USER MOD reduce.3.24.130724 H: found=0, std=0, add=436, rem=0, adj=22 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 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 169 LYS NZ :NH3+ -170:sc=-0.00507 (180deg=-0.0999) USER MOD Set 2.1: A 156 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 158 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 149 LYS NZ :NH3+ -151:sc= 0.0328 (180deg=-0.329) USER MOD Set 3.2: A 175 ASN : amide:sc= 0 X(o=0.033,f=-0.29) USER MOD Set 4.1: A 147 CYS SG : rot -157:sc= 1.26 USER MOD Set 4.2: A 150 CYS SG : rot -104:sc= 0.334 USER MOD Set 4.3: A 168 CYS SG : rot -24:sc= 0.561 USER MOD Set 4.4: A 171 CYS SG : rot -12:sc= 0.594 USER MOD Set 5.1: A 120 CYS SG : rot 154:sc= 0.806 USER MOD Set 5.2: A 123 CYS SG : rot -56:sc= 0.542 USER MOD Set 5.3: A 141 HIS : no HD1:sc= 0.49 K(o=1.3,f=-0.61) USER MOD Set 5.4: A 144 CYS SG : rot 138:sc= -0.548 USER MOD Single : A 119 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0371) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 14:sc= 0.0507 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ -169:sc= -0.278 (180deg=-0.472) USER MOD Single : A 138 LYS NZ :NH3+ 145:sc= 0 (180deg=-0.752) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot 51:sc= 0.0801 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 22:sc= 0.209 USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N GLU A 118 -2.343 -11.421 -4.973 1.00 0.00 N ATOM 12 CA GLU A 118 -1.463 -10.812 -5.943 1.00 0.00 C ATOM 13 C GLU A 118 -0.099 -10.946 -5.323 1.00 0.00 C ATOM 14 O GLU A 118 0.240 -12.005 -4.798 1.00 0.00 O ATOM 15 CB GLU A 118 -1.765 -9.317 -6.265 1.00 0.00 C ATOM 16 CG GLU A 118 -3.155 -9.064 -6.881 1.00 0.00 C ATOM 17 CD GLU A 118 -3.323 -7.579 -7.206 1.00 0.00 C ATOM 18 OE1 GLU A 118 -2.516 -7.053 -8.017 1.00 0.00 O ATOM 19 OE2 GLU A 118 -4.265 -6.951 -6.651 1.00 0.00 O ATOM 0 HA GLU A 118 -1.577 -11.305 -6.908 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.677 -8.736 -5.347 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.004 -8.945 -6.952 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.274 -9.658 -7.787 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.933 -9.383 -6.187 1.00 0.00 H new ATOM 26 N LYS A 119 0.721 -9.870 -5.376 1.00 0.00 N ATOM 27 CA LYS A 119 2.025 -9.835 -4.774 1.00 0.00 C ATOM 28 C LYS A 119 2.065 -8.728 -3.768 1.00 0.00 C ATOM 29 O LYS A 119 1.254 -7.802 -3.794 1.00 0.00 O ATOM 30 CB LYS A 119 3.180 -9.691 -5.760 1.00 0.00 C ATOM 31 CG LYS A 119 3.283 -10.853 -6.762 1.00 0.00 C ATOM 32 CD LYS A 119 4.464 -10.702 -7.733 1.00 0.00 C ATOM 33 CE LYS A 119 4.565 -11.837 -8.764 1.00 0.00 C ATOM 34 NZ LYS A 119 4.814 -13.143 -8.110 1.00 0.00 N ATOM 0 H LYS A 119 0.469 -9.003 -5.850 1.00 0.00 H new ATOM 0 HA LYS A 119 2.173 -10.806 -4.302 1.00 0.00 H new ATOM 0 HB2 LYS A 119 3.063 -8.757 -6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.115 -9.618 -5.204 1.00 0.00 H new ATOM 0 HG2 LYS A 119 3.387 -11.790 -6.215 1.00 0.00 H new ATOM 0 HG3 LYS A 119 2.356 -10.918 -7.332 1.00 0.00 H new ATOM 0 HD2 LYS A 119 4.371 -9.752 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 119 5.391 -10.660 -7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.642 -11.888 -9.342 1.00 0.00 H new ATOM 0 HE3 LYS A 119 5.370 -11.621 -9.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 4.961 -13.873 -8.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.661 -13.075 -7.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.995 -13.399 -7.523 1.00 0.00 H new ATOM 48 N CYS A 120 3.041 -8.837 -2.844 1.00 0.00 N ATOM 49 CA CYS A 120 3.326 -7.894 -1.800 1.00 0.00 C ATOM 50 C CYS A 120 4.459 -7.034 -2.283 1.00 0.00 C ATOM 51 O CYS A 120 5.490 -7.542 -2.720 1.00 0.00 O ATOM 52 CB CYS A 120 3.719 -8.592 -0.480 1.00 0.00 C ATOM 53 SG CYS A 120 3.843 -7.450 0.927 1.00 0.00 S ATOM 0 H CYS A 120 3.673 -9.637 -2.825 1.00 0.00 H new ATOM 0 HA CYS A 120 2.435 -7.304 -1.587 1.00 0.00 H new ATOM 0 HB2 CYS A 120 2.982 -9.362 -0.251 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.676 -9.097 -0.615 1.00 0.00 H new ATOM 0 HG CYS A 120 3.615 -8.096 2.032 1.00 0.00 H new ATOM 58 N SER A 121 4.262 -5.694 -2.245 1.00 0.00 N ATOM 59 CA SER A 121 5.206 -4.709 -2.723 1.00 0.00 C ATOM 60 C SER A 121 6.439 -4.633 -1.853 1.00 0.00 C ATOM 61 O SER A 121 7.532 -4.375 -2.355 1.00 0.00 O ATOM 62 CB SER A 121 4.596 -3.288 -2.759 1.00 0.00 C ATOM 63 OG SER A 121 3.433 -3.260 -3.576 1.00 0.00 O ATOM 0 H SER A 121 3.411 -5.278 -1.866 1.00 0.00 H new ATOM 0 HA SER A 121 5.469 -5.037 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.343 -2.970 -1.748 1.00 0.00 H new ATOM 0 HB3 SER A 121 5.332 -2.581 -3.141 1.00 0.00 H new ATOM 0 HG SER A 121 3.061 -2.353 -3.585 1.00 0.00 H new ATOM 69 N ARG A 122 6.284 -4.854 -0.525 1.00 0.00 N ATOM 70 CA ARG A 122 7.339 -4.675 0.443 1.00 0.00 C ATOM 71 C ARG A 122 8.261 -5.862 0.439 1.00 0.00 C ATOM 72 O ARG A 122 9.443 -5.726 0.122 1.00 0.00 O ATOM 73 CB ARG A 122 6.770 -4.526 1.874 1.00 0.00 C ATOM 74 CG ARG A 122 7.802 -4.275 2.995 1.00 0.00 C ATOM 75 CD ARG A 122 8.281 -2.819 3.123 1.00 0.00 C ATOM 76 NE ARG A 122 7.124 -1.957 3.540 1.00 0.00 N ATOM 77 CZ ARG A 122 6.646 -1.906 4.822 1.00 0.00 C ATOM 78 NH1 ARG A 122 7.296 -2.523 5.850 1.00 0.00 N ATOM 79 NH2 ARG A 122 5.486 -1.231 5.072 1.00 0.00 N ATOM 0 H ARG A 122 5.404 -5.165 -0.114 1.00 0.00 H new ATOM 0 HA ARG A 122 7.877 -3.769 0.164 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.056 -3.702 1.875 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.213 -5.431 2.117 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.366 -4.583 3.945 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.668 -4.913 2.820 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.085 -2.750 3.856 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.686 -2.471 2.173 1.00 0.00 H new ATOM 0 HE ARG A 122 6.671 -1.380 2.832 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.159 -3.037 5.672 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.919 -2.470 6.796 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.988 -0.773 4.309 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.118 -1.184 6.022 1.00 0.00 H new ATOM 93 N CYS A 123 7.740 -7.058 0.816 1.00 0.00 N ATOM 94 CA CYS A 123 8.569 -8.188 1.169 1.00 0.00 C ATOM 95 C CYS A 123 8.873 -9.011 -0.055 1.00 0.00 C ATOM 96 O CYS A 123 9.895 -9.694 -0.104 1.00 0.00 O ATOM 97 CB CYS A 123 7.972 -9.051 2.323 1.00 0.00 C ATOM 98 SG CYS A 123 6.408 -9.932 1.977 1.00 0.00 S ATOM 0 H CYS A 123 6.739 -7.243 0.876 1.00 0.00 H new ATOM 0 HA CYS A 123 9.506 -7.793 1.563 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.719 -9.789 2.615 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.812 -8.402 3.184 1.00 0.00 H new ATOM 0 HG CYS A 123 5.506 -9.080 1.589 1.00 0.00 H new ATOM 103 N GLY A 124 8.008 -8.923 -1.095 1.00 0.00 N ATOM 104 CA GLY A 124 8.294 -9.457 -2.405 1.00 0.00 C ATOM 105 C GLY A 124 7.782 -10.856 -2.557 1.00 0.00 C ATOM 106 O GLY A 124 8.109 -11.527 -3.535 1.00 0.00 O ATOM 0 H GLY A 124 7.095 -8.474 -1.025 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.842 -8.819 -3.165 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.370 -9.443 -2.577 1.00 0.00 H new ATOM 110 N ASP A 125 6.959 -11.328 -1.592 1.00 0.00 N ATOM 111 CA ASP A 125 6.390 -12.652 -1.618 1.00 0.00 C ATOM 112 C ASP A 125 5.055 -12.530 -2.286 1.00 0.00 C ATOM 113 O ASP A 125 4.396 -11.497 -2.186 1.00 0.00 O ATOM 114 CB ASP A 125 6.163 -13.265 -0.210 1.00 0.00 C ATOM 115 CG ASP A 125 7.503 -13.570 0.465 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.236 -12.606 0.818 1.00 0.00 O ATOM 117 OD2 ASP A 125 7.808 -14.780 0.645 1.00 0.00 O ATOM 0 H ASP A 125 6.683 -10.780 -0.777 1.00 0.00 H new ATOM 0 HA ASP A 125 7.088 -13.309 -2.138 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.588 -12.573 0.406 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.576 -14.179 -0.295 1.00 0.00 H new ATOM 122 N SER A 126 4.627 -13.604 -2.991 1.00 0.00 N ATOM 123 CA SER A 126 3.344 -13.657 -3.646 1.00 0.00 C ATOM 124 C SER A 126 2.364 -14.110 -2.602 1.00 0.00 C ATOM 125 O SER A 126 2.421 -15.251 -2.144 1.00 0.00 O ATOM 126 CB SER A 126 3.333 -14.621 -4.859 1.00 0.00 C ATOM 127 OG SER A 126 2.117 -14.538 -5.593 1.00 0.00 O ATOM 0 H SER A 126 5.182 -14.452 -3.108 1.00 0.00 H new ATOM 0 HA SER A 126 3.090 -12.678 -4.051 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.170 -14.387 -5.516 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.478 -15.644 -4.511 1.00 0.00 H new ATOM 0 HG SER A 126 1.624 -13.737 -5.319 1.00 0.00 H new ATOM 133 N VAL A 127 1.461 -13.193 -2.181 1.00 0.00 N ATOM 134 CA VAL A 127 0.542 -13.445 -1.102 1.00 0.00 C ATOM 135 C VAL A 127 -0.745 -13.943 -1.703 1.00 0.00 C ATOM 136 O VAL A 127 -1.294 -13.352 -2.633 1.00 0.00 O ATOM 137 CB VAL A 127 0.346 -12.250 -0.169 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.285 -11.035 -0.876 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.461 -12.684 1.071 1.00 0.00 C ATOM 0 H VAL A 127 1.368 -12.265 -2.595 1.00 0.00 H new ATOM 0 HA VAL A 127 0.962 -14.207 -0.446 1.00 0.00 H new ATOM 0 HB VAL A 127 1.331 -11.914 0.155 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.399 -10.218 -0.163 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.360 -10.715 -1.694 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.263 -11.311 -1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.598 -11.829 1.733 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.435 -13.061 0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.079 -13.470 1.600 1.00 0.00 H new ATOM 149 N TYR A 128 -1.228 -15.089 -1.170 1.00 0.00 N ATOM 150 CA TYR A 128 -2.472 -15.701 -1.550 1.00 0.00 C ATOM 151 C TYR A 128 -3.449 -15.264 -0.496 1.00 0.00 C ATOM 152 O TYR A 128 -4.355 -14.481 -0.773 1.00 0.00 O ATOM 153 CB TYR A 128 -2.366 -17.251 -1.625 1.00 0.00 C ATOM 154 CG TYR A 128 -3.645 -17.866 -2.134 1.00 0.00 C ATOM 155 CD1 TYR A 128 -4.001 -17.745 -3.489 1.00 0.00 C ATOM 156 CD2 TYR A 128 -4.515 -18.542 -1.260 1.00 0.00 C ATOM 157 CE1 TYR A 128 -5.202 -18.287 -3.962 1.00 0.00 C ATOM 158 CE2 TYR A 128 -5.717 -19.084 -1.730 1.00 0.00 C ATOM 159 CZ TYR A 128 -6.062 -18.958 -3.082 1.00 0.00 C ATOM 160 OH TYR A 128 -7.276 -19.504 -3.556 1.00 0.00 O ATOM 0 H TYR A 128 -0.732 -15.609 -0.446 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.780 -15.396 -2.550 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.541 -17.529 -2.280 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.137 -17.650 -0.637 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -3.342 -17.229 -4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -4.253 -18.644 -0.217 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -5.466 -18.188 -5.005 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -6.379 -19.600 -1.050 1.00 0.00 H new ATOM 0 HH TYR A 128 -7.752 -19.936 -2.816 1.00 0.00 H new ATOM 170 N ALA A 129 -3.259 -15.764 0.745 1.00 0.00 N ATOM 171 CA ALA A 129 -4.041 -15.367 1.879 1.00 0.00 C ATOM 172 C ALA A 129 -3.243 -15.795 3.072 1.00 0.00 C ATOM 173 O ALA A 129 -3.601 -16.745 3.767 1.00 0.00 O ATOM 174 CB ALA A 129 -5.436 -16.026 1.929 1.00 0.00 C ATOM 0 H ALA A 129 -2.545 -16.460 0.963 1.00 0.00 H new ATOM 0 HA ALA A 129 -4.230 -14.294 1.838 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.971 -15.679 2.813 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -5.998 -15.755 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -5.325 -17.109 1.974 1.00 0.00 H new ATOM 180 N ALA A 130 -2.115 -15.087 3.328 1.00 0.00 N ATOM 181 CA ALA A 130 -1.227 -15.369 4.432 1.00 0.00 C ATOM 182 C ALA A 130 -1.664 -14.500 5.579 1.00 0.00 C ATOM 183 O ALA A 130 -2.604 -14.847 6.295 1.00 0.00 O ATOM 184 CB ALA A 130 0.253 -15.110 4.080 1.00 0.00 C ATOM 0 H ALA A 130 -1.812 -14.300 2.754 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.287 -16.426 4.690 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.878 -15.337 4.944 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.545 -15.746 3.244 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.383 -14.064 3.803 1.00 0.00 H new ATOM 190 N GLU A 131 -1.004 -13.331 5.757 1.00 0.00 N ATOM 191 CA GLU A 131 -1.384 -12.321 6.716 1.00 0.00 C ATOM 192 C GLU A 131 -2.001 -11.206 5.907 1.00 0.00 C ATOM 193 O GLU A 131 -1.752 -10.024 6.139 1.00 0.00 O ATOM 194 CB GLU A 131 -0.156 -11.805 7.510 1.00 0.00 C ATOM 195 CG GLU A 131 -0.516 -11.040 8.800 1.00 0.00 C ATOM 196 CD GLU A 131 0.746 -10.447 9.422 1.00 0.00 C ATOM 197 OE1 GLU A 131 1.378 -9.581 8.761 1.00 0.00 O ATOM 198 OE2 GLU A 131 1.091 -10.843 10.567 1.00 0.00 O ATOM 0 H GLU A 131 -0.177 -13.079 5.215 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.078 -12.720 7.455 1.00 0.00 H new ATOM 0 HB2 GLU A 131 0.478 -12.653 7.768 1.00 0.00 H new ATOM 0 HB3 GLU A 131 0.432 -11.152 6.865 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -1.229 -10.246 8.576 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -1.000 -11.712 9.509 1.00 0.00 H new ATOM 205 N LYS A 132 -2.829 -11.576 4.901 1.00 0.00 N ATOM 206 CA LYS A 132 -3.316 -10.661 3.906 1.00 0.00 C ATOM 207 C LYS A 132 -4.485 -9.883 4.440 1.00 0.00 C ATOM 208 O LYS A 132 -5.425 -10.447 4.998 1.00 0.00 O ATOM 209 CB LYS A 132 -3.742 -11.387 2.618 1.00 0.00 C ATOM 210 CG LYS A 132 -4.037 -10.442 1.444 1.00 0.00 C ATOM 211 CD LYS A 132 -4.341 -11.183 0.135 1.00 0.00 C ATOM 212 CE LYS A 132 -5.825 -11.506 -0.109 1.00 0.00 C ATOM 213 NZ LYS A 132 -6.366 -12.482 0.865 1.00 0.00 N ATOM 0 H LYS A 132 -3.166 -12.531 4.779 1.00 0.00 H new ATOM 0 HA LYS A 132 -2.496 -9.985 3.665 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -2.954 -12.081 2.325 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -4.631 -11.983 2.825 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -4.885 -9.808 1.701 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -3.182 -9.784 1.292 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -3.976 -10.581 -0.697 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -3.777 -12.116 0.125 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -6.406 -10.586 -0.056 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -5.945 -11.901 -1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -7.303 -12.805 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -5.724 -13.297 0.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -6.452 -12.030 1.798 1.00 0.00 H new ATOM 227 N VAL A 133 -4.423 -8.550 4.248 1.00 0.00 N ATOM 228 CA VAL A 133 -5.499 -7.627 4.473 1.00 0.00 C ATOM 229 C VAL A 133 -5.602 -6.869 3.185 1.00 0.00 C ATOM 230 O VAL A 133 -4.658 -6.827 2.396 1.00 0.00 O ATOM 231 CB VAL A 133 -5.283 -6.656 5.631 1.00 0.00 C ATOM 232 CG1 VAL A 133 -5.410 -7.448 6.945 1.00 0.00 C ATOM 233 CG2 VAL A 133 -3.923 -5.928 5.531 1.00 0.00 C ATOM 0 H VAL A 133 -3.575 -8.090 3.917 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.399 -8.173 4.755 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.040 -5.872 5.596 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.260 -6.777 7.790 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.403 -7.893 7.007 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.657 -8.236 6.969 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.812 -5.247 6.375 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.116 -6.661 5.547 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.881 -5.362 4.600 1.00 0.00 H new ATOM 243 N ILE A 134 -6.778 -6.256 2.943 1.00 0.00 N ATOM 244 CA ILE A 134 -7.001 -5.406 1.803 1.00 0.00 C ATOM 245 C ILE A 134 -7.109 -4.046 2.429 1.00 0.00 C ATOM 246 O ILE A 134 -7.760 -3.876 3.460 1.00 0.00 O ATOM 247 CB ILE A 134 -8.250 -5.766 0.993 1.00 0.00 C ATOM 248 CG1 ILE A 134 -8.098 -7.134 0.270 1.00 0.00 C ATOM 249 CG2 ILE A 134 -8.535 -4.669 -0.059 1.00 0.00 C ATOM 250 CD1 ILE A 134 -8.334 -8.382 1.129 1.00 0.00 C ATOM 0 H ILE A 134 -7.592 -6.351 3.550 1.00 0.00 H new ATOM 0 HA ILE A 134 -6.205 -5.493 1.064 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.080 -5.840 1.695 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -8.794 -7.158 -0.568 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -7.093 -7.191 -0.149 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -9.425 -4.935 -0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.697 -3.716 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.684 -4.582 -0.734 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.201 -9.275 0.518 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -7.621 -8.396 1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -9.349 -8.363 1.527 1.00 0.00 H new ATOM 262 N GLY A 135 -6.447 -3.044 1.806 1.00 0.00 N ATOM 263 CA GLY A 135 -6.445 -1.682 2.267 1.00 0.00 C ATOM 264 C GLY A 135 -7.447 -0.963 1.433 1.00 0.00 C ATOM 265 O GLY A 135 -8.611 -0.836 1.814 1.00 0.00 O ATOM 0 H GLY A 135 -5.898 -3.186 0.958 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.706 -1.628 3.324 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.456 -1.236 2.160 1.00 0.00 H new ATOM 269 N ALA A 136 -7.001 -0.489 0.250 1.00 0.00 N ATOM 270 CA ALA A 136 -7.845 0.164 -0.715 1.00 0.00 C ATOM 271 C ALA A 136 -8.459 -0.900 -1.576 1.00 0.00 C ATOM 272 O ALA A 136 -9.677 -1.080 -1.574 1.00 0.00 O ATOM 273 CB ALA A 136 -7.054 1.134 -1.606 1.00 0.00 C ATOM 0 H ALA A 136 -6.027 -0.561 -0.045 1.00 0.00 H new ATOM 0 HA ALA A 136 -8.601 0.745 -0.187 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.729 1.605 -2.320 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.589 1.901 -0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.282 0.585 -2.145 1.00 0.00 H new ATOM 279 N GLY A 137 -7.616 -1.645 -2.320 1.00 0.00 N ATOM 280 CA GLY A 137 -8.104 -2.699 -3.165 1.00 0.00 C ATOM 281 C GLY A 137 -6.948 -3.502 -3.663 1.00 0.00 C ATOM 282 O GLY A 137 -7.011 -4.037 -4.769 1.00 0.00 O ATOM 0 H GLY A 137 -6.604 -1.520 -2.338 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -8.793 -3.336 -2.611 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -8.660 -2.281 -4.004 1.00 0.00 H new ATOM 286 N LYS A 138 -5.860 -3.611 -2.857 1.00 0.00 N ATOM 287 CA LYS A 138 -4.702 -4.398 -3.214 1.00 0.00 C ATOM 288 C LYS A 138 -4.261 -5.166 -1.988 1.00 0.00 C ATOM 289 O LYS A 138 -4.521 -4.718 -0.872 1.00 0.00 O ATOM 290 CB LYS A 138 -3.509 -3.551 -3.717 1.00 0.00 C ATOM 291 CG LYS A 138 -3.762 -2.980 -5.120 1.00 0.00 C ATOM 292 CD LYS A 138 -2.560 -2.225 -5.705 1.00 0.00 C ATOM 293 CE LYS A 138 -2.737 -1.864 -7.189 1.00 0.00 C ATOM 294 NZ LYS A 138 -3.939 -1.023 -7.408 1.00 0.00 N ATOM 0 H LYS A 138 -5.783 -3.149 -1.951 1.00 0.00 H new ATOM 0 HA LYS A 138 -4.995 -5.053 -4.035 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -3.325 -2.733 -3.020 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -2.609 -4.165 -3.732 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -4.029 -3.796 -5.792 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.618 -2.307 -5.080 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -2.399 -1.312 -5.132 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -1.664 -2.836 -5.590 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -1.853 -1.334 -7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -2.819 -2.777 -7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -3.751 -0.341 -8.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -4.742 -1.628 -7.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -4.168 -0.510 -6.533 1.00 0.00 H new ATOM 308 N PRO A 139 -3.580 -6.308 -2.142 1.00 0.00 N ATOM 309 CA PRO A 139 -3.008 -7.068 -1.042 1.00 0.00 C ATOM 310 C PRO A 139 -1.893 -6.364 -0.321 1.00 0.00 C ATOM 311 O PRO A 139 -1.078 -5.702 -0.962 1.00 0.00 O ATOM 312 CB PRO A 139 -2.447 -8.323 -1.709 1.00 0.00 C ATOM 313 CG PRO A 139 -3.429 -8.570 -2.844 1.00 0.00 C ATOM 314 CD PRO A 139 -3.697 -7.150 -3.337 1.00 0.00 C ATOM 0 HA PRO A 139 -3.769 -7.249 -0.283 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -1.434 -8.166 -2.078 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -2.408 -9.165 -1.018 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -3.002 -9.200 -3.624 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -4.338 -9.062 -2.499 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -2.978 -6.854 -4.101 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -4.688 -7.067 -3.783 1.00 0.00 H new ATOM 322 N TRP A 140 -1.877 -6.507 1.020 1.00 0.00 N ATOM 323 CA TRP A 140 -0.904 -5.926 1.900 1.00 0.00 C ATOM 324 C TRP A 140 -0.811 -6.894 3.039 1.00 0.00 C ATOM 325 O TRP A 140 -1.824 -7.442 3.458 1.00 0.00 O ATOM 326 CB TRP A 140 -1.319 -4.556 2.495 1.00 0.00 C ATOM 327 CG TRP A 140 -1.611 -3.474 1.473 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.819 -2.916 1.159 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.642 -2.856 0.608 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.678 -2.001 0.143 1.00 0.00 N ATOM 331 CE2 TRP A 140 -1.347 -1.948 -0.215 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.733 -3.023 0.483 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -0.683 -1.196 -1.179 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.400 -2.261 -0.486 1.00 0.00 C ATOM 335 CH2 TRP A 140 0.703 -1.360 -1.305 1.00 0.00 C ATOM 0 H TRP A 140 -2.579 -7.056 1.516 1.00 0.00 H new ATOM 0 HA TRP A 140 0.018 -5.751 1.346 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.205 -4.699 3.113 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.524 -4.207 3.154 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.754 -3.160 1.642 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -3.430 -1.454 -0.275 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.270 -3.718 1.112 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -1.220 -0.506 -1.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.468 -2.369 -0.604 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.242 -0.785 -2.043 1.00 0.00 H new ATOM 346 N HIS A 141 0.408 -7.136 3.579 1.00 0.00 N ATOM 347 CA HIS A 141 0.568 -7.791 4.858 1.00 0.00 C ATOM 348 C HIS A 141 0.475 -6.680 5.861 1.00 0.00 C ATOM 349 O HIS A 141 0.690 -5.516 5.524 1.00 0.00 O ATOM 350 CB HIS A 141 1.877 -8.577 5.104 1.00 0.00 C ATOM 351 CG HIS A 141 2.085 -9.749 4.186 1.00 0.00 C ATOM 352 ND1 HIS A 141 3.138 -9.878 3.308 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.385 -10.906 4.144 1.00 0.00 C ATOM 354 CE1 HIS A 141 3.064 -11.085 2.762 1.00 0.00 C ATOM 355 NE2 HIS A 141 2.013 -11.726 3.249 1.00 0.00 N ATOM 0 H HIS A 141 1.287 -6.878 3.130 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.195 -8.567 4.922 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.720 -7.895 4.998 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.883 -8.933 6.134 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.496 -11.138 4.712 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.754 -11.483 2.033 1.00 0.00 H new ATOM 0 HE2 HIS A 141 1.722 -12.671 2.999 1.00 0.00 H new ATOM 363 N LYS A 142 0.071 -7.004 7.108 1.00 0.00 N ATOM 364 CA LYS A 142 -0.243 -6.016 8.114 1.00 0.00 C ATOM 365 C LYS A 142 0.962 -5.260 8.608 1.00 0.00 C ATOM 366 O LYS A 142 0.838 -4.159 9.137 1.00 0.00 O ATOM 367 CB LYS A 142 -0.921 -6.643 9.355 1.00 0.00 C ATOM 368 CG LYS A 142 -2.219 -7.402 9.043 1.00 0.00 C ATOM 369 CD LYS A 142 -2.770 -8.137 10.275 1.00 0.00 C ATOM 370 CE LYS A 142 -4.005 -8.992 9.967 1.00 0.00 C ATOM 371 NZ LYS A 142 -4.450 -9.736 11.169 1.00 0.00 N ATOM 0 H LYS A 142 -0.041 -7.966 7.428 1.00 0.00 H new ATOM 0 HA LYS A 142 -0.920 -5.329 7.607 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -0.219 -7.326 9.833 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -1.138 -5.854 10.075 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -2.968 -6.701 8.674 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -2.035 -8.121 8.245 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -1.989 -8.775 10.689 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.025 -7.406 11.042 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -4.813 -8.354 9.610 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -3.775 -9.694 9.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -5.287 -10.307 10.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -3.685 -10.361 11.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -4.691 -9.063 11.924 1.00 0.00 H new ATOM 385 N ASN A 143 2.154 -5.851 8.415 1.00 0.00 N ATOM 386 CA ASN A 143 3.434 -5.272 8.756 1.00 0.00 C ATOM 387 C ASN A 143 3.966 -4.557 7.543 1.00 0.00 C ATOM 388 O ASN A 143 4.646 -3.540 7.656 1.00 0.00 O ATOM 389 CB ASN A 143 4.477 -6.341 9.166 1.00 0.00 C ATOM 390 CG ASN A 143 3.999 -7.052 10.439 1.00 0.00 C ATOM 391 OD1 ASN A 143 3.727 -6.403 11.456 1.00 0.00 O ATOM 392 ND2 ASN A 143 3.903 -8.415 10.373 1.00 0.00 N ATOM 0 H ASN A 143 2.239 -6.779 8.001 1.00 0.00 H new ATOM 0 HA ASN A 143 3.280 -4.602 9.602 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.611 -7.063 8.361 1.00 0.00 H new ATOM 0 HB3 ASN A 143 5.446 -5.873 9.339 1.00 0.00 H new ATOM 0 HD21 ASN A 143 3.595 -8.945 11.188 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.140 -8.902 9.508 1.00 0.00 H new ATOM 399 N CYS A 144 3.643 -5.101 6.348 1.00 0.00 N ATOM 400 CA CYS A 144 4.087 -4.644 5.055 1.00 0.00 C ATOM 401 C CYS A 144 3.140 -3.618 4.477 1.00 0.00 C ATOM 402 O CYS A 144 2.939 -3.603 3.263 1.00 0.00 O ATOM 403 CB CYS A 144 4.120 -5.782 4.009 1.00 0.00 C ATOM 404 SG CYS A 144 5.219 -7.187 4.342 1.00 0.00 S ATOM 0 H CYS A 144 3.031 -5.914 6.280 1.00 0.00 H new ATOM 0 HA CYS A 144 5.082 -4.236 5.232 1.00 0.00 H new ATOM 0 HB2 CYS A 144 3.106 -6.166 3.896 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.406 -5.350 3.050 1.00 0.00 H new ATOM 0 HG CYS A 144 4.610 -8.295 4.041 1.00 0.00 H new ATOM 409 N PHE A 145 2.485 -2.762 5.303 1.00 0.00 N ATOM 410 CA PHE A 145 1.444 -1.877 4.824 1.00 0.00 C ATOM 411 C PHE A 145 2.128 -0.662 4.232 1.00 0.00 C ATOM 412 O PHE A 145 2.370 0.328 4.911 1.00 0.00 O ATOM 413 CB PHE A 145 0.483 -1.499 5.984 1.00 0.00 C ATOM 414 CG PHE A 145 -0.923 -1.240 5.518 1.00 0.00 C ATOM 415 CD1 PHE A 145 -1.752 -2.322 5.174 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.451 0.062 5.476 1.00 0.00 C ATOM 417 CE1 PHE A 145 -3.077 -2.109 4.775 1.00 0.00 C ATOM 418 CE2 PHE A 145 -2.780 0.274 5.088 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.590 -0.809 4.729 1.00 0.00 C ATOM 0 H PHE A 145 2.675 -2.682 6.302 1.00 0.00 H new ATOM 0 HA PHE A 145 0.832 -2.359 4.062 1.00 0.00 H new ATOM 0 HB2 PHE A 145 0.474 -2.304 6.719 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.863 -0.611 6.489 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -1.363 -3.328 5.218 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.829 0.903 5.744 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -3.702 -2.947 4.503 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.181 1.277 5.066 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.610 -0.641 4.417 1.00 0.00 H new ATOM 429 N ARG A 146 2.518 -0.753 2.940 1.00 0.00 N ATOM 430 CA ARG A 146 3.465 0.150 2.337 1.00 0.00 C ATOM 431 C ARG A 146 2.703 1.155 1.534 1.00 0.00 C ATOM 432 O ARG A 146 1.658 0.857 0.960 1.00 0.00 O ATOM 433 CB ARG A 146 4.472 -0.597 1.423 1.00 0.00 C ATOM 434 CG ARG A 146 5.678 0.213 0.931 1.00 0.00 C ATOM 435 CD ARG A 146 6.642 -0.637 0.093 1.00 0.00 C ATOM 436 NE ARG A 146 7.824 0.206 -0.271 1.00 0.00 N ATOM 437 CZ ARG A 146 8.920 -0.298 -0.914 1.00 0.00 C ATOM 438 NH1 ARG A 146 8.989 -1.616 -1.263 1.00 0.00 N ATOM 439 NH2 ARG A 146 9.963 0.534 -1.212 1.00 0.00 N ATOM 0 H ARG A 146 2.169 -1.467 2.301 1.00 0.00 H new ATOM 0 HA ARG A 146 4.041 0.635 3.125 1.00 0.00 H new ATOM 0 HB2 ARG A 146 4.843 -1.468 1.964 1.00 0.00 H new ATOM 0 HB3 ARG A 146 3.932 -0.969 0.552 1.00 0.00 H new ATOM 0 HG2 ARG A 146 5.329 1.057 0.336 1.00 0.00 H new ATOM 0 HG3 ARG A 146 6.211 0.626 1.788 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.961 -1.514 0.656 1.00 0.00 H new ATOM 0 HD3 ARG A 146 6.144 -0.999 -0.806 1.00 0.00 H new ATOM 0 HE ARG A 146 7.811 1.197 -0.029 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.214 -2.243 -1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 146 9.815 -1.974 -1.742 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.918 1.520 -0.955 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.786 0.169 -1.692 1.00 0.00 H new ATOM 453 N CYS A 147 3.255 2.385 1.470 1.00 0.00 N ATOM 454 CA CYS A 147 2.772 3.484 0.680 1.00 0.00 C ATOM 455 C CYS A 147 3.118 3.172 -0.762 1.00 0.00 C ATOM 456 O CYS A 147 4.178 2.628 -1.059 1.00 0.00 O ATOM 457 CB CYS A 147 3.464 4.782 1.158 1.00 0.00 C ATOM 458 SG CYS A 147 3.003 6.238 0.199 1.00 0.00 S ATOM 0 H CYS A 147 4.090 2.627 2.003 1.00 0.00 H new ATOM 0 HA CYS A 147 1.696 3.624 0.779 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.215 4.953 2.205 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.545 4.649 1.105 1.00 0.00 H new ATOM 0 HG CYS A 147 3.933 7.140 0.305 1.00 0.00 H new ATOM 463 N ALA A 148 2.202 3.478 -1.703 1.00 0.00 N ATOM 464 CA ALA A 148 2.372 3.105 -3.089 1.00 0.00 C ATOM 465 C ALA A 148 3.068 4.207 -3.837 1.00 0.00 C ATOM 466 O ALA A 148 3.582 3.990 -4.933 1.00 0.00 O ATOM 467 CB ALA A 148 1.031 2.819 -3.780 1.00 0.00 C ATOM 0 H ALA A 148 1.339 3.985 -1.509 1.00 0.00 H new ATOM 0 HA ALA A 148 2.970 2.194 -3.102 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.209 2.543 -4.819 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.525 2.000 -3.268 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.405 3.711 -3.744 1.00 0.00 H new ATOM 473 N LYS A 149 3.107 5.420 -3.239 1.00 0.00 N ATOM 474 CA LYS A 149 3.690 6.594 -3.828 1.00 0.00 C ATOM 475 C LYS A 149 5.141 6.646 -3.438 1.00 0.00 C ATOM 476 O LYS A 149 6.009 6.587 -4.308 1.00 0.00 O ATOM 477 CB LYS A 149 2.948 7.874 -3.375 1.00 0.00 C ATOM 478 CG LYS A 149 3.456 9.189 -3.988 1.00 0.00 C ATOM 479 CD LYS A 149 2.477 10.351 -3.747 1.00 0.00 C ATOM 480 CE LYS A 149 2.997 11.703 -4.246 1.00 0.00 C ATOM 481 NZ LYS A 149 2.004 12.772 -3.994 1.00 0.00 N ATOM 0 H LYS A 149 2.718 5.588 -2.311 1.00 0.00 H new ATOM 0 HA LYS A 149 3.600 6.543 -4.913 1.00 0.00 H new ATOM 0 HB2 LYS A 149 1.891 7.765 -3.619 1.00 0.00 H new ATOM 0 HB3 LYS A 149 3.019 7.949 -2.290 1.00 0.00 H new ATOM 0 HG2 LYS A 149 4.427 9.438 -3.560 1.00 0.00 H new ATOM 0 HG3 LYS A 149 3.605 9.056 -5.060 1.00 0.00 H new ATOM 0 HD2 LYS A 149 1.532 10.128 -4.243 1.00 0.00 H new ATOM 0 HD3 LYS A 149 2.267 10.423 -2.680 1.00 0.00 H new ATOM 0 HE2 LYS A 149 3.934 11.945 -3.745 1.00 0.00 H new ATOM 0 HE3 LYS A 149 3.212 11.644 -5.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 2.104 13.516 -4.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 1.045 12.373 -4.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 2.165 13.180 -3.051 1.00 0.00 H new ATOM 495 N CYS A 150 5.436 6.763 -2.118 1.00 0.00 N ATOM 496 CA CYS A 150 6.771 7.033 -1.637 1.00 0.00 C ATOM 497 C CYS A 150 7.416 5.812 -1.013 1.00 0.00 C ATOM 498 O CYS A 150 8.642 5.717 -0.983 1.00 0.00 O ATOM 499 CB CYS A 150 6.813 8.278 -0.707 1.00 0.00 C ATOM 500 SG CYS A 150 6.224 8.070 1.007 1.00 0.00 S ATOM 0 H CYS A 150 4.741 6.669 -1.377 1.00 0.00 H new ATOM 0 HA CYS A 150 7.378 7.280 -2.508 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.843 8.634 -0.668 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.221 9.066 -1.173 1.00 0.00 H new ATOM 0 HG CYS A 150 5.043 8.600 1.127 1.00 0.00 H new ATOM 505 N GLY A 151 6.611 4.838 -0.520 1.00 0.00 N ATOM 506 CA GLY A 151 7.119 3.603 0.043 1.00 0.00 C ATOM 507 C GLY A 151 7.422 3.654 1.510 1.00 0.00 C ATOM 508 O GLY A 151 8.055 2.732 2.025 1.00 0.00 O ATOM 0 H GLY A 151 5.593 4.906 -0.511 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.389 2.813 -0.135 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.027 3.324 -0.491 1.00 0.00 H new ATOM 512 N LYS A 152 6.989 4.727 2.225 1.00 0.00 N ATOM 513 CA LYS A 152 7.095 4.855 3.668 1.00 0.00 C ATOM 514 C LYS A 152 6.408 3.695 4.347 1.00 0.00 C ATOM 515 O LYS A 152 5.308 3.301 3.959 1.00 0.00 O ATOM 516 CB LYS A 152 6.451 6.166 4.181 1.00 0.00 C ATOM 517 CG LYS A 152 6.553 6.414 5.698 1.00 0.00 C ATOM 518 CD LYS A 152 5.839 7.702 6.137 1.00 0.00 C ATOM 519 CE LYS A 152 5.872 7.923 7.655 1.00 0.00 C ATOM 520 NZ LYS A 152 5.104 9.135 8.029 1.00 0.00 N ATOM 0 H LYS A 152 6.549 5.535 1.785 1.00 0.00 H new ATOM 0 HA LYS A 152 8.158 4.866 3.907 1.00 0.00 H new ATOM 0 HB2 LYS A 152 6.917 7.004 3.663 1.00 0.00 H new ATOM 0 HB3 LYS A 152 5.397 6.164 3.902 1.00 0.00 H new ATOM 0 HG2 LYS A 152 6.123 5.566 6.231 1.00 0.00 H new ATOM 0 HG3 LYS A 152 7.604 6.470 5.983 1.00 0.00 H new ATOM 0 HD2 LYS A 152 6.304 8.555 5.642 1.00 0.00 H new ATOM 0 HD3 LYS A 152 4.802 7.667 5.804 1.00 0.00 H new ATOM 0 HE2 LYS A 152 5.456 7.053 8.163 1.00 0.00 H new ATOM 0 HE3 LYS A 152 6.904 8.024 7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.140 9.264 9.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 5.518 9.966 7.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 4.114 9.025 7.728 1.00 0.00 H new ATOM 534 N SER A 153 7.090 3.100 5.356 1.00 0.00 N ATOM 535 CA SER A 153 6.666 1.878 5.989 1.00 0.00 C ATOM 536 C SER A 153 5.699 2.172 7.098 1.00 0.00 C ATOM 537 O SER A 153 5.941 3.036 7.939 1.00 0.00 O ATOM 538 CB SER A 153 7.851 1.027 6.519 1.00 0.00 C ATOM 539 OG SER A 153 8.715 1.770 7.373 1.00 0.00 O ATOM 0 H SER A 153 7.956 3.478 5.740 1.00 0.00 H new ATOM 0 HA SER A 153 6.171 1.284 5.221 1.00 0.00 H new ATOM 0 HB2 SER A 153 7.462 0.165 7.061 1.00 0.00 H new ATOM 0 HB3 SER A 153 8.423 0.641 5.675 1.00 0.00 H new ATOM 0 HG SER A 153 9.444 1.193 7.683 1.00 0.00 H new ATOM 545 N LEU A 154 4.552 1.454 7.072 1.00 0.00 N ATOM 546 CA LEU A 154 3.439 1.688 7.956 1.00 0.00 C ATOM 547 C LEU A 154 2.910 0.325 8.305 1.00 0.00 C ATOM 548 O LEU A 154 3.327 -0.688 7.736 1.00 0.00 O ATOM 549 CB LEU A 154 2.286 2.505 7.306 1.00 0.00 C ATOM 550 CG LEU A 154 2.744 3.727 6.470 1.00 0.00 C ATOM 551 CD1 LEU A 154 1.687 4.112 5.423 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.125 4.937 7.341 1.00 0.00 C ATOM 0 H LEU A 154 4.394 0.688 6.417 1.00 0.00 H new ATOM 0 HA LEU A 154 3.782 2.270 8.811 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.706 1.841 6.665 1.00 0.00 H new ATOM 0 HB3 LEU A 154 1.617 2.852 8.094 1.00 0.00 H new ATOM 0 HG LEU A 154 3.650 3.421 5.947 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.037 4.972 4.852 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.520 3.272 4.748 1.00 0.00 H new ATOM 0 HD13 LEU A 154 0.753 4.365 5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 154 3.437 5.762 6.701 1.00 0.00 H new ATOM 0 HD22 LEU A 154 2.264 5.244 7.934 1.00 0.00 H new ATOM 0 HD23 LEU A 154 3.944 4.663 8.006 1.00 0.00 H new ATOM 564 N GLU A 155 1.957 0.283 9.265 1.00 0.00 N ATOM 565 CA GLU A 155 1.333 -0.937 9.705 1.00 0.00 C ATOM 566 C GLU A 155 -0.150 -0.715 9.682 1.00 0.00 C ATOM 567 O GLU A 155 -0.880 -1.434 9.001 1.00 0.00 O ATOM 568 CB GLU A 155 1.760 -1.362 11.131 1.00 0.00 C ATOM 569 CG GLU A 155 3.255 -1.724 11.213 1.00 0.00 C ATOM 570 CD GLU A 155 3.586 -2.253 12.607 1.00 0.00 C ATOM 571 OE1 GLU A 155 3.435 -1.475 13.588 1.00 0.00 O ATOM 572 OE2 GLU A 155 3.995 -3.440 12.710 1.00 0.00 O ATOM 0 H GLU A 155 1.613 1.114 9.745 1.00 0.00 H new ATOM 0 HA GLU A 155 1.644 -1.740 9.037 1.00 0.00 H new ATOM 0 HB2 GLU A 155 1.546 -0.552 11.828 1.00 0.00 H new ATOM 0 HB3 GLU A 155 1.164 -2.218 11.446 1.00 0.00 H new ATOM 0 HG2 GLU A 155 3.498 -2.476 10.462 1.00 0.00 H new ATOM 0 HG3 GLU A 155 3.863 -0.846 10.994 1.00 0.00 H new ATOM 579 N SER A 156 -0.629 0.295 10.445 1.00 0.00 N ATOM 580 CA SER A 156 -2.037 0.564 10.626 1.00 0.00 C ATOM 581 C SER A 156 -2.539 1.482 9.540 1.00 0.00 C ATOM 582 O SER A 156 -1.773 1.956 8.700 1.00 0.00 O ATOM 583 CB SER A 156 -2.342 1.164 12.026 1.00 0.00 C ATOM 584 OG SER A 156 -1.600 2.353 12.277 1.00 0.00 O ATOM 0 H SER A 156 -0.024 0.943 10.950 1.00 0.00 H new ATOM 0 HA SER A 156 -2.562 -0.389 10.560 1.00 0.00 H new ATOM 0 HB2 SER A 156 -3.408 1.380 12.102 1.00 0.00 H new ATOM 0 HB3 SER A 156 -2.111 0.425 12.794 1.00 0.00 H new ATOM 0 HG SER A 156 -1.824 2.697 13.167 1.00 0.00 H new ATOM 590 N THR A 157 -3.871 1.736 9.551 1.00 0.00 N ATOM 591 CA THR A 157 -4.543 2.621 8.629 1.00 0.00 C ATOM 592 C THR A 157 -4.628 3.980 9.282 1.00 0.00 C ATOM 593 O THR A 157 -5.623 4.331 9.916 1.00 0.00 O ATOM 594 CB THR A 157 -5.922 2.127 8.199 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.706 1.679 9.302 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.753 0.971 7.191 1.00 0.00 C ATOM 0 H THR A 157 -4.504 1.309 10.227 1.00 0.00 H new ATOM 0 HA THR A 157 -3.965 2.664 7.706 1.00 0.00 H new ATOM 0 HB THR A 157 -6.447 2.966 7.743 1.00 0.00 H new ATOM 0 HG1 THR A 157 -6.711 2.367 10.000 1.00 0.00 H new ATOM 0 HG21 THR A 157 -6.734 0.613 6.880 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.203 1.326 6.319 1.00 0.00 H new ATOM 0 HG23 THR A 157 -5.202 0.156 7.661 1.00 0.00 H new ATOM 604 N THR A 158 -3.545 4.773 9.124 1.00 0.00 N ATOM 605 CA THR A 158 -3.430 6.129 9.617 1.00 0.00 C ATOM 606 C THR A 158 -3.681 7.042 8.455 1.00 0.00 C ATOM 607 O THR A 158 -4.226 8.138 8.583 1.00 0.00 O ATOM 608 CB THR A 158 -2.049 6.397 10.203 1.00 0.00 C ATOM 609 OG1 THR A 158 -1.758 5.432 11.207 1.00 0.00 O ATOM 610 CG2 THR A 158 -1.974 7.805 10.832 1.00 0.00 C ATOM 0 H THR A 158 -2.709 4.459 8.631 1.00 0.00 H new ATOM 0 HA THR A 158 -4.151 6.295 10.417 1.00 0.00 H new ATOM 0 HB THR A 158 -1.323 6.333 9.393 1.00 0.00 H new ATOM 0 HG1 THR A 158 -0.869 5.606 11.580 1.00 0.00 H new ATOM 0 HG21 THR A 158 -0.977 7.968 11.242 1.00 0.00 H new ATOM 0 HG22 THR A 158 -2.180 8.556 10.069 1.00 0.00 H new ATOM 0 HG23 THR A 158 -2.712 7.887 11.630 1.00 0.00 H new ATOM 618 N LEU A 159 -3.265 6.552 7.283 1.00 0.00 N ATOM 619 CA LEU A 159 -3.180 7.251 6.035 1.00 0.00 C ATOM 620 C LEU A 159 -4.482 7.253 5.286 1.00 0.00 C ATOM 621 O LEU A 159 -5.452 6.606 5.680 1.00 0.00 O ATOM 622 CB LEU A 159 -2.082 6.652 5.126 1.00 0.00 C ATOM 623 CG LEU A 159 -2.269 5.198 4.606 1.00 0.00 C ATOM 624 CD1 LEU A 159 -1.260 4.901 3.480 1.00 0.00 C ATOM 625 CD2 LEU A 159 -2.173 4.112 5.695 1.00 0.00 C ATOM 0 H LEU A 159 -2.960 5.583 7.195 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.926 8.280 6.289 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.975 7.304 4.259 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.140 6.691 5.672 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.290 5.153 4.228 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.401 3.880 3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.419 5.597 2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.245 5.015 3.861 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.315 3.130 5.243 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -1.191 4.156 6.167 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.944 4.281 6.446 1.00 0.00 H new ATOM 637 N THR A 160 -4.497 8.009 4.160 1.00 0.00 N ATOM 638 CA THR A 160 -5.606 8.112 3.246 1.00 0.00 C ATOM 639 C THR A 160 -5.426 7.027 2.211 1.00 0.00 C ATOM 640 O THR A 160 -4.309 6.588 1.934 1.00 0.00 O ATOM 641 CB THR A 160 -5.711 9.505 2.619 1.00 0.00 C ATOM 642 OG1 THR A 160 -6.914 9.664 1.872 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.487 9.836 1.732 1.00 0.00 C ATOM 0 H THR A 160 -3.697 8.574 3.875 1.00 0.00 H new ATOM 0 HA THR A 160 -6.549 7.974 3.775 1.00 0.00 H new ATOM 0 HB THR A 160 -5.730 10.210 3.450 1.00 0.00 H new ATOM 0 HG1 THR A 160 -6.945 10.566 1.489 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.604 10.833 1.308 1.00 0.00 H new ATOM 0 HG22 THR A 160 -3.580 9.803 2.336 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.413 9.105 0.926 1.00 0.00 H new ATOM 651 N GLU A 161 -6.553 6.549 1.642 1.00 0.00 N ATOM 652 CA GLU A 161 -6.555 5.493 0.666 1.00 0.00 C ATOM 653 C GLU A 161 -7.226 6.084 -0.536 1.00 0.00 C ATOM 654 O GLU A 161 -8.380 6.506 -0.456 1.00 0.00 O ATOM 655 CB GLU A 161 -7.324 4.250 1.172 1.00 0.00 C ATOM 656 CG GLU A 161 -6.811 3.788 2.552 1.00 0.00 C ATOM 657 CD GLU A 161 -7.405 2.436 2.941 1.00 0.00 C ATOM 658 OE1 GLU A 161 -8.655 2.295 2.891 1.00 0.00 O ATOM 659 OE2 GLU A 161 -6.609 1.530 3.307 1.00 0.00 O ATOM 0 H GLU A 161 -7.483 6.903 1.864 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.545 5.145 0.448 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.387 4.481 1.237 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -7.217 3.438 0.453 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -5.723 3.718 2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -7.069 4.532 3.306 1.00 0.00 H new ATOM 666 N LYS A 162 -6.490 6.165 -1.671 1.00 0.00 N ATOM 667 CA LYS A 162 -6.926 6.907 -2.828 1.00 0.00 C ATOM 668 C LYS A 162 -6.475 6.173 -4.057 1.00 0.00 C ATOM 669 O LYS A 162 -5.351 5.677 -4.119 1.00 0.00 O ATOM 670 CB LYS A 162 -6.290 8.321 -2.914 1.00 0.00 C ATOM 671 CG LYS A 162 -6.683 9.289 -1.783 1.00 0.00 C ATOM 672 CD LYS A 162 -8.156 9.736 -1.785 1.00 0.00 C ATOM 673 CE LYS A 162 -8.540 10.592 -3.000 1.00 0.00 C ATOM 674 NZ LYS A 162 -9.947 11.045 -2.905 1.00 0.00 N ATOM 0 H LYS A 162 -5.584 5.711 -1.787 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.009 7.006 -2.751 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -5.205 8.214 -2.918 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -6.569 8.770 -3.867 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -6.466 8.813 -0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -6.051 10.175 -1.849 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -8.794 8.853 -1.758 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -8.356 10.302 -0.875 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -7.879 11.456 -3.064 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -8.400 10.016 -3.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -10.183 11.622 -3.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -10.576 10.218 -2.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -10.071 11.614 -2.043 1.00 0.00 H new ATOM 688 N GLU A 163 -7.366 6.139 -5.080 1.00 0.00 N ATOM 689 CA GLU A 163 -7.096 5.714 -6.439 1.00 0.00 C ATOM 690 C GLU A 163 -6.788 4.241 -6.571 1.00 0.00 C ATOM 691 O GLU A 163 -6.084 3.832 -7.494 1.00 0.00 O ATOM 692 CB GLU A 163 -6.004 6.555 -7.154 1.00 0.00 C ATOM 693 CG GLU A 163 -6.301 8.067 -7.155 1.00 0.00 C ATOM 694 CD GLU A 163 -5.158 8.818 -7.837 1.00 0.00 C ATOM 695 OE1 GLU A 163 -4.916 8.561 -9.047 1.00 0.00 O ATOM 696 OE2 GLU A 163 -4.512 9.662 -7.158 1.00 0.00 O ATOM 0 H GLU A 163 -8.336 6.426 -4.952 1.00 0.00 H new ATOM 0 HA GLU A 163 -8.041 5.898 -6.950 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -5.045 6.381 -6.667 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -5.906 6.210 -8.183 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -7.239 8.263 -7.675 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -6.424 8.424 -6.132 1.00 0.00 H new ATOM 703 N GLY A 164 -7.327 3.400 -5.653 1.00 0.00 N ATOM 704 CA GLY A 164 -7.196 1.961 -5.724 1.00 0.00 C ATOM 705 C GLY A 164 -5.984 1.475 -4.982 1.00 0.00 C ATOM 706 O GLY A 164 -5.867 0.282 -4.703 1.00 0.00 O ATOM 0 H GLY A 164 -7.863 3.723 -4.848 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -8.089 1.494 -5.308 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -7.131 1.653 -6.768 1.00 0.00 H new ATOM 710 N GLU A 165 -5.051 2.399 -4.655 1.00 0.00 N ATOM 711 CA GLU A 165 -3.850 2.125 -3.911 1.00 0.00 C ATOM 712 C GLU A 165 -3.975 2.900 -2.633 1.00 0.00 C ATOM 713 O GLU A 165 -5.026 3.469 -2.346 1.00 0.00 O ATOM 714 CB GLU A 165 -2.576 2.568 -4.668 1.00 0.00 C ATOM 715 CG GLU A 165 -2.446 1.876 -6.035 1.00 0.00 C ATOM 716 CD GLU A 165 -1.097 2.190 -6.678 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.859 3.380 -7.013 1.00 0.00 O ATOM 718 OE2 GLU A 165 -0.286 1.239 -6.848 1.00 0.00 O ATOM 0 H GLU A 165 -5.138 3.380 -4.921 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.748 1.053 -3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -2.596 3.649 -4.810 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -1.698 2.342 -4.063 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -2.553 0.798 -5.913 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -3.252 2.204 -6.692 1.00 0.00 H new ATOM 725 N ILE A 166 -2.897 2.927 -1.819 1.00 0.00 N ATOM 726 CA ILE A 166 -2.849 3.695 -0.600 1.00 0.00 C ATOM 727 C ILE A 166 -1.653 4.589 -0.754 1.00 0.00 C ATOM 728 O ILE A 166 -0.638 4.171 -1.304 1.00 0.00 O ATOM 729 CB ILE A 166 -2.788 2.836 0.664 1.00 0.00 C ATOM 730 CG1 ILE A 166 -1.527 1.937 0.746 1.00 0.00 C ATOM 731 CG2 ILE A 166 -4.087 2.001 0.715 1.00 0.00 C ATOM 732 CD1 ILE A 166 -1.496 1.029 1.980 1.00 0.00 C ATOM 0 H ILE A 166 -2.041 2.406 -2.009 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.767 4.265 -0.461 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.709 3.491 1.532 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -1.474 1.319 -0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.640 2.570 0.750 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -4.081 1.373 1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -4.948 2.669 0.748 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -4.150 1.371 -0.173 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -0.585 0.430 1.969 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -1.517 1.640 2.882 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -2.364 0.369 1.968 1.00 0.00 H new ATOM 744 N TYR A 167 -1.760 5.866 -0.315 1.00 0.00 N ATOM 745 CA TYR A 167 -0.689 6.835 -0.439 1.00 0.00 C ATOM 746 C TYR A 167 -0.685 7.533 0.883 1.00 0.00 C ATOM 747 O TYR A 167 -1.755 7.764 1.444 1.00 0.00 O ATOM 748 CB TYR A 167 -0.911 7.956 -1.493 1.00 0.00 C ATOM 749 CG TYR A 167 -1.280 7.429 -2.853 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.484 6.487 -3.525 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.426 7.925 -3.497 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.821 6.056 -4.814 1.00 0.00 C ATOM 753 CE2 TYR A 167 -2.773 7.491 -4.781 1.00 0.00 C ATOM 754 CZ TYR A 167 -1.971 6.555 -5.443 1.00 0.00 C ATOM 755 OH TYR A 167 -2.320 6.123 -6.741 1.00 0.00 O ATOM 0 H TYR A 167 -2.599 6.235 0.133 1.00 0.00 H new ATOM 0 HA TYR A 167 0.213 6.302 -0.739 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -1.699 8.623 -1.143 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.002 8.552 -1.576 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.397 6.091 -3.043 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -3.047 8.651 -2.994 1.00 0.00 H new ATOM 0 HE1 TYR A 167 -0.195 5.339 -5.324 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -3.660 7.878 -5.261 1.00 0.00 H new ATOM 0 HH TYR A 167 -1.900 5.256 -6.921 1.00 0.00 H new ATOM 765 N CYS A 168 0.502 7.864 1.452 1.00 0.00 N ATOM 766 CA CYS A 168 0.557 8.170 2.861 1.00 0.00 C ATOM 767 C CYS A 168 0.372 9.635 3.105 1.00 0.00 C ATOM 768 O CYS A 168 0.257 10.429 2.176 1.00 0.00 O ATOM 769 CB CYS A 168 1.757 7.557 3.627 1.00 0.00 C ATOM 770 SG CYS A 168 3.376 8.316 3.347 1.00 0.00 S ATOM 0 H CYS A 168 1.393 7.919 0.958 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.294 7.654 3.305 1.00 0.00 H new ATOM 0 HB2 CYS A 168 1.539 7.605 4.694 1.00 0.00 H new ATOM 0 HB3 CYS A 168 1.826 6.502 3.362 1.00 0.00 H new ATOM 0 HG CYS A 168 3.383 8.909 2.190 1.00 0.00 H new ATOM 775 N LYS A 169 0.302 10.005 4.399 1.00 0.00 N ATOM 776 CA LYS A 169 -0.061 11.315 4.872 1.00 0.00 C ATOM 777 C LYS A 169 0.994 12.345 4.554 1.00 0.00 C ATOM 778 O LYS A 169 0.663 13.487 4.242 1.00 0.00 O ATOM 779 CB LYS A 169 -0.353 11.293 6.395 1.00 0.00 C ATOM 780 CG LYS A 169 0.727 10.603 7.251 1.00 0.00 C ATOM 781 CD LYS A 169 0.330 10.471 8.730 1.00 0.00 C ATOM 782 CE LYS A 169 1.364 9.715 9.580 1.00 0.00 C ATOM 783 NZ LYS A 169 1.510 8.307 9.135 1.00 0.00 N ATOM 0 H LYS A 169 0.509 9.357 5.159 1.00 0.00 H new ATOM 0 HA LYS A 169 -0.971 11.603 4.345 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -0.471 12.319 6.743 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -1.305 10.789 6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 169 0.926 9.611 6.844 1.00 0.00 H new ATOM 0 HG3 LYS A 169 1.656 11.169 7.179 1.00 0.00 H new ATOM 0 HD2 LYS A 169 0.186 11.467 9.149 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -0.628 9.956 8.796 1.00 0.00 H new ATOM 0 HE2 LYS A 169 2.328 10.220 9.516 1.00 0.00 H new ATOM 0 HE3 LYS A 169 1.062 9.737 10.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 2.082 7.782 9.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 0.570 7.868 9.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 1.980 8.283 8.208 1.00 0.00 H new ATOM 797 N GLY A 170 2.290 11.955 4.601 1.00 0.00 N ATOM 798 CA GLY A 170 3.396 12.868 4.444 1.00 0.00 C ATOM 799 C GLY A 170 3.590 13.283 3.016 1.00 0.00 C ATOM 800 O GLY A 170 3.873 14.448 2.740 1.00 0.00 O ATOM 0 H GLY A 170 2.576 10.987 4.751 1.00 0.00 H new ATOM 0 HA2 GLY A 170 3.225 13.753 5.057 1.00 0.00 H new ATOM 0 HA3 GLY A 170 4.308 12.397 4.811 1.00 0.00 H new ATOM 804 N CYS A 171 3.456 12.323 2.071 1.00 0.00 N ATOM 805 CA CYS A 171 3.770 12.533 0.679 1.00 0.00 C ATOM 806 C CYS A 171 2.607 13.135 -0.071 1.00 0.00 C ATOM 807 O CYS A 171 2.811 13.936 -0.978 1.00 0.00 O ATOM 808 CB CYS A 171 4.218 11.220 -0.019 1.00 0.00 C ATOM 809 SG CYS A 171 3.012 9.879 0.025 1.00 0.00 S ATOM 0 H CYS A 171 3.123 11.381 2.277 1.00 0.00 H new ATOM 0 HA CYS A 171 4.602 13.237 0.657 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.453 11.442 -1.060 1.00 0.00 H new ATOM 0 HB3 CYS A 171 5.140 10.874 0.449 1.00 0.00 H new ATOM 0 HG CYS A 171 2.061 10.178 0.860 1.00 0.00 H new ATOM 814 N TYR A 172 1.361 12.734 0.278 1.00 0.00 N ATOM 815 CA TYR A 172 0.184 13.009 -0.510 1.00 0.00 C ATOM 816 C TYR A 172 -0.391 14.346 -0.124 1.00 0.00 C ATOM 817 O TYR A 172 -0.929 15.053 -0.976 1.00 0.00 O ATOM 818 CB TYR A 172 -0.882 11.897 -0.324 1.00 0.00 C ATOM 819 CG TYR A 172 -1.919 11.899 -1.418 1.00 0.00 C ATOM 820 CD1 TYR A 172 -1.579 11.483 -2.717 1.00 0.00 C ATOM 821 CD2 TYR A 172 -3.244 12.283 -1.151 1.00 0.00 C ATOM 822 CE1 TYR A 172 -2.546 11.445 -3.729 1.00 0.00 C ATOM 823 CE2 TYR A 172 -4.213 12.247 -2.161 1.00 0.00 C ATOM 824 CZ TYR A 172 -3.867 11.820 -3.450 1.00 0.00 C ATOM 825 OH TYR A 172 -4.852 11.755 -4.462 1.00 0.00 O ATOM 0 H TYR A 172 1.166 12.206 1.129 1.00 0.00 H new ATOM 0 HA TYR A 172 0.472 13.031 -1.561 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -0.388 10.926 -0.299 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.375 12.029 0.639 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.563 11.190 -2.936 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.517 12.609 -0.158 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -2.274 11.127 -4.724 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -5.228 12.548 -1.946 1.00 0.00 H new ATOM 0 HH TYR A 172 -5.714 12.049 -4.099 1.00 0.00 H new ATOM 835 N ALA A 173 -0.277 14.733 1.174 1.00 0.00 N ATOM 836 CA ALA A 173 -0.794 15.992 1.663 1.00 0.00 C ATOM 837 C ALA A 173 0.084 17.135 1.227 1.00 0.00 C ATOM 838 O ALA A 173 -0.410 18.227 0.948 1.00 0.00 O ATOM 839 CB ALA A 173 -0.889 16.039 3.199 1.00 0.00 C ATOM 0 H ALA A 173 0.178 14.167 1.890 1.00 0.00 H new ATOM 0 HA ALA A 173 -1.795 16.084 1.242 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -1.283 17.007 3.510 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -1.553 15.248 3.547 1.00 0.00 H new ATOM 0 HB3 ALA A 173 0.102 15.896 3.629 1.00 0.00 H new ATOM 845 N LYS A 174 1.416 16.894 1.147 1.00 0.00 N ATOM 846 CA LYS A 174 2.391 17.887 0.763 1.00 0.00 C ATOM 847 C LYS A 174 2.344 18.060 -0.732 1.00 0.00 C ATOM 848 O LYS A 174 2.200 19.179 -1.224 1.00 0.00 O ATOM 849 CB LYS A 174 3.811 17.461 1.215 1.00 0.00 C ATOM 850 CG LYS A 174 4.937 18.499 1.028 1.00 0.00 C ATOM 851 CD LYS A 174 5.626 18.480 -0.348 1.00 0.00 C ATOM 852 CE LYS A 174 6.826 19.433 -0.425 1.00 0.00 C ATOM 853 NZ LYS A 174 7.461 19.380 -1.763 1.00 0.00 N ATOM 0 H LYS A 174 1.826 15.984 1.355 1.00 0.00 H new ATOM 0 HA LYS A 174 2.157 18.834 1.249 1.00 0.00 H new ATOM 0 HB2 LYS A 174 3.766 17.194 2.271 1.00 0.00 H new ATOM 0 HB3 LYS A 174 4.086 16.559 0.669 1.00 0.00 H new ATOM 0 HG2 LYS A 174 4.524 19.494 1.195 1.00 0.00 H new ATOM 0 HG3 LYS A 174 5.692 18.334 1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 174 5.959 17.466 -0.569 1.00 0.00 H new ATOM 0 HD3 LYS A 174 4.902 18.752 -1.116 1.00 0.00 H new ATOM 0 HE2 LYS A 174 6.500 20.451 -0.213 1.00 0.00 H new ATOM 0 HE3 LYS A 174 7.556 19.166 0.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 8.270 20.033 -1.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 7.791 18.412 -1.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 6.768 19.657 -2.487 1.00 0.00 H new ATOM 867 N ASN A 175 2.437 16.936 -1.477 1.00 0.00 N ATOM 868 CA ASN A 175 2.407 16.918 -2.916 1.00 0.00 C ATOM 869 C ASN A 175 1.132 16.150 -3.279 1.00 0.00 C ATOM 870 O ASN A 175 0.224 16.755 -3.908 1.00 0.00 O ATOM 871 CB ASN A 175 3.645 16.194 -3.511 1.00 0.00 C ATOM 872 CG ASN A 175 3.669 16.265 -5.046 1.00 0.00 C ATOM 873 OD1 ASN A 175 3.523 15.242 -5.725 1.00 0.00 O ATOM 874 ND2 ASN A 175 3.862 17.507 -5.587 1.00 0.00 N ATOM 0 H ASN A 175 2.536 16.008 -1.065 1.00 0.00 H new ATOM 0 HA ASN A 175 2.422 17.931 -3.319 1.00 0.00 H new ATOM 0 HB2 ASN A 175 4.554 16.644 -3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 175 3.641 15.150 -3.196 1.00 0.00 H new ATOM 0 HD21 ASN A 175 3.891 17.623 -6.600 1.00 0.00 H new ATOM 0 HD22 ASN A 175 3.977 18.317 -4.977 1.00 0.00 H new