469 1.00 73.22 H new ATOM 0 HG22 THR A 81 1.543 9.412 5.620 1.00 73.22 H new ATOM 0 HG23 THR A 81 1.935 7.790 5.000 1.00 73.22 H new ATOM 639 N GLY A 82 0.200 7.050 3.524 1.00 23.33 N ATOM 640 CA GLY A 82 -0.092 5.653 3.258 1.00 25.53 C ATOM 641 C GLY A 82 0.564 4.723 4.259 1.00 24.52 C ATOM 642 O GLY A 82 1.143 3.705 3.882 1.00 35.23 O ATOM 0 H GLY A 82 0.054 7.342 4.490 1.00 23.33 H new ATOM 0 HA2 GLY A 82 -1.171 5.500 3.278 1.00 25.53 H new ATOM 0 HA3 GLY A 82 0.247 5.399 2.254 1.00 25.53 H new ATOM 646 N ALA A 83 0.475 5.074 5.538 1.00 3.51 N ATOM 647 CA ALA A 83 1.063 4.262 6.596 1.00 32.12 C ATOM 648 C ALA A 83 0.634 2.804 6.473 1.00 64.23 C ATOM 649 O ALA A 83 -0.258 2.475 5.692 1.00 72.35 O ATOM 650 CB ALA A 83 0.680 4.814 7.961 1.00 62.12 C ATOM 0 H ALA A 83 0.001 5.916 5.866 1.00 3.51 H new ATOM 0 HA ALA A 83 2.147 4.304 6.491 1.00 32.12 H new ATOM 0 HB1 ALA A 83 1.126 4.197 8.741 1.00 62.12 H new ATOM 0 HB2 ALA A 83 1.044 5.837 8.055 1.00 62.12 H new ATOM 0 HB3 ALA A 83 -0.405 4.803 8.066 1.00 62.12 H new ATOM 656 N GLN A 84 1.273 1.936 7.250 1.00 73.32 N ATOM 657 CA GLN A 84 0.957 0.513 7.226 1.00 63.14 C ATOM 658 C GLN A 84 1.041 -0.087 8.625 1.00 21.43 C ATOM 659 O GLN A 84 2.113 -0.129 9.230 1.00 43.23 O ATOM 660 CB GLN A 84 1.908 -0.226 6.284 1.00 55.51 C ATOM 661 CG GLN A 84 3.265 0.443 6.141 1.00 52.30 C ATOM 662 CD GLN A 84 4.083 0.381 7.416 1.00 44.22 C ATOM 663 OE1 GLN A 84 4.568 -0.681 7.806 1.00 42.11 O ATOM 664 NE2 GLN A 84 4.241 1.524 8.074 1.00 52.14 N ATOM 0 H GLN A 84 2.012 2.193 7.904 1.00 73.32 H new ATOM 0 HA GLN A 84 -0.064 0.400 6.863 1.00 63.14 H new ATOM 0 HB2 GLN A 84 2.050 -1.243 6.650 1.00 55.51 H new ATOM 0 HB3 GLN A 84 1.445 -0.303 5.300 1.00 55.51 H new ATOM 0 HG2 GLN A 84 3.819 -0.037 5.334 1.00 52.30 H new ATOM 0 HG3 GLN A 84 3.124 1.485 5.855 1.00 52.30 H new ATOM 0 HE21 GLN A 84 3.821 2.381 7.715 1.00 52.14 H new ATOM 0 HE22 GLN A 84 4.782 1.544 8.939 1.00 52.14 H new ATOM 671 N ILE A 85 -0.095 -0.549 9.135 1.00 5.43 N ATOM 672 CA ILE A 85 -0.150 -1.147 10.464 1.00 43.42 C ATOM 673 C ILE A 85 -1.138 -2.308 10.504 1.00 61.24 C ATOM 674 O ILE A 85 -2.142 -2.306 9.793 1.00 74.25 O ATOM 675 CB ILE A 85 -0.549 -0.111 11.531 1.00 63.42 C ATOM 676 CG1 ILE A 85 0.395 1.092 11.484 1.00 33.41 C ATOM 677 CG2 ILE A 85 -0.539 -0.745 12.914 1.00 21.44 C ATOM 678 CD1 ILE A 85 1.781 0.794 12.016 1.00 45.22 C ATOM 0 H ILE A 85 -0.991 -0.521 8.648 1.00 5.43 H new ATOM 0 HA ILE A 85 0.851 -1.517 10.685 1.00 43.42 H new ATOM 0 HB ILE A 85 -1.560 0.236 11.319 1.00 63.42 H new ATOM 0 HG12 ILE A 85 0.477 1.439 10.454 1.00 33.41 H new ATOM 0 HG13 ILE A 85 -0.040 1.908 12.062 1.00 33.41 H new ATOM 0 HG21 ILE A 85 -0.823 -0.000 13.658 1.00 21.44 H new ATOM 0 HG22 ILE A 85 -1.248 -1.573 12.940 1.00 21.44 H new ATOM 0 HG23 ILE A 85 0.461 -1.117 13.137 1.00 21.44 H new ATOM 0 HD11 ILE A 85 2.396 1.692 11.952 1.00 45.22 H new ATOM 0 HD12 ILE A 85 1.711 0.475 13.056 1.00 45.22 H new ATOM 0 HD13 ILE A 85 2.235 0.000 11.423 1.00 45.22 H new ATOM 689 N GLU A 86 -0.846 -3.297 11.343 1.00 53.24 N ATOM 690 CA GLU A 86 -1.710 -4.464 11.476 1.00 14.40 C ATOM 691 C GLU A 86 -2.304 -4.544 12.880 1.00 75.42 C ATOM 692 O GLU A 86 -1.619 -4.910 13.834 1.00 74.41 O ATOM 693 CB GLU A 86 -0.927 -5.743 11.168 1.00 42.41 C ATOM 694 CG GLU A 86 0.434 -5.800 11.840 1.00 0.51 C ATOM 695 CD GLU A 86 1.535 -5.215 10.977 1.00 33.33 C ATOM 696 OE1 GLU A 86 2.245 -4.306 11.456 1.00 31.24 O ATOM 697 OE2 GLU A 86 1.686 -5.666 9.822 1.00 34.41 O ATOM 0 H GLU A 86 -0.019 -3.313 11.940 1.00 53.24 H new ATOM 0 HA GLU A 86 -2.526 -4.364 10.760 1.00 14.40 H new ATOM 0 HB2 GLU A 86 -1.515 -6.604 11.484 1.00 42.41 H new ATOM 0 HB3 GLU A 86 -0.794 -5.827 10.089 1.00 42.41 H new ATOM 0 HG2 GLU A 86 0.392 -5.258 12.785 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.675 -6.836 12.077 1.00 0.51 H new ATOM 702 N GLU A 87 -3.581 -4.197 12.996 1.00 44.23 N ATOM 703 CA GLU A 87 -4.267 -4.228 14.282 1.00 5.02 C ATOM 704 C GLU A 87 -5.630 -4.902 14.157 1.00 71.23 C ATOM 705 O GLU A 87 -6.069 -5.238 13.058 1.00 73.23 O ATOM 706 CB GLU A 87 -4.436 -2.809 14.829 1.00 61.00 C ATOM 707 CG GLU A 87 -3.121 -2.079 15.047 1.00 11.53 C ATOM 708 CD GLU A 87 -2.653 -2.138 16.488 1.00 3.21 C ATOM 709 OE1 GLU A 87 -1.873 -3.054 16.821 1.00 73.53 O ATOM 710 OE2 GLU A 87 -3.068 -1.268 17.283 1.00 63.13 O ATOM 0 H GLU A 87 -4.162 -3.891 12.215 1.00 44.23 H new ATOM 0 HA GLU A 87 -3.657 -4.807 14.975 1.00 5.02 H new ATOM 0 HB2 GLU A 87 -5.051 -2.233 14.137 1.00 61.00 H new ATOM 0 HB3 GLU A 87 -4.977 -2.855 15.774 1.00 61.00 H new ATOM 0 HG2 GLU A 87 -2.357 -2.514 14.403 1.00 11.53 H new ATOM 0 HG3 GLU A 87 -3.234 -1.037 14.748 1.00 11.53 H new ATOM 715 N ASN A 88 -6.295 -5.097 15.291 1.00 31.54 N ATOM 716 CA ASN A 88 -7.607 -5.732 15.309 1.00 34.43 C ATOM 717 C ASN A 88 -8.701 -4.711 15.609 1.00 14.42 C ATOM 718 O ASN A 88 -8.460 -3.504 15.593 1.00 53.42 O ATOM 719 CB ASN A 88 -7.640 -6.853 16.350 1.00 42.41 C ATOM 720 CG ASN A 88 -6.525 -7.861 16.151 1.00 72.52 C ATOM 721 OD1 ASN A 88 -6.316 -8.362 15.046 1.00 50.10 O ATOM 722 ND2 ASN A 88 -5.800 -8.162 17.223 1.00 44.25 N ATOM 0 H ASN A 88 -5.946 -4.824 16.210 1.00 31.54 H new ATOM 0 HA ASN A 88 -7.792 -6.157 14.322 1.00 34.43 H new ATOM 0 HB2 ASN A 88 -7.561 -6.421 17.348 1.00 42.41 H new ATOM 0 HB3 ASN A 88 -8.601 -7.364 16.299 1.00 42.41 H new ATOM 0 HD21 ASN A 88 -5.035 -8.833 17.149 1.00 44.25 H new ATOM 0 HD22 ASN A 88 -6.008 -7.722 18.120 1.00 44.25 H new ATOM 728 N VAL A 89 -9.904 -5.205 15.883 1.00 13.43 N ATOM 729 CA VAL A 89 -11.035 -4.338 16.189 1.00 52.25 C ATOM 730 C VAL A 89 -10.678 -3.332 17.277 1.00 21.45 C ATOM 731 O VAL A 89 -11.131 -2.187 17.252 1.00 1.31 O ATOM 732 CB VAL A 89 -12.262 -5.152 16.641 1.00 53.43 C ATOM 733 CG1 VAL A 89 -13.421 -4.228 16.981 1.00 11.02 C ATOM 734 CG2 VAL A 89 -12.663 -6.151 15.566 1.00 74.33 C ATOM 0 H VAL A 89 -10.120 -6.202 15.899 1.00 13.43 H new ATOM 0 HA VAL A 89 -11.281 -3.804 15.271 1.00 52.25 H new ATOM 0 HB VAL A 89 -11.997 -5.707 17.541 1.00 53.43 H new ATOM 0 HG11 VAL A 89 -14.279 -4.821 17.298 1.00 11.02 H new ATOM 0 HG12 VAL A 89 -13.126 -3.556 17.787 1.00 11.02 H new ATOM 0 HG13 VAL A 89 -13.690 -3.643 16.102 1.00 11.02 H new ATOM 0 HG21 VAL A 89 -13.531 -6.718 15.902 1.00 74.33 H new ATOM 0 HG22 VAL A 89 -12.910 -5.618 14.648 1.00 74.33 H new ATOM 0 HG23 VAL A 89 -11.835 -6.834 15.377 1.00 74.33 H new ATOM 744 N TYR A 90 -9.862 -3.766 18.230 1.00 22.44 N ATOM 745 CA TYR A 90 -9.444 -2.904 19.331 1.00 43.45 C ATOM 746 C TYR A 90 -8.101 -2.248 19.028 1.00 33.21 C ATOM 747 O TYR A 90 -7.291 -2.023 19.927 1.00 31.22 O ATOM 748 CB TYR A 90 -9.352 -3.706 20.630 1.00 41.35 C ATOM 749 CG TYR A 90 -10.540 -4.611 20.867 1.00 72.30 C ATOM 750 CD1 TYR A 90 -11.758 -4.094 21.290 1.00 23.25 C ATOM 751 CD2 TYR A 90 -10.445 -5.983 20.668 1.00 31.23 C ATOM 752 CE1 TYR A 90 -12.846 -4.917 21.510 1.00 54.24 C ATOM 753 CE2 TYR A 90 -11.527 -6.813 20.883 1.00 11.15 C ATOM 754 CZ TYR A 90 -12.725 -6.276 21.304 1.00 25.24 C ATOM 755 OH TYR A 90 -13.807 -7.099 21.521 1.00 64.25 O ATOM 0 H TYR A 90 -9.476 -4.710 18.263 1.00 22.44 H new ATOM 0 HA TYR A 90 -10.193 -2.121 19.450 1.00 43.45 H new ATOM 0 HB2 TYR A 90 -8.444 -4.309 20.612 1.00 41.35 H new ATOM 0 HB3 TYR A 90 -9.259 -3.015 21.468 1.00 41.35 H new ATOM 0 HD1 TYR A 90 -11.856 -3.030 21.450 1.00 23.25 H new ATOM 0 HD2 TYR A 90 -9.508 -6.408 20.339 1.00 31.23 H new ATOM 0 HE1 TYR A 90 -13.785 -4.499 21.841 1.00 54.24 H new ATOM 0 HE2 TYR A 90 -11.436 -7.877 20.722 1.00 11.15 H new ATOM 0 HH TYR A 90 -13.556 -8.027 21.329 1.00 64.25 H new ATOM 764 N ALA A 91 -7.871 -1.943 17.755 1.00 71.30 N ATOM 765 CA ALA A 91 -6.627 -1.311 17.333 1.00 45.13 C ATOM 766 C ALA A 91 -6.293 -0.113 18.216 1.00 22.12 C ATOM 767 O ALA A 91 -7.097 0.808 18.359 1.00 12.30 O ATOM 768 CB ALA A 91 -6.720 -0.886 15.875 1.00 70.40 C ATOM 0 H ALA A 91 -8.530 -2.123 16.998 1.00 71.30 H new ATOM 0 HA ALA A 91 -5.824 -2.040 17.437 1.00 45.13 H new ATOM 0 HB1 ALA A 91 -5.784 -0.415 15.573 1.00 70.40 H new ATOM 0 HB2 ALA A 91 -6.904 -1.761 15.252 1.00 70.40 H new ATOM 0 HB3 ALA A 91 -7.539 -0.176 15.754 1.00 70.40 H new ATOM 774 N ASP A 92 -5.103 -0.132 18.805 1.00 20.14 N ATOM 775 CA ASP A 92 -4.662 0.953 19.675 1.00 41.12 C ATOM 776 C ASP A 92 -3.655 1.847 18.959 1.00 53.11 C ATOM 777 O ASP A 92 -2.740 1.359 18.295 1.00 44.05 O ATOM 778 CB ASP A 92 -4.045 0.391 20.955 1.00 14.33 C ATOM 779 CG ASP A 92 -4.179 1.341 22.129 1.00 0.23 C ATOM 780 OD1 ASP A 92 -3.726 2.499 22.010 1.00 73.10 O ATOM 781 OD2 ASP A 92 -4.738 0.927 23.166 1.00 74.01 O ATOM 0 H ASP A 92 -4.426 -0.887 18.696 1.00 20.14 H new ATOM 0 HA ASP A 92 -5.533 1.554 19.936 1.00 41.12 H new ATOM 0 HB2 ASP A 92 -4.526 -0.556 21.201 1.00 14.33 H new ATOM 0 HB3 ASP A 92 -2.990 0.178 20.783 1.00 14.33 H new ATOM 785 N ILE A 93 -3.830 3.156 19.098 1.00 22.44 N ATOM 786 CA ILE A 93 -2.935 4.118 18.466 1.00 45.42 C ATOM 787 C ILE A 93 -1.508 3.960 18.976 1.00 34.31 C ATOM 788 O ILE A 93 -0.547 4.212 18.249 1.00 33.14 O ATOM 789 CB ILE A 93 -3.400 5.566 18.713 1.00 12.01 C ATOM 790 CG1 ILE A 93 -4.894 5.703 18.418 1.00 44.11 C ATOM 791 CG2 ILE A 93 -2.594 6.534 17.860 1.00 53.52 C ATOM 792 CD1 ILE A 93 -5.281 5.245 17.029 1.00 74.32 C ATOM 0 H ILE A 93 -4.583 3.576 19.643 1.00 22.44 H new ATOM 0 HA ILE A 93 -2.959 3.915 17.395 1.00 45.42 H new ATOM 0 HB ILE A 93 -3.233 5.811 19.762 1.00 12.01 H new ATOM 0 HG12 ILE A 93 -5.455 5.125 19.152 1.00 44.11 H new ATOM 0 HG13 ILE A 93 -5.186 6.746 18.542 1.00 44.11 H new ATOM 0 HG21 ILE A 93 -2.934 7.553 18.046 1.00 53.52 H new ATOM 0 HG22 ILE A 93 -1.538 6.452 18.116 1.00 53.52 H new ATOM 0 HG23 ILE A 93 -2.732 6.292 16.806 1.00 53.52 H new ATOM 0 HD11 ILE A 93 -6.355 5.371 16.890 1.00 74.32 H new ATOM 0 HD12 ILE A 93 -4.747 5.840 16.288 1.00 74.32 H new ATOM 0 HD13 ILE A 93 -5.020 4.194 16.907 1.00 74.32 H new ATOM 803 N ARG A 94 -1.377 3.538 20.230 1.00 60.41 N ATOM 804 CA ARG A 94 -0.066 3.346 20.837 1.00 33.44 C ATOM 805 C ARG A 94 0.837 2.513 19.931 1.00 42.50 C ATOM 806 O ARG A 94 2.035 2.773 19.823 1.00 72.11 O ATOM 807 CB ARG A 94 -0.206 2.663 22.200 1.00 65.45 C ATOM 808 CG ARG A 94 1.122 2.399 22.889 1.00 71.22 C ATOM 809 CD ARG A 94 1.840 3.695 23.230 1.00 1.15 C ATOM 810 NE ARG A 94 1.069 4.519 24.157 1.00 22.33 N ATOM 811 CZ ARG A 94 0.905 4.225 25.442 1.00 2.31 C ATOM 812 NH1 ARG A 94 1.456 3.132 25.950 1.00 53.12 N ATOM 813 NH2 ARG A 94 0.189 5.025 26.221 1.00 2.14 N ATOM 0 H ARG A 94 -2.162 3.323 20.844 1.00 60.41 H new ATOM 0 HA ARG A 94 0.389 4.327 20.974 1.00 33.44 H new ATOM 0 HB2 ARG A 94 -0.824 3.286 22.847 1.00 65.45 H new ATOM 0 HB3 ARG A 94 -0.733 1.717 22.071 1.00 65.45 H new ATOM 0 HG2 ARG A 94 0.953 1.825 23.800 1.00 71.22 H new ATOM 0 HG3 ARG A 94 1.754 1.791 22.242 1.00 71.22 H new ATOM 0 HD2 ARG A 94 2.811 3.467 23.669 1.00 1.15 H new ATOM 0 HD3 ARG A 94 2.028 4.257 22.315 1.00 1.15 H new ATOM 0 HE ARG A 94 0.632 5.368 23.798 1.00 22.33 H new ATOM 0 HH11 ARG A 94 2.007 2.515 25.354 1.00 53.12 H new ATOM 0 HH12 ARG A 94 1.329 2.908 26.937 1.00 53.12 H new ATOM 0 HH21 ARG A 94 -0.236 5.867 25.833 1.00 2.14 H new ATOM 0 HH22 ARG A 94 0.064 4.798 27.208 1.00 2.14 H new ATOM 824 N ASP A 95 0.253 1.512 19.282 1.00 2.33 N ATOM 825 CA ASP A 95 1.002 0.641 18.384 1.00 73.42 C ATOM 826 C ASP A 95 1.218 1.313 17.031 1.00 13.44 C ATOM 827 O ASP A 95 2.238 1.096 16.376 1.00 55.12 O ATOM 828 CB ASP A 95 0.270 -0.688 18.197 1.00 3.30 C ATOM 829 CG ASP A 95 1.221 -1.851 18.000 1.00 75.24 C ATOM 830 OD1 ASP A 95 2.416 -1.601 17.735 1.00 33.14 O ATOM 831 OD2 ASP A 95 0.772 -3.012 18.109 1.00 72.13 O ATOM 0 H ASP A 95 -0.738 1.283 19.361 1.00 2.33 H new ATOM 0 HA ASP A 95 1.976 0.448 18.834 1.00 73.42 H new ATOM 0 HB2 ASP A 95 -0.357 -0.879 19.068 1.00 3.30 H new ATOM 0 HB3 ASP A 95 -0.394 -0.616 17.335 1.00 3.30 H new ATOM 835 N ILE A 96 0.252 2.125 16.619 1.00 62.42 N ATOM 836 CA ILE A 96 0.336 2.828 15.345 1.00 35.14 C ATOM 837 C ILE A 96 1.563 3.732 15.295 1.00 31.35 C ATOM 838 O ILE A 96 2.412 3.594 14.416 1.00 74.43 O ATOM 839 CB ILE A 96 -0.922 3.675 15.085 1.00 41.23 C ATOM 840 CG1 ILE A 96 -2.180 2.813 15.211 1.00 52.51 C ATOM 841 CG2 ILE A 96 -0.852 4.319 13.708 1.00 1.21 C ATOM 842 CD1 ILE A 96 -2.332 1.800 14.099 1.00 55.42 C ATOM 0 H ILE A 96 -0.599 2.313 17.149 1.00 62.42 H new ATOM 0 HA ILE A 96 0.417 2.066 14.570 1.00 35.14 H new ATOM 0 HB ILE A 96 -0.969 4.466 15.834 1.00 41.23 H new ATOM 0 HG12 ILE A 96 -2.158 2.290 16.167 1.00 52.51 H new ATOM 0 HG13 ILE A 96 -3.056 3.462 15.222 1.00 52.51 H new ATOM 0 HG21 ILE A 96 -1.749 4.915 13.539 1.00 1.21 H new ATOM 0 HG22 ILE A 96 0.027 4.962 13.651 1.00 1.21 H new ATOM 0 HG23 ILE A 96 -0.783 3.542 12.946 1.00 1.21 H new ATOM 0 HD11 ILE A 96 -3.245 1.225 14.253 1.00 55.42 H new ATOM 0 HD12 ILE A 96 -2.386 2.317 13.141 1.00 55.42 H new ATOM 0 HD13 ILE A 96 -1.475 1.127 14.100 1.00 55.42 H new ATOM 853 N GLN A 97 1.651 4.655 16.247 1.00 3.22 N ATOM 854 CA GLN A 97 2.774 5.581 16.313 1.00 73.40 C ATOM 855 C GLN A 97 4.099 4.827 16.363 1.00 1.33 C ATOM 856 O GLN A 97 5.107 5.289 15.831 1.00 71.13 O ATOM 857 CB GLN A 97 2.644 6.489 17.538 1.00 60.45 C ATOM 858 CG GLN A 97 3.391 7.806 17.400 1.00 70.22 C ATOM 859 CD GLN A 97 3.426 8.595 18.695 1.00 11.30 C ATOM 860 OE1 GLN A 97 3.543 8.025 19.779 1.00 12.04 O ATOM 861 NE2 GLN A 97 3.323 9.915 18.587 1.00 51.41 N ATOM 0 H GLN A 97 0.957 4.781 16.984 1.00 3.22 H new ATOM 0 HA GLN A 97 2.759 6.194 15.412 1.00 73.40 H new ATOM 0 HB2 GLN A 97 1.589 6.696 17.716 1.00 60.45 H new ATOM 0 HB3 GLN A 97 3.017 5.959 18.414 1.00 60.45 H new ATOM 0 HG2 GLN A 97 4.411 7.608 17.072 1.00 70.22 H new ATOM 0 HG3 GLN A 97 2.918 8.408 16.624 1.00 70.22 H new ATOM 0 HE21 GLN A 97 3.228 10.346 17.667 1.00 51.41 H new ATOM 0 HE22 GLN A 97 3.339 10.498 19.424 1.00 51.41 H new ATOM 868 N GLU A 98 4.088 3.665 17.008 1.00 15.23 N ATOM 869 CA GLU A 98 5.289 2.847 17.128 1.00 72.41 C ATOM 870 C GLU A 98 5.948 2.644 15.766 1.00 24.23 C ATOM 871 O GLU A 98 7.094 3.041 15.554 1.00 43.34 O ATOM 872 CB GLU A 98 4.951 1.491 17.751 1.00 30.11 C ATOM 873 CG GLU A 98 6.124 0.838 18.463 1.00 44.31 C ATOM 874 CD GLU A 98 7.092 0.172 17.504 1.00 41.52 C ATOM 875 OE1 GLU A 98 8.304 0.458 17.591 1.00 4.32 O ATOM 876 OE2 GLU A 98 6.637 -0.634 16.665 1.00 11.15 O ATOM 0 H GLU A 98 3.261 3.269 17.455 1.00 15.23 H new ATOM 0 HA GLU A 98 5.990 3.371 17.777 1.00 72.41 H new ATOM 0 HB2 GLU A 98 4.133 1.620 18.460 1.00 30.11 H new ATOM 0 HB3 GLU A 98 4.593 0.821 16.970 1.00 30.11 H new ATOM 0 HG2 GLU A 98 6.655 1.591 19.045 1.00 44.31 H new ATOM 0 HG3 GLU A 98 5.749 0.096 19.168 1.00 44.31 H new ATOM 881 N ARG A 99 5.215 2.022 14.849 1.00 34.32 N ATOM 882 CA ARG A 99 5.728 1.764 13.509 1.00 35.11 C ATOM 883 C ARG A 99 5.674 3.026 12.654 1.00 54.34 C ATOM 884 O ARG A 99 6.490 3.213 11.750 1.00 12.53 O ATOM 885 CB ARG A 99 4.927 0.646 12.839 1.00 44.43 C ATOM 886 CG ARG A 99 5.786 -0.492 12.316 1.00 73.14 C ATOM 887 CD ARG A 99 6.415 -1.284 13.452 1.00 61.11 C ATOM 888 NE ARG A 99 7.797 -0.883 13.699 1.00 21.33 N ATOM 889 CZ ARG A 99 8.682 -1.647 14.329 1.00 13.22 C ATOM 890 NH1 ARG A 99 8.331 -2.847 14.773 1.00 63.15 N ATOM 891 NH2 ARG A 99 9.922 -1.213 14.516 1.00 23.24 N ATOM 0 H ARG A 99 4.265 1.688 15.009 1.00 34.32 H new ATOM 0 HA ARG A 99 6.768 1.452 13.600 1.00 35.11 H new ATOM 0 HB2 ARG A 99 4.208 0.247 13.555 1.00 44.43 H new ATOM 0 HB3 ARG A 99 4.354 1.067 12.012 1.00 44.43 H new ATOM 0 HG2 ARG A 99 5.178 -1.156 11.702 1.00 73.14 H new ATOM 0 HG3 ARG A 99 6.570 -0.092 11.673 1.00 73.14 H new ATOM 0 HD2 ARG A 99 5.829 -1.143 14.360 1.00 61.11 H new ATOM 0 HD3 ARG A 99 6.383 -2.347 13.214 1.00 61.11 H new ATOM 0 HE ARG A 99 8.099 0.034 13.370 1.00 21.33 H new ATOM 0 HH11 ARG A 99 7.379 -3.185 14.631 1.00 63.15 H new ATOM 0 HH12 ARG A 99 9.013 -3.431 15.256 1.00 63.15 H new ATOM 0 HH21 ARG A 99 10.197 -0.291 14.176 1.00 23.24 H new ATOM 0 HH22 ARG A 99 10.601 -1.801 15.000 1.00 23.24 H new ATOM 902 N PHE A 100 4.708 3.890 12.945 1.00 65.15 N ATOM 903 CA PHE A 100 4.546 5.135 12.201 1.00 22.44 C ATOM 904 C PHE A 100 5.871 5.885 12.101 1.00 2.41 C ATOM 905 O PHE A 100 6.112 6.614 11.139 1.00 14.14 O ATOM 906 CB PHE A 100 3.495 6.021 12.873 1.00 63.02 C ATOM 907 CG PHE A 100 3.081 7.198 12.036 1.00 22.24 C ATOM 908 CD1 PHE A 100 2.743 7.033 10.703 1.00 64.23 C ATOM 909 CD2 PHE A 100 3.030 8.470 12.584 1.00 25.50 C ATOM 910 CE1 PHE A 100 2.362 8.114 9.931 1.00 41.13 C ATOM 911 CE2 PHE A 100 2.649 9.554 11.817 1.00 65.15 C ATOM 912 CZ PHE A 100 2.315 9.377 10.488 1.00 33.41 C ATOM 0 H PHE A 100 4.025 3.752 13.690 1.00 65.15 H new ATOM 0 HA PHE A 100 4.212 4.887 11.193 1.00 22.44 H new ATOM 0 HB2 PHE A 100 2.615 5.419 13.100 1.00 63.02 H new ATOM 0 HB3 PHE A 100 3.889 6.381 13.823 1.00 63.02 H new ATOM 0 HD1 PHE A 100 2.778 6.048 10.262 1.00 64.23 H new ATOM 0 HD2 PHE A 100 3.291 8.615 13.622 1.00 25.50 H new ATOM 0 HE1 PHE A 100 2.101 7.971 8.893 1.00 41.13 H new ATOM 0 HE2 PHE A 100 2.612 10.540 12.256 1.00 65.15 H new ATOM 0 HZ PHE A 100 2.018 10.224 9.887 1.00 33.41 H new ATOM 921 N SER A 101 6.726 5.701 13.102 1.00 45.31 N ATOM 922 CA SER A 101 8.025 6.362 13.130 1.00 63.11 C ATOM 923 C SER A 101 8.791 6.111 11.835 1.00 40.31 C ATOM 924 O SER A 101 9.506 6.983 11.346 1.00 54.34 O ATOM 925 CB SER A 101 8.845 5.873 14.325 1.00 10.41 C ATOM 926 OG SER A 101 9.221 4.517 14.163 1.00 14.21 O ATOM 0 H SER A 101 6.542 5.099 13.905 1.00 45.31 H new ATOM 0 HA SER A 101 7.857 7.434 13.229 1.00 63.11 H new ATOM 0 HB2 SER A 101 9.736 6.490 14.436 1.00 10.41 H new ATOM 0 HB3 SER A 101 8.264 5.986 15.240 1.00 10.41 H new ATOM 0 HG SER A 101 8.562 3.940 14.602 1.00 14.21 H new ATOM 931 N GLU A 102 8.633 4.910 11.286 1.00 72.30 N ATOM 932 CA GLU A 102 9.311 4.542 10.049 1.00 54.03 C ATOM 933 C GLU A 102 8.789 5.368 8.876 1.00 61.12 C ATOM 934 O GLU A 102 9.544 5.734 7.975 1.00 22.21 O ATOM 935 CB GLU A 102 9.121 3.051 9.761 1.00 70.43 C ATOM 936 CG GLU A 102 7.777 2.718 9.133 1.00 62.34 C ATOM 937 CD GLU A 102 7.789 2.858 7.623 1.00 11.33 C ATOM 938 OE1 GLU A 102 8.872 3.117 7.058 1.00 13.31 O ATOM 939 OE2 GLU A 102 6.713 2.705 7.006 1.00 22.54 O ATOM 0 H GLU A 102 8.042 4.177 11.678 1.00 72.30 H new ATOM 0 HA GLU A 102 10.374 4.748 10.172 1.00 54.03 H new ATOM 0 HB2 GLU A 102 9.916 2.714 9.096 1.00 70.43 H new ATOM 0 HB3 GLU A 102 9.226 2.494 10.692 1.00 70.43 H new ATOM 0 HG2 GLU A 102 7.499 1.698 9.398 1.00 62.34 H new ATOM 0 HG3 GLU A 102 7.013 3.375 9.549 1.00 62.34 H new ATOM 944 N VAL A 103 7.492 5.657 8.895 1.00 62.23 N ATOM 945 CA VAL A 103 6.868 6.441 7.835 1.00 5.41 C ATOM 946 C VAL A 103 7.301 7.901 7.902 1.00 0.45 C ATOM 947 O VAL A 103 7.784 8.461 6.918 1.00 24.35 O ATOM 948 CB VAL A 103 5.331 6.369 7.915 1.00 54.25 C ATOM 949 CG1 VAL A 103 4.699 7.244 6.844 1.00 72.44 C ATOM 950 CG2 VAL A 103 4.858 4.928 7.784 1.00 75.34 C ATOM 0 H VAL A 103 6.853 5.360 9.632 1.00 62.23 H new ATOM 0 HA VAL A 103 7.197 6.011 6.889 1.00 5.41 H new ATOM 0 HB VAL A 103 5.017 6.744 8.889 1.00 54.25 H new ATOM 0 HG11 VAL A 103 3.613 7.180 6.916 1.00 72.44 H new ATOM 0 HG12 VAL A 103 5.012 8.278 6.987 1.00 72.44 H new ATOM 0 HG13 VAL A 103 5.018 6.902 5.860 1.00 72.44 H new ATOM 0 HG21 VAL A 103 3.770 4.895 7.843 1.00 75.34 H new ATOM 0 HG22 VAL A 103 5.182 4.525 6.825 1.00 75.34 H new ATOM 0 HG23 VAL A 103 5.283 4.331 8.591 1.00 75.34 H new ATOM 960 N ARG A 104 7.125 8.511 9.070 1.00 12.41 N ATOM 961 CA ARG A 104 7.497 9.907 9.266 1.00 31.42 C ATOM 962 C ARG A 104 8.987 10.114 9.008 1.00 51.24 C ATOM 963 O ARG A 104 9.397 11.138 8.460 1.00 41.10 O ATOM 964 CB ARG A 104 7.148 10.355 10.687 1.00 2.21 C ATOM 965 CG ARG A 104 7.359 11.841 10.925 1.00 23.41 C ATOM 966 CD ARG A 104 6.581 12.327 12.139 1.00 32.24 C ATOM 967 NE ARG A 104 7.243 11.971 13.391 1.00 31.21 N ATOM 968 CZ ARG A 104 8.373 12.530 13.810 1.00 13.41 C ATOM 969 NH1 ARG A 104 8.963 13.467 13.080 1.00 12.14 N ATOM 970 NH2 ARG A 104 8.914 12.153 14.961 1.00 11.15 N ATOM 0 H ARG A 104 6.727 8.061 9.894 1.00 12.41 H new ATOM 0 HA ARG A 104 6.935 10.510 8.553 1.00 31.42 H new ATOM 0 HB2 ARG A 104 6.107 10.107 10.892 1.00 2.21 H new ATOM 0 HB3 ARG A 104 7.755 9.792 11.396 1.00 2.21 H new ATOM 0 HG2 ARG A 104 8.421 12.040 11.068 1.00 23.41 H new ATOM 0 HG3 ARG A 104 7.046 12.400 10.043 1.00 23.41 H new ATOM 0 HD2 ARG A 104 6.464 13.409 12.085 1.00 32.24 H new ATOM 0 HD3 ARG A 104 5.579 11.897 12.124 1.00 32.24 H new ATOM 0 HE ARG A 104 6.814 11.254 13.976 1.00 31.21 H new ATOM 0 HH11 ARG A 104 8.549 13.760 12.195 1.00 12.14 H new ATOM 0 HH12 ARG A 104 9.831 13.895 13.404 1.00 12.14 H new ATOM 0 HH21 ARG A 104 8.462 11.433 15.525 1.00 11.15 H new ATOM 0 HH22 ARG A 104 9.782 12.583 15.282 1.00 11.15 H new ATOM 981 N LYS A 105 9.793 9.135 9.407 1.00 41.23 N ATOM 982 CA LYS A 105 11.237 9.208 9.218 1.00 23.02 C ATOM 983 C LYS A 105 11.597 9.134 7.738 1.00 41.44 C ATOM 984 O LYS A 105 12.351 9.963 7.229 1.00 53.21 O ATOM 985 CB LYS A 105 11.929 8.076 9.980 1.00 64.23 C ATOM 986 CG LYS A 105 12.164 8.387 11.448 1.00 13.32 C ATOM 987 CD LYS A 105 13.467 9.140 11.657 1.00 21.51 C ATOM 988 CE LYS A 105 13.789 9.297 13.136 1.00 73.35 C ATOM 989 NZ LYS A 105 14.359 8.049 13.715 1.00 71.55 N ATOM 0 H LYS A 105 9.470 8.282 9.863 1.00 41.23 H new ATOM 0 HA LYS A 105 11.582 10.165 9.609 1.00 23.02 H new ATOM 0 HB2 LYS A 105 11.324 7.173 9.901 1.00 64.23 H new ATOM 0 HB3 LYS A 105 12.886 7.861 9.505 1.00 64.23 H new ATOM 0 HG2 LYS A 105 11.334 8.980 11.832 1.00 13.32 H new ATOM 0 HG3 LYS A 105 12.184 7.459 12.019 1.00 13.32 H new ATOM 0 HD2 LYS A 105 14.279 8.609 11.161 1.00 21.51 H new ATOM 0 HD3 LYS A 105 13.399 10.123 11.192 1.00 21.51 H new ATOM 0 HE2 LYS A 105 14.497 10.115 13.269 1.00 73.35 H new ATOM 0 HE3 LYS A 105 12.883 9.568 13.678 1.00 73.35 H new ATOM 0 HZ1 LYS A 105 14.565 8.197 14.724 1.00 71.55 H new ATOM 0 HZ2 LYS A 105 13.674 7.274 13.611 1.00 71.55 H new ATOM 0 HZ3 LYS A 105 15.237 7.804 13.215 1.00 71.55 H new ATOM 999 N LYS A 106 11.052 8.135 7.051 1.00 62.20 N ATOM 1000 CA LYS A 106 11.313 7.952 5.628 1.00 21.42 C ATOM 1001 C LYS A 106 10.778 9.131 4.821 1.00 3.24 C ATOM 1002 O LYS A 106 11.370 9.529 3.819 1.00 71.23 O ATOM 1003 CB LYS A 106 10.676 6.651 5.134 1.00 20.33 C ATOM 1004 CG LYS A 106 11.641 5.478 5.099 1.00 45.20 C ATOM 1005 CD LYS A 106 11.372 4.571 3.910 1.00 42.33 C ATOM 1006 CE LYS A 106 10.343 3.502 4.244 1.00 31.03 C ATOM 1007 NZ LYS A 106 10.986 2.227 4.666 1.00 42.43 N ATOM 0 H LYS A 106 10.426 7.439 7.457 1.00 62.20 H new ATOM 0 HA LYS A 106 12.392 7.897 5.486 1.00 21.42 H new ATOM 0 HB2 LYS A 106 9.835 6.400 5.780 1.00 20.33 H new ATOM 0 HB3 LYS A 106 10.274 6.810 4.134 1.00 20.33 H new ATOM 0 HG2 LYS A 106 12.665 5.849 5.051 1.00 45.20 H new ATOM 0 HG3 LYS A 106 11.553 4.905 6.022 1.00 45.20 H new ATOM 0 HD2 LYS A 106 11.018 5.168 3.069 1.00 42.33 H new ATOM 0 HD3 LYS A 106 12.302 4.097 3.596 1.00 42.33 H new ATOM 0 HE2 LYS A 106 9.691 3.861 5.040 1.00 31.03 H new ATOM 0 HE3 LYS A 106 9.712 3.320 3.374 1.00 31.03 H new ATOM 0 HZ1 LYS A 106 10.252 1.524 4.885 1.00 42.43 H new ATOM 0 HZ2 LYS A 106 11.588 1.871 3.897 1.00 42.43 H new ATOM 0 HZ3 LYS A 106 11.568 2.395 5.512 1.00 42.43 H new ATOM 1017 N MET A 107 9.654 9.684 5.266 1.00 42.15 N ATOM 1018 CA MET A 107 9.041 10.820 4.585 1.00 13.42 C ATOM 1019 C MET A 107 9.927 12.057 4.685 1.00 24.14 C ATOM 1020 O MET A 107 10.367 12.602 3.673 1.00 44.10 O ATOM 1021 CB MET A 107 7.663 11.116 5.181 1.00 15.53 C ATOM 1022 CG MET A 107 6.510 10.656 4.303 1.00 52.43 C ATOM 1023 SD MET A 107 6.571 8.891 3.944 1.00 53.52 S ATOM 1024 CE MET A 107 6.493 8.906 2.155 1.00 75.32 C ATOM 0 H MET A 107 9.150 9.365 6.093 1.00 42.15 H new ATOM 0 HA MET A 107 8.926 10.562 3.532 1.00 13.42 H new ATOM 0 HB2 MET A 107 7.585 10.630 6.154 1.00 15.53 H new ATOM 0 HB3 MET A 107 7.573 12.189 5.352 1.00 15.53 H new ATOM 0 HG2 MET A 107 5.567 10.890 4.797 1.00 52.43 H new ATOM 0 HG3 MET A 107 6.527 11.214 3.367 1.00 52.43 H new ATOM 0 HE1 MET A 107 6.521 7.883 1.781 1.00 75.32 H new ATOM 0 HE2 MET A 107 5.567 9.384 1.835 1.00 75.32 H new ATOM 0 HE3 MET A 107 7.343 9.461 1.758 1.00 75.32 H new ATOM 1032 N VAL A 108 10.186 12.496 5.913 1.00 62.21 N ATOM 1033 CA VAL A 108 11.020 13.669 6.145 1.00 22.33 C ATOM 1034 C VAL A 108 12.417 13.474 5.566 1.00 1.23 C ATOM 1035 O VAL A 108 13.050 14.426 5.115 1.00 64.54 O ATOM 1036 CB VAL A 108 11.140 13.984 7.648 1.00 1.35 C ATOM 1037 CG1 VAL A 108 11.912 12.886 8.365 1.00 1.52 C ATOM 1038 CG2 VAL A 108 11.803 15.337 7.859 1.00 55.55 C ATOM 0 H VAL A 108 9.830 12.057 6.762 1.00 62.21 H new ATOM 0 HA VAL A 108 10.535 14.506 5.643 1.00 22.33 H new ATOM 0 HB VAL A 108 10.137 14.027 8.072 1.00 1.35 H new ATOM 0 HG11 VAL A 108 11.986 13.126 9.426 1.00 1.52 H new ATOM 0 HG12 VAL A 108 11.391 11.936 8.244 1.00 1.52 H new ATOM 0 HG13 VAL A 108 12.913 12.808 7.940 1.00 1.52 H new ATOM 0 HG21 VAL A 108 11.879 15.542 8.927 1.00 55.55 H new ATOM 0 HG22 VAL A 108 12.800 15.326 7.420 1.00 55.55 H new ATOM 0 HG23 VAL A 108 11.205 16.114 7.382 1.00 55.55 H new ATOM 1048 N GLU A 109 12.890 12.231 5.582 1.00 12.04 N ATOM 1049 CA GLU A 109 14.212 11.911 5.058 1.00 50.13 C ATOM 1050 C GLU A 109 14.220 11.965 3.532 1.00 0.55 C ATOM 1051 O GLU A 109 15.200 12.387 2.921 1.00 75.32 O ATOM 1052 CB GLU A 109 14.652 10.524 5.533 1.00 63.41 C ATOM 1053 CG GLU A 109 15.912 10.019 4.851 1.00 25.14 C ATOM 1054 CD GLU A 109 17.073 10.986 4.980 1.00 33.40 C ATOM 1055 OE1 GLU A 109 17.517 11.524 3.944 1.00 5.03 O ATOM 1056 OE2 GLU A 109 17.539 11.204 6.119 1.00 61.35 O ATOM 0 H GLU A 109 12.377 11.431 5.952 1.00 12.04 H new ATOM 0 HA GLU A 109 14.914 12.655 5.435 1.00 50.13 H new ATOM 0 HB2 GLU A 109 14.819 10.554 6.610 1.00 63.41 H new ATOM 0 HB3 GLU A 109 13.844 9.815 5.355 1.00 63.41 H new ATOM 0 HG2 GLU A 109 16.194 9.059 5.283 1.00 25.14 H new ATOM 0 HG3 GLU A 109 15.704 9.845 3.795 1.00 25.14 H new ATOM 1061 N ASN A 110 13.120 11.531 2.926 1.00 51.25 N ATOM 1062 CA ASN A 110 13.000 11.528 1.472 1.00 61.02 C ATOM 1063 C ASN A 110 12.983 12.952 0.925 1.00 50.23 C ATOM 1064 O ASN A 110 13.361 13.191 -0.222 1.00 51.44 O ATOM 1065 CB ASN A 110 11.729 10.791 1.046 1.00 1.45 C ATOM 1066 CG ASN A 110 11.557 10.756 -0.460 1.00 32.51 C ATOM 1067 OD1 ASN A 110 11.247 11.771 -1.084 1.00 42.44 O ATOM 1068 ND2 ASN A 110 11.759 9.584 -1.052 1.00 64.33 N ATOM 0 H ASN A 110 12.300 11.177 3.418 1.00 51.25 H new ATOM 0 HA ASN A 110 13.867 11.010 1.062 1.00 61.02 H new ATOM 0 HB2 ASN A 110 11.758 9.771 1.429 1.00 1.45 H new ATOM 0 HB3 ASN A 110 10.863 11.276 1.496 1.00 1.45 H new ATOM 0 HD21 ASN A 110 11.658 9.500 -2.064 1.00 64.33 H new ATOM 0 HD22 ASN A 110 12.015 8.769 -0.495 1.00 64.33 H new ATOM 1074 N ASP A 111 12.542 13.892 1.752 1.00 72.44 N ATOM 1075 CA ASP A 111 12.477 15.294 1.352 1.00 53.02 C ATOM 1076 C ASP A 111 11.435 15.498 0.256 1.00 23.30 C ATOM 1077 O ASP A 111 11.776 15.671 -0.914 1.00 71.44 O ATOM 1078 CB ASP A 111 13.847 15.771 0.866 1.00 64.20 C ATOM 1079 CG ASP A 111 13.987 17.280 0.924 1.00 50.24 C ATOM 1080 OD1 ASP A 111 13.789 17.852 2.016 1.00 33.24 O ATOM 1081 OD2 ASP A 111 14.294 17.888 -0.123 1.00 21.54 O ATOM 0 H ASP A 111 12.224 13.710 2.704 1.00 72.44 H new ATOM 0 HA ASP A 111 12.183 15.882 2.222 1.00 53.02 H new ATOM 0 HB2 ASP A 111 14.626 15.313 1.476 1.00 64.20 H new ATOM 0 HB3 ASP A 111 14.004 15.433 -0.158 1.00 64.20 H new ATOM 1085 N ASP A 112 10.165 15.475 0.643 1.00 4.13 N ATOM 1086 CA ASP A 112 9.073 15.658 -0.306 1.00 23.02 C ATOM 1087 C ASP A 112 8.118 16.750 0.168 1.00 14.03 C ATOM 1088 O ASP A 112 7.642 17.560 -0.628 1.00 72.31 O ATOM 1089 CB ASP A 112 8.311 14.346 -0.499 1.00 34.22 C ATOM 1090 CG ASP A 112 7.439 14.359 -1.739 1.00 60.01 C ATOM 1091 OD1 ASP A 112 6.226 14.085 -1.614 1.00 73.35 O ATOM 1092 OD2 ASP A 112 7.969 14.645 -2.832 1.00 43.55 O ATOM 0 H ASP A 112 9.866 15.331 1.608 1.00 4.13 H new ATOM 0 HA ASP A 112 9.502 15.964 -1.260 1.00 23.02 H new ATOM 0 HB2 ASP A 112 9.022 13.523 -0.567 1.00 34.22 H new ATOM 0 HB3 ASP A 112 7.690 14.158 0.377 1.00 34.22 H new ATOM 1096 N ILE A 113 7.842 16.763 1.468 1.00 61.01 N ATOM 1097 CA ILE A 113 6.944 17.755 2.047 1.00 42.13 C ATOM 1098 C ILE A 113 7.609 18.488 3.207 1.00 13.20 C ATOM 1099 O ILE A 113 8.780 18.260 3.508 1.00 11.21 O ATOM 1100 CB ILE A 113 5.638 17.109 2.544 1.00 43.51 C ATOM 1101 CG1 ILE A 113 5.941 16.017 3.571 1.00 0.12 C ATOM 1102 CG2 ILE A 113 4.850 16.539 1.374 1.00 52.24 C ATOM 1103 CD1 ILE A 113 6.024 16.530 4.992 1.00 63.42 C ATOM 0 H ILE A 113 8.227 16.099 2.140 1.00 61.01 H new ATOM 0 HA ILE A 113 6.709 18.468 1.257 1.00 42.13 H new ATOM 0 HB ILE A 113 5.032 17.876 3.026 1.00 43.51 H new ATOM 0 HG12 ILE A 113 5.167 15.251 3.514 1.00 0.12 H new ATOM 0 HG13 ILE A 113 6.884 15.537 3.311 1.00 0.12 H new ATOM 0 HG21 ILE A 113 3.929 16.086 1.742 1.00 52.24 H new ATOM 0 HG22 ILE A 113 4.607 17.339 0.675 1.00 52.24 H new ATOM 0 HG23 ILE A 113 5.449 15.783 0.866 1.00 52.24 H new ATOM 0 HD11 ILE A 113 6.241 15.701 5.666 1.00 63.42 H new ATOM 0 HD12 ILE A 113 6.817 17.274 5.064 1.00 63.42 H new ATOM 0 HD13 ILE A 113 5.073 16.985 5.271 1.00 63.42 H new ATOM 1114 N GLU A 114 6.853 19.368 3.855 1.00 25.12 N ATOM 1115 CA GLU A 114 7.370 20.134 4.983 1.00 1.55 C ATOM 1116 C GLU A 114 6.446 20.010 6.193 1.00 72.45 C ATOM 1117 O GLU A 114 6.867 19.582 7.267 1.00 54.45 O ATOM 1118 CB GLU A 114 7.530 21.606 4.599 1.00 35.11 C ATOM 1119 CG GLU A 114 8.252 21.814 3.277 1.00 3.50 C ATOM 1120 CD GLU A 114 8.922 23.170 3.186 1.00 63.42 C ATOM 1121 OE1 GLU A 114 8.270 24.179 3.531 1.00 33.22 O ATOM 1122 OE2 GLU A 114 10.098 23.225 2.771 1.00 31.10 O ATOM 0 H GLU A 114 5.881 19.568 3.619 1.00 25.12 H new ATOM 0 HA GLU A 114 8.346 19.728 5.248 1.00 1.55 H new ATOM 0 HB2 GLU A 114 6.544 22.067 4.542 1.00 35.11 H new ATOM 0 HB3 GLU A 114 8.078 22.121 5.388 1.00 35.11 H new ATOM 0 HG2 GLU A 114 9.002 21.033 3.150 1.00 3.50 H new ATOM 0 HG3 GLU A 114 7.540 21.709 2.458 1.00 3.50 H new ATOM 1127 N MET A 115 5.187 20.391 6.010 1.00 51.24 N ATOM 1128 CA MET A 115 4.204 20.323 7.085 1.00 44.42 C ATOM 1129 C MET A 115 2.866 19.809 6.566 1.00 42.43 C ATOM 1130 O MET A 115 1.812 20.121 7.122 1.00 73.51 O ATOM 1131 CB MET A 115 4.020 21.701 7.724 1.00 32.20 C ATOM 1132 CG MET A 115 5.140 22.081 8.681 1.00 5.44 C ATOM 1133 SD MET A 115 4.884 23.696 9.442 1.00 13.04 S ATOM 1134 CE MET A 115 6.442 23.916 10.298 1.00 31.22 C ATOM 0 H MET A 115 4.823 20.750 5.128 1.00 51.24 H new ATOM 0 HA MET A 115 4.574 19.627 7.838 1.00 44.42 H new ATOM 0 HB2 MET A 115 3.955 22.452 6.937 1.00 32.20 H new ATOM 0 HB3 MET A 115 3.072 21.720 8.261 1.00 32.20 H new ATOM 0 HG2 MET A 115 5.218 21.324 9.461 1.00 5.44 H new ATOM 0 HG3 MET A 115 6.088 22.083 8.143 1.00 5.44 H new ATOM 0 HE1 MET A 115 6.439 24.873 10.819 1.00 31.22 H new ATOM 0 HE2 MET A 115 6.578 23.110 11.020 1.00 31.22 H new ATOM 0 HE3 MET A 115 7.259 23.898 9.577 1.00 31.22 H new ATOM 1142 N GLN A 116 2.914 19.019 5.498 1.00 42.31 N ATOM 1143 CA GLN A 116 1.704 18.462 4.904 1.00 25.42 C ATOM 1144 C GLN A 116 1.233 17.235 5.677 1.00 13.13 C ATOM 1145 O GLN A 116 0.035 17.023 5.856 1.00 65.13 O ATOM 1146 CB GLN A 116 1.950 18.095 3.440 1.00 73.31 C ATOM 1147 CG GLN A 116 0.748 18.334 2.541 1.00 71.51 C ATOM 1148 CD GLN A 116 1.142 18.790 1.150 1.00 41.11 C ATOM 1149 OE1 GLN A 116 0.867 19.923 0.755 1.00 32.43 O ATOM 1150 NE2 GLN A 116 1.787 17.906 0.398 1.00 33.32 N ATOM 0 H GLN A 116 3.778 18.750 5.026 1.00 42.31 H new ATOM 0 HA GLN A 116 0.923 19.221 4.953 1.00 25.42 H new ATOM 0 HB2 GLN A 116 2.794 18.675 3.066 1.00 73.31 H new ATOM 0 HB3 GLN A 116 2.234 17.044 3.381 1.00 73.31 H new ATOM 0 HG2 GLN A 116 0.166 17.415 2.467 1.00 71.51 H new ATOM 0 HG3 GLN A 116 0.102 19.085 2.996 1.00 71.51 H new ATOM 0 HE21 GLN A 116 1.994 16.978 0.766 1.00 33.32 H new ATOM 0 HE22 GLN A 116 2.075 18.155 -0.548 1.00 33.32 H new ATOM 1157 N ALA A 117 2.187 16.427 6.132 1.00 63.22 N ATOM 1158 CA ALA A 117 1.870 15.221 6.886 1.00 13.04 C ATOM 1159 C ALA A 117 1.586 15.547 8.349 1.00 40.42 C ATOM 1160 O ALA A 117 0.736 14.918 8.982 1.00 71.32 O ATOM 1161 CB ALA A 117 3.008 14.218 6.780 1.00 75.11 C ATOM 0 H ALA A 117 3.185 16.587 5.991 1.00 63.22 H new ATOM 0 HA ALA A 117 0.970 14.780 6.457 1.00 13.04 H new ATOM 0 HB1 ALA A 117 2.757 13.322 7.348 1.00 75.11 H new ATOM 0 HB2 ALA A 117 3.163 13.953 5.734 1.00 75.11 H new ATOM 0 HB3 ALA A 117 3.920 14.659 7.182 1.00 75.11 H new ATOM 1167 N LEU A 118 2.301 16.532 8.880 1.00 43.21 N ATOM 1168 CA LEU A 118 2.125 16.942 10.270 1.00 70.33 C ATOM 1169 C LEU A 118 1.015 17.980 10.395 1.00 62.23 C ATOM 1170 O LEU A 118 0.268 17.991 11.372 1.00 33.34 O ATOM 1171 CB LEU A 118 3.434 17.509 10.823 1.00 14.35 C ATOM 1172 CG LEU A 118 3.541 17.583 12.347 1.00 2.13 C ATOM 1173 CD1 LEU A 118 3.745 16.196 12.937 1.00 74.30 C ATOM 1174 CD2 LEU A 118 4.674 18.511 12.757 1.00 64.52 C ATOM 0 H LEU A 118 3.008 17.062 8.370 1.00 43.21 H new ATOM 0 HA LEU A 118 1.842 16.064 10.850 1.00 70.33 H new ATOM 0 HB2 LEU A 118 4.257 16.900 10.450 1.00 14.35 H new ATOM 0 HB3 LEU A 118 3.572 18.512 10.420 1.00 14.35 H new ATOM 0 HG LEU A 118 2.607 17.987 12.738 1.00 2.13 H new ATOM 0 HD11 LEU A 118 3.819 16.269 14.022 1.00 74.30 H new ATOM 0 HD12 LEU A 118 2.900 15.560 12.673 1.00 74.30 H new ATOM 0 HD13 LEU A 118 4.663 15.763 12.539 1.00 74.30 H new ATOM 0 HD21 LEU A 118 4.736 18.552 13.845 1.00 64.52 H new ATOM 0 HD22 LEU A 118 5.615 18.136 12.354 1.00 64.52 H new ATOM 0 HD23 LEU A 118 4.485 19.511 12.367 1.00 64.52 H new ATOM 1185 N GLY A 119 0.911 18.853 9.396 1.00 32.42 N ATOM 1186 CA GLY A 119 -0.111 19.882 9.414 1.00 51.42 C ATOM 1187 C GLY A 119 -1.497 19.319 9.659 1.00 72.11 C ATOM 1188 O GLY A 119 -2.336 19.966 10.284 1.00 24.44 O ATOM 0 H GLY A 119 1.517 18.865 8.575 1.00 32.42 H new ATOM 0 HA2 GLY A 119 0.124 20.610 10.190 1.00 51.42 H new ATOM 0 HA3 GLY A 119 -0.102 20.415 8.464 1.00 51.42 H new ATOM 1192 N SER A 120 -1.738 18.109 9.164 1.00 30.32 N ATOM 1193 CA SER A 120 -3.033 17.461 9.329 1.00 13.50 C ATOM 1194 C SER A 120 -2.864 15.965 9.581 1.00 12.23 C ATOM 1195 O SER A 120 -2.841 15.166 8.647 1.00 53.51 O ATOM 1196 CB SER A 120 -3.900 17.684 8.088 1.00 2.31 C ATOM 1197 OG SER A 120 -4.989 16.777 8.055 1.00 21.04 O ATOM 0 H SER A 120 -1.053 17.558 8.646 1.00 30.32 H new ATOM 0 HA SER A 120 -3.526 17.905 10.194 1.00 13.50 H new ATOM 0 HB2 SER A 120 -4.275 18.707 8.082 1.00 2.31 H new ATOM 0 HB3 SER A 120 -3.294 17.562 7.191 1.00 2.31 H new ATOM 0 HG SER A 120 -5.528 16.942 7.253 1.00 21.04 H new ATOM 1202 N ASN A 121 -2.746 15.596 10.853 1.00 4.21 N ATOM 1203 CA ASN A 121 -2.579 14.197 11.230 1.00 61.20 C ATOM 1204 C ASN A 121 -3.511 13.829 12.380 1.00 3.32 C ATOM 1205 O ASN A 121 -3.235 14.134 13.542 1.00 41.15 O ATOM 1206 CB ASN A 121 -1.127 13.926 11.629 1.00 1.22 C ATOM 1207 CG ASN A 121 -0.771 12.453 11.550 1.00 63.14 C ATOM 1208 OD1 ASN A 121 -1.267 11.642 12.332 1.00 54.14 O ATOM 1209 ND2 ASN A 121 0.092 12.103 10.604 1.00 23.10 N ATOM 0 H ASN A 121 -2.763 16.246 11.639 1.00 4.21 H new ATOM 0 HA ASN A 121 -2.834 13.581 10.368 1.00 61.20 H new ATOM 0 HB2 ASN A 121 -0.462 14.493 10.978 1.00 1.22 H new ATOM 0 HB3 ASN A 121 -0.959 14.284 12.645 1.00 1.22 H new ATOM 0 HD21 ASN A 121 0.370 11.127 10.503 1.00 23.10 H new ATOM 0 HD22 ASN A 121 0.477 12.810 9.978 1.00 23.10 H new ATOM 1215 N THR A 122 -4.617 13.169 12.050 1.00 22.02 N ATOM 1216 CA THR A 122 -5.591 12.759 13.055 1.00 43.24 C ATOM 1217 C THR A 122 -6.417 11.574 12.567 1.00 22.31 C ATOM 1218 O THR A 122 -6.281 10.460 13.072 1.00 0.52 O ATOM 1219 CB THR A 122 -6.540 13.915 13.422 1.00 65.52 C ATOM 1220 OG1 THR A 122 -6.575 14.877 12.362 1.00 74.23 O ATOM 1221 CG2 THR A 122 -6.095 14.591 14.711 1.00 52.53 C ATOM 0 H THR A 122 -4.861 12.907 11.095 1.00 22.02 H new ATOM 0 HA THR A 122 -5.028 12.466 13.941 1.00 43.24 H new ATOM 0 HB THR A 122 -7.538 13.503 13.571 1.00 65.52 H new ATOM 0 HG1 THR A 122 -7.182 15.608 12.603 1.00 74.23 H new ATOM 0 HG21 THR A 122 -6.780 15.404 14.951 1.00 52.53 H new ATOM 0 HG22 THR A 122 -6.097 13.864 15.523 1.00 52.53 H new ATOM 0 HG23 THR A 122 -5.089 14.990 14.584 1.00 52.53 H new ATOM 1229 N THR A 123 -7.274 11.822 11.582 1.00 42.05 N ATOM 1230 CA THR A 123 -8.123 10.776 11.026 1.00 0.40 C ATOM 1231 C THR A 123 -7.288 9.663 10.403 1.00 51.05 C ATOM 1232 O THR A 123 -6.158 9.892 9.970 1.00 31.12 O ATOM 1233 CB THR A 123 -9.085 11.338 9.962 1.00 0.14 C ATOM 1234 OG1 THR A 123 -9.903 10.287 9.436 1.00 11.25 O ATOM 1235 CG2 THR A 123 -8.314 12.002 8.832 1.00 1.02 C ATOM 0 H THR A 123 -7.399 12.739 11.153 1.00 42.05 H new ATOM 0 HA THR A 123 -8.706 10.370 11.853 1.00 0.40 H new ATOM 0 HB THR A 123 -9.719 12.087 10.437 1.00 0.14 H new ATOM 0 HG1 THR A 123 -10.099 9.639 10.145 1.00 11.25 H new ATOM 0 HG21 THR A 123 -9.014 12.391 8.093 1.00 1.02 H new ATOM 0 HG22 THR A 123 -7.716 12.821 9.232 1.00 1.02 H new ATOM 0 HG23 THR A 123 -7.658 11.270 8.360 1.00 1.02 H new ATOM 1243 N ILE A 124 -7.852 8.460 10.358 1.00 65.44 N ATOM 1244 CA ILE A 124 -7.159 7.314 9.784 1.00 21.41 C ATOM 1245 C ILE A 124 -8.112 6.448 8.966 1.00 33.54 C ATOM 1246 O ILE A 124 -9.322 6.456 9.192 1.00 42.34 O ATOM 1247 CB ILE A 124 -6.506 6.447 10.877 1.00 34.44 C ATOM 1248 CG1 ILE A 124 -7.573 5.885 11.818 1.00 32.43 C ATOM 1249 CG2 ILE A 124 -5.479 7.259 11.655 1.00 64.05 C ATOM 1250 CD1 ILE A 124 -7.898 4.430 11.564 1.00 74.42 C ATOM 0 H ILE A 124 -8.786 8.255 10.712 1.00 65.44 H new ATOM 0 HA ILE A 124 -6.381 7.710 9.131 1.00 21.41 H new ATOM 0 HB ILE A 124 -5.993 5.612 10.400 1.00 34.44 H new ATOM 0 HG12 ILE A 124 -7.234 5.999 12.848 1.00 32.43 H new ATOM 0 HG13 ILE A 124 -8.484 6.475 11.715 1.00 32.43 H new ATOM 0 HG21 ILE A 124 -5.026 6.633 12.424 1.00 64.05 H new ATOM 0 HG22 ILE A 124 -4.705 7.615 10.975 1.00 64.05 H new ATOM 0 HG23 ILE A 124 -5.969 8.112 12.124 1.00 64.05 H new ATOM 0 HD11 ILE A 124 -8.662 4.100 12.268 1.00 74.42 H new ATOM 0 HD12 ILE A 124 -8.268 4.312 10.545 1.00 74.42 H new ATOM 0 HD13 ILE A 124 -6.999 3.828 11.695 1.00 74.42 H new ATOM 1261 N HIS A 125 -7.556 5.701 8.018 1.00 30.20 N ATOM 1262 CA HIS A 125 -8.356 4.826 7.168 1.00 63.24 C ATOM 1263 C HIS A 125 -8.280 3.382 7.650 1.00 2.44 C ATOM 1264 O HIS A 125 -7.194 2.839 7.850 1.00 70.33 O ATOM 1265 CB HIS A 125 -7.882 4.918 5.716 1.00 23.43 C ATOM 1266 CG HIS A 125 -8.564 5.994 4.931 1.00 63.43 C ATOM 1267 ND1 HIS A 125 -9.182 5.765 3.719 1.00 65.21 N ATOM 1268 CD2 HIS A 125 -8.724 7.314 5.190 1.00 52.14 C ATOM 1269 CE1 HIS A 125 -9.692 6.898 3.266 1.00 34.43 C ATOM 1270 NE2 HIS A 125 -9.427 7.852 4.140 1.00 65.21 N ATOM 0 H HIS A 125 -6.556 5.684 7.819 1.00 30.20 H new ATOM 0 HA HIS A 125 -9.394 5.155 7.225 1.00 63.24 H new ATOM 0 HB2 HIS A 125 -6.807 5.097 5.704 1.00 23.43 H new ATOM 0 HB3 HIS A 125 -8.051 3.959 5.226 1.00 23.43 H new ATOM 0 HD2 HIS A 125 -8.366 7.844 6.060 1.00 52.14 H new ATOM 0 HE1 HIS A 125 -10.233 7.022 2.339 1.00 34.43 H new ATOM 0 HE2 HIS A 125 -9.700 8.831 4.050 1.00 65.21 H new ATOM 1277 N ALA A 126 -9.442 2.763 7.837 1.00 53.43 N ATOM 1278 CA ALA A 126 -9.507 1.380 8.293 1.00 21.54 C ATOM 1279 C ALA A 126 -9.839 0.436 7.144 1.00 21.11 C ATOM 1280 O ALA A 126 -10.858 0.597 6.470 1.00 0.05 O ATOM 1281 CB ALA A 126 -10.534 1.241 9.408 1.00 34.31 C ATOM 0 H ALA A 126 -10.351 3.198 7.680 1.00 53.43 H new ATOM 0 HA ALA A 126 -8.526 1.105 8.680 1.00 21.54 H new ATOM 0 HB1 ALA A 126 -10.573 0.203 9.740 1.00 34.31 H new ATOM 0 HB2 ALA A 126 -10.251 1.879 10.245 1.00 34.31 H new ATOM 0 HB3 ALA A 126 -11.515 1.541 9.039 1.00 34.31 H new ATOM 1287 N TYR A 127 -8.975 -0.547 6.923 1.00 31.53 N ATOM 1288 CA TYR A 127 -9.175 -1.516 5.852 1.00 41.22 C ATOM 1289 C TYR A 127 -9.435 -2.909 6.418 1.00 72.33 C ATOM 1290 O TYR A 127 -8.511 -3.597 6.852 1.00 21.00 O ATOM 1291 CB TYR A 127 -7.956 -1.547 4.929 1.00 61.51 C ATOM 1292 CG TYR A 127 -8.123 -0.719 3.676 1.00 65.42 C ATOM 1293 CD1 TYR A 127 -8.348 -1.322 2.445 1.00 55.10 C ATOM 1294 CD2 TYR A 127 -8.055 0.669 3.722 1.00 14.31 C ATOM 1295 CE1 TYR A 127 -8.501 -0.569 1.296 1.00 30.44 C ATOM 1296 CE2 TYR A 127 -8.208 1.430 2.580 1.00 53.22 C ATOM 1297 CZ TYR A 127 -8.430 0.807 1.369 1.00 11.04 C ATOM 1298 OH TYR A 127 -8.582 1.561 0.229 1.00 22.12 O ATOM 0 H TYR A 127 -8.128 -0.695 7.472 1.00 31.53 H new ATOM 0 HA TYR A 127 -10.049 -1.209 5.278 1.00 41.22 H new ATOM 0 HB2 TYR A 127 -7.086 -1.188 5.478 1.00 61.51 H new ATOM 0 HB3 TYR A 127 -7.751 -2.580 4.647 1.00 61.51 H new ATOM 0 HD1 TYR A 127 -8.404 -2.399 2.385 1.00 55.10 H new ATOM 0 HD2 TYR A 127 -7.879 1.161 4.668 1.00 14.31 H new ATOM 0 HE1 TYR A 127 -8.675 -1.055 0.347 1.00 30.44 H new ATOM 0 HE2 TYR A 127 -8.154 2.507 2.634 1.00 53.22 H new ATOM 0 HH TYR A 127 -8.506 2.512 0.453 1.00 22.12 H new ATOM 1307 N PHE A 128 -10.699 -3.317 6.409 1.00 10.21 N ATOM 1308 CA PHE A 128 -11.083 -4.627 6.922 1.00 11.44 C ATOM 1309 C PHE A 128 -11.043 -5.677 5.815 1.00 42.30 C ATOM 1310 O PHE A 128 -11.431 -5.410 4.677 1.00 61.41 O ATOM 1311 CB PHE A 128 -12.483 -4.569 7.535 1.00 31.31 C ATOM 1312 CG PHE A 128 -12.684 -3.402 8.460 1.00 15.54 C ATOM 1313 CD1 PHE A 128 -13.574 -2.391 8.137 1.00 30.43 C ATOM 1314 CD2 PHE A 128 -11.984 -3.319 9.653 1.00 11.31 C ATOM 1315 CE1 PHE A 128 -13.759 -1.316 8.986 1.00 4.03 C ATOM 1316 CE2 PHE A 128 -12.166 -2.247 10.507 1.00 20.10 C ATOM 1317 CZ PHE A 128 -13.057 -1.245 10.174 1.00 73.34 C ATOM 0 H PHE A 128 -11.475 -2.760 6.052 1.00 10.21 H new ATOM 0 HA PHE A 128 -10.368 -4.911 7.694 1.00 11.44 H new ATOM 0 HB2 PHE A 128 -13.220 -4.519 6.734 1.00 31.31 H new ATOM 0 HB3 PHE A 128 -12.670 -5.493 8.082 1.00 31.31 H new ATOM 0 HD1 PHE A 128 -14.129 -2.443 7.212 1.00 30.43 H new ATOM 0 HD2 PHE A 128 -11.288 -4.101 9.919 1.00 11.31 H new ATOM 0 HE1 PHE A 128 -14.452 -0.532 8.721 1.00 4.03 H new ATOM 0 HE2 PHE A 128 -11.613 -2.193 11.433 1.00 20.10 H new ATOM 0 HZ PHE A 128 -13.204 -0.408 10.841 1.00 73.34 H new ATOM 1326 N ARG A 129 -10.573 -6.872 6.157 1.00 64.34 N ATOM 1327 CA ARG A 129 -10.481 -7.961 5.193 1.00 50.22 C ATOM 1328 C ARG A 129 -11.527 -9.035 5.483 1.00 24.54 C ATOM 1329 O ARG A 129 -11.517 -9.653 6.547 1.00 1.44 O ATOM 1330 CB ARG A 129 -9.081 -8.578 5.220 1.00 13.20 C ATOM 1331 CG ARG A 129 -8.579 -8.888 6.620 1.00 24.32 C ATOM 1332 CD ARG A 129 -7.722 -10.145 6.640 1.00 65.41 C ATOM 1333 NE ARG A 129 -6.694 -10.121 5.603 1.00 12.34 N ATOM 1334 CZ ARG A 129 -5.857 -11.128 5.377 1.00 41.33 C ATOM 1335 NH1 ARG A 129 -5.928 -12.231 6.109 1.00 72.22 N ATOM 1336 NH2 ARG A 129 -4.949 -11.032 4.414 1.00 31.32 N ATOM 0 H ARG A 129 -10.250 -7.110 7.095 1.00 64.34 H new ATOM 0 HA ARG A 129 -10.671 -7.551 4.201 1.00 50.22 H new ATOM 0 HB2 ARG A 129 -9.087 -9.497 4.634 1.00 13.20 H new ATOM 0 HB3 ARG A 129 -8.383 -7.895 4.736 1.00 13.20 H new ATOM 0 HG2 ARG A 129 -7.999 -8.045 6.994 1.00 24.32 H new ATOM 0 HG3 ARG A 129 -9.428 -9.014 7.292 1.00 24.32 H new ATOM 0 HD2 ARG A 129 -7.249 -10.246 7.617 1.00 65.41 H new ATOM 0 HD3 ARG A 129 -8.357 -11.020 6.501 1.00 65.41 H new ATOM 0 HE ARG A 129 -6.614 -9.287 5.021 1.00 12.34 H new ATOM 0 HH11 ARG A 129 -6.627 -12.308 6.848 1.00 72.22 H new ATOM 0 HH12 ARG A 129 -5.284 -13.002 5.933 1.00 72.22 H new ATOM 0 HH21 ARG A 129 -4.894 -10.185 3.848 1.00 31.32 H new ATOM 0 HH22 ARG A 129 -4.306 -11.805 4.240 1.00 31.32 H new ATOM 1347 N LYS A 130 -12.428 -9.248 4.531 1.00 74.34 N ATOM 1348 CA LYS A 130 -13.480 -10.246 4.683 1.00 44.14 C ATOM 1349 C LYS A 130 -14.016 -10.259 6.111 1.00 32.32 C ATOM 1350 O LYS A 130 -14.202 -11.321 6.704 1.00 2.15 O ATOM 1351 CB LYS A 130 -12.953 -11.633 4.312 1.00 1.51 C ATOM 1352 CG LYS A 130 -11.808 -12.105 5.191 1.00 22.55 C ATOM 1353 CD LYS A 130 -11.589 -13.603 5.068 1.00 75.31 C ATOM 1354 CE LYS A 130 -12.494 -14.378 6.014 1.00 73.41 C ATOM 1355 NZ LYS A 130 -12.137 -15.823 6.063 1.00 53.24 N ATOM 0 H LYS A 130 -12.451 -8.743 3.645 1.00 74.34 H new ATOM 0 HA LYS A 130 -14.296 -9.982 4.010 1.00 44.14 H new ATOM 0 HB2 LYS A 130 -13.770 -12.352 4.377 1.00 1.51 H new ATOM 0 HB3 LYS A 130 -12.621 -11.620 3.274 1.00 1.51 H new ATOM 0 HG2 LYS A 130 -10.895 -11.579 4.913 1.00 22.55 H new ATOM 0 HG3 LYS A 130 -12.018 -11.852 6.230 1.00 22.55 H new ATOM 0 HD2 LYS A 130 -11.780 -13.917 4.042 1.00 75.31 H new ATOM 0 HD3 LYS A 130 -10.547 -13.839 5.285 1.00 75.31 H new ATOM 0 HE2 LYS A 130 -12.423 -13.952 7.015 1.00 73.41 H new ATOM 0 HE3 LYS A 130 -13.531 -14.271 5.695 1.00 73.41 H new ATOM 0 HZ1 LYS A 130 -12.776 -16.317 6.718 1.00 53.24 H new ATOM 0 HZ2 LYS A 130 -12.229 -16.236 5.113 1.00 53.24 H new ATOM 0 HZ3 LYS A 130 -11.156 -15.927 6.392 1.00 53.24 H new ATOM 1365 N ASP A 131 -14.262 -9.073 6.656 1.00 32.05 N ATOM 1366 CA ASP A 131 -14.778 -8.948 8.014 1.00 11.12 C ATOM 1367 C ASP A 131 -16.016 -9.819 8.207 1.00 12.40 C ATOM 1368 O ASP A 131 -16.226 -10.388 9.278 1.00 64.20 O ATOM 1369 CB ASP A 131 -15.114 -7.489 8.324 1.00 74.42 C ATOM 1370 CG ASP A 131 -16.125 -6.909 7.354 1.00 70.32 C ATOM 1371 OD1 ASP A 131 -15.707 -6.195 6.417 1.00 53.11 O ATOM 1372 OD2 ASP A 131 -17.333 -7.169 7.530 1.00 11.02 O ATOM 0 H ASP A 131 -14.112 -8.184 6.178 1.00 32.05 H new ATOM 0 HA ASP A 131 -14.004 -9.288 8.702 1.00 11.12 H new ATOM 0 HB2 ASP A 131 -15.506 -7.417 9.339 1.00 74.42 H new ATOM 0 HB3 ASP A 131 -14.201 -6.894 8.292 1.00 74.42 H new ATOM 1376 N TRP A 132 -16.831 -9.918 7.163 1.00 24.02 N ATOM 1377 CA TRP A 132 -18.049 -10.718 7.219 1.00 3.41 C ATOM 1378 C TRP A 132 -18.017 -11.830 6.176 1.00 42.35 C ATOM 1379 O TRP A 132 -17.978 -13.012 6.516 1.00 51.45 O ATOM 1380 CB TRP A 132 -19.277 -9.832 7.001 1.00 50.22 C ATOM 1381 CG TRP A 132 -19.730 -9.129 8.245 1.00 53.25 C ATOM 1382 CD1 TRP A 132 -19.760 -9.641 9.511 1.00 72.53 C ATOM 1383 CD2 TRP A 132 -20.219 -7.787 8.340 1.00 4.42 C ATOM 1384 NE1 TRP A 132 -20.238 -8.697 10.387 1.00 24.22 N ATOM 1385 CE2 TRP A 132 -20.527 -7.551 9.695 1.00 12.02 C ATOM 1386 CE3 TRP A 132 -20.426 -6.761 7.414 1.00 22.11 C ATOM 1387 CZ2 TRP A 132 -21.030 -6.332 10.142 1.00 12.23 C ATOM 1388 CZ3 TRP A 132 -20.926 -5.552 7.860 1.00 31.01 C ATOM 1389 CH2 TRP A 132 -21.222 -5.346 9.214 1.00 31.21 C ATOM 0 H TRP A 132 -16.671 -9.455 6.268 1.00 24.02 H new ATOM 0 HA TRP A 132 -18.110 -11.173 8.207 1.00 3.41 H new ATOM 0 HB2 TRP A 132 -19.050 -9.090 6.235 1.00 50.22 H new ATOM 0 HB3 TRP A 132 -20.095 -10.444 6.620 1.00 50.22 H new ATOM 0 HD1 TRP A 132 -19.453 -10.640 9.783 1.00 72.53 H new ATOM 0 HE1 TRP A 132 -20.358 -8.828 11.391 1.00 24.22 H new ATOM 0 HE3 TRP A 132 -20.199 -6.910 6.369 1.00 22.11 H new ATOM 0 HZ2 TRP A 132 -21.260 -6.171 11.185 1.00 12.23 H new ATOM 0 HZ3 TRP A 132 -21.091 -4.753 7.153 1.00 31.01 H new ATOM 0 HH2 TRP A 132 -21.610 -4.389 9.531 1.00 31.21 H new ATOM 1399 N SER A 133 -18.035 -11.442 4.904 1.00 12.42 N ATOM 1400 CA SER A 133 -18.012 -12.407 3.810 1.00 1.42 C ATOM 1401 C SER A 133 -16.700 -12.319 3.037 1.00 15.53 C ATOM 1402 O SER A 133 -15.758 -11.652 3.464 1.00 1.22 O ATOM 1403 CB SER A 133 -19.192 -12.168 2.866 1.00 71.22 C ATOM 1404 OG SER A 133 -19.566 -13.364 2.205 1.00 4.22 O ATOM 0 H SER A 133 -18.065 -10.467 4.606 1.00 12.42 H new ATOM 0 HA SER A 133 -18.095 -13.406 4.237 1.00 1.42 H new ATOM 0 HB2 SER A 133 -20.040 -11.780 3.430 1.00 71.22 H new ATOM 0 HB3 SER A 133 -18.925 -11.410 2.130 1.00 71.22 H new ATOM 0 HG SER A 133 -20.323 -13.185 1.609 1.00 4.22 H new ATOM 1409 N ASP A 134 -16.648 -12.999 1.896 1.00 51.01 N ATOM 1410 CA ASP A 134 -15.452 -12.999 1.061 1.00 61.43 C ATOM 1411 C ASP A 134 -15.357 -11.711 0.249 1.00 63.41 C ATOM 1412 O ASP A 134 -15.437 -11.730 -0.979 1.00 1.11 O ATOM 1413 CB ASP A 134 -15.458 -14.207 0.123 1.00 3.50 C ATOM 1414 CG ASP A 134 -15.155 -15.503 0.848 1.00 10.31 C ATOM 1415 OD1 ASP A 134 -15.339 -16.580 0.241 1.00 5.44 O ATOM 1416 OD2 ASP A 134 -14.730 -15.442 2.021 1.00 43.35 O ATOM 0 H ASP A 134 -17.419 -13.556 1.529 1.00 51.01 H new ATOM 0 HA ASP A 134 -14.582 -13.061 1.715 1.00 61.43 H new ATOM 0 HB2 ASP A 134 -16.432 -14.283 -0.360 1.00 3.50 H new ATOM 0 HB3 ASP A 134 -14.722 -14.055 -0.666 1.00 3.50 H new ATOM 1420 N LYS A 135 -15.186 -10.591 0.944 1.00 24.13 N ATOM 1421 CA LYS A 135 -15.081 -9.292 0.290 1.00 73.41 C ATOM 1422 C LYS A 135 -14.129 -8.375 1.051 1.00 34.33 C ATOM 1423 O LYS A 135 -13.685 -8.702 2.152 1.00 34.32 O ATOM 1424 CB LYS A 135 -16.459 -8.638 0.182 1.00 5.31 C ATOM 1425 CG LYS A 135 -17.423 -9.394 -0.717 1.00 12.13 C ATOM 1426 CD LYS A 135 -18.745 -8.658 -0.861 1.00 74.21 C ATOM 1427 CE LYS A 135 -19.704 -9.009 0.267 1.00 32.21 C ATOM 1428 NZ LYS A 135 -20.995 -8.277 0.145 1.00 31.44 N ATOM 0 H LYS A 135 -15.117 -10.557 1.961 1.00 24.13 H new ATOM 0 HA LYS A 135 -14.682 -9.450 -0.712 1.00 73.41 H new ATOM 0 HB2 LYS A 135 -16.893 -8.557 1.179 1.00 5.31 H new ATOM 0 HB3 LYS A 135 -16.341 -7.623 -0.198 1.00 5.31 H new ATOM 0 HG2 LYS A 135 -16.973 -9.532 -1.700 1.00 12.13 H new ATOM 0 HG3 LYS A 135 -17.602 -10.388 -0.306 1.00 12.13 H new ATOM 0 HD2 LYS A 135 -18.565 -7.583 -0.866 1.00 74.21 H new ATOM 0 HD3 LYS A 135 -19.200 -8.910 -1.819 1.00 74.21 H new ATOM 0 HE2 LYS A 135 -19.893 -10.082 0.262 1.00 32.21 H new ATOM 0 HE3 LYS A 135 -19.241 -8.771 1.225 1.00 32.21 H new ATOM 0 HZ1 LYS A 135 -21.657 -8.618 0.871 1.00 31.44 H new ATOM 0 HZ2 LYS A 135 -20.830 -7.259 0.277 1.00 31.44 H new ATOM 0 HZ3 LYS A 135 -21.400 -8.443 -0.798 1.00 31.44 H new ATOM 1438 N ALA A 136 -13.821 -7.226 0.460 1.00 64.41 N ATOM 1439 CA ALA A 136 -12.926 -6.260 1.085 1.00 0.21 C ATOM 1440 C ALA A 136 -13.683 -5.010 1.518 1.00 64.24 C ATOM 1441 O ALA A 136 -14.415 -4.410 0.729 1.00 3.04 O ATOM 1442 CB ALA A 136 -11.798 -5.893 0.133 1.00 74.41 C ATOM 0 H ALA A 136 -14.178 -6.941 -0.452 1.00 64.41 H new ATOM 0 HA ALA A 136 -12.499 -6.721 1.976 1.00 0.21 H new ATOM 0 HB1 ALA A 136 -11.137 -5.171 0.613 1.00 74.41 H new ATOM 0 HB2 ALA A 136 -11.232 -6.789 -0.123 1.00 74.41 H new ATOM 0 HB3 ALA A 136 -12.215 -5.456 -0.774 1.00 74.41 H new ATOM 1448 N LEU A 137 -13.504 -4.620 2.775 1.00 31.11 N ATOM 1449 CA LEU A 137 -14.171 -3.440 3.314 1.00 74.21 C ATOM 1450 C LEU A 137 -13.170 -2.317 3.569 1.00 52.52 C ATOM 1451 O LEU A 137 -12.151 -2.517 4.231 1.00 71.34 O ATOM 1452 CB LEU A 137 -14.902 -3.791 4.611 1.00 22.43 C ATOM 1453 CG LEU A 137 -16.372 -3.379 4.685 1.00 4.23 C ATOM 1454 CD1 LEU A 137 -16.534 -1.909 4.326 1.00 14.54 C ATOM 1455 CD2 LEU A 137 -17.217 -4.250 3.767 1.00 53.25 C ATOM 0 H LEU A 137 -12.902 -5.104 3.441 1.00 31.11 H new ATOM 0 HA LEU A 137 -14.896 -3.095 2.577 1.00 74.21 H new ATOM 0 HB2 LEU A 137 -14.840 -4.869 4.759 1.00 22.43 H new ATOM 0 HB3 LEU A 137 -14.372 -3.324 5.441 1.00 22.43 H new ATOM 0 HG LEU A 137 -16.718 -3.522 5.709 1.00 4.23 H new ATOM 0 HD11 LEU A 137 -17.587 -1.634 4.384 1.00 14.54 H new ATOM 0 HD12 LEU A 137 -15.961 -1.299 5.024 1.00 14.54 H new ATOM 0 HD13 LEU A 137 -16.170 -1.740 3.312 1.00 14.54 H new ATOM 0 HD21 LEU A 137 -18.261 -3.942 3.833 1.00 53.25 H new ATOM 0 HD22 LEU A 137 -16.870 -4.139 2.740 1.00 53.25 H new ATOM 0 HD23 LEU A 137 -17.126 -5.293 4.070 1.00 53.25 H new ATOM 1466 N LYS A 138 -13.468 -1.135 3.040 1.00 3.00 N ATOM 1467 CA LYS A 138 -12.597 0.022 3.212 1.00 4.12 C ATOM 1468 C LYS A 138 -13.398 1.246 3.648 1.00 54.51 C ATOM 1469 O LYS A 138 -14.249 1.738 2.906 1.00 14.21 O ATOM 1470 CB LYS A 138 -11.852 0.323 1.909 1.00 4.05 C ATOM 1471 CG LYS A 138 -12.734 0.255 0.675 1.00 50.22 C ATOM 1472 CD LYS A 138 -12.530 1.462 -0.225 1.00 33.31 C ATOM 1473 CE LYS A 138 -12.582 1.077 -1.695 1.00 12.25 C ATOM 1474 NZ LYS A 138 -11.229 1.073 -2.317 1.00 40.40 N ATOM 0 H LYS A 138 -14.306 -0.953 2.488 1.00 3.00 H new ATOM 0 HA LYS A 138 -11.872 -0.212 3.992 1.00 4.12 H new ATOM 0 HB2 LYS A 138 -11.409 1.317 1.975 1.00 4.05 H new ATOM 0 HB3 LYS A 138 -11.031 -0.385 1.798 1.00 4.05 H new ATOM 0 HG2 LYS A 138 -12.513 -0.656 0.119 1.00 50.22 H new ATOM 0 HG3 LYS A 138 -13.780 0.198 0.977 1.00 50.22 H new ATOM 0 HD2 LYS A 138 -13.298 2.207 -0.016 1.00 33.31 H new ATOM 0 HD3 LYS A 138 -11.568 1.924 -0.003 1.00 33.31 H new ATOM 0 HE2 LYS A 138 -13.031 0.089 -1.796 1.00 12.25 H new ATOM 0 HE3 LYS A 138 -13.225 1.775 -2.230 1.00 12.25 H new ATOM 0 HZ1 LYS A 138 -11.308 0.806 -3.319 1.00 40.40 H new ATOM 0 HZ2 LYS A 138 -10.811 2.022 -2.244 1.00 40.40 H new ATOM 0 HZ3 LYS A 138 -10.622 0.388 -1.823 1.00 40.40 H new ATOM 1484 N ILE A 139 -13.118 1.731 4.853 1.00 4.31 N ATOM 1485 CA ILE A 139 -13.812 2.898 5.385 1.00 54.24 C ATOM 1486 C ILE A 139 -12.850 3.812 6.136 1.00 72.30 C ATOM 1487 O ILE A 139 -11.902 3.348 6.770 1.00 5.12 O ATOM 1488 CB ILE A 139 -14.958 2.491 6.329 1.00 52.22 C ATOM 1489 CG1 ILE A 139 -15.775 3.719 6.733 1.00 11.25 C ATOM 1490 CG2 ILE A 139 -14.406 1.786 7.559 1.00 61.22 C ATOM 1491 CD1 ILE A 139 -15.308 4.358 8.021 1.00 22.14 C ATOM 0 H ILE A 139 -12.417 1.335 5.479 1.00 4.31 H new ATOM 0 HA ILE A 139 -14.229 3.433 4.532 1.00 54.24 H new ATOM 0 HB ILE A 139 -15.615 1.799 5.802 1.00 52.22 H new ATOM 0 HG12 ILE A 139 -15.727 4.457 5.932 1.00 11.25 H new ATOM 0 HG13 ILE A 139 -16.821 3.431 6.838 1.00 11.25 H new ATOM 0 HG21 ILE A 139 -15.228 1.504 8.217 1.00 61.22 H new ATOM 0 HG22 ILE A 139 -13.864 0.891 7.253 1.00 61.22 H new ATOM 0 HG23 ILE A 139 -13.730 2.456 8.090 1.00 61.22 H new ATOM 0 HD11 ILE A 139 -15.933 5.223 8.246 1.00 22.14 H new ATOM 0 HD12 ILE A 139 -15.383 3.635 8.834 1.00 22.14 H new ATOM 0 HD13 ILE A 139 -14.271 4.677 7.914 1.00 22.14 H new ATOM 1502 N ASP A 140 -13.101 5.115 6.061 1.00 21.11 N ATOM 1503 CA ASP A 140 -12.260 6.096 6.737 1.00 52.21 C ATOM 1504 C ASP A 140 -12.822 6.437 8.114 1.00 72.14 C ATOM 1505 O ASP A 140 -13.930 6.961 8.231 1.00 41.01 O ATOM 1506 CB ASP A 140 -12.141 7.365 5.892 1.00 54.11 C ATOM 1507 CG ASP A 140 -11.278 8.422 6.553 1.00 15.22 C ATOM 1508 OD1 ASP A 140 -10.640 8.109 7.580 1.00 10.20 O ATOM 1509 OD2 ASP A 140 -11.242 9.562 6.045 1.00 61.11 O ATOM 0 H ASP A 140 -13.880 5.516 5.539 1.00 21.11 H new ATOM 0 HA ASP A 140 -11.269 5.661 6.867 1.00 52.21 H new ATOM 0 HB2 ASP A 140 -11.719 7.112 4.919 1.00 54.11 H new ATOM 0 HB3 ASP A 140 -13.136 7.773 5.712 1.00 54.11 H new ATOM 1513 N LEU A 141 -12.050 6.137 9.152 1.00 10.42 N ATOM 1514 CA LEU A 141 -12.470 6.411 10.522 1.00 44.12 C ATOM 1515 C LEU A 141 -11.888 7.731 11.017 1.00 62.31 C ATOM 1516 O LEU A 141 -10.740 8.062 10.724 1.00 24.42 O ATOM 1517 CB LEU A 141 -12.040 5.272 11.447 1.00 32.51 C ATOM 1518 CG LEU A 141 -12.953 4.045 11.473 1.00 63.44 C ATOM 1519 CD1 LEU A 141 -12.332 2.936 12.308 1.00 3.40 C ATOM 1520 CD2 LEU A 141 -14.327 4.416 12.010 1.00 45.23 C ATOM 0 H LEU A 141 -11.130 5.704 9.072 1.00 10.42 H new ATOM 0 HA LEU A 141 -13.557 6.488 10.533 1.00 44.12 H new ATOM 0 HB2 LEU A 141 -11.041 4.950 11.153 1.00 32.51 H new ATOM 0 HB3 LEU A 141 -11.963 5.664 12.461 1.00 32.51 H new ATOM 0 HG LEU A 141 -13.071 3.680 10.453 1.00 63.44 H new ATOM 0 HD11 LEU A 141 -12.995 2.071 12.315 1.00 3.40 H new ATOM 0 HD12 LEU A 141 -11.371 2.653 11.879 1.00 3.40 H new ATOM 0 HD13 LEU A 141 -12.184 3.288 13.329 1.00 3.40 H new ATOM 0 HD21 LEU A 141 -14.964 3.532 12.022 1.00 45.23 H new ATOM 0 HD22 LEU A 141 -14.229 4.806 13.023 1.00 45.23 H new ATOM 0 HD23 LEU A 141 -14.774 5.177 11.370 1.00 45.23 H new ATOM 1531 N MET A 142 -12.688 8.480 11.769 1.00 72.54 N ATOM 1532 CA MET A 142 -12.250 9.763 12.307 1.00 33.30 C ATOM 1533 C MET A 142 -12.767 9.961 13.729 1.00 73.20 C ATOM 1534 O MET A 142 -13.754 9.355 14.146 1.00 32.45 O ATOM 1535 CB MET A 142 -12.731 10.906 11.413 1.00 62.45 C ATOM 1536 CG MET A 142 -14.160 10.736 10.925 1.00 3.51 C ATOM 1537 SD MET A 142 -14.898 12.288 10.378 1.00 62.20 S ATOM 1538 CE MET A 142 -16.378 12.333 11.385 1.00 50.20 C ATOM 0 H MET A 142 -13.642 8.221 12.020 1.00 72.54 H new ATOM 0 HA MET A 142 -11.160 9.766 12.332 1.00 33.30 H new ATOM 0 HB2 MET A 142 -12.653 11.844 11.963 1.00 62.45 H new ATOM 0 HB3 MET A 142 -12.069 10.986 10.551 1.00 62.45 H new ATOM 0 HG2 MET A 142 -14.176 10.021 10.102 1.00 3.51 H new ATOM 0 HG3 MET A 142 -14.765 10.313 11.727 1.00 3.51 H new ATOM 0 HE1 MET A 142 -16.943 13.238 11.161 1.00 50.20 H new ATOM 0 HE2 MET A 142 -16.992 11.459 11.169 1.00 50.20 H new ATOM 0 HE3 MET A 142 -16.101 12.330 12.439 1.00 50.20 H new ATOM 1546 N PRO A 143 -12.086 10.829 14.491 1.00 34.32 N ATOM 1547 CA PRO A 143 -12.459 11.126 15.878 1.00 64.33 C ATOM 1548 C PRO A 143 -13.761 11.915 15.971 1.00 23.12 C ATOM 1549 O PRO A 143 -14.446 12.122 14.969 1.00 73.44 O ATOM 1550 CB PRO A 143 -11.287 11.969 16.388 1.00 53.10 C ATOM 1551 CG PRO A 143 -10.705 12.589 15.165 1.00 50.54 C ATOM 1552 CD PRO A 143 -10.899 11.587 14.059 1.00 3.10 C ATOM 0 HA PRO A 143 -12.633 10.219 16.456 1.00 64.33 H new ATOM 0 HB2 PRO A 143 -11.623 12.728 17.095 1.00 53.10 H new ATOM 0 HB3 PRO A 143 -10.553 11.353 16.907 1.00 53.10 H new ATOM 0 HG2 PRO A 143 -11.202 13.530 14.930 1.00 50.54 H new ATOM 0 HG3 PRO A 143 -9.648 12.814 15.307 1.00 50.54 H new ATOM 0 HD2 PRO A 143 -11.062 12.075 13.098 1.00 3.10 H new ATOM 0 HD3 PRO A 143 -10.029 10.941 13.945 1.00 3.10 H new ATOM 1557 N HIS A 144 -14.097 12.353 17.180 1.00 71.44 N ATOM 1558 CA HIS A 144 -15.317 13.120 17.404 1.00 73.20 C ATOM 1559 C HIS A 144 -15.079 14.606 17.150 1.00 14.22 C ATOM 1560 O HIS A 144 -14.202 15.216 17.760 1.00 63.34 O ATOM 1561 CB HIS A 144 -15.823 12.909 18.831 1.00 21.21 C ATOM 1562 CG HIS A 144 -16.358 11.533 19.079 1.00 1.00 C ATOM 1563 ND1 HIS A 144 -17.516 11.060 18.500 1.00 52.22 N ATOM 1564 CD2 HIS A 144 -15.885 10.524 19.849 1.00 63.03 C ATOM 1565 CE1 HIS A 144 -17.734 9.820 18.904 1.00 61.34 C ATOM 1566 NE2 HIS A 144 -16.758 9.472 19.723 1.00 5.34 N ATOM 0 H HIS A 144 -13.541 12.190 18.020 1.00 71.44 H new ATOM 0 HA HIS A 144 -16.073 12.766 16.703 1.00 73.20 H new ATOM 0 HB2 HIS A 144 -15.009 13.105 19.529 1.00 21.21 H new ATOM 0 HB3 HIS A 144 -16.606 13.638 19.042 1.00 21.21 H new ATOM 0 HD2 HIS A 144 -14.988 10.543 20.450 1.00 63.03 H new ATOM 0 HE1 HIS A 144 -18.568 9.198 18.614 1.00 61.34 H new ATOM 0 HE2 HIS A 144 -16.668 8.568 20.187 1.00 5.34 H new ATOM 1930 N THR A 169 -16.035 12.151 6.561 1.00 55.02 N ATOM 1931 CA THR A 169 -15.746 10.829 6.020 1.00 40.02 C ATOM 1932 C THR A 169 -16.973 10.232 5.340 1.00 32.23 C ATOM 1933 O THR A 169 -18.102 10.439 5.783 1.00 33.14 O ATOM 1934 CB THR A 169 -15.263 9.866 7.120 1.00 12.34 C ATOM 1935 OG1 THR A 169 -16.055 10.033 8.302 1.00 43.14 O ATOM 1936 CG2 THR A 169 -13.798 10.108 7.448 1.00 41.01 C ATOM 0 HA THR A 169 -14.952 10.956 5.284 1.00 40.02 H new ATOM 0 HB THR A 169 -15.373 8.846 6.751 1.00 12.34 H new ATOM 0 HG1 THR A 169 -15.725 10.803 8.811 1.00 43.14 H new ATOM 0 HG21 THR A 169 -13.481 9.416 8.228 1.00 41.01 H new ATOM 0 HG22 THR A 169 -13.194 9.950 6.554 1.00 41.01 H new ATOM 0 HG23 THR A 169 -13.668 11.132 7.797 1.00 41.01 H new ATOM 1944 N GLY A 170 -16.744 9.490 4.262 1.00 32.00 N ATOM 1945 CA GLY A 170 -17.841 8.874 3.538 1.00 3.21 C ATOM 1946 C GLY A 170 -18.196 7.504 4.081 1.00 71.00 C ATOM 1947 O GLY A 170 -17.560 6.993 5.002 1.00 33.15 O ATOM 0 H GLY A 170 -15.818 9.304 3.876 1.00 32.00 H new ATOM 0 HA2 GLY A 170 -18.717 9.521 3.592 1.00 3.21 H new ATOM 0 HA3 GLY A 170 -17.574 8.786 2.485 1.00 3.21 H new ATOM 1951 N PRO A 171 -19.237 6.886 3.503 1.00 51.43 N ATOM 1952 CA PRO A 171 -19.700 5.559 3.919 1.00 13.31 C ATOM 1953 C PRO A 171 -18.714 4.457 3.545 1.00 64.40 C ATOM 1954 O PRO A 171 -17.910 4.616 2.628 1.00 62.55 O ATOM 1955 CB PRO A 171 -21.012 5.384 3.150 1.00 3.31 C ATOM 1956 CG PRO A 171 -20.872 6.262 1.955 1.00 42.01 C ATOM 1957 CD PRO A 171 -20.043 7.436 2.399 1.00 54.10 C ATOM 0 HA PRO A 171 -19.810 5.487 5.001 1.00 13.31 H new ATOM 0 HB2 PRO A 171 -21.166 4.344 2.861 1.00 3.31 H new ATOM 0 HB3 PRO A 171 -21.869 5.676 3.757 1.00 3.31 H new ATOM 0 HG2 PRO A 171 -20.389 5.731 1.135 1.00 42.01 H new ATOM 0 HG3 PRO A 171 -21.847 6.587 1.593 1.00 42.01 H new ATOM 0 HD2 PRO A 171 -19.415 7.813 1.592 1.00 54.10 H new ATOM 0 HD3 PRO A 171 -20.667 8.266 2.731 1.00 54.10 H new ATOM 1962 N ALA A 172 -18.782 3.341 4.262 1.00 12.25 N ATOM 1963 CA ALA A 172 -17.896 2.212 4.004 1.00 61.32 C ATOM 1964 C ALA A 172 -18.107 1.659 2.598 1.00 71.32 C ATOM 1965 O ALA A 172 -19.234 1.590 2.110 1.00 3.50 O ATOM 1966 CB ALA A 172 -18.116 1.120 5.041 1.00 70.23 C ATOM 0 H ALA A 172 -19.441 3.194 5.026 1.00 12.25 H new ATOM 0 HA ALA A 172 -16.867 2.565 4.077 1.00 61.32 H new ATOM 0 HB1 ALA A 172 -17.448 0.284 4.836 1.00 70.23 H new ATOM 0 HB2 ALA A 172 -17.908 1.515 6.035 1.00 70.23 H new ATOM 0 HB3 ALA A 172 -19.150 0.778 4.996 1.00 70.23 H new ATOM 1972 N VAL A 173 -17.013 1.267 1.952 1.00 62.32 N ATOM 1973 CA VAL A 173 -17.078 0.720 0.602 1.00 42.13 C ATOM 1974 C VAL A 173 -16.722 -0.762 0.592 1.00 52.20 C ATOM 1975 O VAL A 173 -15.646 -1.155 1.041 1.00 22.51 O ATOM 1976 CB VAL A 173 -16.132 1.471 -0.354 1.00 51.14 C ATOM 1977 CG1 VAL A 173 -16.343 1.008 -1.788 1.00 63.12 C ATOM 1978 CG2 VAL A 173 -16.337 2.974 -0.235 1.00 21.34 C ATOM 0 H VAL A 173 -16.072 1.318 2.342 1.00 62.32 H new ATOM 0 HA VAL A 173 -18.105 0.846 0.258 1.00 42.13 H new ATOM 0 HB VAL A 173 -15.104 1.244 -0.072 1.00 51.14 H new ATOM 0 HG11 VAL A 173 -15.666 1.550 -2.449 1.00 63.12 H new ATOM 0 HG12 VAL A 173 -16.141 -0.061 -1.859 1.00 63.12 H new ATOM 0 HG13 VAL A 173 -17.373 1.203 -2.085 1.00 63.12 H new ATOM 0 HG21 VAL A 173 -15.661 3.489 -0.917 1.00 21.34 H new ATOM 0 HG22 VAL A 173 -17.367 3.222 -0.490 1.00 21.34 H new ATOM 0 HG23 VAL A 173 -16.130 3.290 0.788 1.00 21.34 H new ATOM 1988 N GLU A 174 -17.633 -1.581 0.076 1.00 65.45 N ATOM 1989 CA GLU A 174 -17.415 -3.021 0.007 1.00 34.40 C ATOM 1990 C GLU A 174 -17.157 -3.465 -1.430 1.00 63.00 C ATOM 1991 O GLU A 174 -17.954 -3.189 -2.328 1.00 54.13 O ATOM 1992 CB GLU A 174 -18.622 -3.770 0.575 1.00 25.54 C ATOM 1993 CG GLU A 174 -19.956 -3.251 0.066 1.00 24.30 C ATOM 1994 CD GLU A 174 -20.973 -4.357 -0.135 1.00 22.13 C ATOM 1995 OE1 GLU A 174 -20.797 -5.441 0.459 1.00 31.10 O ATOM 1996 OE2 GLU A 174 -21.948 -4.136 -0.885 1.00 34.32 O ATOM 0 H GLU A 174 -18.529 -1.272 -0.300 1.00 65.45 H new ATOM 0 HA GLU A 174 -16.535 -3.258 0.605 1.00 34.40 H new ATOM 0 HB2 GLU A 174 -18.534 -4.827 0.324 1.00 25.54 H new ATOM 0 HB3 GLU A 174 -18.605 -3.698 1.662 1.00 25.54 H new ATOM 0 HG2 GLU A 174 -20.352 -2.522 0.773 1.00 24.30 H new ATOM 0 HG3 GLU A 174 -19.802 -2.728 -0.878 1.00 24.30 H new ATOM 2001 N VAL A 175 -16.040 -4.153 -1.639 1.00 70.44 N ATOM 2002 CA VAL A 175 -15.677 -4.636 -2.967 1.00 24.54 C ATOM 2003 C VAL A 175 -14.962 -5.980 -2.886 1.00 62.42 C ATOM 2004 O VAL A 175 -13.977 -6.127 -2.163 1.00 10.11 O ATOM 2005 CB VAL A 175 -14.773 -3.629 -3.703 1.00 34.52 C ATOM 2006 CG1 VAL A 175 -14.555 -4.061 -5.144 1.00 61.23 C ATOM 2007 CG2 VAL A 175 -15.370 -2.231 -3.640 1.00 44.23 C ATOM 0 H VAL A 175 -15.370 -4.389 -0.907 1.00 70.44 H new ATOM 0 HA VAL A 175 -16.605 -4.755 -3.526 1.00 24.54 H new ATOM 0 HB VAL A 175 -13.803 -3.607 -3.206 1.00 34.52 H new ATOM 0 HG11 VAL A 175 -13.914 -3.337 -5.648 1.00 61.23 H new ATOM 0 HG12 VAL A 175 -14.079 -5.042 -5.162 1.00 61.23 H new ATOM 0 HG13 VAL A 175 -15.515 -4.114 -5.657 1.00 61.23 H new ATOM 0 HG21 VAL A 175 -14.718 -1.533 -4.165 1.00 44.23 H new ATOM 0 HG22 VAL A 175 -16.353 -2.234 -4.111 1.00 44.23 H new ATOM 0 HG23 VAL A 175 -15.467 -1.924 -2.599 1.00 44.23 H new ATOM 2017 N ASP A 176 -15.464 -6.956 -3.633 1.00 40.00 N ATOM 2018 CA ASP A 176 -14.873 -8.289 -3.647 1.00 70.03 C ATOM 2019 C ASP A 176 -13.380 -8.218 -3.952 1.00 53.14 C ATOM 2020 O ASP A 176 -12.952 -7.487 -4.846 1.00 51.12 O ATOM 2021 CB ASP A 176 -15.576 -9.171 -4.681 1.00 72.24 C ATOM 2022 CG ASP A 176 -17.057 -9.327 -4.397 1.00 42.22 C ATOM 2023 OD1 ASP A 176 -17.766 -8.299 -4.360 1.00 72.02 O ATOM 2024 OD2 ASP A 176 -17.507 -10.477 -4.214 1.00 63.54 O ATOM 0 H ASP A 176 -16.279 -6.850 -4.237 1.00 40.00 H new ATOM 0 HA ASP A 176 -15.003 -8.728 -2.658 1.00 70.03 H new ATOM 0 HB2 ASP A 176 -15.443 -8.740 -5.673 1.00 72.24 H new ATOM 0 HB3 ASP A 176 -15.106 -10.154 -4.695 1.00 72.24 H new ATOM 2028 N VAL A 177 -12.591 -8.981 -3.203 1.00 34.42 N ATOM 2029 CA VAL A 177 -11.145 -9.004 -3.393 1.00 3.33 C ATOM 2030 C VAL A 177 -10.787 -9.247 -4.854 1.00 22.30 C ATOM 2031 O VAL A 177 -9.817 -8.689 -5.368 1.00 62.20 O ATOM 2032 CB VAL A 177 -10.483 -10.092 -2.526 1.00 2.13 C ATOM 2033 CG1 VAL A 177 -10.556 -9.719 -1.053 1.00 32.01 C ATOM 2034 CG2 VAL A 177 -11.137 -11.443 -2.775 1.00 24.13 C ATOM 0 H VAL A 177 -12.928 -9.592 -2.459 1.00 34.42 H new ATOM 0 HA VAL A 177 -10.770 -8.027 -3.088 1.00 3.33 H new ATOM 0 HB VAL A 177 -9.432 -10.165 -2.806 1.00 2.13 H new ATOM 0 HG11 VAL A 177 -10.083 -10.499 -0.456 1.00 32.01 H new ATOM 0 HG12 VAL A 177 -10.038 -8.774 -0.891 1.00 32.01 H new ATOM 0 HG13 VAL A 177 -11.599 -9.616 -0.755 1.00 32.01 H new ATOM 0 HG21 VAL A 177 -10.657 -12.200 -2.154 1.00 24.13 H new ATOM 0 HG22 VAL A 177 -12.196 -11.386 -2.524 1.00 24.13 H new ATOM 0 HG23 VAL A 177 -11.027 -11.712 -3.825 1.00 24.13 H new ATOM 2044 N LYS A 178 -11.577 -10.082 -5.521 1.00 20.54 N ATOM 2045 CA LYS A 178 -11.345 -10.399 -6.925 1.00 45.35 C ATOM 2046 C LYS A 178 -11.643 -9.193 -7.811 1.00 23.41 C ATOM 2047 O LYS A 178 -10.977 -8.973 -8.822 1.00 51.50 O ATOM 2048 CB LYS A 178 -12.213 -11.585 -7.351 1.00 52.14 C ATOM 2049 CG LYS A 178 -12.081 -12.793 -6.441 1.00 34.25 C ATOM 2050 CD LYS A 178 -13.040 -13.901 -6.843 1.00 23.14 C ATOM 2051 CE LYS A 178 -14.371 -13.776 -6.119 1.00 2.32 C ATOM 2052 NZ LYS A 178 -15.372 -14.757 -6.624 1.00 43.11 N ATOM 0 H LYS A 178 -12.384 -10.552 -5.111 1.00 20.54 H new ATOM 0 HA LYS A 178 -10.294 -10.664 -7.044 1.00 45.35 H new ATOM 0 HB2 LYS A 178 -13.256 -11.271 -7.375 1.00 52.14 H new ATOM 0 HB3 LYS A 178 -11.944 -11.875 -8.367 1.00 52.14 H new ATOM 0 HG2 LYS A 178 -11.057 -13.166 -6.476 1.00 34.25 H new ATOM 0 HG3 LYS A 178 -12.277 -12.497 -5.411 1.00 34.25 H new ATOM 0 HD2 LYS A 178 -13.206 -13.867 -7.920 1.00 23.14 H new ATOM 0 HD3 LYS A 178 -12.593 -14.870 -6.620 1.00 23.14 H new ATOM 0 HE2 LYS A 178 -14.219 -13.930 -5.051 1.00 2.32 H new ATOM 0 HE3 LYS A 178 -14.759 -12.765 -6.244 1.00 2.32 H new ATOM 0 HZ1 LYS A 178 -16.266 -14.639 -6.105 1.00 43.11 H new ATOM 0 HZ2 LYS A 178 -15.536 -14.594 -7.638 1.00 43.11 H new ATOM 0 HZ3 LYS A 178 -15.014 -15.723 -6.482 1.00 43.11 H new ATOM 2062 N ASP A 179 -12.647 -8.413 -7.423 1.00 11.20 N ATOM 2063 CA ASP A 179 -13.031 -7.228 -8.180 1.00 64.11 C ATOM 2064 C ASP A 179 -11.947 -6.158 -8.101 1.00 65.12 C ATOM 2065 O ASP A 179 -11.508 -5.628 -9.122 1.00 51.42 O ATOM 2066 CB ASP A 179 -14.356 -6.670 -7.658 1.00 61.30 C ATOM 2067 CG ASP A 179 -15.035 -5.756 -8.659 1.00 40.21 C ATOM 2068 OD1 ASP A 179 -14.806 -5.935 -9.873 1.00 44.12 O ATOM 2069 OD2 ASP A 179 -15.794 -4.863 -8.229 1.00 20.34 O ATOM 0 H ASP A 179 -13.209 -8.581 -6.589 1.00 11.20 H new ATOM 0 HA ASP A 179 -13.154 -7.518 -9.223 1.00 64.11 H new ATOM 0 HB2 ASP A 179 -15.024 -7.496 -7.414 1.00 61.30 H new ATOM 0 HB3 ASP A 179 -14.177 -6.122 -6.733 1.00 61.30 H new ATOM 2073 N ILE A 180 -11.522 -5.842 -6.882 1.00 74.02 N ATOM 2074 CA ILE A 180 -10.490 -4.835 -6.671 1.00 1.31 C ATOM 2075 C ILE A 180 -9.178 -5.246 -7.329 1.00 60.23 C ATOM 2076 O ILE A 180 -8.901 -6.428 -7.534 1.00 21.43 O ATOM 2077 CB ILE A 180 -10.243 -4.588 -5.171 1.00 2.11 C ATOM 2078 CG1 ILE A 180 -10.018 -5.916 -4.443 1.00 63.12 C ATOM 2079 CG2 ILE A 180 -11.415 -3.835 -4.558 1.00 21.11 C ATOM 2080 CD1 ILE A 180 -9.535 -5.749 -3.020 1.00 13.15 C ATOM 0 H ILE A 180 -11.876 -6.269 -6.026 1.00 74.02 H new ATOM 0 HA ILE A 180 -10.850 -3.914 -7.129 1.00 1.31 H new ATOM 0 HB ILE A 180 -9.346 -3.978 -5.061 1.00 2.11 H new ATOM 0 HG12 ILE A 180 -10.950 -6.481 -4.438 1.00 63.12 H new ATOM 0 HG13 ILE A 180 -9.290 -6.507 -4.999 1.00 63.12 H new ATOM 0 HG21 ILE A 180 -11.226 -3.668 -3.498 1.00 21.11 H new ATOM 0 HG22 ILE A 180 -11.534 -2.875 -5.061 1.00 21.11 H new ATOM 0 HG23 ILE A 180 -12.326 -4.422 -4.676 1.00 21.11 H new ATOM 0 HD11 ILE A 180 -9.397 -6.730 -2.565 1.00 13.15 H new ATOM 0 HD12 ILE A 180 -8.587 -5.211 -3.018 1.00 13.15 H new ATOM 0 HD13 ILE A 180 -10.273 -5.185 -2.449 1.00 13.15 H new