USER MOD reduce.3.24.130724 H: found=0, std=0, add=436, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 429 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 158 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 169 LYS NZ :NH3+ -167:sc= -0.0125 (180deg=-0.174) USER MOD Set 2.1: A 147 CYS SG : rot -161:sc= 1.87 USER MOD Set 2.2: A 150 CYS SG : rot -104:sc= 0.273 USER MOD Set 2.3: A 168 CYS SG : rot 47:sc= 0.33 USER MOD Set 2.4: A 171 CYS SG : rot -115:sc= 0.26 USER MOD Set 3.1: A 120 CYS SG : rot 171:sc= 0.626 USER MOD Set 3.2: A 123 CYS SG : rot -62:sc= 0.489 USER MOD Set 3.3: A 141 HIS : no HD1:sc= 0.269 K(o=0.96,f=-0.58) USER MOD Set 3.4: A 144 CYS SG : rot 141:sc= -0.425 USER MOD Single : A 119 LYS NZ :NH3+ 151:sc= -0.0328 (180deg=-1.08) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0111) USER MOD Single : A 142 LYS NZ :NH3+ -124:sc=-0.00421 (180deg=-0.281) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00657) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot -30:sc= 0.263 USER MOD Single : A 160 THR OG1 : rot 6:sc= 0.198 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot -49:sc= 0.381 USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0132) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 11 N GLU A 118 -2.301 -13.550 -4.305 1.00 0.00 N ATOM 12 CA GLU A 118 -1.901 -12.398 -5.069 1.00 0.00 C ATOM 13 C GLU A 118 -0.662 -11.934 -4.384 1.00 0.00 C ATOM 14 O GLU A 118 -0.520 -12.079 -3.173 1.00 0.00 O ATOM 15 CB GLU A 118 -2.996 -11.298 -5.081 1.00 0.00 C ATOM 16 CG GLU A 118 -2.960 -10.305 -6.264 1.00 0.00 C ATOM 17 CD GLU A 118 -1.812 -9.301 -6.162 1.00 0.00 C ATOM 18 OE1 GLU A 118 -1.741 -8.582 -5.131 1.00 0.00 O ATOM 19 OE2 GLU A 118 -0.994 -9.235 -7.118 1.00 0.00 O ATOM 0 HA GLU A 118 -1.739 -12.633 -6.121 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -3.971 -11.786 -5.074 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.918 -10.729 -4.155 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -2.868 -10.862 -7.197 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.906 -9.765 -6.308 1.00 0.00 H new ATOM 26 N LYS A 119 0.301 -11.411 -5.169 1.00 0.00 N ATOM 27 CA LYS A 119 1.629 -11.165 -4.693 1.00 0.00 C ATOM 28 C LYS A 119 1.754 -9.815 -4.041 1.00 0.00 C ATOM 29 O LYS A 119 1.210 -8.820 -4.515 1.00 0.00 O ATOM 30 CB LYS A 119 2.680 -11.365 -5.784 1.00 0.00 C ATOM 31 CG LYS A 119 4.072 -11.737 -5.253 1.00 0.00 C ATOM 32 CD LYS A 119 5.190 -11.800 -6.308 1.00 0.00 C ATOM 33 CE LYS A 119 5.249 -13.097 -7.134 1.00 0.00 C ATOM 34 NZ LYS A 119 4.144 -13.200 -8.115 1.00 0.00 N ATOM 0 H LYS A 119 0.156 -11.156 -6.146 1.00 0.00 H new ATOM 0 HA LYS A 119 1.825 -11.912 -3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.340 -12.148 -6.462 1.00 0.00 H new ATOM 0 HB3 LYS A 119 2.759 -10.449 -6.370 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.356 -11.011 -4.491 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.006 -12.707 -4.761 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.068 -10.960 -6.992 1.00 0.00 H new ATOM 0 HD3 LYS A 119 6.148 -11.666 -5.805 1.00 0.00 H new ATOM 0 HE2 LYS A 119 6.202 -13.145 -7.660 1.00 0.00 H new ATOM 0 HE3 LYS A 119 5.213 -13.954 -6.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 4.456 -13.763 -8.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 3.326 -13.661 -7.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.873 -12.248 -8.434 1.00 0.00 H new ATOM 48 N CYS A 120 2.501 -9.785 -2.913 1.00 0.00 N ATOM 49 CA CYS A 120 2.820 -8.606 -2.155 1.00 0.00 C ATOM 50 C CYS A 120 4.056 -8.006 -2.772 1.00 0.00 C ATOM 51 O CYS A 120 5.063 -8.685 -2.967 1.00 0.00 O ATOM 52 CB CYS A 120 3.064 -8.944 -0.667 1.00 0.00 C ATOM 53 SG CYS A 120 3.414 -7.520 0.404 1.00 0.00 S ATOM 0 H CYS A 120 2.904 -10.631 -2.509 1.00 0.00 H new ATOM 0 HA CYS A 120 1.988 -7.902 -2.184 1.00 0.00 H new ATOM 0 HB2 CYS A 120 2.186 -9.462 -0.280 1.00 0.00 H new ATOM 0 HB3 CYS A 120 3.900 -9.641 -0.602 1.00 0.00 H new ATOM 0 HG CYS A 120 3.405 -7.900 1.647 1.00 0.00 H new ATOM 58 N SER A 121 3.961 -6.705 -3.132 1.00 0.00 N ATOM 59 CA SER A 121 4.951 -5.993 -3.901 1.00 0.00 C ATOM 60 C SER A 121 6.127 -5.544 -3.066 1.00 0.00 C ATOM 61 O SER A 121 7.212 -5.328 -3.606 1.00 0.00 O ATOM 62 CB SER A 121 4.334 -4.762 -4.619 1.00 0.00 C ATOM 63 OG SER A 121 3.702 -3.863 -3.713 1.00 0.00 O ATOM 0 H SER A 121 3.162 -6.125 -2.877 1.00 0.00 H new ATOM 0 HA SER A 121 5.315 -6.703 -4.644 1.00 0.00 H new ATOM 0 HB2 SER A 121 5.116 -4.234 -5.164 1.00 0.00 H new ATOM 0 HB3 SER A 121 3.606 -5.102 -5.356 1.00 0.00 H new ATOM 0 HG SER A 121 3.331 -3.105 -4.210 1.00 0.00 H new ATOM 69 N ARG A 122 5.943 -5.388 -1.731 1.00 0.00 N ATOM 70 CA ARG A 122 6.946 -4.812 -0.863 1.00 0.00 C ATOM 71 C ARG A 122 7.984 -5.845 -0.529 1.00 0.00 C ATOM 72 O ARG A 122 9.171 -5.634 -0.770 1.00 0.00 O ATOM 73 CB ARG A 122 6.327 -4.294 0.457 1.00 0.00 C ATOM 74 CG ARG A 122 7.287 -3.810 1.573 1.00 0.00 C ATOM 75 CD ARG A 122 8.014 -2.475 1.338 1.00 0.00 C ATOM 76 NE ARG A 122 9.052 -2.620 0.267 1.00 0.00 N ATOM 77 CZ ARG A 122 9.859 -1.585 -0.120 1.00 0.00 C ATOM 78 NH1 ARG A 122 9.782 -0.367 0.492 1.00 0.00 N ATOM 79 NH2 ARG A 122 10.748 -1.774 -1.138 1.00 0.00 N ATOM 0 H ARG A 122 5.089 -5.664 -1.247 1.00 0.00 H new ATOM 0 HA ARG A 122 7.396 -3.973 -1.394 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.659 -3.469 0.211 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.709 -5.091 0.871 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.717 -3.727 2.498 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.040 -4.582 1.731 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.294 -1.708 1.052 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.483 -2.143 2.264 1.00 0.00 H new ATOM 0 HE ARG A 122 9.161 -3.525 -0.191 1.00 0.00 H new ATOM 0 HH11 ARG A 122 9.116 -0.218 1.250 1.00 0.00 H new ATOM 0 HH12 ARG A 122 10.391 0.394 0.191 1.00 0.00 H new ATOM 0 HH21 ARG A 122 10.806 -2.680 -1.603 1.00 0.00 H new ATOM 0 HH22 ARG A 122 11.354 -1.009 -1.434 1.00 0.00 H new ATOM 93 N CYS A 123 7.551 -6.994 0.042 1.00 0.00 N ATOM 94 CA CYS A 123 8.454 -7.952 0.635 1.00 0.00 C ATOM 95 C CYS A 123 8.903 -8.943 -0.408 1.00 0.00 C ATOM 96 O CYS A 123 9.960 -9.554 -0.263 1.00 0.00 O ATOM 97 CB CYS A 123 7.832 -8.675 1.864 1.00 0.00 C ATOM 98 SG CYS A 123 6.296 -9.605 1.531 1.00 0.00 S ATOM 0 H CYS A 123 6.568 -7.262 0.094 1.00 0.00 H new ATOM 0 HA CYS A 123 9.320 -7.405 1.008 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.572 -9.363 2.272 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.627 -7.933 2.636 1.00 0.00 H new ATOM 0 HG CYS A 123 5.371 -8.785 1.128 1.00 0.00 H new ATOM 103 N GLY A 124 8.118 -9.093 -1.505 1.00 0.00 N ATOM 104 CA GLY A 124 8.506 -9.870 -2.658 1.00 0.00 C ATOM 105 C GLY A 124 7.883 -11.231 -2.618 1.00 0.00 C ATOM 106 O GLY A 124 7.846 -11.926 -3.632 1.00 0.00 O ATOM 0 H GLY A 124 7.196 -8.666 -1.592 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.203 -9.353 -3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.592 -9.963 -2.691 1.00 0.00 H new ATOM 110 N ASP A 125 7.376 -11.645 -1.433 1.00 0.00 N ATOM 111 CA ASP A 125 6.748 -12.928 -1.229 1.00 0.00 C ATOM 112 C ASP A 125 5.308 -12.789 -1.621 1.00 0.00 C ATOM 113 O ASP A 125 4.800 -11.677 -1.748 1.00 0.00 O ATOM 114 CB ASP A 125 6.797 -13.394 0.248 1.00 0.00 C ATOM 115 CG ASP A 125 8.252 -13.478 0.713 1.00 0.00 C ATOM 116 OD1 ASP A 125 9.007 -14.313 0.150 1.00 0.00 O ATOM 117 OD2 ASP A 125 8.624 -12.703 1.635 1.00 0.00 O ATOM 0 H ASP A 125 7.403 -11.071 -0.591 1.00 0.00 H new ATOM 0 HA ASP A 125 7.283 -13.667 -1.826 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.243 -12.698 0.878 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.316 -14.367 0.349 1.00 0.00 H new ATOM 122 N SER A 126 4.616 -13.932 -1.830 1.00 0.00 N ATOM 123 CA SER A 126 3.215 -13.936 -2.164 1.00 0.00 C ATOM 124 C SER A 126 2.460 -13.993 -0.871 1.00 0.00 C ATOM 125 O SER A 126 2.807 -14.768 0.020 1.00 0.00 O ATOM 126 CB SER A 126 2.816 -15.127 -3.073 1.00 0.00 C ATOM 127 OG SER A 126 1.473 -15.022 -3.535 1.00 0.00 O ATOM 0 H SER A 126 5.031 -14.862 -1.767 1.00 0.00 H new ATOM 0 HA SER A 126 2.978 -13.037 -2.733 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.491 -15.172 -3.928 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.937 -16.060 -2.522 1.00 0.00 H new ATOM 0 HG SER A 126 1.262 -15.791 -4.105 1.00 0.00 H new ATOM 133 N VAL A 127 1.408 -13.149 -0.749 1.00 0.00 N ATOM 134 CA VAL A 127 0.535 -13.158 0.395 1.00 0.00 C ATOM 135 C VAL A 127 -0.623 -14.056 0.033 1.00 0.00 C ATOM 136 O VAL A 127 -1.278 -13.885 -0.995 1.00 0.00 O ATOM 137 CB VAL A 127 0.124 -11.770 0.881 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.613 -10.937 -0.189 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.685 -11.916 2.182 1.00 0.00 C ATOM 0 H VAL A 127 1.161 -12.453 -1.453 1.00 0.00 H new ATOM 0 HA VAL A 127 1.058 -13.548 1.268 1.00 0.00 H new ATOM 0 HB VAL A 127 1.029 -11.198 1.086 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.875 -9.963 0.225 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.035 -10.801 -1.054 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.521 -11.458 -0.494 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.983 -10.930 2.538 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.574 -12.518 1.992 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.071 -12.404 2.939 1.00 0.00 H new ATOM 149 N TYR A 128 -0.851 -15.085 0.879 1.00 0.00 N ATOM 150 CA TYR A 128 -1.820 -16.127 0.648 1.00 0.00 C ATOM 151 C TYR A 128 -3.030 -15.751 1.448 1.00 0.00 C ATOM 152 O TYR A 128 -4.033 -15.301 0.898 1.00 0.00 O ATOM 153 CB TYR A 128 -1.313 -17.523 1.093 1.00 0.00 C ATOM 154 CG TYR A 128 -0.163 -17.945 0.216 1.00 0.00 C ATOM 155 CD1 TYR A 128 -0.402 -18.628 -0.988 1.00 0.00 C ATOM 156 CD2 TYR A 128 1.164 -17.650 0.576 1.00 0.00 C ATOM 157 CE1 TYR A 128 0.658 -18.994 -1.826 1.00 0.00 C ATOM 158 CE2 TYR A 128 2.228 -18.015 -0.258 1.00 0.00 C ATOM 159 CZ TYR A 128 1.976 -18.686 -1.463 1.00 0.00 C ATOM 160 OH TYR A 128 3.048 -19.046 -2.311 1.00 0.00 O ATOM 0 H TYR A 128 -0.343 -15.197 1.756 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.028 -16.207 -0.419 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -0.996 -17.491 2.135 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.120 -18.252 1.028 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.415 -18.874 -1.270 1.00 0.00 H new ATOM 0 HD2 TYR A 128 1.365 -17.137 1.505 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.460 -19.514 -2.752 1.00 0.00 H new ATOM 0 HE2 TYR A 128 3.243 -17.780 0.027 1.00 0.00 H new ATOM 0 HH TYR A 128 3.894 -18.757 -1.910 1.00 0.00 H new ATOM 170 N ALA A 129 -2.936 -15.918 2.782 1.00 0.00 N ATOM 171 CA ALA A 129 -3.943 -15.484 3.707 1.00 0.00 C ATOM 172 C ALA A 129 -3.215 -15.328 5.009 1.00 0.00 C ATOM 173 O ALA A 129 -3.645 -15.839 6.042 1.00 0.00 O ATOM 174 CB ALA A 129 -5.094 -16.498 3.875 1.00 0.00 C ATOM 0 H ALA A 129 -2.138 -16.367 3.231 1.00 0.00 H new ATOM 0 HA ALA A 129 -4.415 -14.568 3.351 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.821 -16.108 4.588 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -5.580 -16.660 2.913 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -4.695 -17.443 4.243 1.00 0.00 H new ATOM 180 N ALA A 130 -2.069 -14.605 4.971 1.00 0.00 N ATOM 181 CA ALA A 130 -1.203 -14.412 6.106 1.00 0.00 C ATOM 182 C ALA A 130 -1.707 -13.219 6.870 1.00 0.00 C ATOM 183 O ALA A 130 -2.553 -13.359 7.753 1.00 0.00 O ATOM 184 CB ALA A 130 0.268 -14.203 5.686 1.00 0.00 C ATOM 0 H ALA A 130 -1.736 -14.142 4.125 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.221 -15.307 6.728 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.883 -14.062 6.574 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.618 -15.078 5.138 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.343 -13.322 5.049 1.00 0.00 H new ATOM 190 N GLU A 131 -1.204 -12.013 6.523 1.00 0.00 N ATOM 191 CA GLU A 131 -1.635 -10.765 7.099 1.00 0.00 C ATOM 192 C GLU A 131 -2.418 -10.039 6.041 1.00 0.00 C ATOM 193 O GLU A 131 -2.379 -8.811 5.973 1.00 0.00 O ATOM 194 CB GLU A 131 -0.437 -9.870 7.502 1.00 0.00 C ATOM 195 CG GLU A 131 0.494 -10.504 8.548 1.00 0.00 C ATOM 196 CD GLU A 131 1.661 -9.554 8.814 1.00 0.00 C ATOM 197 OE1 GLU A 131 1.407 -8.429 9.324 1.00 0.00 O ATOM 198 OE2 GLU A 131 2.821 -9.937 8.506 1.00 0.00 O ATOM 0 H GLU A 131 -0.474 -11.902 5.819 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.221 -10.972 7.995 1.00 0.00 H new ATOM 0 HB2 GLU A 131 0.143 -9.634 6.610 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -0.817 -8.927 7.894 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -0.053 -10.697 9.471 1.00 0.00 H new ATOM 0 HG3 GLU A 131 0.864 -11.465 8.190 1.00 0.00 H new ATOM 205 N LYS A 132 -3.151 -10.786 5.172 1.00 0.00 N ATOM 206 CA LYS A 132 -3.730 -10.229 3.974 1.00 0.00 C ATOM 207 C LYS A 132 -4.914 -9.376 4.327 1.00 0.00 C ATOM 208 O LYS A 132 -5.787 -9.790 5.089 1.00 0.00 O ATOM 209 CB LYS A 132 -4.166 -11.329 2.986 1.00 0.00 C ATOM 210 CG LYS A 132 -4.334 -10.855 1.533 1.00 0.00 C ATOM 211 CD LYS A 132 -4.495 -12.046 0.579 1.00 0.00 C ATOM 212 CE LYS A 132 -4.609 -11.662 -0.901 1.00 0.00 C ATOM 213 NZ LYS A 132 -4.740 -12.868 -1.752 1.00 0.00 N ATOM 0 H LYS A 132 -3.341 -11.779 5.303 1.00 0.00 H new ATOM 0 HA LYS A 132 -2.965 -9.622 3.489 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.430 -12.132 3.009 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.111 -11.752 3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -5.205 -10.204 1.458 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -3.468 -10.263 1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -3.642 -12.714 0.704 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -5.384 -12.608 0.865 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -5.473 -11.014 -1.047 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -3.729 -11.093 -1.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -4.816 -12.583 -2.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -3.903 -13.473 -1.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -5.593 -13.396 -1.477 1.00 0.00 H new ATOM 227 N VAL A 133 -4.935 -8.149 3.766 1.00 0.00 N ATOM 228 CA VAL A 133 -5.926 -7.142 4.033 1.00 0.00 C ATOM 229 C VAL A 133 -5.961 -6.322 2.780 1.00 0.00 C ATOM 230 O VAL A 133 -5.015 -6.326 1.993 1.00 0.00 O ATOM 231 CB VAL A 133 -5.634 -6.209 5.216 1.00 0.00 C ATOM 232 CG1 VAL A 133 -5.755 -6.967 6.553 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.244 -5.553 5.094 1.00 0.00 C ATOM 0 H VAL A 133 -4.230 -7.844 3.096 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.858 -7.637 4.307 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.380 -5.414 5.196 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.544 -6.286 7.378 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.766 -7.361 6.658 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.041 -7.790 6.570 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -4.074 -4.900 5.950 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.477 -6.327 5.070 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -4.197 -4.968 4.176 1.00 0.00 H new ATOM 243 N ILE A 134 -7.076 -5.588 2.572 1.00 0.00 N ATOM 244 CA ILE A 134 -7.200 -4.619 1.515 1.00 0.00 C ATOM 245 C ILE A 134 -7.129 -3.294 2.219 1.00 0.00 C ATOM 246 O ILE A 134 -7.742 -3.104 3.269 1.00 0.00 O ATOM 247 CB ILE A 134 -8.505 -4.762 0.737 1.00 0.00 C ATOM 248 CG1 ILE A 134 -8.634 -6.177 0.109 1.00 0.00 C ATOM 249 CG2 ILE A 134 -8.627 -3.653 -0.331 1.00 0.00 C ATOM 250 CD1 ILE A 134 -7.535 -6.551 -0.892 1.00 0.00 C ATOM 0 H ILE A 134 -7.912 -5.669 3.151 1.00 0.00 H new ATOM 0 HA ILE A 134 -6.419 -4.744 0.765 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.333 -4.644 1.437 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -8.638 -6.914 0.912 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -9.599 -6.247 -0.393 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -9.564 -3.773 -0.875 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.611 -2.677 0.154 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.792 -3.725 -1.028 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -7.716 -7.556 -1.272 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -7.541 -5.843 -1.721 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -6.565 -6.520 -0.396 1.00 0.00 H new ATOM 262 N GLY A 135 -6.357 -2.349 1.638 1.00 0.00 N ATOM 263 CA GLY A 135 -6.212 -1.009 2.140 1.00 0.00 C ATOM 264 C GLY A 135 -7.093 -0.162 1.291 1.00 0.00 C ATOM 265 O GLY A 135 -8.207 0.180 1.683 1.00 0.00 O ATOM 0 H GLY A 135 -5.816 -2.523 0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.505 -0.950 3.188 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.175 -0.679 2.080 1.00 0.00 H new ATOM 269 N ALA A 136 -6.596 0.173 0.080 1.00 0.00 N ATOM 270 CA ALA A 136 -7.332 0.913 -0.909 1.00 0.00 C ATOM 271 C ALA A 136 -7.978 -0.070 -1.837 1.00 0.00 C ATOM 272 O ALA A 136 -9.195 -0.055 -2.010 1.00 0.00 O ATOM 273 CB ALA A 136 -6.428 1.841 -1.732 1.00 0.00 C ATOM 0 H ALA A 136 -5.654 -0.078 -0.220 1.00 0.00 H new ATOM 0 HA ALA A 136 -8.066 1.534 -0.396 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.029 2.378 -2.465 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -5.940 2.556 -1.069 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -5.671 1.249 -2.247 1.00 0.00 H new ATOM 279 N GLY A 137 -7.164 -0.955 -2.458 1.00 0.00 N ATOM 280 CA GLY A 137 -7.671 -1.888 -3.427 1.00 0.00 C ATOM 281 C GLY A 137 -6.746 -3.056 -3.536 1.00 0.00 C ATOM 282 O GLY A 137 -7.191 -4.164 -3.831 1.00 0.00 O ATOM 0 H GLY A 137 -6.160 -1.024 -2.289 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -8.665 -2.226 -3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.772 -1.401 -4.397 1.00 0.00 H new ATOM 286 N LYS A 138 -5.424 -2.839 -3.322 1.00 0.00 N ATOM 287 CA LYS A 138 -4.431 -3.860 -3.556 1.00 0.00 C ATOM 288 C LYS A 138 -4.219 -4.678 -2.296 1.00 0.00 C ATOM 289 O LYS A 138 -4.361 -4.137 -1.200 1.00 0.00 O ATOM 290 CB LYS A 138 -3.070 -3.284 -4.011 1.00 0.00 C ATOM 291 CG LYS A 138 -3.195 -2.483 -5.319 1.00 0.00 C ATOM 292 CD LYS A 138 -1.856 -2.155 -6.006 1.00 0.00 C ATOM 293 CE LYS A 138 -0.902 -1.262 -5.200 1.00 0.00 C ATOM 294 NZ LYS A 138 -1.511 0.054 -4.893 1.00 0.00 N ATOM 0 H LYS A 138 -5.043 -1.955 -2.986 1.00 0.00 H new ATOM 0 HA LYS A 138 -4.814 -4.485 -4.363 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.668 -2.641 -3.228 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -2.359 -4.099 -4.150 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.816 -3.046 -6.015 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.718 -1.550 -5.109 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -1.345 -3.091 -6.233 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -2.066 -1.667 -6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.632 -1.764 -4.271 1.00 0.00 H new ATOM 0 HE3 LYS A 138 0.020 -1.114 -5.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -0.820 0.648 -4.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -1.792 0.521 -5.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -2.349 -0.083 -4.292 1.00 0.00 H new ATOM 308 N PRO A 139 -3.873 -5.966 -2.394 1.00 0.00 N ATOM 309 CA PRO A 139 -3.483 -6.795 -1.262 1.00 0.00 C ATOM 310 C PRO A 139 -2.201 -6.356 -0.606 1.00 0.00 C ATOM 311 O PRO A 139 -1.282 -5.925 -1.300 1.00 0.00 O ATOM 312 CB PRO A 139 -3.317 -8.193 -1.856 1.00 0.00 C ATOM 313 CG PRO A 139 -4.374 -8.217 -2.956 1.00 0.00 C ATOM 314 CD PRO A 139 -4.274 -6.802 -3.529 1.00 0.00 C ATOM 0 HA PRO A 139 -4.232 -6.737 -0.472 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -2.314 -8.347 -2.254 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -3.488 -8.972 -1.113 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -4.162 -8.977 -3.708 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -5.368 -8.427 -2.561 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -3.542 -6.752 -4.335 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -5.227 -6.475 -3.944 1.00 0.00 H new ATOM 322 N TRP A 140 -2.172 -6.429 0.742 1.00 0.00 N ATOM 323 CA TRP A 140 -1.127 -5.892 1.567 1.00 0.00 C ATOM 324 C TRP A 140 -0.983 -6.802 2.747 1.00 0.00 C ATOM 325 O TRP A 140 -1.976 -7.290 3.279 1.00 0.00 O ATOM 326 CB TRP A 140 -1.429 -4.485 2.143 1.00 0.00 C ATOM 327 CG TRP A 140 -1.620 -3.382 1.124 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.719 -2.593 0.935 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.627 -2.931 0.186 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.494 -1.693 -0.078 1.00 0.00 N ATOM 331 CE2 TRP A 140 -1.208 -1.873 -0.546 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.677 -3.348 -0.063 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -0.486 -1.211 -1.533 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.409 -2.670 -1.048 1.00 0.00 C ATOM 335 CH2 TRP A 140 0.836 -1.615 -1.772 1.00 0.00 C ATOM 0 H TRP A 140 -2.910 -6.883 1.280 1.00 0.00 H new ATOM 0 HA TRP A 140 -0.240 -5.812 0.939 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.329 -4.549 2.754 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.612 -4.202 2.807 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.635 -2.666 1.502 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -3.164 -1.007 -0.426 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.112 -4.170 0.486 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.931 -0.407 -2.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.428 -2.964 -1.252 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.421 -1.106 -2.524 1.00 0.00 H new ATOM 346 N HIS A 141 0.277 -7.030 3.200 1.00 0.00 N ATOM 347 CA HIS A 141 0.533 -7.500 4.545 1.00 0.00 C ATOM 348 C HIS A 141 0.465 -6.254 5.382 1.00 0.00 C ATOM 349 O HIS A 141 0.674 -5.156 4.869 1.00 0.00 O ATOM 350 CB HIS A 141 1.928 -8.117 4.811 1.00 0.00 C ATOM 351 CG HIS A 141 2.207 -9.422 4.124 1.00 0.00 C ATOM 352 ND1 HIS A 141 3.211 -9.604 3.202 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.697 -10.643 4.406 1.00 0.00 C ATOM 354 CE1 HIS A 141 3.284 -10.902 2.932 1.00 0.00 C ATOM 355 NE2 HIS A 141 2.385 -11.553 3.654 1.00 0.00 N ATOM 0 H HIS A 141 1.116 -6.890 2.638 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.182 -8.295 4.756 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.687 -7.397 4.505 1.00 0.00 H new ATOM 0 HB3 HIS A 141 2.041 -8.262 5.885 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.895 -10.858 5.097 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.970 -11.356 2.232 1.00 0.00 H new ATOM 0 HE2 HIS A 141 2.232 -12.561 3.650 1.00 0.00 H new ATOM 363 N LYS A 142 0.134 -6.382 6.687 1.00 0.00 N ATOM 364 CA LYS A 142 -0.063 -5.240 7.552 1.00 0.00 C ATOM 365 C LYS A 142 1.240 -4.612 7.999 1.00 0.00 C ATOM 366 O LYS A 142 1.234 -3.606 8.702 1.00 0.00 O ATOM 367 CB LYS A 142 -0.912 -5.580 8.798 1.00 0.00 C ATOM 368 CG LYS A 142 -2.364 -5.934 8.437 1.00 0.00 C ATOM 369 CD LYS A 142 -3.264 -6.190 9.660 1.00 0.00 C ATOM 370 CE LYS A 142 -2.969 -7.497 10.413 1.00 0.00 C ATOM 371 NZ LYS A 142 -3.237 -8.680 9.564 1.00 0.00 N ATOM 0 H LYS A 142 0.001 -7.281 7.149 1.00 0.00 H new ATOM 0 HA LYS A 142 -0.606 -4.518 6.942 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -0.457 -6.417 9.327 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -0.907 -4.731 9.481 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -2.790 -5.122 7.848 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -2.365 -6.822 7.805 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -3.158 -5.356 10.353 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -4.304 -6.202 9.333 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -1.928 -7.506 10.735 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -3.582 -7.547 11.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -3.915 -9.305 10.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -3.635 -8.371 8.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -2.349 -9.195 9.397 1.00 0.00 H new ATOM 385 N ASN A 143 2.388 -5.180 7.570 1.00 0.00 N ATOM 386 CA ASN A 143 3.705 -4.624 7.763 1.00 0.00 C ATOM 387 C ASN A 143 4.083 -3.885 6.497 1.00 0.00 C ATOM 388 O ASN A 143 4.866 -2.937 6.524 1.00 0.00 O ATOM 389 CB ASN A 143 4.731 -5.763 8.020 1.00 0.00 C ATOM 390 CG ASN A 143 6.116 -5.217 8.403 1.00 0.00 C ATOM 391 OD1 ASN A 143 6.272 -4.588 9.456 1.00 0.00 O ATOM 392 ND2 ASN A 143 7.129 -5.464 7.517 1.00 0.00 N ATOM 0 H ASN A 143 2.402 -6.067 7.066 1.00 0.00 H new ATOM 0 HA ASN A 143 3.708 -3.952 8.621 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.363 -6.409 8.817 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.819 -6.380 7.126 1.00 0.00 H new ATOM 0 HD21 ASN A 143 8.071 -5.123 7.711 1.00 0.00 H new ATOM 0 HD22 ASN A 143 6.943 -5.989 6.663 1.00 0.00 H new ATOM 399 N CYS A 144 3.532 -4.348 5.356 1.00 0.00 N ATOM 400 CA CYS A 144 3.955 -4.045 4.013 1.00 0.00 C ATOM 401 C CYS A 144 3.069 -3.033 3.323 1.00 0.00 C ATOM 402 O CYS A 144 2.878 -3.149 2.114 1.00 0.00 O ATOM 403 CB CYS A 144 3.927 -5.313 3.127 1.00 0.00 C ATOM 404 SG CYS A 144 5.101 -6.622 3.580 1.00 0.00 S ATOM 0 H CYS A 144 2.732 -4.981 5.371 1.00 0.00 H new ATOM 0 HA CYS A 144 4.962 -3.641 4.121 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.920 -5.729 3.154 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.122 -5.017 2.096 1.00 0.00 H new ATOM 0 HG CYS A 144 4.532 -7.782 3.442 1.00 0.00 H new ATOM 409 N PHE A 145 2.473 -2.028 4.020 1.00 0.00 N ATOM 410 CA PHE A 145 1.609 -1.060 3.356 1.00 0.00 C ATOM 411 C PHE A 145 2.502 -0.049 2.694 1.00 0.00 C ATOM 412 O PHE A 145 2.826 0.985 3.273 1.00 0.00 O ATOM 413 CB PHE A 145 0.659 -0.281 4.308 1.00 0.00 C ATOM 414 CG PHE A 145 -0.686 -0.935 4.444 1.00 0.00 C ATOM 415 CD1 PHE A 145 -0.812 -2.220 4.992 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.853 -0.236 4.081 1.00 0.00 C ATOM 417 CE1 PHE A 145 -2.072 -2.794 5.178 1.00 0.00 C ATOM 418 CE2 PHE A 145 -3.116 -0.810 4.263 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.226 -2.093 4.808 1.00 0.00 C ATOM 0 H PHE A 145 2.583 -1.882 5.024 1.00 0.00 H new ATOM 0 HA PHE A 145 0.977 -1.620 2.667 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.121 -0.202 5.292 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.529 0.735 3.934 1.00 0.00 H new ATOM 0 HD1 PHE A 145 0.073 -2.771 5.273 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.772 0.754 3.657 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -2.156 -3.781 5.608 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -4.004 -0.263 3.983 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.199 -2.542 4.943 1.00 0.00 H new ATOM 429 N ARG A 146 2.932 -0.343 1.444 1.00 0.00 N ATOM 430 CA ARG A 146 3.913 0.461 0.779 1.00 0.00 C ATOM 431 C ARG A 146 3.199 1.546 0.046 1.00 0.00 C ATOM 432 O ARG A 146 2.258 1.322 -0.710 1.00 0.00 O ATOM 433 CB ARG A 146 4.806 -0.320 -0.204 1.00 0.00 C ATOM 434 CG ARG A 146 6.012 0.492 -0.690 1.00 0.00 C ATOM 435 CD ARG A 146 6.873 -0.243 -1.723 1.00 0.00 C ATOM 436 NE ARG A 146 6.081 -0.427 -2.982 1.00 0.00 N ATOM 437 CZ ARG A 146 6.467 -1.290 -3.971 1.00 0.00 C ATOM 438 NH1 ARG A 146 7.590 -2.053 -3.842 1.00 0.00 N ATOM 439 NH2 ARG A 146 5.715 -1.383 -5.107 1.00 0.00 N ATOM 0 H ARG A 146 2.598 -1.138 0.899 1.00 0.00 H new ATOM 0 HA ARG A 146 4.584 0.853 1.543 1.00 0.00 H new ATOM 0 HB2 ARG A 146 5.159 -1.231 0.279 1.00 0.00 H new ATOM 0 HB3 ARG A 146 4.210 -0.626 -1.064 1.00 0.00 H new ATOM 0 HG2 ARG A 146 5.658 1.427 -1.124 1.00 0.00 H new ATOM 0 HG3 ARG A 146 6.632 0.753 0.167 1.00 0.00 H new ATOM 0 HD2 ARG A 146 7.780 0.326 -1.929 1.00 0.00 H new ATOM 0 HD3 ARG A 146 7.186 -1.211 -1.331 1.00 0.00 H new ATOM 0 HE ARG A 146 5.223 0.111 -3.106 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.158 -1.986 -2.997 1.00 0.00 H new ATOM 0 HH12 ARG A 146 7.862 -2.691 -4.590 1.00 0.00 H new ATOM 0 HH21 ARG A 146 4.876 -0.813 -5.211 1.00 0.00 H new ATOM 0 HH22 ARG A 146 5.993 -2.023 -5.851 1.00 0.00 H new ATOM 453 N CYS A 147 3.693 2.766 0.293 1.00 0.00 N ATOM 454 CA CYS A 147 3.210 4.023 -0.178 1.00 0.00 C ATOM 455 C CYS A 147 3.554 4.184 -1.639 1.00 0.00 C ATOM 456 O CYS A 147 4.604 3.747 -2.103 1.00 0.00 O ATOM 457 CB CYS A 147 3.818 5.126 0.700 1.00 0.00 C ATOM 458 SG CYS A 147 3.488 6.813 0.170 1.00 0.00 S ATOM 0 H CYS A 147 4.516 2.883 0.884 1.00 0.00 H new ATOM 0 HA CYS A 147 2.124 4.086 -0.104 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.444 5.004 1.716 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.898 4.981 0.738 1.00 0.00 H new ATOM 0 HG CYS A 147 4.351 7.617 0.718 1.00 0.00 H new ATOM 463 N ALA A 148 2.621 4.779 -2.415 1.00 0.00 N ATOM 464 CA ALA A 148 2.784 4.962 -3.838 1.00 0.00 C ATOM 465 C ALA A 148 3.683 6.132 -4.141 1.00 0.00 C ATOM 466 O ALA A 148 4.305 6.179 -5.202 1.00 0.00 O ATOM 467 CB ALA A 148 1.441 5.216 -4.531 1.00 0.00 C ATOM 0 H ALA A 148 1.739 5.140 -2.052 1.00 0.00 H new ATOM 0 HA ALA A 148 3.228 4.040 -4.213 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.603 5.349 -5.601 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.780 4.365 -4.367 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.983 6.115 -4.119 1.00 0.00 H new ATOM 473 N LYS A 149 3.778 7.098 -3.198 1.00 0.00 N ATOM 474 CA LYS A 149 4.557 8.300 -3.347 1.00 0.00 C ATOM 475 C LYS A 149 5.945 8.024 -2.840 1.00 0.00 C ATOM 476 O LYS A 149 6.879 7.920 -3.633 1.00 0.00 O ATOM 477 CB LYS A 149 3.930 9.486 -2.569 1.00 0.00 C ATOM 478 CG LYS A 149 4.677 10.831 -2.651 1.00 0.00 C ATOM 479 CD LYS A 149 4.733 11.430 -4.066 1.00 0.00 C ATOM 480 CE LYS A 149 5.342 12.838 -4.111 1.00 0.00 C ATOM 481 NZ LYS A 149 6.756 12.831 -3.670 1.00 0.00 N ATOM 0 H LYS A 149 3.296 7.040 -2.301 1.00 0.00 H new ATOM 0 HA LYS A 149 4.581 8.583 -4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 149 2.915 9.636 -2.936 1.00 0.00 H new ATOM 0 HB3 LYS A 149 3.851 9.202 -1.519 1.00 0.00 H new ATOM 0 HG2 LYS A 149 4.193 11.545 -1.984 1.00 0.00 H new ATOM 0 HG3 LYS A 149 5.695 10.693 -2.286 1.00 0.00 H new ATOM 0 HD2 LYS A 149 5.316 10.770 -4.709 1.00 0.00 H new ATOM 0 HD3 LYS A 149 3.724 11.466 -4.477 1.00 0.00 H new ATOM 0 HE2 LYS A 149 5.278 13.231 -5.126 1.00 0.00 H new ATOM 0 HE3 LYS A 149 4.764 13.506 -3.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 7.148 13.792 -3.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 6.810 12.511 -2.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 7.305 12.186 -4.274 1.00 0.00 H new ATOM 495 N CYS A 150 6.114 7.917 -1.498 1.00 0.00 N ATOM 496 CA CYS A 150 7.414 7.935 -0.879 1.00 0.00 C ATOM 497 C CYS A 150 7.943 6.537 -0.638 1.00 0.00 C ATOM 498 O CYS A 150 9.156 6.333 -0.618 1.00 0.00 O ATOM 499 CB CYS A 150 7.402 8.799 0.416 1.00 0.00 C ATOM 500 SG CYS A 150 6.621 8.086 1.908 1.00 0.00 S ATOM 0 H CYS A 150 5.342 7.817 -0.839 1.00 0.00 H new ATOM 0 HA CYS A 150 8.109 8.407 -1.574 1.00 0.00 H new ATOM 0 HB2 CYS A 150 8.434 9.046 0.664 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.896 9.737 0.188 1.00 0.00 H new ATOM 0 HG CYS A 150 5.459 8.639 2.096 1.00 0.00 H new ATOM 505 N GLY A 151 7.042 5.531 -0.507 1.00 0.00 N ATOM 506 CA GLY A 151 7.418 4.129 -0.460 1.00 0.00 C ATOM 507 C GLY A 151 7.722 3.641 0.917 1.00 0.00 C ATOM 508 O GLY A 151 8.248 2.541 1.076 1.00 0.00 O ATOM 0 H GLY A 151 6.037 5.688 -0.432 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.610 3.530 -0.879 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.291 3.974 -1.093 1.00 0.00 H new ATOM 512 N LYS A 152 7.402 4.448 1.956 1.00 0.00 N ATOM 513 CA LYS A 152 7.527 4.050 3.338 1.00 0.00 C ATOM 514 C LYS A 152 6.502 2.979 3.615 1.00 0.00 C ATOM 515 O LYS A 152 5.337 3.124 3.250 1.00 0.00 O ATOM 516 CB LYS A 152 7.287 5.241 4.296 1.00 0.00 C ATOM 517 CG LYS A 152 7.456 4.920 5.789 1.00 0.00 C ATOM 518 CD LYS A 152 7.205 6.139 6.688 1.00 0.00 C ATOM 519 CE LYS A 152 7.285 5.799 8.181 1.00 0.00 C ATOM 520 NZ LYS A 152 7.013 6.993 9.014 1.00 0.00 N ATOM 0 H LYS A 152 7.049 5.397 1.835 1.00 0.00 H new ATOM 0 HA LYS A 152 8.539 3.682 3.508 1.00 0.00 H new ATOM 0 HB2 LYS A 152 7.976 6.044 4.033 1.00 0.00 H new ATOM 0 HB3 LYS A 152 6.278 5.620 4.134 1.00 0.00 H new ATOM 0 HG2 LYS A 152 6.767 4.122 6.065 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.465 4.546 5.964 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.936 6.913 6.456 1.00 0.00 H new ATOM 0 HD3 LYS A 152 6.221 6.553 6.466 1.00 0.00 H new ATOM 0 HE2 LYS A 152 6.566 5.015 8.418 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.274 5.406 8.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 7.073 6.736 10.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 7.715 7.731 8.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 6.060 7.352 8.805 1.00 0.00 H new ATOM 534 N SER A 153 6.944 1.861 4.245 1.00 0.00 N ATOM 535 CA SER A 153 6.088 0.752 4.588 1.00 0.00 C ATOM 536 C SER A 153 5.453 1.068 5.916 1.00 0.00 C ATOM 537 O SER A 153 6.118 1.556 6.830 1.00 0.00 O ATOM 538 CB SER A 153 6.820 -0.614 4.621 1.00 0.00 C ATOM 539 OG SER A 153 7.947 -0.613 5.491 1.00 0.00 O ATOM 0 H SER A 153 7.917 1.726 4.521 1.00 0.00 H new ATOM 0 HA SER A 153 5.334 0.638 3.809 1.00 0.00 H new ATOM 0 HB2 SER A 153 6.122 -1.388 4.939 1.00 0.00 H new ATOM 0 HB3 SER A 153 7.145 -0.872 3.613 1.00 0.00 H new ATOM 0 HG SER A 153 8.372 -1.496 5.477 1.00 0.00 H new ATOM 545 N LEU A 154 4.124 0.848 6.011 1.00 0.00 N ATOM 546 CA LEU A 154 3.308 1.385 7.070 1.00 0.00 C ATOM 547 C LEU A 154 2.609 0.232 7.726 1.00 0.00 C ATOM 548 O LEU A 154 2.792 -0.924 7.341 1.00 0.00 O ATOM 549 CB LEU A 154 2.247 2.390 6.542 1.00 0.00 C ATOM 550 CG LEU A 154 2.831 3.509 5.646 1.00 0.00 C ATOM 551 CD1 LEU A 154 1.735 4.196 4.812 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.672 4.526 6.439 1.00 0.00 C ATOM 0 H LEU A 154 3.603 0.285 5.339 1.00 0.00 H new ATOM 0 HA LEU A 154 3.946 1.927 7.768 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.493 1.843 5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 154 1.740 2.847 7.392 1.00 0.00 H new ATOM 0 HG LEU A 154 3.516 3.025 4.950 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.182 4.976 4.195 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.250 3.460 4.171 1.00 0.00 H new ATOM 0 HD13 LEU A 154 0.995 4.640 5.478 1.00 0.00 H new ATOM 0 HD21 LEU A 154 4.056 5.288 5.761 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.050 4.998 7.200 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.506 4.013 6.919 1.00 0.00 H new ATOM 564 N GLU A 155 1.781 0.557 8.749 1.00 0.00 N ATOM 565 CA GLU A 155 1.052 -0.371 9.578 1.00 0.00 C ATOM 566 C GLU A 155 -0.214 -0.788 8.861 1.00 0.00 C ATOM 567 O GLU A 155 -0.174 -1.079 7.669 1.00 0.00 O ATOM 568 CB GLU A 155 0.781 0.229 10.986 1.00 0.00 C ATOM 569 CG GLU A 155 0.152 1.637 10.980 1.00 0.00 C ATOM 570 CD GLU A 155 -0.069 2.103 12.418 1.00 0.00 C ATOM 571 OE1 GLU A 155 0.945 2.283 13.144 1.00 0.00 O ATOM 572 OE2 GLU A 155 -1.253 2.287 12.809 1.00 0.00 O ATOM 0 H GLU A 155 1.611 1.528 9.013 1.00 0.00 H new ATOM 0 HA GLU A 155 1.651 -1.265 9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 155 0.122 -0.446 11.532 1.00 0.00 H new ATOM 0 HB3 GLU A 155 1.722 0.269 11.535 1.00 0.00 H new ATOM 0 HG2 GLU A 155 0.804 2.336 10.456 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -0.796 1.621 10.442 1.00 0.00 H new ATOM 579 N SER A 156 -1.376 -0.851 9.559 1.00 0.00 N ATOM 580 CA SER A 156 -2.646 -1.250 8.991 1.00 0.00 C ATOM 581 C SER A 156 -3.251 -0.084 8.235 1.00 0.00 C ATOM 582 O SER A 156 -2.536 0.817 7.802 1.00 0.00 O ATOM 583 CB SER A 156 -3.611 -1.808 10.073 1.00 0.00 C ATOM 584 OG SER A 156 -3.852 -0.870 11.117 1.00 0.00 O ATOM 0 H SER A 156 -1.435 -0.617 10.550 1.00 0.00 H new ATOM 0 HA SER A 156 -2.476 -2.066 8.289 1.00 0.00 H new ATOM 0 HB2 SER A 156 -4.558 -2.081 9.607 1.00 0.00 H new ATOM 0 HB3 SER A 156 -3.190 -2.720 10.497 1.00 0.00 H new ATOM 0 HG SER A 156 -4.465 -1.262 11.774 1.00 0.00 H new ATOM 590 N THR A 157 -4.592 -0.085 8.037 1.00 0.00 N ATOM 591 CA THR A 157 -5.286 0.918 7.259 1.00 0.00 C ATOM 592 C THR A 157 -5.648 2.051 8.191 1.00 0.00 C ATOM 593 O THR A 157 -6.729 2.074 8.777 1.00 0.00 O ATOM 594 CB THR A 157 -6.534 0.378 6.571 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.227 -0.826 5.878 1.00 0.00 O ATOM 596 CG2 THR A 157 -7.069 1.410 5.557 1.00 0.00 C ATOM 0 H THR A 157 -5.210 -0.798 8.425 1.00 0.00 H new ATOM 0 HA THR A 157 -4.628 1.257 6.459 1.00 0.00 H new ATOM 0 HB THR A 157 -7.290 0.183 7.332 1.00 0.00 H new ATOM 0 HG1 THR A 157 -5.295 -0.801 5.576 1.00 0.00 H new ATOM 0 HG21 THR A 157 -7.961 1.014 5.071 1.00 0.00 H new ATOM 0 HG22 THR A 157 -7.319 2.335 6.077 1.00 0.00 H new ATOM 0 HG23 THR A 157 -6.305 1.611 4.806 1.00 0.00 H new ATOM 604 N THR A 158 -4.705 3.007 8.359 1.00 0.00 N ATOM 605 CA THR A 158 -4.843 4.153 9.234 1.00 0.00 C ATOM 606 C THR A 158 -4.525 5.410 8.463 1.00 0.00 C ATOM 607 O THR A 158 -4.711 6.518 8.964 1.00 0.00 O ATOM 608 CB THR A 158 -3.940 4.068 10.461 1.00 0.00 C ATOM 609 OG1 THR A 158 -2.581 3.822 10.107 1.00 0.00 O ATOM 610 CG2 THR A 158 -4.442 2.927 11.372 1.00 0.00 C ATOM 0 H THR A 158 -3.811 2.985 7.869 1.00 0.00 H new ATOM 0 HA THR A 158 -5.873 4.169 9.591 1.00 0.00 H new ATOM 0 HB THR A 158 -3.981 5.026 10.979 1.00 0.00 H new ATOM 0 HG1 THR A 158 -2.035 3.776 10.919 1.00 0.00 H new ATOM 0 HG21 THR A 158 -3.804 2.857 12.253 1.00 0.00 H new ATOM 0 HG22 THR A 158 -5.467 3.133 11.682 1.00 0.00 H new ATOM 0 HG23 THR A 158 -4.411 1.984 10.825 1.00 0.00 H new ATOM 618 N LEU A 159 -4.033 5.245 7.220 1.00 0.00 N ATOM 619 CA LEU A 159 -3.498 6.282 6.382 1.00 0.00 C ATOM 620 C LEU A 159 -4.558 6.690 5.393 1.00 0.00 C ATOM 621 O LEU A 159 -5.719 6.306 5.527 1.00 0.00 O ATOM 622 CB LEU A 159 -2.220 5.786 5.663 1.00 0.00 C ATOM 623 CG LEU A 159 -2.347 4.375 5.030 1.00 0.00 C ATOM 624 CD1 LEU A 159 -1.735 4.318 3.622 1.00 0.00 C ATOM 625 CD2 LEU A 159 -1.750 3.277 5.933 1.00 0.00 C ATOM 0 H LEU A 159 -4.006 4.330 6.770 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.217 7.146 6.984 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.958 6.499 4.882 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.396 5.778 6.377 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.415 4.178 4.935 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.846 3.312 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -2.247 5.029 2.974 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.676 4.573 3.675 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -1.862 2.307 5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.692 3.479 6.101 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.273 3.268 6.889 1.00 0.00 H new ATOM 637 N THR A 160 -4.178 7.511 4.380 1.00 0.00 N ATOM 638 CA THR A 160 -5.087 8.017 3.376 1.00 0.00 C ATOM 639 C THR A 160 -5.114 7.045 2.226 1.00 0.00 C ATOM 640 O THR A 160 -4.096 6.464 1.855 1.00 0.00 O ATOM 641 CB THR A 160 -4.744 9.417 2.875 1.00 0.00 C ATOM 642 OG1 THR A 160 -3.390 9.527 2.447 1.00 0.00 O ATOM 643 CG2 THR A 160 -5.016 10.439 3.998 1.00 0.00 C ATOM 0 H THR A 160 -3.217 7.830 4.256 1.00 0.00 H new ATOM 0 HA THR A 160 -6.068 8.109 3.843 1.00 0.00 H new ATOM 0 HB THR A 160 -5.374 9.621 2.009 1.00 0.00 H new ATOM 0 HG1 THR A 160 -2.967 8.643 2.470 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.772 11.441 3.645 1.00 0.00 H new ATOM 0 HG22 THR A 160 -6.068 10.399 4.279 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.400 10.200 4.865 1.00 0.00 H new ATOM 651 N GLU A 161 -6.321 6.841 1.653 1.00 0.00 N ATOM 652 CA GLU A 161 -6.539 5.938 0.553 1.00 0.00 C ATOM 653 C GLU A 161 -7.028 6.784 -0.581 1.00 0.00 C ATOM 654 O GLU A 161 -7.863 7.671 -0.401 1.00 0.00 O ATOM 655 CB GLU A 161 -7.615 4.854 0.825 1.00 0.00 C ATOM 656 CG GLU A 161 -7.148 3.667 1.694 1.00 0.00 C ATOM 657 CD GLU A 161 -6.793 4.087 3.118 1.00 0.00 C ATOM 658 OE1 GLU A 161 -7.700 4.590 3.834 1.00 0.00 O ATOM 659 OE2 GLU A 161 -5.610 3.903 3.509 1.00 0.00 O ATOM 0 H GLU A 161 -7.169 7.316 1.962 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.607 5.408 0.358 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.468 5.326 1.312 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -7.967 4.467 -0.131 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -7.935 2.914 1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -6.279 3.201 1.229 1.00 0.00 H new ATOM 666 N LYS A 162 -6.503 6.491 -1.789 1.00 0.00 N ATOM 667 CA LYS A 162 -6.980 7.002 -3.047 1.00 0.00 C ATOM 668 C LYS A 162 -7.541 5.796 -3.750 1.00 0.00 C ATOM 669 O LYS A 162 -7.663 4.730 -3.149 1.00 0.00 O ATOM 670 CB LYS A 162 -5.861 7.652 -3.901 1.00 0.00 C ATOM 671 CG LYS A 162 -5.148 8.827 -3.204 1.00 0.00 C ATOM 672 CD LYS A 162 -6.040 10.024 -2.828 1.00 0.00 C ATOM 673 CE LYS A 162 -6.652 10.746 -4.037 1.00 0.00 C ATOM 674 NZ LYS A 162 -7.413 11.942 -3.607 1.00 0.00 N ATOM 0 H LYS A 162 -5.704 5.865 -1.896 1.00 0.00 H new ATOM 0 HA LYS A 162 -7.712 7.795 -2.892 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -5.123 6.891 -4.155 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -6.291 8.005 -4.838 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -4.673 8.453 -2.297 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -4.351 9.183 -3.857 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -6.844 9.676 -2.179 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.451 10.737 -2.251 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -5.862 11.041 -4.728 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -7.310 10.066 -4.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -7.818 12.414 -4.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -8.180 11.654 -2.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -6.777 12.599 -3.112 1.00 0.00 H new ATOM 688 N GLU A 163 -7.920 5.941 -5.043 1.00 0.00 N ATOM 689 CA GLU A 163 -8.644 4.930 -5.780 1.00 0.00 C ATOM 690 C GLU A 163 -7.721 3.815 -6.201 1.00 0.00 C ATOM 691 O GLU A 163 -7.029 3.902 -7.215 1.00 0.00 O ATOM 692 CB GLU A 163 -9.364 5.512 -7.020 1.00 0.00 C ATOM 693 CG GLU A 163 -10.302 4.512 -7.725 1.00 0.00 C ATOM 694 CD GLU A 163 -10.993 5.197 -8.903 1.00 0.00 C ATOM 695 OE1 GLU A 163 -11.762 6.165 -8.659 1.00 0.00 O ATOM 696 OE2 GLU A 163 -10.765 4.759 -10.063 1.00 0.00 O ATOM 0 H GLU A 163 -7.720 6.778 -5.590 1.00 0.00 H new ATOM 0 HA GLU A 163 -9.406 4.535 -5.109 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -9.942 6.385 -6.716 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -8.616 5.858 -7.733 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -9.734 3.650 -8.075 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -11.046 4.138 -7.022 1.00 0.00 H new ATOM 703 N GLY A 164 -7.692 2.732 -5.383 1.00 0.00 N ATOM 704 CA GLY A 164 -6.928 1.534 -5.624 1.00 0.00 C ATOM 705 C GLY A 164 -5.465 1.720 -5.341 1.00 0.00 C ATOM 706 O GLY A 164 -4.651 0.912 -5.786 1.00 0.00 O ATOM 0 H GLY A 164 -8.226 2.692 -4.515 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -7.316 0.728 -5.001 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -7.058 1.226 -6.662 1.00 0.00 H new ATOM 710 N GLU A 165 -5.094 2.802 -4.614 1.00 0.00 N ATOM 711 CA GLU A 165 -3.709 3.150 -4.432 1.00 0.00 C ATOM 712 C GLU A 165 -3.604 3.835 -3.101 1.00 0.00 C ATOM 713 O GLU A 165 -4.525 4.544 -2.711 1.00 0.00 O ATOM 714 CB GLU A 165 -3.235 4.070 -5.580 1.00 0.00 C ATOM 715 CG GLU A 165 -1.720 4.294 -5.625 1.00 0.00 C ATOM 716 CD GLU A 165 -1.331 4.941 -6.953 1.00 0.00 C ATOM 717 OE1 GLU A 165 -1.537 4.289 -8.011 1.00 0.00 O ATOM 718 OE2 GLU A 165 -0.816 6.089 -6.930 1.00 0.00 O ATOM 0 H GLU A 165 -5.751 3.432 -4.155 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.071 2.267 -4.451 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -3.555 3.641 -6.529 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -3.730 5.036 -5.484 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -1.413 4.931 -4.796 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -1.199 3.344 -5.507 1.00 0.00 H new ATOM 725 N ILE A 166 -2.491 3.618 -2.352 1.00 0.00 N ATOM 726 CA ILE A 166 -2.324 4.165 -1.020 1.00 0.00 C ATOM 727 C ILE A 166 -1.192 5.154 -1.032 1.00 0.00 C ATOM 728 O ILE A 166 -0.329 5.131 -1.904 1.00 0.00 O ATOM 729 CB ILE A 166 -2.106 3.128 0.075 1.00 0.00 C ATOM 730 CG1 ILE A 166 -0.882 2.219 -0.182 1.00 0.00 C ATOM 731 CG2 ILE A 166 -3.417 2.330 0.239 1.00 0.00 C ATOM 732 CD1 ILE A 166 -0.573 1.286 0.993 1.00 0.00 C ATOM 0 H ILE A 166 -1.700 3.059 -2.671 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.268 4.648 -0.768 1.00 0.00 H new ATOM 0 HB ILE A 166 -1.865 3.637 1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -1.061 1.622 -1.076 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.010 2.841 -0.384 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -3.290 1.578 1.018 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -4.224 3.008 0.517 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.664 1.839 -0.702 1.00 0.00 H new ATOM 0 HD11 ILE A 166 0.296 0.674 0.752 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -0.364 1.879 1.883 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -1.431 0.641 1.180 1.00 0.00 H new ATOM 744 N TYR A 167 -1.232 6.086 -0.056 1.00 0.00 N ATOM 745 CA TYR A 167 -0.361 7.229 0.080 1.00 0.00 C ATOM 746 C TYR A 167 -0.320 7.449 1.569 1.00 0.00 C ATOM 747 O TYR A 167 -1.344 7.241 2.215 1.00 0.00 O ATOM 748 CB TYR A 167 -0.927 8.543 -0.519 1.00 0.00 C ATOM 749 CG TYR A 167 -0.812 8.590 -2.017 1.00 0.00 C ATOM 750 CD1 TYR A 167 -1.740 7.941 -2.850 1.00 0.00 C ATOM 751 CD2 TYR A 167 0.205 9.356 -2.607 1.00 0.00 C ATOM 752 CE1 TYR A 167 -1.655 8.060 -4.243 1.00 0.00 C ATOM 753 CE2 TYR A 167 0.291 9.486 -3.997 1.00 0.00 C ATOM 754 CZ TYR A 167 -0.643 8.842 -4.818 1.00 0.00 C ATOM 755 OH TYR A 167 -0.572 9.002 -6.219 1.00 0.00 O ATOM 0 H TYR A 167 -1.922 6.040 0.694 1.00 0.00 H new ATOM 0 HA TYR A 167 0.581 7.027 -0.429 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -1.974 8.646 -0.235 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.395 9.392 -0.090 1.00 0.00 H new ATOM 0 HD1 TYR A 167 -2.526 7.345 -2.411 1.00 0.00 H new ATOM 0 HD2 TYR A 167 0.931 9.852 -1.980 1.00 0.00 H new ATOM 0 HE1 TYR A 167 -2.368 7.550 -4.874 1.00 0.00 H new ATOM 0 HE2 TYR A 167 1.077 10.082 -4.437 1.00 0.00 H new ATOM 0 HH TYR A 167 -0.636 8.125 -6.652 1.00 0.00 H new ATOM 765 N CYS A 168 0.834 7.838 2.195 1.00 0.00 N ATOM 766 CA CYS A 168 0.836 8.072 3.634 1.00 0.00 C ATOM 767 C CYS A 168 -0.010 9.279 3.945 1.00 0.00 C ATOM 768 O CYS A 168 -0.201 10.145 3.096 1.00 0.00 O ATOM 769 CB CYS A 168 2.213 8.388 4.278 1.00 0.00 C ATOM 770 SG CYS A 168 3.542 7.291 3.786 1.00 0.00 S ATOM 0 H CYS A 168 1.729 7.985 1.729 1.00 0.00 H new ATOM 0 HA CYS A 168 0.474 7.129 4.043 1.00 0.00 H new ATOM 0 HB2 CYS A 168 2.492 9.411 4.023 1.00 0.00 H new ATOM 0 HB3 CYS A 168 2.109 8.347 5.362 1.00 0.00 H new ATOM 0 HG CYS A 168 3.526 7.142 2.495 1.00 0.00 H new ATOM 775 N LYS A 169 -0.532 9.361 5.186 1.00 0.00 N ATOM 776 CA LYS A 169 -1.327 10.478 5.635 1.00 0.00 C ATOM 777 C LYS A 169 -0.456 11.694 5.836 1.00 0.00 C ATOM 778 O LYS A 169 -0.884 12.814 5.565 1.00 0.00 O ATOM 779 CB LYS A 169 -2.119 10.156 6.926 1.00 0.00 C ATOM 780 CG LYS A 169 -1.316 9.432 8.022 1.00 0.00 C ATOM 781 CD LYS A 169 -2.171 9.095 9.254 1.00 0.00 C ATOM 782 CE LYS A 169 -1.467 8.185 10.270 1.00 0.00 C ATOM 783 NZ LYS A 169 -1.185 6.848 9.694 1.00 0.00 N ATOM 0 H LYS A 169 -0.402 8.639 5.895 1.00 0.00 H new ATOM 0 HA LYS A 169 -2.060 10.688 4.856 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -2.507 11.088 7.337 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -2.980 9.541 6.662 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -0.896 8.513 7.613 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -0.477 10.058 8.326 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -2.458 10.022 9.750 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -3.091 8.612 8.925 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -0.534 8.649 10.591 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -2.091 8.076 11.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -0.916 6.192 10.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -2.035 6.491 9.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -0.406 6.922 9.009 1.00 0.00 H new ATOM 797 N GLY A 170 0.805 11.485 6.284 1.00 0.00 N ATOM 798 CA GLY A 170 1.731 12.546 6.580 1.00 0.00 C ATOM 799 C GLY A 170 2.382 13.080 5.338 1.00 0.00 C ATOM 800 O GLY A 170 2.610 14.285 5.236 1.00 0.00 O ATOM 0 H GLY A 170 1.189 10.554 6.444 1.00 0.00 H new ATOM 0 HA2 GLY A 170 1.207 13.353 7.092 1.00 0.00 H new ATOM 0 HA3 GLY A 170 2.497 12.180 7.263 1.00 0.00 H new ATOM 804 N CYS A 171 2.716 12.192 4.367 1.00 0.00 N ATOM 805 CA CYS A 171 3.486 12.566 3.200 1.00 0.00 C ATOM 806 C CYS A 171 2.612 13.217 2.156 1.00 0.00 C ATOM 807 O CYS A 171 3.100 14.003 1.349 1.00 0.00 O ATOM 808 CB CYS A 171 4.313 11.387 2.592 1.00 0.00 C ATOM 809 SG CYS A 171 3.460 10.233 1.483 1.00 0.00 S ATOM 0 H CYS A 171 2.451 11.207 4.390 1.00 0.00 H new ATOM 0 HA CYS A 171 4.218 13.297 3.545 1.00 0.00 H new ATOM 0 HB2 CYS A 171 5.154 11.815 2.046 1.00 0.00 H new ATOM 0 HB3 CYS A 171 4.730 10.810 3.418 1.00 0.00 H new ATOM 0 HG CYS A 171 3.425 9.053 2.028 1.00 0.00 H new ATOM 814 N TYR A 172 1.297 12.883 2.152 1.00 0.00 N ATOM 815 CA TYR A 172 0.342 13.351 1.174 1.00 0.00 C ATOM 816 C TYR A 172 -0.234 14.663 1.639 1.00 0.00 C ATOM 817 O TYR A 172 -0.612 15.499 0.819 1.00 0.00 O ATOM 818 CB TYR A 172 -0.796 12.319 0.964 1.00 0.00 C ATOM 819 CG TYR A 172 -1.587 12.550 -0.298 1.00 0.00 C ATOM 820 CD1 TYR A 172 -0.958 12.488 -1.554 1.00 0.00 C ATOM 821 CD2 TYR A 172 -2.972 12.785 -0.243 1.00 0.00 C ATOM 822 CE1 TYR A 172 -1.696 12.655 -2.732 1.00 0.00 C ATOM 823 CE2 TYR A 172 -3.713 12.957 -1.419 1.00 0.00 C ATOM 824 CZ TYR A 172 -3.075 12.891 -2.665 1.00 0.00 C ATOM 825 OH TYR A 172 -3.821 13.056 -3.854 1.00 0.00 O ATOM 0 H TYR A 172 0.885 12.267 2.852 1.00 0.00 H new ATOM 0 HA TYR A 172 0.853 13.484 0.220 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -0.368 11.317 0.937 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.471 12.354 1.819 1.00 0.00 H new ATOM 0 HD1 TYR A 172 0.106 12.310 -1.611 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.469 12.833 0.715 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -1.203 12.602 -3.691 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -4.776 13.140 -1.366 1.00 0.00 H new ATOM 0 HH TYR A 172 -4.763 13.211 -3.631 1.00 0.00 H new ATOM 835 N ALA A 173 -0.283 14.882 2.980 1.00 0.00 N ATOM 836 CA ALA A 173 -0.699 16.134 3.576 1.00 0.00 C ATOM 837 C ALA A 173 0.339 17.201 3.339 1.00 0.00 C ATOM 838 O ALA A 173 0.004 18.376 3.196 1.00 0.00 O ATOM 839 CB ALA A 173 -0.907 16.015 5.097 1.00 0.00 C ATOM 0 H ALA A 173 -0.027 14.172 3.666 1.00 0.00 H new ATOM 0 HA ALA A 173 -1.646 16.398 3.104 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -1.218 16.979 5.498 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -1.677 15.271 5.302 1.00 0.00 H new ATOM 0 HB3 ALA A 173 0.027 15.710 5.569 1.00 0.00 H new ATOM 845 N LYS A 174 1.629 16.792 3.261 1.00 0.00 N ATOM 846 CA LYS A 174 2.744 17.655 2.955 1.00 0.00 C ATOM 847 C LYS A 174 2.722 17.971 1.481 1.00 0.00 C ATOM 848 O LYS A 174 2.776 19.137 1.089 1.00 0.00 O ATOM 849 CB LYS A 174 4.091 16.983 3.323 1.00 0.00 C ATOM 850 CG LYS A 174 5.353 17.826 3.053 1.00 0.00 C ATOM 851 CD LYS A 174 5.420 19.134 3.861 1.00 0.00 C ATOM 852 CE LYS A 174 6.724 19.918 3.657 1.00 0.00 C ATOM 853 NZ LYS A 174 6.870 20.368 2.253 1.00 0.00 N ATOM 0 H LYS A 174 1.906 15.823 3.417 1.00 0.00 H new ATOM 0 HA LYS A 174 2.653 18.569 3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 174 4.069 16.723 4.381 1.00 0.00 H new ATOM 0 HB3 LYS A 174 4.174 16.049 2.767 1.00 0.00 H new ATOM 0 HG2 LYS A 174 6.234 17.225 3.281 1.00 0.00 H new ATOM 0 HG3 LYS A 174 5.397 18.065 1.990 1.00 0.00 H new ATOM 0 HD2 LYS A 174 4.578 19.767 3.581 1.00 0.00 H new ATOM 0 HD3 LYS A 174 5.307 18.903 4.920 1.00 0.00 H new ATOM 0 HE2 LYS A 174 6.738 20.782 4.321 1.00 0.00 H new ATOM 0 HE3 LYS A 174 7.573 19.292 3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 7.726 20.952 2.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 6.948 19.539 1.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 6.038 20.929 1.980 1.00 0.00 H new ATOM 867 N ASN A 175 2.616 16.919 0.636 1.00 0.00 N ATOM 868 CA ASN A 175 2.559 17.033 -0.800 1.00 0.00 C ATOM 869 C ASN A 175 1.120 17.428 -1.174 1.00 0.00 C ATOM 870 O ASN A 175 0.938 18.526 -1.762 1.00 0.00 O ATOM 871 CB ASN A 175 2.915 15.688 -1.490 1.00 0.00 C ATOM 872 CG ASN A 175 2.975 15.811 -3.021 1.00 0.00 C ATOM 873 OD1 ASN A 175 2.151 15.219 -3.729 1.00 0.00 O ATOM 874 ND2 ASN A 175 3.981 16.590 -3.523 1.00 0.00 N ATOM 0 H ASN A 175 2.568 15.954 0.964 1.00 0.00 H new ATOM 0 HA ASN A 175 3.281 17.778 -1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 175 3.878 15.336 -1.119 1.00 0.00 H new ATOM 0 HB3 ASN A 175 2.174 14.936 -1.218 1.00 0.00 H new ATOM 0 HD21 ASN A 175 4.081 16.707 -4.531 1.00 0.00 H new ATOM 0 HD22 ASN A 175 4.631 17.054 -2.889 1.00 0.00 H new