USER MOD reduce.3.24.130724 H: found=0, std=0, add=436, rem=0, adj=20 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 147 CYS SG : rot 151:sc= 0.901 USER MOD Set 1.2: A 150 CYS SG : rot -53:sc= 0.499 USER MOD Set 1.3: A 168 CYS SG : rot -21:sc= 0.603 USER MOD Set 1.4: A 171 CYS SG : rot -3:sc= 1.16 USER MOD Set 2.1: A 120 CYS SG : rot 154:sc= 0.823 USER MOD Set 2.2: A 123 CYS SG : rot -57:sc= 0.558 USER MOD Set 2.3: A 141 HIS : no HD1:sc= 0.541 K(o=1.3,f=-0.46) USER MOD Set 2.4: A 144 CYS SG : rot 135:sc= -0.662 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 22:sc= 0.205 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 156:sc= 0.116 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -121:sc= 0.0152 (180deg=-0.288) 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) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0137) USER MOD Single : A 153 SER OG : rot 160:sc= 0 USER MOD Single : A 156 SER OG : rot 59:sc= 0.13 USER MOD Single : A 157 THR OG1 : rot 53:sc= 0.0761 USER MOD Single : A 158 THR OG1 : rot 81:sc= 0.00108 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 180:sc= 0 USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 TYR OH : rot 100:sc= 0.126 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=-0.002) USER MOD ----------------------------------------------------------------- ATOM 11 N GLU A 118 -1.086 -13.806 -5.720 1.00 0.00 N ATOM 12 CA GLU A 118 -0.516 -12.530 -6.071 1.00 0.00 C ATOM 13 C GLU A 118 0.676 -12.369 -5.176 1.00 0.00 C ATOM 14 O GLU A 118 0.909 -13.190 -4.292 1.00 0.00 O ATOM 15 CB GLU A 118 -1.490 -11.328 -5.907 1.00 0.00 C ATOM 16 CG GLU A 118 -2.267 -11.264 -4.574 1.00 0.00 C ATOM 17 CD GLU A 118 -3.469 -12.211 -4.583 1.00 0.00 C ATOM 18 OE1 GLU A 118 -4.394 -11.983 -5.407 1.00 0.00 O ATOM 19 OE2 GLU A 118 -3.481 -13.171 -3.768 1.00 0.00 O ATOM 0 HA GLU A 118 -0.262 -12.524 -7.131 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -0.919 -10.406 -6.017 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.211 -11.356 -6.724 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -1.602 -11.525 -3.751 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -2.607 -10.243 -4.398 1.00 0.00 H new ATOM 26 N LYS A 119 1.486 -11.313 -5.416 1.00 0.00 N ATOM 27 CA LYS A 119 2.696 -11.073 -4.672 1.00 0.00 C ATOM 28 C LYS A 119 2.472 -9.925 -3.737 1.00 0.00 C ATOM 29 O LYS A 119 1.553 -9.125 -3.903 1.00 0.00 O ATOM 30 CB LYS A 119 3.919 -10.760 -5.570 1.00 0.00 C ATOM 31 CG LYS A 119 3.774 -9.507 -6.452 1.00 0.00 C ATOM 32 CD LYS A 119 5.017 -9.239 -7.312 1.00 0.00 C ATOM 33 CE LYS A 119 4.888 -7.966 -8.160 1.00 0.00 C ATOM 34 NZ LYS A 119 6.109 -7.738 -8.968 1.00 0.00 N ATOM 0 H LYS A 119 1.299 -10.615 -6.136 1.00 0.00 H new ATOM 0 HA LYS A 119 2.925 -11.992 -4.132 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.796 -10.639 -4.934 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.108 -11.619 -6.214 1.00 0.00 H new ATOM 0 HG2 LYS A 119 2.906 -9.624 -7.102 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.583 -8.642 -5.818 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.890 -9.152 -6.665 1.00 0.00 H new ATOM 0 HD3 LYS A 119 5.190 -10.092 -7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.023 -8.050 -8.818 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.713 -7.109 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.995 -6.871 -9.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 6.929 -7.635 -8.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.261 -8.547 -9.604 1.00 0.00 H new ATOM 48 N CYS A 120 3.353 -9.847 -2.718 1.00 0.00 N ATOM 49 CA CYS A 120 3.467 -8.751 -1.795 1.00 0.00 C ATOM 50 C CYS A 120 4.601 -7.909 -2.304 1.00 0.00 C ATOM 51 O CYS A 120 5.692 -8.416 -2.560 1.00 0.00 O ATOM 52 CB CYS A 120 3.754 -9.212 -0.349 1.00 0.00 C ATOM 53 SG CYS A 120 3.694 -7.865 0.871 1.00 0.00 S ATOM 0 H CYS A 120 4.024 -10.591 -2.527 1.00 0.00 H new ATOM 0 HA CYS A 120 2.525 -8.204 -1.746 1.00 0.00 H new ATOM 0 HB2 CYS A 120 3.029 -9.976 -0.070 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.738 -9.679 -0.314 1.00 0.00 H new ATOM 0 HG CYS A 120 3.403 -8.352 2.041 1.00 0.00 H new ATOM 58 N SER A 121 4.341 -6.596 -2.500 1.00 0.00 N ATOM 59 CA SER A 121 5.284 -5.644 -3.043 1.00 0.00 C ATOM 60 C SER A 121 6.442 -5.371 -2.107 1.00 0.00 C ATOM 61 O SER A 121 7.547 -5.078 -2.562 1.00 0.00 O ATOM 62 CB SER A 121 4.595 -4.302 -3.416 1.00 0.00 C ATOM 63 OG SER A 121 3.884 -3.733 -2.322 1.00 0.00 O ATOM 0 H SER A 121 3.439 -6.178 -2.272 1.00 0.00 H new ATOM 0 HA SER A 121 5.680 -6.106 -3.947 1.00 0.00 H new ATOM 0 HB2 SER A 121 5.348 -3.595 -3.763 1.00 0.00 H new ATOM 0 HB3 SER A 121 3.907 -4.468 -4.245 1.00 0.00 H new ATOM 0 HG SER A 121 3.470 -2.891 -2.604 1.00 0.00 H new ATOM 69 N ARG A 122 6.209 -5.458 -0.774 1.00 0.00 N ATOM 70 CA ARG A 122 7.175 -5.085 0.231 1.00 0.00 C ATOM 71 C ARG A 122 8.139 -6.208 0.474 1.00 0.00 C ATOM 72 O ARG A 122 9.336 -6.062 0.227 1.00 0.00 O ATOM 73 CB ARG A 122 6.481 -4.710 1.563 1.00 0.00 C ATOM 74 CG ARG A 122 7.316 -3.880 2.560 1.00 0.00 C ATOM 75 CD ARG A 122 8.256 -4.698 3.457 1.00 0.00 C ATOM 76 NE ARG A 122 8.977 -3.774 4.397 1.00 0.00 N ATOM 77 CZ ARG A 122 10.135 -3.124 4.067 1.00 0.00 C ATOM 78 NH1 ARG A 122 10.700 -3.260 2.831 1.00 0.00 N ATOM 79 NH2 ARG A 122 10.740 -2.324 4.995 1.00 0.00 N ATOM 0 H ARG A 122 5.328 -5.796 -0.386 1.00 0.00 H new ATOM 0 HA ARG A 122 7.716 -4.214 -0.140 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.573 -4.153 1.331 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.172 -5.630 2.059 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.910 -3.157 2.000 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.637 -3.311 3.195 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.687 -5.437 4.021 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.974 -5.246 2.847 1.00 0.00 H new ATOM 0 HE ARG A 122 8.584 -3.624 5.326 1.00 0.00 H new ATOM 0 HH11 ARG A 122 10.258 -3.856 2.131 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.564 -2.765 2.608 1.00 0.00 H new ATOM 0 HH21 ARG A 122 10.328 -2.217 5.922 1.00 0.00 H new ATOM 0 HH22 ARG A 122 11.604 -1.834 4.761 1.00 0.00 H new ATOM 93 N CYS A 123 7.634 -7.358 0.988 1.00 0.00 N ATOM 94 CA CYS A 123 8.471 -8.382 1.565 1.00 0.00 C ATOM 95 C CYS A 123 8.899 -9.365 0.506 1.00 0.00 C ATOM 96 O CYS A 123 9.965 -9.969 0.619 1.00 0.00 O ATOM 97 CB CYS A 123 7.801 -9.099 2.775 1.00 0.00 C ATOM 98 SG CYS A 123 6.282 -10.048 2.417 1.00 0.00 S ATOM 0 H CYS A 123 6.638 -7.579 1.003 1.00 0.00 H new ATOM 0 HA CYS A 123 9.358 -7.890 1.963 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.531 -9.777 3.217 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.565 -8.348 3.529 1.00 0.00 H new ATOM 0 HG CYS A 123 5.396 -9.263 1.880 1.00 0.00 H new ATOM 103 N GLY A 124 8.088 -9.515 -0.570 1.00 0.00 N ATOM 104 CA GLY A 124 8.464 -10.269 -1.741 1.00 0.00 C ATOM 105 C GLY A 124 7.910 -11.661 -1.701 1.00 0.00 C ATOM 106 O GLY A 124 8.129 -12.434 -2.633 1.00 0.00 O ATOM 0 H GLY A 124 7.155 -9.106 -0.628 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.104 -9.759 -2.634 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.551 -10.311 -1.814 1.00 0.00 H new ATOM 110 N ASP A 125 7.173 -12.016 -0.621 1.00 0.00 N ATOM 111 CA ASP A 125 6.583 -13.324 -0.462 1.00 0.00 C ATOM 112 C ASP A 125 5.241 -13.302 -1.131 1.00 0.00 C ATOM 113 O ASP A 125 4.658 -12.239 -1.335 1.00 0.00 O ATOM 114 CB ASP A 125 6.379 -13.729 1.020 1.00 0.00 C ATOM 115 CG ASP A 125 7.736 -13.801 1.722 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.580 -14.635 1.296 1.00 0.00 O ATOM 117 OD2 ASP A 125 7.947 -13.025 2.693 1.00 0.00 O ATOM 0 H ASP A 125 6.983 -11.384 0.157 1.00 0.00 H new ATOM 0 HA ASP A 125 7.264 -14.051 -0.903 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.737 -13.004 1.521 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.876 -14.694 1.078 1.00 0.00 H new ATOM 122 N SER A 126 4.726 -14.496 -1.502 1.00 0.00 N ATOM 123 CA SER A 126 3.464 -14.629 -2.188 1.00 0.00 C ATOM 124 C SER A 126 2.385 -14.628 -1.142 1.00 0.00 C ATOM 125 O SER A 126 2.374 -15.480 -0.253 1.00 0.00 O ATOM 126 CB SER A 126 3.393 -15.930 -3.029 1.00 0.00 C ATOM 127 OG SER A 126 2.212 -15.997 -3.818 1.00 0.00 O ATOM 0 H SER A 126 5.192 -15.386 -1.324 1.00 0.00 H new ATOM 0 HA SER A 126 3.341 -13.801 -2.886 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.266 -15.988 -3.679 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.433 -16.793 -2.364 1.00 0.00 H new ATOM 0 HG SER A 126 1.854 -15.094 -3.948 1.00 0.00 H new ATOM 133 N VAL A 127 1.464 -13.640 -1.230 1.00 0.00 N ATOM 134 CA VAL A 127 0.362 -13.498 -0.314 1.00 0.00 C ATOM 135 C VAL A 127 -0.859 -14.008 -1.034 1.00 0.00 C ATOM 136 O VAL A 127 -1.018 -13.813 -2.239 1.00 0.00 O ATOM 137 CB VAL A 127 0.207 -12.073 0.213 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.280 -11.085 -0.866 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.709 -12.083 1.449 1.00 0.00 C ATOM 0 H VAL A 127 1.486 -12.923 -1.955 1.00 0.00 H new ATOM 0 HA VAL A 127 0.535 -14.081 0.590 1.00 0.00 H new ATOM 0 HB VAL A 127 1.192 -11.710 0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.371 -10.089 -0.433 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.437 -11.060 -1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.251 -11.407 -1.243 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.821 -11.067 1.827 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.687 -12.478 1.174 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.269 -12.712 2.223 1.00 0.00 H new ATOM 149 N TYR A 128 -1.730 -14.734 -0.301 1.00 0.00 N ATOM 150 CA TYR A 128 -2.925 -15.316 -0.855 1.00 0.00 C ATOM 151 C TYR A 128 -3.930 -15.368 0.256 1.00 0.00 C ATOM 152 O TYR A 128 -5.069 -14.934 0.085 1.00 0.00 O ATOM 153 CB TYR A 128 -2.733 -16.714 -1.524 1.00 0.00 C ATOM 154 CG TYR A 128 -1.772 -17.624 -0.795 1.00 0.00 C ATOM 155 CD1 TYR A 128 -0.391 -17.560 -1.060 1.00 0.00 C ATOM 156 CD2 TYR A 128 -2.236 -18.564 0.141 1.00 0.00 C ATOM 157 CE1 TYR A 128 0.507 -18.392 -0.383 1.00 0.00 C ATOM 158 CE2 TYR A 128 -1.342 -19.398 0.822 1.00 0.00 C ATOM 159 CZ TYR A 128 0.034 -19.310 0.563 1.00 0.00 C ATOM 160 OH TYR A 128 0.938 -20.150 1.252 1.00 0.00 O ATOM 0 H TYR A 128 -1.604 -14.921 0.694 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.260 -14.692 -1.683 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -3.702 -17.208 -1.592 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.376 -16.570 -2.544 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -0.020 -16.860 -1.795 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -3.295 -18.644 0.337 1.00 0.00 H new ATOM 0 HE1 TYR A 128 1.565 -18.326 -0.590 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -1.711 -20.109 1.546 1.00 0.00 H new ATOM 0 HH TYR A 128 0.443 -20.725 1.872 1.00 0.00 H new ATOM 170 N ALA A 129 -3.525 -15.899 1.429 1.00 0.00 N ATOM 171 CA ALA A 129 -4.393 -16.002 2.568 1.00 0.00 C ATOM 172 C ALA A 129 -3.504 -16.104 3.769 1.00 0.00 C ATOM 173 O ALA A 129 -3.656 -17.004 4.594 1.00 0.00 O ATOM 174 CB ALA A 129 -5.315 -17.239 2.511 1.00 0.00 C ATOM 0 H ALA A 129 -2.585 -16.261 1.589 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.049 -15.132 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.947 -17.263 3.399 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -5.941 -17.185 1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -4.708 -18.144 2.474 1.00 0.00 H new ATOM 180 N ALA A 130 -2.547 -15.153 3.897 1.00 0.00 N ATOM 181 CA ALA A 130 -1.659 -15.067 5.030 1.00 0.00 C ATOM 182 C ALA A 130 -2.275 -14.072 5.974 1.00 0.00 C ATOM 183 O ALA A 130 -3.213 -14.408 6.697 1.00 0.00 O ATOM 184 CB ALA A 130 -0.227 -14.651 4.636 1.00 0.00 C ATOM 0 H ALA A 130 -2.387 -14.428 3.198 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.550 -16.047 5.495 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.396 -14.603 5.529 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.187 -15.384 3.943 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.251 -13.672 4.157 1.00 0.00 H new ATOM 190 N GLU A 131 -1.766 -12.818 5.976 1.00 0.00 N ATOM 191 CA GLU A 131 -2.290 -11.739 6.777 1.00 0.00 C ATOM 192 C GLU A 131 -2.744 -10.699 5.795 1.00 0.00 C ATOM 193 O GLU A 131 -2.451 -9.515 5.960 1.00 0.00 O ATOM 194 CB GLU A 131 -1.238 -11.089 7.720 1.00 0.00 C ATOM 195 CG GLU A 131 -0.678 -12.011 8.824 1.00 0.00 C ATOM 196 CD GLU A 131 0.328 -13.022 8.269 1.00 0.00 C ATOM 197 OE1 GLU A 131 1.339 -12.580 7.660 1.00 0.00 O ATOM 198 OE2 GLU A 131 0.098 -14.248 8.448 1.00 0.00 O ATOM 0 H GLU A 131 -0.967 -12.545 5.404 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.078 -12.127 7.422 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -0.406 -10.729 7.115 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -1.689 -10.217 8.193 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -0.198 -11.406 9.593 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -1.500 -12.543 9.304 1.00 0.00 H new ATOM 205 N LYS A 132 -3.475 -11.114 4.727 1.00 0.00 N ATOM 206 CA LYS A 132 -3.776 -10.214 3.642 1.00 0.00 C ATOM 207 C LYS A 132 -4.944 -9.344 4.025 1.00 0.00 C ATOM 208 O LYS A 132 -5.969 -9.828 4.503 1.00 0.00 O ATOM 209 CB LYS A 132 -4.076 -10.900 2.298 1.00 0.00 C ATOM 210 CG LYS A 132 -3.886 -9.936 1.112 1.00 0.00 C ATOM 211 CD LYS A 132 -4.821 -10.217 -0.063 1.00 0.00 C ATOM 212 CE LYS A 132 -4.560 -11.550 -0.768 1.00 0.00 C ATOM 213 NZ LYS A 132 -5.559 -11.774 -1.838 1.00 0.00 N ATOM 0 H LYS A 132 -3.850 -12.056 4.618 1.00 0.00 H new ATOM 0 HA LYS A 132 -2.870 -9.628 3.483 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.420 -11.762 2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.099 -11.276 2.301 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -4.046 -8.914 1.456 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -2.854 -9.998 0.767 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -5.850 -10.204 0.295 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -4.726 -9.410 -0.789 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -3.556 -11.553 -1.193 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -4.603 -12.365 -0.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -5.167 -12.424 -2.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -6.420 -12.189 -1.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -5.793 -10.867 -2.290 1.00 0.00 H new ATOM 227 N VAL A 133 -4.777 -8.024 3.807 1.00 0.00 N ATOM 228 CA VAL A 133 -5.784 -7.018 3.975 1.00 0.00 C ATOM 229 C VAL A 133 -5.703 -6.206 2.717 1.00 0.00 C ATOM 230 O VAL A 133 -4.657 -6.143 2.069 1.00 0.00 O ATOM 231 CB VAL A 133 -5.580 -6.123 5.195 1.00 0.00 C ATOM 232 CG1 VAL A 133 -5.965 -6.924 6.454 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.127 -5.603 5.275 1.00 0.00 C ATOM 0 H VAL A 133 -3.886 -7.637 3.495 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.755 -7.483 4.146 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.217 -5.242 5.115 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.826 -6.301 7.338 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.009 -7.229 6.386 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.332 -7.808 6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -4.015 -4.969 6.155 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.442 -6.448 5.347 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.898 -5.025 4.380 1.00 0.00 H new ATOM 243 N ILE A 134 -6.835 -5.576 2.337 1.00 0.00 N ATOM 244 CA ILE A 134 -6.917 -4.717 1.183 1.00 0.00 C ATOM 245 C ILE A 134 -7.105 -3.347 1.763 1.00 0.00 C ATOM 246 O ILE A 134 -7.874 -3.162 2.706 1.00 0.00 O ATOM 247 CB ILE A 134 -8.068 -5.077 0.246 1.00 0.00 C ATOM 248 CG1 ILE A 134 -7.975 -6.556 -0.225 1.00 0.00 C ATOM 249 CG2 ILE A 134 -8.121 -4.103 -0.952 1.00 0.00 C ATOM 250 CD1 ILE A 134 -6.715 -6.913 -1.021 1.00 0.00 C ATOM 0 H ILE A 134 -7.716 -5.664 2.843 1.00 0.00 H new ATOM 0 HA ILE A 134 -6.026 -4.806 0.561 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.000 -4.975 0.802 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -8.027 -7.203 0.651 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -8.848 -6.780 -0.838 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.948 -4.377 -1.607 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.268 -3.086 -0.588 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.185 -4.158 -1.507 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -6.748 -7.966 -1.302 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -6.667 -6.299 -1.920 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -5.833 -6.728 -0.408 1.00 0.00 H new ATOM 262 N GLY A 135 -6.376 -2.353 1.205 1.00 0.00 N ATOM 263 CA GLY A 135 -6.432 -0.985 1.640 1.00 0.00 C ATOM 264 C GLY A 135 -7.400 -0.293 0.746 1.00 0.00 C ATOM 265 O GLY A 135 -8.554 -0.076 1.114 1.00 0.00 O ATOM 0 H GLY A 135 -5.731 -2.507 0.430 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.752 -0.922 2.680 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.448 -0.519 1.580 1.00 0.00 H new ATOM 269 N ALA A 136 -6.930 0.053 -0.471 1.00 0.00 N ATOM 270 CA ALA A 136 -7.740 0.643 -1.499 1.00 0.00 C ATOM 271 C ALA A 136 -8.052 -0.452 -2.476 1.00 0.00 C ATOM 272 O ALA A 136 -9.214 -0.814 -2.656 1.00 0.00 O ATOM 273 CB ALA A 136 -7.019 1.791 -2.221 1.00 0.00 C ATOM 0 H ALA A 136 -5.958 -0.082 -0.748 1.00 0.00 H new ATOM 0 HA ALA A 136 -8.640 1.072 -1.057 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.672 2.205 -2.989 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.765 2.570 -1.502 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.107 1.414 -2.684 1.00 0.00 H new ATOM 279 N GLY A 137 -7.008 -1.024 -3.117 1.00 0.00 N ATOM 280 CA GLY A 137 -7.209 -2.096 -4.051 1.00 0.00 C ATOM 281 C GLY A 137 -5.877 -2.659 -4.423 1.00 0.00 C ATOM 282 O GLY A 137 -5.561 -2.773 -5.606 1.00 0.00 O ATOM 0 H GLY A 137 -6.035 -0.747 -2.990 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.837 -2.870 -3.609 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.727 -1.733 -4.938 1.00 0.00 H new ATOM 286 N LYS A 138 -5.069 -3.043 -3.406 1.00 0.00 N ATOM 287 CA LYS A 138 -3.802 -3.705 -3.610 1.00 0.00 C ATOM 288 C LYS A 138 -3.677 -4.732 -2.511 1.00 0.00 C ATOM 289 O LYS A 138 -4.251 -4.529 -1.440 1.00 0.00 O ATOM 290 CB LYS A 138 -2.586 -2.751 -3.506 1.00 0.00 C ATOM 291 CG LYS A 138 -2.362 -1.890 -4.759 1.00 0.00 C ATOM 292 CD LYS A 138 -1.089 -1.035 -4.667 1.00 0.00 C ATOM 293 CE LYS A 138 -0.715 -0.368 -5.996 1.00 0.00 C ATOM 294 NZ LYS A 138 0.518 0.439 -5.854 1.00 0.00 N ATOM 0 H LYS A 138 -5.298 -2.892 -2.424 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.792 -4.128 -4.615 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.723 -2.095 -2.646 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.689 -3.341 -3.317 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -2.298 -2.537 -5.634 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.223 -1.238 -4.907 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -1.229 -0.265 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -0.261 -1.662 -4.336 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.569 -1.130 -6.762 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -1.534 0.268 -6.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 0.316 1.429 -6.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 0.854 0.390 -4.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 1.252 0.066 -6.490 1.00 0.00 H new ATOM 308 N PRO A 139 -2.952 -5.840 -2.700 1.00 0.00 N ATOM 309 CA PRO A 139 -2.661 -6.799 -1.647 1.00 0.00 C ATOM 310 C PRO A 139 -1.614 -6.237 -0.717 1.00 0.00 C ATOM 311 O PRO A 139 -0.689 -5.570 -1.179 1.00 0.00 O ATOM 312 CB PRO A 139 -2.118 -8.025 -2.394 1.00 0.00 C ATOM 313 CG PRO A 139 -1.495 -7.456 -3.673 1.00 0.00 C ATOM 314 CD PRO A 139 -2.398 -6.263 -3.989 1.00 0.00 C ATOM 0 HA PRO A 139 -3.531 -7.039 -1.036 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -1.378 -8.558 -1.796 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -2.914 -8.734 -2.622 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -0.460 -7.150 -3.517 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -1.493 -8.187 -4.482 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -1.834 -5.457 -4.457 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -3.190 -6.543 -4.684 1.00 0.00 H new ATOM 322 N TRP A 140 -1.779 -6.473 0.601 1.00 0.00 N ATOM 323 CA TRP A 140 -0.906 -5.936 1.611 1.00 0.00 C ATOM 324 C TRP A 140 -0.912 -6.925 2.734 1.00 0.00 C ATOM 325 O TRP A 140 -1.962 -7.458 3.073 1.00 0.00 O ATOM 326 CB TRP A 140 -1.385 -4.600 2.240 1.00 0.00 C ATOM 327 CG TRP A 140 -1.740 -3.475 1.290 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.976 -2.935 1.083 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.821 -2.701 0.498 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.899 -1.872 0.216 1.00 0.00 N ATOM 331 CE2 TRP A 140 -1.581 -1.703 -0.149 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.555 -2.789 0.313 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -0.972 -0.770 -0.980 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.169 -1.841 -0.519 1.00 0.00 C ATOM 335 CH2 TRP A 140 0.417 -0.839 -1.147 1.00 0.00 C ATOM 0 H TRP A 140 -2.534 -7.048 0.975 1.00 0.00 H new ATOM 0 HA TRP A 140 0.058 -5.754 1.135 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.260 -4.811 2.855 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.603 -4.242 2.910 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.888 -3.293 1.537 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -3.684 -1.304 -0.103 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.133 -3.564 0.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -1.554 -0.012 -1.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.236 -1.884 -0.678 1.00 0.00 H new ATOM 0 HH2 TRP A 140 0.915 -0.110 -1.768 1.00 0.00 H new ATOM 346 N HIS A 141 0.259 -7.161 3.373 1.00 0.00 N ATOM 347 CA HIS A 141 0.319 -7.710 4.711 1.00 0.00 C ATOM 348 C HIS A 141 0.153 -6.515 5.599 1.00 0.00 C ATOM 349 O HIS A 141 0.392 -5.387 5.176 1.00 0.00 O ATOM 350 CB HIS A 141 1.616 -8.436 5.135 1.00 0.00 C ATOM 351 CG HIS A 141 1.887 -9.714 4.398 1.00 0.00 C ATOM 352 ND1 HIS A 141 2.968 -9.919 3.575 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.233 -10.894 4.503 1.00 0.00 C ATOM 354 CE1 HIS A 141 2.955 -11.192 3.198 1.00 0.00 C ATOM 355 NE2 HIS A 141 1.916 -11.803 3.746 1.00 0.00 N ATOM 0 H HIS A 141 1.173 -6.971 2.962 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.439 -8.491 4.774 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.459 -7.761 4.987 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.564 -8.652 6.202 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.338 -11.082 5.078 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.679 -11.657 2.546 1.00 0.00 H new ATOM 0 HE2 HIS A 141 1.668 -12.785 3.624 1.00 0.00 H new ATOM 363 N LYS A 142 -0.337 -6.723 6.840 1.00 0.00 N ATOM 364 CA LYS A 142 -0.660 -5.645 7.746 1.00 0.00 C ATOM 365 C LYS A 142 0.549 -4.864 8.199 1.00 0.00 C ATOM 366 O LYS A 142 0.443 -3.704 8.587 1.00 0.00 O ATOM 367 CB LYS A 142 -1.393 -6.157 9.008 1.00 0.00 C ATOM 368 CG LYS A 142 -2.650 -6.984 8.695 1.00 0.00 C ATOM 369 CD LYS A 142 -3.300 -7.580 9.953 1.00 0.00 C ATOM 370 CE LYS A 142 -4.492 -8.489 9.631 1.00 0.00 C ATOM 371 NZ LYS A 142 -5.057 -9.084 10.864 1.00 0.00 N ATOM 0 H LYS A 142 -0.513 -7.651 7.224 1.00 0.00 H new ATOM 0 HA LYS A 142 -1.309 -4.986 7.170 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -0.705 -6.765 9.596 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -1.674 -5.304 9.626 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -3.375 -6.353 8.181 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -2.387 -7.791 8.011 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -2.554 -8.149 10.507 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.631 -6.771 10.604 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -5.262 -7.915 9.115 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -4.176 -9.282 8.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -5.862 -9.694 10.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -4.327 -9.650 11.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -5.379 -8.326 11.499 1.00 0.00 H new ATOM 385 N ASN A 143 1.730 -5.500 8.117 1.00 0.00 N ATOM 386 CA ASN A 143 3.017 -4.922 8.425 1.00 0.00 C ATOM 387 C ASN A 143 3.551 -4.257 7.176 1.00 0.00 C ATOM 388 O ASN A 143 4.203 -3.217 7.242 1.00 0.00 O ATOM 389 CB ASN A 143 4.013 -6.015 8.898 1.00 0.00 C ATOM 390 CG ASN A 143 5.318 -5.400 9.432 1.00 0.00 C ATOM 391 OD1 ASN A 143 5.307 -4.698 10.451 1.00 0.00 O ATOM 392 ND2 ASN A 143 6.451 -5.672 8.716 1.00 0.00 N ATOM 0 H ASN A 143 1.799 -6.473 7.820 1.00 0.00 H new ATOM 0 HA ASN A 143 2.904 -4.195 9.229 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.549 -6.618 9.678 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.239 -6.686 8.069 1.00 0.00 H new ATOM 0 HD21 ASN A 143 7.348 -5.289 9.015 1.00 0.00 H new ATOM 0 HD22 ASN A 143 6.399 -6.258 7.883 1.00 0.00 H new ATOM 399 N CYS A 144 3.266 -4.870 6.005 1.00 0.00 N ATOM 400 CA CYS A 144 3.729 -4.462 4.700 1.00 0.00 C ATOM 401 C CYS A 144 2.749 -3.510 4.047 1.00 0.00 C ATOM 402 O CYS A 144 2.594 -3.533 2.828 1.00 0.00 O ATOM 403 CB CYS A 144 3.814 -5.678 3.746 1.00 0.00 C ATOM 404 SG CYS A 144 4.927 -7.018 4.271 1.00 0.00 S ATOM 0 H CYS A 144 2.676 -5.701 5.965 1.00 0.00 H new ATOM 0 HA CYS A 144 4.701 -3.994 4.853 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.812 -6.090 3.623 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.137 -5.326 2.766 1.00 0.00 H new ATOM 0 HG CYS A 144 4.338 -8.164 4.099 1.00 0.00 H new ATOM 409 N PHE A 145 2.036 -2.668 4.831 1.00 0.00 N ATOM 410 CA PHE A 145 0.939 -1.861 4.358 1.00 0.00 C ATOM 411 C PHE A 145 1.525 -0.542 3.911 1.00 0.00 C ATOM 412 O PHE A 145 1.489 0.445 4.641 1.00 0.00 O ATOM 413 CB PHE A 145 -0.079 -1.688 5.518 1.00 0.00 C ATOM 414 CG PHE A 145 -1.463 -1.314 5.067 1.00 0.00 C ATOM 415 CD1 PHE A 145 -2.412 -2.314 4.791 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.860 0.030 5.008 1.00 0.00 C ATOM 417 CE1 PHE A 145 -3.733 -1.976 4.469 1.00 0.00 C ATOM 418 CE2 PHE A 145 -3.185 0.370 4.710 1.00 0.00 C ATOM 419 CZ PHE A 145 -4.120 -0.633 4.436 1.00 0.00 C ATOM 0 H PHE A 145 2.228 -2.544 5.825 1.00 0.00 H new ATOM 0 HA PHE A 145 0.409 -2.317 3.521 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -0.131 -2.618 6.083 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.289 -0.921 6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -2.120 -3.353 4.828 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.137 0.810 5.194 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -4.451 -2.752 4.247 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.485 1.407 4.692 1.00 0.00 H new ATOM 0 HZ PHE A 145 -5.140 -0.370 4.199 1.00 0.00 H new ATOM 429 N ARG A 146 2.120 -0.513 2.693 1.00 0.00 N ATOM 430 CA ARG A 146 2.966 0.575 2.260 1.00 0.00 C ATOM 431 C ARG A 146 2.154 1.715 1.732 1.00 0.00 C ATOM 432 O ARG A 146 0.960 1.603 1.477 1.00 0.00 O ATOM 433 CB ARG A 146 3.941 0.217 1.106 1.00 0.00 C ATOM 434 CG ARG A 146 4.832 -1.009 1.336 1.00 0.00 C ATOM 435 CD ARG A 146 5.594 -1.413 0.064 1.00 0.00 C ATOM 436 NE ARG A 146 6.514 -0.313 -0.370 1.00 0.00 N ATOM 437 CZ ARG A 146 7.339 -0.452 -1.453 1.00 0.00 C ATOM 438 NH1 ARG A 146 7.355 -1.609 -2.178 1.00 0.00 N ATOM 439 NH2 ARG A 146 8.157 0.578 -1.815 1.00 0.00 N ATOM 0 H ARG A 146 2.013 -1.253 1.999 1.00 0.00 H new ATOM 0 HA ARG A 146 3.530 0.825 3.158 1.00 0.00 H new ATOM 0 HB2 ARG A 146 3.356 0.052 0.201 1.00 0.00 H new ATOM 0 HB3 ARG A 146 4.583 1.078 0.919 1.00 0.00 H new ATOM 0 HG2 ARG A 146 5.544 -0.795 2.133 1.00 0.00 H new ATOM 0 HG3 ARG A 146 4.219 -1.845 1.672 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.167 -2.322 0.250 1.00 0.00 H new ATOM 0 HD3 ARG A 146 4.887 -1.639 -0.734 1.00 0.00 H new ATOM 0 HE ARG A 146 6.526 0.561 0.155 1.00 0.00 H new ATOM 0 HH11 ARG A 146 6.747 -2.384 -1.915 1.00 0.00 H new ATOM 0 HH12 ARG A 146 7.975 -1.698 -2.983 1.00 0.00 H new ATOM 0 HH21 ARG A 146 8.152 1.446 -1.279 1.00 0.00 H new ATOM 0 HH22 ARG A 146 8.774 0.480 -2.621 1.00 0.00 H new ATOM 453 N CYS A 147 2.858 2.839 1.509 1.00 0.00 N ATOM 454 CA CYS A 147 2.439 3.962 0.725 1.00 0.00 C ATOM 455 C CYS A 147 2.739 3.593 -0.702 1.00 0.00 C ATOM 456 O CYS A 147 3.749 2.951 -0.982 1.00 0.00 O ATOM 457 CB CYS A 147 3.236 5.219 1.114 1.00 0.00 C ATOM 458 SG CYS A 147 2.677 6.692 0.233 1.00 0.00 S ATOM 0 H CYS A 147 3.788 2.973 1.906 1.00 0.00 H new ATOM 0 HA CYS A 147 1.383 4.184 0.880 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.145 5.385 2.187 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.293 5.054 0.905 1.00 0.00 H new ATOM 0 HG CYS A 147 2.893 7.744 0.966 1.00 0.00 H new ATOM 463 N ALA A 148 1.835 3.960 -1.634 1.00 0.00 N ATOM 464 CA ALA A 148 1.955 3.554 -3.012 1.00 0.00 C ATOM 465 C ALA A 148 2.768 4.551 -3.798 1.00 0.00 C ATOM 466 O ALA A 148 3.341 4.196 -4.826 1.00 0.00 O ATOM 467 CB ALA A 148 0.586 3.386 -3.688 1.00 0.00 C ATOM 0 H ALA A 148 1.019 4.539 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 148 2.459 2.588 -3.006 1.00 0.00 H new ATOM 0 HB1 ALA A 148 0.727 3.080 -4.724 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.010 2.626 -3.160 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.048 4.333 -3.660 1.00 0.00 H new ATOM 473 N LYS A 149 2.847 5.823 -3.327 1.00 0.00 N ATOM 474 CA LYS A 149 3.534 6.884 -4.032 1.00 0.00 C ATOM 475 C LYS A 149 4.966 6.903 -3.587 1.00 0.00 C ATOM 476 O LYS A 149 5.863 6.696 -4.403 1.00 0.00 O ATOM 477 CB LYS A 149 2.885 8.277 -3.815 1.00 0.00 C ATOM 478 CG LYS A 149 3.233 9.350 -4.873 1.00 0.00 C ATOM 479 CD LYS A 149 4.591 10.059 -4.731 1.00 0.00 C ATOM 480 CE LYS A 149 4.693 10.932 -3.475 1.00 0.00 C ATOM 481 NZ LYS A 149 6.016 11.594 -3.387 1.00 0.00 N ATOM 0 H LYS A 149 2.429 6.120 -2.445 1.00 0.00 H new ATOM 0 HA LYS A 149 3.462 6.679 -5.100 1.00 0.00 H new ATOM 0 HB2 LYS A 149 1.802 8.154 -3.792 1.00 0.00 H new ATOM 0 HB3 LYS A 149 3.185 8.649 -2.835 1.00 0.00 H new ATOM 0 HG2 LYS A 149 3.198 8.880 -5.856 1.00 0.00 H new ATOM 0 HG3 LYS A 149 2.451 10.109 -4.855 1.00 0.00 H new ATOM 0 HD2 LYS A 149 5.383 9.310 -4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 149 4.763 10.679 -5.611 1.00 0.00 H new ATOM 0 HE2 LYS A 149 3.906 11.686 -3.489 1.00 0.00 H new ATOM 0 HE3 LYS A 149 4.531 10.319 -2.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 6.056 12.178 -2.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 6.764 10.872 -3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 6.158 12.197 -4.222 1.00 0.00 H new ATOM 495 N CYS A 150 5.217 7.154 -2.277 1.00 0.00 N ATOM 496 CA CYS A 150 6.548 7.455 -1.800 1.00 0.00 C ATOM 497 C CYS A 150 7.240 6.200 -1.328 1.00 0.00 C ATOM 498 O CYS A 150 8.468 6.160 -1.265 1.00 0.00 O ATOM 499 CB CYS A 150 6.575 8.583 -0.724 1.00 0.00 C ATOM 500 SG CYS A 150 6.011 8.163 0.960 1.00 0.00 S ATOM 0 H CYS A 150 4.501 7.149 -1.550 1.00 0.00 H new ATOM 0 HA CYS A 150 7.107 7.853 -2.647 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.598 8.954 -0.652 1.00 0.00 H new ATOM 0 HB3 CYS A 150 5.962 9.408 -1.087 1.00 0.00 H new ATOM 0 HG CYS A 150 4.829 7.625 0.900 1.00 0.00 H new ATOM 505 N GLY A 151 6.465 5.125 -1.036 1.00 0.00 N ATOM 506 CA GLY A 151 7.013 3.803 -0.846 1.00 0.00 C ATOM 507 C GLY A 151 7.433 3.512 0.563 1.00 0.00 C ATOM 508 O GLY A 151 8.082 2.495 0.802 1.00 0.00 O ATOM 0 H GLY A 151 5.452 5.173 -0.931 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.271 3.066 -1.152 1.00 0.00 H new ATOM 0 HA3 GLY A 151 7.874 3.680 -1.503 1.00 0.00 H new ATOM 512 N LYS A 152 7.077 4.384 1.540 1.00 0.00 N ATOM 513 CA LYS A 152 7.373 4.145 2.937 1.00 0.00 C ATOM 514 C LYS A 152 6.476 3.050 3.443 1.00 0.00 C ATOM 515 O LYS A 152 5.276 3.071 3.186 1.00 0.00 O ATOM 516 CB LYS A 152 7.132 5.385 3.829 1.00 0.00 C ATOM 517 CG LYS A 152 8.130 6.524 3.568 1.00 0.00 C ATOM 518 CD LYS A 152 7.801 7.824 4.325 1.00 0.00 C ATOM 519 CE LYS A 152 7.821 7.714 5.859 1.00 0.00 C ATOM 520 NZ LYS A 152 9.154 7.304 6.357 1.00 0.00 N ATOM 0 H LYS A 152 6.582 5.258 1.363 1.00 0.00 H new ATOM 0 HA LYS A 152 8.429 3.882 2.994 1.00 0.00 H new ATOM 0 HB2 LYS A 152 6.120 5.753 3.662 1.00 0.00 H new ATOM 0 HB3 LYS A 152 7.195 5.089 4.876 1.00 0.00 H new ATOM 0 HG2 LYS A 152 9.129 6.192 3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.156 6.734 2.499 1.00 0.00 H new ATOM 0 HD2 LYS A 152 8.514 8.591 4.023 1.00 0.00 H new ATOM 0 HD3 LYS A 152 6.814 8.166 4.014 1.00 0.00 H new ATOM 0 HE2 LYS A 152 7.547 8.674 6.297 1.00 0.00 H new ATOM 0 HE3 LYS A 152 7.072 6.991 6.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 9.147 7.289 7.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 9.382 6.355 5.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 9.871 7.980 6.026 1.00 0.00 H new ATOM 534 N SER A 153 7.052 2.059 4.166 1.00 0.00 N ATOM 535 CA SER A 153 6.309 0.941 4.700 1.00 0.00 C ATOM 536 C SER A 153 5.731 1.355 6.023 1.00 0.00 C ATOM 537 O SER A 153 6.427 1.913 6.871 1.00 0.00 O ATOM 538 CB SER A 153 7.142 -0.362 4.841 1.00 0.00 C ATOM 539 OG SER A 153 8.333 -0.167 5.595 1.00 0.00 O ATOM 0 H SER A 153 8.048 2.032 4.384 1.00 0.00 H new ATOM 0 HA SER A 153 5.522 0.692 3.988 1.00 0.00 H new ATOM 0 HB2 SER A 153 6.533 -1.129 5.321 1.00 0.00 H new ATOM 0 HB3 SER A 153 7.400 -0.734 3.849 1.00 0.00 H new ATOM 0 HG SER A 153 8.653 -1.031 5.930 1.00 0.00 H new ATOM 545 N LEU A 154 4.408 1.124 6.185 1.00 0.00 N ATOM 546 CA LEU A 154 3.641 1.630 7.295 1.00 0.00 C ATOM 547 C LEU A 154 2.919 0.443 7.861 1.00 0.00 C ATOM 548 O LEU A 154 2.805 -0.592 7.205 1.00 0.00 O ATOM 549 CB LEU A 154 2.619 2.715 6.863 1.00 0.00 C ATOM 550 CG LEU A 154 3.232 3.842 5.989 1.00 0.00 C ATOM 551 CD1 LEU A 154 2.150 4.639 5.247 1.00 0.00 C ATOM 552 CD2 LEU A 154 4.165 4.784 6.773 1.00 0.00 C ATOM 0 H LEU A 154 3.857 0.572 5.528 1.00 0.00 H new ATOM 0 HA LEU A 154 4.298 2.109 8.021 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.810 2.239 6.310 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.177 3.160 7.755 1.00 0.00 H new ATOM 0 HG LEU A 154 3.852 3.334 5.250 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.620 5.418 4.647 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.587 3.970 4.597 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.474 5.096 5.970 1.00 0.00 H new ATOM 0 HD21 LEU A 154 4.558 5.548 6.102 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.607 5.261 7.578 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.991 4.211 7.194 1.00 0.00 H new ATOM 564 N GLU A 155 2.436 0.563 9.120 1.00 0.00 N ATOM 565 CA GLU A 155 1.813 -0.526 9.830 1.00 0.00 C ATOM 566 C GLU A 155 0.348 -0.204 9.911 1.00 0.00 C ATOM 567 O GLU A 155 -0.067 0.652 10.691 1.00 0.00 O ATOM 568 CB GLU A 155 2.427 -0.723 11.241 1.00 0.00 C ATOM 569 CG GLU A 155 2.293 -2.141 11.835 1.00 0.00 C ATOM 570 CD GLU A 155 0.846 -2.508 12.157 1.00 0.00 C ATOM 571 OE1 GLU A 155 0.199 -1.758 12.936 1.00 0.00 O ATOM 572 OE2 GLU A 155 0.373 -3.555 11.639 1.00 0.00 O ATOM 0 H GLU A 155 2.479 1.431 9.655 1.00 0.00 H new ATOM 0 HA GLU A 155 1.977 -1.467 9.304 1.00 0.00 H new ATOM 0 HB2 GLU A 155 3.485 -0.466 11.196 1.00 0.00 H new ATOM 0 HB3 GLU A 155 1.956 -0.016 11.924 1.00 0.00 H new ATOM 0 HG2 GLU A 155 2.700 -2.866 11.130 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.892 -2.209 12.743 1.00 0.00 H new ATOM 579 N SER A 156 -0.461 -0.894 9.068 1.00 0.00 N ATOM 580 CA SER A 156 -1.901 -0.786 8.966 1.00 0.00 C ATOM 581 C SER A 156 -2.316 0.590 8.507 1.00 0.00 C ATOM 582 O SER A 156 -1.540 1.288 7.853 1.00 0.00 O ATOM 583 CB SER A 156 -2.677 -1.241 10.230 1.00 0.00 C ATOM 584 OG SER A 156 -2.322 -2.572 10.579 1.00 0.00 O ATOM 0 H SER A 156 -0.082 -1.576 8.411 1.00 0.00 H new ATOM 0 HA SER A 156 -2.191 -1.504 8.199 1.00 0.00 H new ATOM 0 HB2 SER A 156 -2.457 -0.570 11.060 1.00 0.00 H new ATOM 0 HB3 SER A 156 -3.750 -1.180 10.047 1.00 0.00 H new ATOM 0 HG SER A 156 -1.358 -2.620 10.749 1.00 0.00 H new ATOM 590 N THR A 157 -3.568 0.998 8.827 1.00 0.00 N ATOM 591 CA THR A 157 -4.154 2.245 8.395 1.00 0.00 C ATOM 592 C THR A 157 -3.774 3.339 9.364 1.00 0.00 C ATOM 593 O THR A 157 -4.533 3.707 10.261 1.00 0.00 O ATOM 594 CB THR A 157 -5.665 2.171 8.206 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.322 1.582 9.326 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.975 1.347 6.939 1.00 0.00 C ATOM 0 H THR A 157 -4.195 0.441 9.407 1.00 0.00 H new ATOM 0 HA THR A 157 -3.751 2.472 7.408 1.00 0.00 H new ATOM 0 HB THR A 157 -6.039 3.190 8.106 1.00 0.00 H new ATOM 0 HG1 THR A 157 -6.047 2.043 10.146 1.00 0.00 H new ATOM 0 HG21 THR A 157 -7.054 1.290 6.797 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.520 1.827 6.072 1.00 0.00 H new ATOM 0 HG23 THR A 157 -5.570 0.341 7.051 1.00 0.00 H new ATOM 604 N THR A 158 -2.558 3.891 9.163 1.00 0.00 N ATOM 605 CA THR A 158 -2.044 5.056 9.844 1.00 0.00 C ATOM 606 C THR A 158 -2.318 6.217 8.940 1.00 0.00 C ATOM 607 O THR A 158 -2.659 7.321 9.366 1.00 0.00 O ATOM 608 CB THR A 158 -0.549 4.942 10.113 1.00 0.00 C ATOM 609 OG1 THR A 158 -0.289 3.767 10.871 1.00 0.00 O ATOM 610 CG2 THR A 158 -0.032 6.168 10.897 1.00 0.00 C ATOM 0 H THR A 158 -1.895 3.507 8.490 1.00 0.00 H new ATOM 0 HA THR A 158 -2.523 5.171 10.817 1.00 0.00 H new ATOM 0 HB THR A 158 -0.034 4.895 9.154 1.00 0.00 H new ATOM 0 HG1 THR A 158 -0.271 2.990 10.274 1.00 0.00 H new ATOM 0 HG21 THR A 158 1.038 6.061 11.076 1.00 0.00 H new ATOM 0 HG22 THR A 158 -0.214 7.073 10.318 1.00 0.00 H new ATOM 0 HG23 THR A 158 -0.554 6.236 11.851 1.00 0.00 H new ATOM 618 N LEU A 159 -2.175 5.927 7.642 1.00 0.00 N ATOM 619 CA LEU A 159 -2.269 6.834 6.541 1.00 0.00 C ATOM 620 C LEU A 159 -3.686 6.971 6.069 1.00 0.00 C ATOM 621 O LEU A 159 -4.587 6.274 6.535 1.00 0.00 O ATOM 622 CB LEU A 159 -1.381 6.389 5.354 1.00 0.00 C ATOM 623 CG LEU A 159 -1.760 5.087 4.593 1.00 0.00 C ATOM 624 CD1 LEU A 159 -1.001 5.020 3.254 1.00 0.00 C ATOM 625 CD2 LEU A 159 -1.542 3.789 5.394 1.00 0.00 C ATOM 0 H LEU A 159 -1.976 4.975 7.333 1.00 0.00 H new ATOM 0 HA LEU A 159 -1.914 7.799 6.903 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.363 7.203 4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -0.363 6.271 5.727 1.00 0.00 H new ATOM 0 HG LEU A 159 -2.835 5.147 4.421 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.272 4.105 2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.265 5.883 2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 159 0.072 5.025 3.444 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -1.833 2.933 4.785 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.490 3.701 5.665 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.149 3.814 6.299 1.00 0.00 H new ATOM 637 N THR A 160 -3.888 7.900 5.105 1.00 0.00 N ATOM 638 CA THR A 160 -5.148 8.141 4.452 1.00 0.00 C ATOM 639 C THR A 160 -5.178 7.260 3.224 1.00 0.00 C ATOM 640 O THR A 160 -4.142 6.903 2.661 1.00 0.00 O ATOM 641 CB THR A 160 -5.359 9.620 4.127 1.00 0.00 C ATOM 642 OG1 THR A 160 -6.662 9.881 3.616 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.283 10.170 3.166 1.00 0.00 C ATOM 0 H THR A 160 -3.142 8.508 4.767 1.00 0.00 H new ATOM 0 HA THR A 160 -5.978 7.890 5.113 1.00 0.00 H new ATOM 0 HB THR A 160 -5.260 10.148 5.076 1.00 0.00 H new ATOM 0 HG1 THR A 160 -6.753 10.838 3.424 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.478 11.224 2.967 1.00 0.00 H new ATOM 0 HG22 THR A 160 -3.299 10.063 3.622 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.312 9.612 2.230 1.00 0.00 H new ATOM 651 N GLU A 161 -6.399 6.858 2.813 1.00 0.00 N ATOM 652 CA GLU A 161 -6.609 5.950 1.719 1.00 0.00 C ATOM 653 C GLU A 161 -7.357 6.719 0.675 1.00 0.00 C ATOM 654 O GLU A 161 -8.370 7.349 0.979 1.00 0.00 O ATOM 655 CB GLU A 161 -7.442 4.716 2.139 1.00 0.00 C ATOM 656 CG GLU A 161 -6.804 3.962 3.322 1.00 0.00 C ATOM 657 CD GLU A 161 -7.602 2.701 3.639 1.00 0.00 C ATOM 658 OE1 GLU A 161 -8.821 2.825 3.935 1.00 0.00 O ATOM 659 OE2 GLU A 161 -7.001 1.594 3.598 1.00 0.00 O ATOM 0 H GLU A 161 -7.264 7.172 3.253 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.651 5.576 1.359 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.448 5.034 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -7.541 4.040 1.290 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -5.774 3.698 3.081 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -6.770 4.609 4.199 1.00 0.00 H new ATOM 666 N LYS A 162 -6.859 6.689 -0.584 1.00 0.00 N ATOM 667 CA LYS A 162 -7.519 7.320 -1.703 1.00 0.00 C ATOM 668 C LYS A 162 -8.060 6.185 -2.522 1.00 0.00 C ATOM 669 O LYS A 162 -7.485 5.098 -2.536 1.00 0.00 O ATOM 670 CB LYS A 162 -6.560 8.208 -2.533 1.00 0.00 C ATOM 671 CG LYS A 162 -7.237 9.042 -3.632 1.00 0.00 C ATOM 672 CD LYS A 162 -6.267 10.007 -4.329 1.00 0.00 C ATOM 673 CE LYS A 162 -6.936 10.834 -5.433 1.00 0.00 C ATOM 674 NZ LYS A 162 -5.961 11.744 -6.076 1.00 0.00 N ATOM 0 H LYS A 162 -5.987 6.221 -0.830 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.303 7.999 -1.367 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -6.036 8.883 -1.856 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -5.806 7.570 -2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -7.672 8.372 -4.374 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -8.058 9.611 -3.196 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -5.838 10.681 -3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.442 9.438 -4.758 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -7.366 10.168 -6.181 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -7.757 11.414 -5.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -6.437 12.293 -6.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -5.569 12.393 -5.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -5.191 11.186 -6.497 1.00 0.00 H new ATOM 688 N GLU A 163 -9.212 6.412 -3.202 1.00 0.00 N ATOM 689 CA GLU A 163 -9.936 5.414 -3.954 1.00 0.00 C ATOM 690 C GLU A 163 -9.177 5.041 -5.205 1.00 0.00 C ATOM 691 O GLU A 163 -9.228 5.721 -6.229 1.00 0.00 O ATOM 692 CB GLU A 163 -11.394 5.834 -4.275 1.00 0.00 C ATOM 693 CG GLU A 163 -11.562 7.273 -4.808 1.00 0.00 C ATOM 694 CD GLU A 163 -13.040 7.550 -5.078 1.00 0.00 C ATOM 695 OE1 GLU A 163 -13.836 7.526 -4.101 1.00 0.00 O ATOM 696 OE2 GLU A 163 -13.393 7.792 -6.263 1.00 0.00 O ATOM 0 H GLU A 163 -9.657 7.329 -3.229 1.00 0.00 H new ATOM 0 HA GLU A 163 -10.015 4.532 -3.319 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -11.801 5.141 -5.012 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -11.993 5.726 -3.371 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -11.174 7.988 -4.082 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -10.984 7.402 -5.723 1.00 0.00 H new ATOM 703 N GLY A 164 -8.407 3.935 -5.105 1.00 0.00 N ATOM 704 CA GLY A 164 -7.526 3.488 -6.143 1.00 0.00 C ATOM 705 C GLY A 164 -6.318 2.929 -5.465 1.00 0.00 C ATOM 706 O GLY A 164 -6.012 1.746 -5.611 1.00 0.00 O ATOM 0 H GLY A 164 -8.399 3.337 -4.279 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -8.008 2.731 -6.762 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -7.254 4.312 -6.802 1.00 0.00 H new ATOM 710 N GLU A 165 -5.588 3.795 -4.717 1.00 0.00 N ATOM 711 CA GLU A 165 -4.304 3.458 -4.147 1.00 0.00 C ATOM 712 C GLU A 165 -4.173 4.262 -2.885 1.00 0.00 C ATOM 713 O GLU A 165 -4.676 5.379 -2.793 1.00 0.00 O ATOM 714 CB GLU A 165 -3.109 3.829 -5.062 1.00 0.00 C ATOM 715 CG GLU A 165 -3.053 3.027 -6.377 1.00 0.00 C ATOM 716 CD GLU A 165 -1.891 3.502 -7.248 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.722 3.399 -6.793 1.00 0.00 O ATOM 718 OE2 GLU A 165 -2.160 3.975 -8.386 1.00 0.00 O ATOM 0 H GLU A 165 -5.894 4.744 -4.505 1.00 0.00 H new ATOM 0 HA GLU A 165 -4.271 2.380 -3.992 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -3.162 4.892 -5.299 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -2.181 3.671 -4.512 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -2.939 1.965 -6.157 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -3.992 3.142 -6.919 1.00 0.00 H new ATOM 725 N ILE A 166 -3.476 3.701 -1.868 1.00 0.00 N ATOM 726 CA ILE A 166 -3.300 4.344 -0.584 1.00 0.00 C ATOM 727 C ILE A 166 -2.042 5.173 -0.663 1.00 0.00 C ATOM 728 O ILE A 166 -1.074 4.772 -1.302 1.00 0.00 O ATOM 729 CB ILE A 166 -3.285 3.358 0.581 1.00 0.00 C ATOM 730 CG1 ILE A 166 -2.116 2.346 0.525 1.00 0.00 C ATOM 731 CG2 ILE A 166 -4.644 2.626 0.560 1.00 0.00 C ATOM 732 CD1 ILE A 166 -2.114 1.335 1.679 1.00 0.00 C ATOM 0 H ILE A 166 -3.027 2.788 -1.935 1.00 0.00 H new ATOM 0 HA ILE A 166 -4.156 4.985 -0.375 1.00 0.00 H new ATOM 0 HB ILE A 166 -3.131 3.909 1.509 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -2.162 1.804 -0.420 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -1.174 2.894 0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -4.682 1.907 1.378 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -5.450 3.351 0.676 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -4.761 2.103 -0.389 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -1.265 0.660 1.570 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -2.036 1.866 2.628 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -3.040 0.760 1.660 1.00 0.00 H new ATOM 744 N TYR A 167 -2.057 6.387 -0.061 1.00 0.00 N ATOM 745 CA TYR A 167 -1.007 7.370 -0.247 1.00 0.00 C ATOM 746 C TYR A 167 -0.929 8.111 1.053 1.00 0.00 C ATOM 747 O TYR A 167 -1.968 8.344 1.666 1.00 0.00 O ATOM 748 CB TYR A 167 -1.340 8.456 -1.308 1.00 0.00 C ATOM 749 CG TYR A 167 -1.524 7.915 -2.700 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.518 7.153 -3.313 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.665 8.252 -3.451 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.615 6.789 -4.662 1.00 0.00 C ATOM 753 CE2 TYR A 167 -2.773 7.881 -4.796 1.00 0.00 C ATOM 754 CZ TYR A 167 -1.736 7.168 -5.410 1.00 0.00 C ATOM 755 OH TYR A 167 -1.823 6.834 -6.781 1.00 0.00 O ATOM 0 H TYR A 167 -2.804 6.694 0.562 1.00 0.00 H new ATOM 0 HA TYR A 167 -0.106 6.846 -0.566 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -2.250 8.976 -1.008 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.540 9.196 -1.320 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.342 6.843 -2.738 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -3.467 8.804 -2.984 1.00 0.00 H new ATOM 0 HE1 TYR A 167 0.175 6.216 -5.125 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -3.656 8.144 -5.360 1.00 0.00 H new ATOM 0 HH TYR A 167 -2.667 7.172 -7.147 1.00 0.00 H new ATOM 765 N CYS A 168 0.287 8.475 1.547 1.00 0.00 N ATOM 766 CA CYS A 168 0.414 8.820 2.945 1.00 0.00 C ATOM 767 C CYS A 168 0.434 10.295 3.169 1.00 0.00 C ATOM 768 O CYS A 168 0.633 11.091 2.255 1.00 0.00 O ATOM 769 CB CYS A 168 1.548 8.074 3.706 1.00 0.00 C ATOM 770 SG CYS A 168 3.263 8.608 3.416 1.00 0.00 S ATOM 0 H CYS A 168 1.148 8.529 1.003 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.500 8.442 3.403 1.00 0.00 H new ATOM 0 HB2 CYS A 168 1.347 8.160 4.774 1.00 0.00 H new ATOM 0 HB3 CYS A 168 1.480 7.016 3.453 1.00 0.00 H new ATOM 0 HG CYS A 168 3.333 9.249 2.287 1.00 0.00 H new ATOM 775 N LYS A 169 0.186 10.665 4.445 1.00 0.00 N ATOM 776 CA LYS A 169 0.050 12.011 4.935 1.00 0.00 C ATOM 777 C LYS A 169 1.380 12.716 4.970 1.00 0.00 C ATOM 778 O LYS A 169 1.433 13.945 4.970 1.00 0.00 O ATOM 779 CB LYS A 169 -0.548 12.019 6.361 1.00 0.00 C ATOM 780 CG LYS A 169 -1.911 11.310 6.440 1.00 0.00 C ATOM 781 CD LYS A 169 -2.494 11.283 7.862 1.00 0.00 C ATOM 782 CE LYS A 169 -3.839 10.548 7.936 1.00 0.00 C ATOM 783 NZ LYS A 169 -4.353 10.515 9.325 1.00 0.00 N ATOM 0 H LYS A 169 0.073 9.974 5.187 1.00 0.00 H new ATOM 0 HA LYS A 169 -0.619 12.534 4.251 1.00 0.00 H new ATOM 0 HB2 LYS A 169 0.149 11.534 7.045 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -0.660 13.050 6.697 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -2.614 11.811 5.775 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -1.804 10.287 6.078 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -1.783 10.800 8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -2.623 12.305 8.217 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -4.563 11.042 7.289 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -3.722 9.530 7.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -5.263 10.012 9.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -3.671 10.022 9.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -4.486 11.487 9.669 1.00 0.00 H new ATOM 797 N GLY A 170 2.488 11.935 4.986 1.00 0.00 N ATOM 798 CA GLY A 170 3.837 12.438 5.027 1.00 0.00 C ATOM 799 C GLY A 170 4.261 12.961 3.687 1.00 0.00 C ATOM 800 O GLY A 170 5.005 13.937 3.617 1.00 0.00 O ATOM 0 H GLY A 170 2.441 10.916 4.970 1.00 0.00 H new ATOM 0 HA2 GLY A 170 3.909 13.232 5.770 1.00 0.00 H new ATOM 0 HA3 GLY A 170 4.515 11.644 5.342 1.00 0.00 H new ATOM 804 N CYS A 171 3.793 12.323 2.586 1.00 0.00 N ATOM 805 CA CYS A 171 4.108 12.747 1.240 1.00 0.00 C ATOM 806 C CYS A 171 3.070 13.708 0.719 1.00 0.00 C ATOM 807 O CYS A 171 3.291 14.336 -0.313 1.00 0.00 O ATOM 808 CB CYS A 171 4.311 11.576 0.247 1.00 0.00 C ATOM 809 SG CYS A 171 2.986 10.363 0.148 1.00 0.00 S ATOM 0 H CYS A 171 3.188 11.503 2.629 1.00 0.00 H new ATOM 0 HA CYS A 171 5.069 13.257 1.309 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.464 11.995 -0.747 1.00 0.00 H new ATOM 0 HB3 CYS A 171 5.230 11.055 0.518 1.00 0.00 H new ATOM 0 HG CYS A 171 2.063 10.657 1.014 1.00 0.00 H new ATOM 814 N TYR A 172 1.933 13.882 1.440 1.00 0.00 N ATOM 815 CA TYR A 172 0.973 14.930 1.159 1.00 0.00 C ATOM 816 C TYR A 172 1.396 16.192 1.864 1.00 0.00 C ATOM 817 O TYR A 172 0.945 17.279 1.508 1.00 0.00 O ATOM 818 CB TYR A 172 -0.472 14.597 1.624 1.00 0.00 C ATOM 819 CG TYR A 172 -1.189 13.696 0.648 1.00 0.00 C ATOM 820 CD1 TYR A 172 -1.296 14.055 -0.710 1.00 0.00 C ATOM 821 CD2 TYR A 172 -1.844 12.532 1.090 1.00 0.00 C ATOM 822 CE1 TYR A 172 -2.024 13.262 -1.605 1.00 0.00 C ATOM 823 CE2 TYR A 172 -2.568 11.734 0.195 1.00 0.00 C ATOM 824 CZ TYR A 172 -2.664 12.103 -1.153 1.00 0.00 C ATOM 825 OH TYR A 172 -3.427 11.324 -2.050 1.00 0.00 O ATOM 0 H TYR A 172 1.675 13.289 2.229 1.00 0.00 H new ATOM 0 HA TYR A 172 0.958 15.043 0.075 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -0.436 14.116 2.602 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.036 15.522 1.744 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -0.811 14.952 -1.065 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.788 12.251 2.131 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -2.092 13.545 -2.645 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -3.052 10.834 0.544 1.00 0.00 H new ATOM 0 HH TYR A 172 -2.901 10.550 -2.340 1.00 0.00 H new ATOM 835 N ALA A 173 2.298 16.081 2.871 1.00 0.00 N ATOM 836 CA ALA A 173 2.849 17.214 3.576 1.00 0.00 C ATOM 837 C ALA A 173 3.906 17.873 2.729 1.00 0.00 C ATOM 838 O ALA A 173 4.031 19.096 2.729 1.00 0.00 O ATOM 839 CB ALA A 173 3.489 16.816 4.919 1.00 0.00 C ATOM 0 H ALA A 173 2.652 15.184 3.203 1.00 0.00 H new ATOM 0 HA ALA A 173 2.022 17.895 3.777 1.00 0.00 H new ATOM 0 HB1 ALA A 173 3.888 17.704 5.409 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.736 16.356 5.559 1.00 0.00 H new ATOM 0 HB3 ALA A 173 4.297 16.106 4.741 1.00 0.00 H new ATOM 845 N LYS A 174 4.682 17.059 1.970 1.00 0.00 N ATOM 846 CA LYS A 174 5.753 17.539 1.129 1.00 0.00 C ATOM 847 C LYS A 174 5.194 18.031 -0.179 1.00 0.00 C ATOM 848 O LYS A 174 5.478 19.156 -0.587 1.00 0.00 O ATOM 849 CB LYS A 174 6.787 16.430 0.817 1.00 0.00 C ATOM 850 CG LYS A 174 7.540 15.898 2.053 1.00 0.00 C ATOM 851 CD LYS A 174 8.396 16.933 2.808 1.00 0.00 C ATOM 852 CE LYS A 174 9.548 17.516 1.978 1.00 0.00 C ATOM 853 NZ LYS A 174 10.363 18.453 2.787 1.00 0.00 N ATOM 0 H LYS A 174 4.563 16.046 1.940 1.00 0.00 H new ATOM 0 HA LYS A 174 6.249 18.343 1.673 1.00 0.00 H new ATOM 0 HB2 LYS A 174 6.275 15.599 0.332 1.00 0.00 H new ATOM 0 HB3 LYS A 174 7.513 16.817 0.103 1.00 0.00 H new ATOM 0 HG2 LYS A 174 6.812 15.480 2.748 1.00 0.00 H new ATOM 0 HG3 LYS A 174 8.187 15.079 1.738 1.00 0.00 H new ATOM 0 HD2 LYS A 174 7.753 17.748 3.140 1.00 0.00 H new ATOM 0 HD3 LYS A 174 8.807 16.466 3.703 1.00 0.00 H new ATOM 0 HE2 LYS A 174 10.178 16.708 1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 174 9.147 18.035 1.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 11.135 18.834 2.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 9.764 19.235 3.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 10.763 17.949 3.604 1.00 0.00 H new ATOM 867 N ASN A 175 4.374 17.193 -0.856 1.00 0.00 N ATOM 868 CA ASN A 175 3.807 17.507 -2.145 1.00 0.00 C ATOM 869 C ASN A 175 2.437 18.152 -1.902 1.00 0.00 C ATOM 870 O ASN A 175 1.507 17.438 -1.443 1.00 0.00 O ATOM 871 CB ASN A 175 3.661 16.246 -3.041 1.00 0.00 C ATOM 872 CG ASN A 175 3.229 16.619 -4.469 1.00 0.00 C ATOM 873 OD1 ASN A 175 3.961 17.314 -5.183 1.00 0.00 O ATOM 874 ND2 ASN A 175 2.016 16.137 -4.879 1.00 0.00 N ATOM 0 H ASN A 175 4.098 16.277 -0.501 1.00 0.00 H new ATOM 0 HA ASN A 175 4.472 18.188 -2.677 1.00 0.00 H new ATOM 0 HB2 ASN A 175 4.609 15.710 -3.075 1.00 0.00 H new ATOM 0 HB3 ASN A 175 2.928 15.569 -2.603 1.00 0.00 H new ATOM 0 HD21 ASN A 175 1.674 16.347 -5.817 1.00 0.00 H new ATOM 0 HD22 ASN A 175 1.453 15.568 -4.247 1.00 0.00 H new