USER MOD reduce.3.24.130724 H: found=0, std=0, add=436, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 429 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 149 LYS NZ :NH3+ 140:sc= 0.23 (180deg=-0.0703) USER MOD Set 1.2: A 175 ASN : amide:sc= -0.065 K(o=0.16,f=-0.8) USER MOD Set 2.1: A 147 CYS SG : rot 155:sc= 0.834 USER MOD Set 2.2: A 150 CYS SG : rot -49:sc= 0.384 USER MOD Set 2.3: A 168 CYS SG : rot -24:sc= 0.771 USER MOD Set 2.4: A 171 CYS SG : rot -20:sc= 0.713 USER MOD Set 3.1: A 120 CYS SG : rot 151:sc= 0.393 USER MOD Set 3.2: A 123 CYS SG : rot -57:sc= 0.505 USER MOD Set 3.3: A 141 HIS : no HD1:sc= -0.699 X(o=-0.67,f=-0.87) USER MOD Set 3.4: A 144 CYS SG : rot 150:sc= -0.87 USER MOD Single : A 119 LYS NZ :NH3+ 148:sc= -0.0347 (180deg=-1.2) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 23:sc= 0.0323 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 159:sc= -1.65! (180deg=-1.9!) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -0.414 X(o=-0.41,f=-0.0037) USER MOD Single : A 152 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00613) USER MOD Single : A 153 SER OG : rot 34:sc= 0.00948 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 176:sc= 0.69 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 0:sc= 0 USER MOD Single : A 169 LYS NZ :NH3+ -158:sc= 0.163 (180deg=0.0528) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ -163:sc= -0.0538 (180deg=-0.337) USER MOD ----------------------------------------------------------------- ATOM 11 N GLU A 118 -2.420 -11.851 -4.891 1.00 0.00 N ATOM 12 CA GLU A 118 -1.475 -11.145 -5.716 1.00 0.00 C ATOM 13 C GLU A 118 -0.160 -11.351 -5.018 1.00 0.00 C ATOM 14 O GLU A 118 0.002 -12.314 -4.269 1.00 0.00 O ATOM 15 CB GLU A 118 -1.833 -9.640 -5.879 1.00 0.00 C ATOM 16 CG GLU A 118 -1.271 -8.952 -7.139 1.00 0.00 C ATOM 17 CD GLU A 118 -1.707 -7.486 -7.147 1.00 0.00 C ATOM 18 OE1 GLU A 118 -2.938 -7.233 -7.240 1.00 0.00 O ATOM 19 OE2 GLU A 118 -0.814 -6.601 -7.060 1.00 0.00 O ATOM 0 HA GLU A 118 -1.462 -11.518 -6.740 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -2.919 -9.543 -5.888 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.472 -9.102 -5.002 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -0.183 -9.021 -7.151 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -1.632 -9.456 -8.035 1.00 0.00 H new ATOM 26 N LYS A 119 0.821 -10.458 -5.258 1.00 0.00 N ATOM 27 CA LYS A 119 2.110 -10.516 -4.635 1.00 0.00 C ATOM 28 C LYS A 119 2.278 -9.278 -3.808 1.00 0.00 C ATOM 29 O LYS A 119 1.661 -8.245 -4.064 1.00 0.00 O ATOM 30 CB LYS A 119 3.270 -10.708 -5.617 1.00 0.00 C ATOM 31 CG LYS A 119 4.285 -11.770 -5.158 1.00 0.00 C ATOM 32 CD LYS A 119 5.547 -11.908 -6.032 1.00 0.00 C ATOM 33 CE LYS A 119 5.361 -12.679 -7.351 1.00 0.00 C ATOM 34 NZ LYS A 119 4.626 -11.896 -8.373 1.00 0.00 N ATOM 0 H LYS A 119 0.714 -9.675 -5.903 1.00 0.00 H new ATOM 0 HA LYS A 119 2.146 -11.406 -4.006 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.870 -10.994 -6.590 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.785 -9.757 -5.751 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.594 -11.535 -4.140 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.782 -12.736 -5.123 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.917 -10.909 -6.265 1.00 0.00 H new ATOM 0 HD3 LYS A 119 6.320 -12.406 -5.447 1.00 0.00 H new ATOM 0 HE2 LYS A 119 6.338 -12.957 -7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.822 -13.606 -7.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 4.967 -12.156 -9.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 3.609 -12.102 -8.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 4.786 -10.881 -8.214 1.00 0.00 H new ATOM 48 N CYS A 120 3.138 -9.392 -2.777 1.00 0.00 N ATOM 49 CA CYS A 120 3.487 -8.343 -1.862 1.00 0.00 C ATOM 50 C CYS A 120 4.649 -7.589 -2.447 1.00 0.00 C ATOM 51 O CYS A 120 5.658 -8.186 -2.820 1.00 0.00 O ATOM 52 CB CYS A 120 3.885 -8.926 -0.490 1.00 0.00 C ATOM 53 SG CYS A 120 4.019 -7.693 0.820 1.00 0.00 S ATOM 0 H CYS A 120 3.618 -10.268 -2.569 1.00 0.00 H new ATOM 0 HA CYS A 120 2.632 -7.684 -1.713 1.00 0.00 H new ATOM 0 HB2 CYS A 120 3.148 -9.674 -0.197 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.840 -9.441 -0.589 1.00 0.00 H new ATOM 0 HG CYS A 120 3.741 -8.244 1.964 1.00 0.00 H new ATOM 58 N SER A 121 4.505 -6.248 -2.569 1.00 0.00 N ATOM 59 CA SER A 121 5.502 -5.382 -3.156 1.00 0.00 C ATOM 60 C SER A 121 6.631 -5.100 -2.190 1.00 0.00 C ATOM 61 O SER A 121 7.752 -4.829 -2.617 1.00 0.00 O ATOM 62 CB SER A 121 4.903 -4.042 -3.663 1.00 0.00 C ATOM 63 OG SER A 121 4.235 -3.315 -2.638 1.00 0.00 O ATOM 0 H SER A 121 3.673 -5.750 -2.251 1.00 0.00 H new ATOM 0 HA SER A 121 5.896 -5.922 -4.017 1.00 0.00 H new ATOM 0 HB2 SER A 121 5.701 -3.426 -4.078 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.203 -4.245 -4.473 1.00 0.00 H new ATOM 0 HG SER A 121 3.878 -2.481 -3.008 1.00 0.00 H new ATOM 69 N ARG A 122 6.355 -5.158 -0.863 1.00 0.00 N ATOM 70 CA ARG A 122 7.317 -4.826 0.161 1.00 0.00 C ATOM 71 C ARG A 122 8.246 -5.989 0.386 1.00 0.00 C ATOM 72 O ARG A 122 9.443 -5.864 0.131 1.00 0.00 O ATOM 73 CB ARG A 122 6.628 -4.395 1.482 1.00 0.00 C ATOM 74 CG ARG A 122 7.499 -4.312 2.757 1.00 0.00 C ATOM 75 CD ARG A 122 8.784 -3.471 2.675 1.00 0.00 C ATOM 76 NE ARG A 122 8.459 -2.015 2.533 1.00 0.00 N ATOM 77 CZ ARG A 122 9.444 -1.066 2.512 1.00 0.00 C ATOM 78 NH1 ARG A 122 10.761 -1.419 2.582 1.00 0.00 N ATOM 79 NH2 ARG A 122 9.112 0.253 2.418 1.00 0.00 N ATOM 0 H ARG A 122 5.447 -5.441 -0.495 1.00 0.00 H new ATOM 0 HA ARG A 122 7.899 -3.971 -0.183 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.177 -3.416 1.320 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.814 -5.093 1.678 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.883 -3.911 3.562 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.776 -5.326 3.044 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.385 -3.628 3.571 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.385 -3.799 1.827 1.00 0.00 H new ATOM 0 HE ARG A 122 7.484 -1.726 2.450 1.00 0.00 H new ATOM 0 HH11 ARG A 122 11.022 -2.403 2.651 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.484 -0.699 2.565 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.132 0.530 2.364 1.00 0.00 H new ATOM 0 HH22 ARG A 122 9.844 0.963 2.402 1.00 0.00 H new ATOM 93 N CYS A 123 7.731 -7.147 0.872 1.00 0.00 N ATOM 94 CA CYS A 123 8.594 -8.201 1.359 1.00 0.00 C ATOM 95 C CYS A 123 8.965 -9.151 0.248 1.00 0.00 C ATOM 96 O CYS A 123 10.033 -9.760 0.292 1.00 0.00 O ATOM 97 CB CYS A 123 8.016 -8.953 2.592 1.00 0.00 C ATOM 98 SG CYS A 123 6.561 -10.009 2.291 1.00 0.00 S ATOM 0 H CYS A 123 6.734 -7.353 0.928 1.00 0.00 H new ATOM 0 HA CYS A 123 9.504 -7.716 1.713 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.806 -9.573 3.015 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.751 -8.215 3.349 1.00 0.00 H new ATOM 0 HG CYS A 123 5.605 -9.294 1.775 1.00 0.00 H new ATOM 103 N GLY A 124 8.103 -9.270 -0.792 1.00 0.00 N ATOM 104 CA GLY A 124 8.423 -9.996 -2.000 1.00 0.00 C ATOM 105 C GLY A 124 7.741 -11.330 -2.047 1.00 0.00 C ATOM 106 O GLY A 124 7.756 -11.988 -3.086 1.00 0.00 O ATOM 0 H GLY A 124 7.170 -8.857 -0.796 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.127 -9.406 -2.867 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.502 -10.137 -2.064 1.00 0.00 H new ATOM 110 N ASP A 125 7.124 -11.770 -0.922 1.00 0.00 N ATOM 111 CA ASP A 125 6.463 -13.053 -0.828 1.00 0.00 C ATOM 112 C ASP A 125 5.063 -12.898 -1.350 1.00 0.00 C ATOM 113 O ASP A 125 4.580 -11.784 -1.524 1.00 0.00 O ATOM 114 CB ASP A 125 6.378 -13.588 0.624 1.00 0.00 C ATOM 115 CG ASP A 125 7.789 -13.774 1.186 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.547 -14.602 0.613 1.00 0.00 O ATOM 117 OD2 ASP A 125 8.125 -13.095 2.192 1.00 0.00 O ATOM 0 H ASP A 125 7.083 -11.225 -0.061 1.00 0.00 H new ATOM 0 HA ASP A 125 7.049 -13.766 -1.408 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.817 -12.891 1.247 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.841 -14.536 0.642 1.00 0.00 H new ATOM 122 N SER A 126 4.374 -14.028 -1.629 1.00 0.00 N ATOM 123 CA SER A 126 3.025 -14.006 -2.141 1.00 0.00 C ATOM 124 C SER A 126 2.096 -13.927 -0.961 1.00 0.00 C ATOM 125 O SER A 126 2.339 -14.556 0.068 1.00 0.00 O ATOM 126 CB SER A 126 2.701 -15.261 -2.993 1.00 0.00 C ATOM 127 OG SER A 126 1.446 -15.154 -3.656 1.00 0.00 O ATOM 0 H SER A 126 4.754 -14.966 -1.499 1.00 0.00 H new ATOM 0 HA SER A 126 2.904 -13.145 -2.799 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.488 -15.409 -3.732 1.00 0.00 H new ATOM 0 HB3 SER A 126 2.697 -16.142 -2.351 1.00 0.00 H new ATOM 0 HG SER A 126 1.205 -14.209 -3.749 1.00 0.00 H new ATOM 133 N VAL A 127 1.010 -13.130 -1.100 1.00 0.00 N ATOM 134 CA VAL A 127 -0.031 -13.033 -0.108 1.00 0.00 C ATOM 135 C VAL A 127 -1.254 -13.609 -0.774 1.00 0.00 C ATOM 136 O VAL A 127 -1.506 -13.367 -1.954 1.00 0.00 O ATOM 137 CB VAL A 127 -0.224 -11.617 0.429 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.919 -10.685 -0.581 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.980 -11.675 1.767 1.00 0.00 C ATOM 0 H VAL A 127 0.852 -12.541 -1.918 1.00 0.00 H new ATOM 0 HA VAL A 127 0.219 -13.588 0.796 1.00 0.00 H new ATOM 0 HB VAL A 127 0.762 -11.182 0.595 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -1.029 -9.692 -0.144 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.318 -10.618 -1.488 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.903 -11.084 -0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.118 -10.664 2.151 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.953 -12.142 1.615 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.405 -12.260 2.485 1.00 0.00 H new ATOM 149 N TYR A 128 -2.006 -14.449 -0.033 1.00 0.00 N ATOM 150 CA TYR A 128 -3.096 -15.209 -0.590 1.00 0.00 C ATOM 151 C TYR A 128 -4.113 -15.306 0.509 1.00 0.00 C ATOM 152 O TYR A 128 -4.940 -14.411 0.667 1.00 0.00 O ATOM 153 CB TYR A 128 -2.693 -16.599 -1.198 1.00 0.00 C ATOM 154 CG TYR A 128 -1.580 -17.331 -0.468 1.00 0.00 C ATOM 155 CD1 TYR A 128 -0.234 -16.973 -0.676 1.00 0.00 C ATOM 156 CD2 TYR A 128 -1.858 -18.411 0.390 1.00 0.00 C ATOM 157 CE1 TYR A 128 0.800 -17.636 -0.007 1.00 0.00 C ATOM 158 CE2 TYR A 128 -0.828 -19.076 1.068 1.00 0.00 C ATOM 159 CZ TYR A 128 0.503 -18.684 0.874 1.00 0.00 C ATOM 160 OH TYR A 128 1.544 -19.351 1.558 1.00 0.00 O ATOM 0 H TYR A 128 -1.859 -14.605 0.964 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.498 -14.702 -1.467 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -3.575 -17.239 -1.215 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.388 -16.449 -2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 128 0.004 -16.174 -1.363 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -2.880 -18.732 0.528 1.00 0.00 H new ATOM 0 HE1 TYR A 128 1.826 -17.340 -0.169 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -1.060 -19.890 1.739 1.00 0.00 H new ATOM 0 HH TYR A 128 1.164 -20.051 2.129 1.00 0.00 H new ATOM 170 N ALA A 129 -4.056 -16.389 1.311 1.00 0.00 N ATOM 171 CA ALA A 129 -4.842 -16.570 2.502 1.00 0.00 C ATOM 172 C ALA A 129 -3.861 -16.584 3.640 1.00 0.00 C ATOM 173 O ALA A 129 -4.025 -17.321 4.612 1.00 0.00 O ATOM 174 CB ALA A 129 -5.620 -17.901 2.484 1.00 0.00 C ATOM 0 H ALA A 129 -3.434 -17.175 1.122 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.582 -15.775 2.590 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -6.200 -17.996 3.402 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -6.293 -17.918 1.627 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -4.918 -18.732 2.410 1.00 0.00 H new ATOM 180 N ALA A 130 -2.804 -15.740 3.531 1.00 0.00 N ATOM 181 CA ALA A 130 -1.750 -15.627 4.504 1.00 0.00 C ATOM 182 C ALA A 130 -2.188 -14.604 5.517 1.00 0.00 C ATOM 183 O ALA A 130 -2.913 -14.939 6.452 1.00 0.00 O ATOM 184 CB ALA A 130 -0.406 -15.232 3.855 1.00 0.00 C ATOM 0 H ALA A 130 -2.682 -15.114 2.735 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.578 -16.592 4.981 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.362 -15.158 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -0.117 -15.990 3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.512 -14.269 3.355 1.00 0.00 H new ATOM 190 N GLU A 131 -1.762 -13.331 5.346 1.00 0.00 N ATOM 191 CA GLU A 131 -2.140 -12.247 6.219 1.00 0.00 C ATOM 192 C GLU A 131 -2.779 -11.206 5.342 1.00 0.00 C ATOM 193 O GLU A 131 -2.523 -10.015 5.503 1.00 0.00 O ATOM 194 CB GLU A 131 -0.942 -11.590 6.962 1.00 0.00 C ATOM 195 CG GLU A 131 -0.209 -12.498 7.974 1.00 0.00 C ATOM 196 CD GLU A 131 0.702 -13.515 7.284 1.00 0.00 C ATOM 197 OE1 GLU A 131 1.610 -13.080 6.527 1.00 0.00 O ATOM 198 OE2 GLU A 131 0.505 -14.739 7.511 1.00 0.00 O ATOM 0 H GLU A 131 -1.143 -13.048 4.587 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.800 -12.642 6.991 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -0.221 -11.246 6.220 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -1.304 -10.707 7.488 1.00 0.00 H new ATOM 0 HG2 GLU A 131 0.384 -11.881 8.650 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -0.942 -13.025 8.584 1.00 0.00 H new ATOM 205 N LYS A 132 -3.646 -11.630 4.385 1.00 0.00 N ATOM 206 CA LYS A 132 -4.194 -10.726 3.400 1.00 0.00 C ATOM 207 C LYS A 132 -5.237 -9.833 4.015 1.00 0.00 C ATOM 208 O LYS A 132 -6.153 -10.286 4.699 1.00 0.00 O ATOM 209 CB LYS A 132 -4.802 -11.449 2.179 1.00 0.00 C ATOM 210 CG LYS A 132 -5.420 -10.513 1.127 1.00 0.00 C ATOM 211 CD LYS A 132 -5.816 -11.249 -0.155 1.00 0.00 C ATOM 212 CE LYS A 132 -6.714 -10.400 -1.060 1.00 0.00 C ATOM 213 NZ LYS A 132 -6.993 -11.091 -2.338 1.00 0.00 N ATOM 0 H LYS A 132 -3.966 -12.594 4.294 1.00 0.00 H new ATOM 0 HA LYS A 132 -3.353 -10.131 3.044 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -4.025 -12.047 1.703 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.569 -12.141 2.527 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -6.300 -10.028 1.550 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -4.707 -9.725 0.884 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -4.916 -11.531 -0.702 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -6.334 -12.172 0.104 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -7.652 -10.185 -0.548 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -6.233 -9.442 -1.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -7.603 -10.492 -2.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -6.099 -11.274 -2.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -7.474 -11.993 -2.147 1.00 0.00 H new ATOM 227 N VAL A 133 -5.086 -8.522 3.732 1.00 0.00 N ATOM 228 CA VAL A 133 -6.016 -7.470 4.029 1.00 0.00 C ATOM 229 C VAL A 133 -5.865 -6.559 2.845 1.00 0.00 C ATOM 230 O VAL A 133 -4.858 -6.609 2.140 1.00 0.00 O ATOM 231 CB VAL A 133 -5.735 -6.692 5.316 1.00 0.00 C ATOM 232 CG1 VAL A 133 -6.173 -7.544 6.525 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.248 -6.289 5.414 1.00 0.00 C ATOM 0 H VAL A 133 -4.251 -8.173 3.261 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.013 -7.879 4.194 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.309 -5.765 5.309 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.976 -6.996 7.447 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.239 -7.759 6.452 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.614 -8.480 6.532 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -4.081 -5.738 6.339 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.627 -7.185 5.408 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.985 -5.659 4.564 1.00 0.00 H new ATOM 243 N ILE A 134 -6.882 -5.710 2.584 1.00 0.00 N ATOM 244 CA ILE A 134 -6.838 -4.751 1.508 1.00 0.00 C ATOM 245 C ILE A 134 -7.102 -3.434 2.178 1.00 0.00 C ATOM 246 O ILE A 134 -7.988 -3.323 3.025 1.00 0.00 O ATOM 247 CB ILE A 134 -7.857 -5.042 0.401 1.00 0.00 C ATOM 248 CG1 ILE A 134 -7.533 -6.413 -0.252 1.00 0.00 C ATOM 249 CG2 ILE A 134 -7.863 -3.900 -0.641 1.00 0.00 C ATOM 250 CD1 ILE A 134 -8.508 -6.839 -1.353 1.00 0.00 C ATOM 0 H ILE A 134 -7.747 -5.686 3.124 1.00 0.00 H new ATOM 0 HA ILE A 134 -5.879 -4.776 0.991 1.00 0.00 H new ATOM 0 HB ILE A 134 -8.858 -5.095 0.829 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -6.527 -6.373 -0.671 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -7.525 -7.178 0.524 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.592 -4.122 -1.420 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.129 -2.963 -0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -6.872 -3.809 -1.086 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.205 -7.807 -1.752 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -9.513 -6.916 -0.939 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -8.500 -6.098 -2.152 1.00 0.00 H new ATOM 262 N GLY A 135 -6.317 -2.401 1.792 1.00 0.00 N ATOM 263 CA GLY A 135 -6.481 -1.048 2.249 1.00 0.00 C ATOM 264 C GLY A 135 -7.186 -0.325 1.150 1.00 0.00 C ATOM 265 O GLY A 135 -8.352 0.045 1.284 1.00 0.00 O ATOM 0 H GLY A 135 -5.542 -2.513 1.139 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -7.060 -1.015 3.172 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -5.516 -0.588 2.462 1.00 0.00 H new ATOM 269 N ALA A 136 -6.471 -0.124 0.021 1.00 0.00 N ATOM 270 CA ALA A 136 -6.981 0.539 -1.150 1.00 0.00 C ATOM 271 C ALA A 136 -7.550 -0.498 -2.073 1.00 0.00 C ATOM 272 O ALA A 136 -8.751 -0.765 -2.047 1.00 0.00 O ATOM 273 CB ALA A 136 -5.882 1.321 -1.884 1.00 0.00 C ATOM 0 H ALA A 136 -5.504 -0.433 -0.081 1.00 0.00 H new ATOM 0 HA ALA A 136 -7.746 1.251 -0.840 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -6.306 1.807 -2.762 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -5.465 2.076 -1.217 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -5.093 0.636 -2.194 1.00 0.00 H new ATOM 279 N GLY A 137 -6.688 -1.110 -2.914 1.00 0.00 N ATOM 280 CA GLY A 137 -7.112 -2.105 -3.860 1.00 0.00 C ATOM 281 C GLY A 137 -5.913 -2.916 -4.231 1.00 0.00 C ATOM 282 O GLY A 137 -5.738 -3.269 -5.396 1.00 0.00 O ATOM 0 H GLY A 137 -5.688 -0.913 -2.938 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.885 -2.740 -3.427 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.544 -1.634 -4.743 1.00 0.00 H new ATOM 286 N LYS A 138 -5.063 -3.236 -3.228 1.00 0.00 N ATOM 287 CA LYS A 138 -3.910 -4.084 -3.395 1.00 0.00 C ATOM 288 C LYS A 138 -3.938 -5.051 -2.240 1.00 0.00 C ATOM 289 O LYS A 138 -4.213 -4.626 -1.119 1.00 0.00 O ATOM 290 CB LYS A 138 -2.572 -3.317 -3.312 1.00 0.00 C ATOM 291 CG LYS A 138 -2.265 -2.496 -4.576 1.00 0.00 C ATOM 292 CD LYS A 138 -1.026 -1.596 -4.428 1.00 0.00 C ATOM 293 CE LYS A 138 -1.348 -0.130 -4.097 1.00 0.00 C ATOM 294 NZ LYS A 138 -2.210 0.003 -2.898 1.00 0.00 N ATOM 0 H LYS A 138 -5.180 -2.896 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.960 -4.550 -4.379 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.596 -2.650 -2.450 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.763 -4.028 -3.143 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -2.114 -3.175 -5.415 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.129 -1.877 -4.818 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -0.387 -2.002 -3.643 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -0.453 -1.630 -5.355 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.418 0.416 -3.935 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -1.844 0.332 -4.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -2.114 0.961 -2.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -3.202 -0.165 -3.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -1.920 -0.694 -2.183 1.00 0.00 H new ATOM 308 N PRO A 139 -3.640 -6.337 -2.431 1.00 0.00 N ATOM 309 CA PRO A 139 -3.406 -7.278 -1.346 1.00 0.00 C ATOM 310 C PRO A 139 -2.145 -6.938 -0.585 1.00 0.00 C ATOM 311 O PRO A 139 -1.172 -6.507 -1.201 1.00 0.00 O ATOM 312 CB PRO A 139 -3.283 -8.633 -2.050 1.00 0.00 C ATOM 313 CG PRO A 139 -4.175 -8.472 -3.279 1.00 0.00 C ATOM 314 CD PRO A 139 -3.876 -7.036 -3.696 1.00 0.00 C ATOM 0 HA PRO A 139 -4.204 -7.264 -0.603 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -2.251 -8.850 -2.327 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -3.620 -9.450 -1.412 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -3.923 -9.186 -4.063 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -5.229 -8.618 -3.041 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -3.004 -6.984 -4.349 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -4.711 -6.598 -4.243 1.00 0.00 H new ATOM 322 N TRP A 140 -2.189 -7.077 0.756 1.00 0.00 N ATOM 323 CA TRP A 140 -1.191 -6.561 1.655 1.00 0.00 C ATOM 324 C TRP A 140 -1.093 -7.504 2.813 1.00 0.00 C ATOM 325 O TRP A 140 -2.102 -8.010 3.292 1.00 0.00 O ATOM 326 CB TRP A 140 -1.545 -5.186 2.279 1.00 0.00 C ATOM 327 CG TRP A 140 -1.586 -3.995 1.348 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.612 -3.117 1.133 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.453 -3.480 0.628 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.199 -2.086 0.321 1.00 0.00 N ATOM 331 CE2 TRP A 140 -0.871 -2.282 0.008 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.855 -3.938 0.500 1.00 0.00 C ATOM 333 CZ2 TRP A 140 0.019 -1.523 -0.740 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.750 -3.170 -0.259 1.00 0.00 C ATOM 335 CH2 TRP A 140 1.337 -1.977 -0.868 1.00 0.00 C ATOM 0 H TRP A 140 -2.946 -7.566 1.234 1.00 0.00 H new ATOM 0 HA TRP A 140 -0.279 -6.452 1.068 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.520 -5.274 2.759 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.820 -4.975 3.066 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.606 -3.219 1.543 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -2.778 -1.308 0.004 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.171 -4.857 0.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.298 -0.605 -1.212 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.771 -3.502 -0.376 1.00 0.00 H new ATOM 0 HH2 TRP A 140 2.045 -1.400 -1.444 1.00 0.00 H new ATOM 346 N HIS A 141 0.149 -7.732 3.311 1.00 0.00 N ATOM 347 CA HIS A 141 0.375 -8.282 4.626 1.00 0.00 C ATOM 348 C HIS A 141 0.253 -7.110 5.555 1.00 0.00 C ATOM 349 O HIS A 141 0.413 -5.963 5.139 1.00 0.00 O ATOM 350 CB HIS A 141 1.756 -8.923 4.883 1.00 0.00 C ATOM 351 CG HIS A 141 2.087 -10.084 3.996 1.00 0.00 C ATOM 352 ND1 HIS A 141 3.198 -10.127 3.191 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.502 -11.301 3.936 1.00 0.00 C ATOM 354 CE1 HIS A 141 3.263 -11.338 2.651 1.00 0.00 C ATOM 355 NE2 HIS A 141 2.251 -12.070 3.089 1.00 0.00 N ATOM 0 H HIS A 141 1.006 -7.532 2.795 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.339 -9.094 4.763 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.524 -8.159 4.759 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.800 -9.253 5.921 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.609 -11.609 4.460 1.00 0.00 H new ATOM 0 HE1 HIS A 141 4.023 -11.674 1.961 1.00 0.00 H new ATOM 0 HE2 HIS A 141 2.062 -13.040 2.838 1.00 0.00 H new ATOM 363 N LYS A 142 -0.105 -7.374 6.827 1.00 0.00 N ATOM 364 CA LYS A 142 -0.574 -6.370 7.749 1.00 0.00 C ATOM 365 C LYS A 142 0.505 -5.456 8.294 1.00 0.00 C ATOM 366 O LYS A 142 0.201 -4.557 9.077 1.00 0.00 O ATOM 367 CB LYS A 142 -1.306 -7.018 8.949 1.00 0.00 C ATOM 368 CG LYS A 142 -2.477 -7.919 8.528 1.00 0.00 C ATOM 369 CD LYS A 142 -3.109 -8.678 9.703 1.00 0.00 C ATOM 370 CE LYS A 142 -4.212 -9.647 9.257 1.00 0.00 C ATOM 371 NZ LYS A 142 -4.763 -10.397 10.409 1.00 0.00 N ATOM 0 H LYS A 142 -0.069 -8.310 7.230 1.00 0.00 H new ATOM 0 HA LYS A 142 -1.251 -5.756 7.155 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -0.593 -7.606 9.527 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -1.678 -6.232 9.607 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -3.241 -7.309 8.045 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -2.126 -8.637 7.787 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -2.334 -9.234 10.230 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.525 -7.962 10.411 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -5.011 -9.092 8.765 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -3.811 -10.346 8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -5.507 -11.044 10.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -4.004 -10.945 10.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -5.166 -9.729 11.097 1.00 0.00 H new ATOM 385 N ASN A 143 1.780 -5.666 7.893 1.00 0.00 N ATOM 386 CA ASN A 143 2.914 -4.863 8.294 1.00 0.00 C ATOM 387 C ASN A 143 3.558 -4.288 7.047 1.00 0.00 C ATOM 388 O ASN A 143 4.382 -3.379 7.128 1.00 0.00 O ATOM 389 CB ASN A 143 3.946 -5.737 9.063 1.00 0.00 C ATOM 390 CG ASN A 143 5.077 -4.912 9.701 1.00 0.00 C ATOM 391 OD1 ASN A 143 6.247 -5.062 9.330 1.00 0.00 O ATOM 392 ND2 ASN A 143 4.702 -4.030 10.677 1.00 0.00 N ATOM 0 H ASN A 143 2.035 -6.426 7.263 1.00 0.00 H new ATOM 0 HA ASN A 143 2.583 -4.060 8.953 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.430 -6.298 9.842 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.378 -6.466 8.378 1.00 0.00 H new ATOM 0 HD21 ASN A 143 5.404 -3.453 11.140 1.00 0.00 H new ATOM 0 HD22 ASN A 143 3.720 -3.949 10.942 1.00 0.00 H new ATOM 399 N CYS A 144 3.197 -4.827 5.862 1.00 0.00 N ATOM 400 CA CYS A 144 3.865 -4.597 4.604 1.00 0.00 C ATOM 401 C CYS A 144 3.171 -3.552 3.755 1.00 0.00 C ATOM 402 O CYS A 144 3.193 -3.648 2.530 1.00 0.00 O ATOM 403 CB CYS A 144 3.881 -5.889 3.756 1.00 0.00 C ATOM 404 SG CYS A 144 4.952 -7.235 4.340 1.00 0.00 S ATOM 0 H CYS A 144 2.399 -5.456 5.774 1.00 0.00 H new ATOM 0 HA CYS A 144 4.868 -4.260 4.865 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.861 -6.268 3.694 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.185 -5.627 2.743 1.00 0.00 H new ATOM 0 HG CYS A 144 4.439 -8.379 3.995 1.00 0.00 H new ATOM 409 N PHE A 145 2.529 -2.517 4.347 1.00 0.00 N ATOM 410 CA PHE A 145 1.771 -1.547 3.584 1.00 0.00 C ATOM 411 C PHE A 145 2.771 -0.534 3.113 1.00 0.00 C ATOM 412 O PHE A 145 3.227 0.287 3.901 1.00 0.00 O ATOM 413 CB PHE A 145 0.700 -0.780 4.414 1.00 0.00 C ATOM 414 CG PHE A 145 -0.618 -1.510 4.533 1.00 0.00 C ATOM 415 CD1 PHE A 145 -0.707 -2.809 5.059 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.810 -0.846 4.183 1.00 0.00 C ATOM 417 CE1 PHE A 145 -1.952 -3.428 5.228 1.00 0.00 C ATOM 418 CE2 PHE A 145 -3.054 -1.463 4.345 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.126 -2.759 4.866 1.00 0.00 C ATOM 0 H PHE A 145 2.532 -2.348 5.353 1.00 0.00 H new ATOM 0 HA PHE A 145 1.238 -2.075 2.793 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.093 -0.594 5.413 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.526 0.193 3.954 1.00 0.00 H new ATOM 0 HD1 PHE A 145 0.194 -3.336 5.336 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.762 0.156 3.783 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -2.006 -4.425 5.639 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.958 -0.940 4.068 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.084 -3.241 4.988 1.00 0.00 H new ATOM 429 N ARG A 146 3.159 -0.577 1.818 1.00 0.00 N ATOM 430 CA ARG A 146 4.089 0.388 1.290 1.00 0.00 C ATOM 431 C ARG A 146 3.284 1.444 0.592 1.00 0.00 C ATOM 432 O ARG A 146 2.306 1.153 -0.094 1.00 0.00 O ATOM 433 CB ARG A 146 5.152 -0.179 0.320 1.00 0.00 C ATOM 434 CG ARG A 146 6.342 0.774 0.170 1.00 0.00 C ATOM 435 CD ARG A 146 7.339 0.416 -0.937 1.00 0.00 C ATOM 436 NE ARG A 146 8.037 -0.873 -0.621 1.00 0.00 N ATOM 437 CZ ARG A 146 9.143 -1.284 -1.315 1.00 0.00 C ATOM 438 NH1 ARG A 146 9.584 -0.590 -2.405 1.00 0.00 N ATOM 439 NH2 ARG A 146 9.823 -2.396 -0.911 1.00 0.00 N ATOM 0 H ARG A 146 2.834 -1.270 1.144 1.00 0.00 H new ATOM 0 HA ARG A 146 4.663 0.774 2.132 1.00 0.00 H new ATOM 0 HB2 ARG A 146 5.502 -1.144 0.686 1.00 0.00 H new ATOM 0 HB3 ARG A 146 4.699 -0.353 -0.656 1.00 0.00 H new ATOM 0 HG2 ARG A 146 5.960 1.777 -0.020 1.00 0.00 H new ATOM 0 HG3 ARG A 146 6.877 0.811 1.119 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.817 0.329 -1.890 1.00 0.00 H new ATOM 0 HD3 ARG A 146 8.072 1.215 -1.047 1.00 0.00 H new ATOM 0 HE ARG A 146 7.678 -1.460 0.132 1.00 0.00 H new ATOM 0 HH11 ARG A 146 9.088 0.247 -2.712 1.00 0.00 H new ATOM 0 HH12 ARG A 146 10.410 -0.908 -2.912 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.507 -2.918 -0.094 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.647 -2.705 -1.426 1.00 0.00 H new ATOM 453 N CYS A 147 3.726 2.708 0.745 1.00 0.00 N ATOM 454 CA CYS A 147 3.140 3.895 0.190 1.00 0.00 C ATOM 455 C CYS A 147 3.445 3.901 -1.292 1.00 0.00 C ATOM 456 O CYS A 147 4.519 3.487 -1.721 1.00 0.00 O ATOM 457 CB CYS A 147 3.771 5.122 0.888 1.00 0.00 C ATOM 458 SG CYS A 147 3.041 6.673 0.349 1.00 0.00 S ATOM 0 H CYS A 147 4.557 2.916 1.299 1.00 0.00 H new ATOM 0 HA CYS A 147 2.061 3.926 0.340 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.651 5.023 1.967 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.842 5.139 0.687 1.00 0.00 H new ATOM 0 HG CYS A 147 3.182 7.567 1.283 1.00 0.00 H new ATOM 463 N ALA A 148 2.457 4.324 -2.116 1.00 0.00 N ATOM 464 CA ALA A 148 2.543 4.218 -3.556 1.00 0.00 C ATOM 465 C ALA A 148 3.216 5.432 -4.134 1.00 0.00 C ATOM 466 O ALA A 148 3.691 5.396 -5.269 1.00 0.00 O ATOM 467 CB ALA A 148 1.167 4.061 -4.224 1.00 0.00 C ATOM 0 H ALA A 148 1.589 4.744 -1.783 1.00 0.00 H new ATOM 0 HA ALA A 148 3.127 3.321 -3.760 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.293 3.986 -5.304 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.683 3.158 -3.852 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.548 4.927 -3.990 1.00 0.00 H new ATOM 473 N LYS A 149 3.299 6.531 -3.346 1.00 0.00 N ATOM 474 CA LYS A 149 3.997 7.732 -3.729 1.00 0.00 C ATOM 475 C LYS A 149 5.417 7.584 -3.270 1.00 0.00 C ATOM 476 O LYS A 149 6.319 7.405 -4.087 1.00 0.00 O ATOM 477 CB LYS A 149 3.422 9.008 -3.065 1.00 0.00 C ATOM 478 CG LYS A 149 2.186 9.573 -3.777 1.00 0.00 C ATOM 479 CD LYS A 149 1.555 10.742 -3.007 1.00 0.00 C ATOM 480 CE LYS A 149 0.349 11.361 -3.724 1.00 0.00 C ATOM 481 NZ LYS A 149 -0.186 12.511 -2.960 1.00 0.00 N ATOM 0 H LYS A 149 2.871 6.586 -2.422 1.00 0.00 H new ATOM 0 HA LYS A 149 3.899 7.849 -4.808 1.00 0.00 H new ATOM 0 HB2 LYS A 149 3.163 8.783 -2.031 1.00 0.00 H new ATOM 0 HB3 LYS A 149 4.197 9.774 -3.040 1.00 0.00 H new ATOM 0 HG2 LYS A 149 2.466 9.907 -4.776 1.00 0.00 H new ATOM 0 HG3 LYS A 149 1.447 8.781 -3.901 1.00 0.00 H new ATOM 0 HD2 LYS A 149 1.244 10.393 -2.022 1.00 0.00 H new ATOM 0 HD3 LYS A 149 2.309 11.513 -2.848 1.00 0.00 H new ATOM 0 HE2 LYS A 149 0.642 11.687 -4.722 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -0.430 10.609 -3.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -0.455 13.270 -3.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -1.022 12.210 -2.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 0.542 12.862 -2.305 1.00 0.00 H new ATOM 495 N CYS A 150 5.641 7.688 -1.940 1.00 0.00 N ATOM 496 CA CYS A 150 6.949 7.947 -1.400 1.00 0.00 C ATOM 497 C CYS A 150 7.680 6.671 -1.030 1.00 0.00 C ATOM 498 O CYS A 150 8.910 6.648 -1.018 1.00 0.00 O ATOM 499 CB CYS A 150 6.874 8.983 -0.241 1.00 0.00 C ATOM 500 SG CYS A 150 6.250 8.397 1.369 1.00 0.00 S ATOM 0 H CYS A 150 4.910 7.592 -1.235 1.00 0.00 H new ATOM 0 HA CYS A 150 7.556 8.401 -2.183 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.874 9.389 -0.087 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.241 9.808 -0.567 1.00 0.00 H new ATOM 0 HG CYS A 150 5.136 7.751 1.193 1.00 0.00 H new ATOM 505 N GLY A 151 6.938 5.572 -0.748 1.00 0.00 N ATOM 506 CA GLY A 151 7.506 4.268 -0.479 1.00 0.00 C ATOM 507 C GLY A 151 7.843 4.051 0.962 1.00 0.00 C ATOM 508 O GLY A 151 8.532 3.087 1.287 1.00 0.00 O ATOM 0 H GLY A 151 5.919 5.587 -0.705 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.801 3.500 -0.799 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.408 4.142 -1.078 1.00 0.00 H new ATOM 512 N LYS A 152 7.382 4.951 1.867 1.00 0.00 N ATOM 513 CA LYS A 152 7.544 4.823 3.299 1.00 0.00 C ATOM 514 C LYS A 152 6.819 3.590 3.778 1.00 0.00 C ATOM 515 O LYS A 152 5.727 3.286 3.302 1.00 0.00 O ATOM 516 CB LYS A 152 6.974 6.059 4.038 1.00 0.00 C ATOM 517 CG LYS A 152 7.096 6.043 5.570 1.00 0.00 C ATOM 518 CD LYS A 152 6.525 7.311 6.224 1.00 0.00 C ATOM 519 CE LYS A 152 6.507 7.258 7.759 1.00 0.00 C ATOM 520 NZ LYS A 152 7.877 7.148 8.313 1.00 0.00 N ATOM 0 H LYS A 152 6.880 5.796 1.594 1.00 0.00 H new ATOM 0 HA LYS A 152 8.610 4.746 3.515 1.00 0.00 H new ATOM 0 HB2 LYS A 152 7.481 6.948 3.662 1.00 0.00 H new ATOM 0 HB3 LYS A 152 5.920 6.159 3.778 1.00 0.00 H new ATOM 0 HG2 LYS A 152 6.574 5.170 5.963 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.145 5.938 5.846 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.115 8.171 5.906 1.00 0.00 H new ATOM 0 HD3 LYS A 152 5.509 7.470 5.863 1.00 0.00 H new ATOM 0 HE2 LYS A 152 6.026 8.155 8.150 1.00 0.00 H new ATOM 0 HE3 LYS A 152 5.911 6.407 8.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 7.832 7.149 9.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 8.314 6.263 7.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 8.448 7.955 7.991 1.00 0.00 H new ATOM 534 N SER A 153 7.444 2.838 4.719 1.00 0.00 N ATOM 535 CA SER A 153 6.878 1.629 5.267 1.00 0.00 C ATOM 536 C SER A 153 5.880 2.007 6.329 1.00 0.00 C ATOM 537 O SER A 153 6.161 2.811 7.217 1.00 0.00 O ATOM 538 CB SER A 153 7.928 0.651 5.861 1.00 0.00 C ATOM 539 OG SER A 153 8.796 1.284 6.795 1.00 0.00 O ATOM 0 H SER A 153 8.358 3.074 5.105 1.00 0.00 H new ATOM 0 HA SER A 153 6.406 1.094 4.443 1.00 0.00 H new ATOM 0 HB2 SER A 153 7.413 -0.176 6.351 1.00 0.00 H new ATOM 0 HB3 SER A 153 8.520 0.223 5.052 1.00 0.00 H new ATOM 0 HG SER A 153 8.304 1.978 7.281 1.00 0.00 H new ATOM 545 N LEU A 154 4.667 1.434 6.208 1.00 0.00 N ATOM 546 CA LEU A 154 3.517 1.736 7.019 1.00 0.00 C ATOM 547 C LEU A 154 3.119 0.402 7.569 1.00 0.00 C ATOM 548 O LEU A 154 3.453 -0.630 6.986 1.00 0.00 O ATOM 549 CB LEU A 154 2.348 2.344 6.204 1.00 0.00 C ATOM 550 CG LEU A 154 2.805 3.425 5.191 1.00 0.00 C ATOM 551 CD1 LEU A 154 1.693 3.757 4.183 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.356 4.694 5.869 1.00 0.00 C ATOM 0 H LEU A 154 4.475 0.720 5.506 1.00 0.00 H new ATOM 0 HA LEU A 154 3.750 2.482 7.779 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.835 1.546 5.667 1.00 0.00 H new ATOM 0 HB3 LEU A 154 1.624 2.782 6.891 1.00 0.00 H new ATOM 0 HG LEU A 154 3.639 2.993 4.638 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.047 4.518 3.488 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.423 2.858 3.630 1.00 0.00 H new ATOM 0 HD13 LEU A 154 0.819 4.131 4.716 1.00 0.00 H new ATOM 0 HD21 LEU A 154 3.659 5.412 5.107 1.00 0.00 H new ATOM 0 HD22 LEU A 154 2.582 5.136 6.497 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.217 4.433 6.484 1.00 0.00 H new ATOM 564 N GLU A 155 2.401 0.382 8.717 1.00 0.00 N ATOM 565 CA GLU A 155 2.008 -0.848 9.364 1.00 0.00 C ATOM 566 C GLU A 155 0.773 -1.352 8.663 1.00 0.00 C ATOM 567 O GLU A 155 0.880 -2.077 7.677 1.00 0.00 O ATOM 568 CB GLU A 155 1.783 -0.678 10.888 1.00 0.00 C ATOM 569 CG GLU A 155 1.514 -2.002 11.631 1.00 0.00 C ATOM 570 CD GLU A 155 1.332 -1.730 13.123 1.00 0.00 C ATOM 571 OE1 GLU A 155 2.310 -1.262 13.765 1.00 0.00 O ATOM 572 OE2 GLU A 155 0.213 -1.988 13.641 1.00 0.00 O ATOM 0 H GLU A 155 2.090 1.224 9.202 1.00 0.00 H new ATOM 0 HA GLU A 155 2.814 -1.577 9.282 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.660 -0.200 11.324 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.941 -0.005 11.048 1.00 0.00 H new ATOM 0 HG2 GLU A 155 0.622 -2.481 11.228 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.344 -2.692 11.476 1.00 0.00 H new ATOM 579 N SER A 156 -0.424 -0.953 9.148 1.00 0.00 N ATOM 580 CA SER A 156 -1.694 -1.289 8.559 1.00 0.00 C ATOM 581 C SER A 156 -2.146 -0.035 7.855 1.00 0.00 C ATOM 582 O SER A 156 -1.405 0.510 7.039 1.00 0.00 O ATOM 583 CB SER A 156 -2.713 -1.824 9.605 1.00 0.00 C ATOM 584 OG SER A 156 -2.799 -0.996 10.762 1.00 0.00 O ATOM 0 H SER A 156 -0.511 -0.374 9.983 1.00 0.00 H new ATOM 0 HA SER A 156 -1.610 -2.116 7.854 1.00 0.00 H new ATOM 0 HB2 SER A 156 -3.697 -1.898 9.142 1.00 0.00 H new ATOM 0 HB3 SER A 156 -2.425 -2.832 9.905 1.00 0.00 H new ATOM 0 HG SER A 156 -3.453 -1.374 11.387 1.00 0.00 H new ATOM 590 N THR A 157 -3.368 0.462 8.163 1.00 0.00 N ATOM 591 CA THR A 157 -3.920 1.668 7.593 1.00 0.00 C ATOM 592 C THR A 157 -3.441 2.848 8.421 1.00 0.00 C ATOM 593 O THR A 157 -2.261 2.921 8.764 1.00 0.00 O ATOM 594 CB THR A 157 -5.436 1.600 7.426 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.095 1.255 8.641 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.772 0.553 6.341 1.00 0.00 C ATOM 0 H THR A 157 -3.993 0.010 8.831 1.00 0.00 H new ATOM 0 HA THR A 157 -3.557 1.795 6.573 1.00 0.00 H new ATOM 0 HB THR A 157 -5.789 2.589 7.133 1.00 0.00 H new ATOM 0 HG1 THR A 157 -7.063 1.224 8.491 1.00 0.00 H new ATOM 0 HG21 THR A 157 -6.853 0.496 6.213 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.310 0.845 5.398 1.00 0.00 H new ATOM 0 HG23 THR A 157 -5.391 -0.422 6.645 1.00 0.00 H new ATOM 604 N THR A 158 -4.343 3.819 8.721 1.00 0.00 N ATOM 605 CA THR A 158 -4.054 5.097 9.344 1.00 0.00 C ATOM 606 C THR A 158 -3.255 5.915 8.357 1.00 0.00 C ATOM 607 O THR A 158 -2.092 6.252 8.574 1.00 0.00 O ATOM 608 CB THR A 158 -3.425 5.044 10.734 1.00 0.00 C ATOM 609 OG1 THR A 158 -4.115 4.103 11.548 1.00 0.00 O ATOM 610 CG2 THR A 158 -3.475 6.429 11.416 1.00 0.00 C ATOM 0 H THR A 158 -5.336 3.706 8.516 1.00 0.00 H new ATOM 0 HA THR A 158 -5.007 5.578 9.565 1.00 0.00 H new ATOM 0 HB THR A 158 -2.384 4.742 10.618 1.00 0.00 H new ATOM 0 HG1 THR A 158 -3.703 4.075 12.437 1.00 0.00 H new ATOM 0 HG21 THR A 158 -3.021 6.364 12.405 1.00 0.00 H new ATOM 0 HG22 THR A 158 -2.927 7.152 10.812 1.00 0.00 H new ATOM 0 HG23 THR A 158 -4.512 6.749 11.514 1.00 0.00 H new ATOM 618 N LEU A 159 -3.900 6.191 7.206 1.00 0.00 N ATOM 619 CA LEU A 159 -3.281 6.802 6.064 1.00 0.00 C ATOM 620 C LEU A 159 -4.431 7.236 5.199 1.00 0.00 C ATOM 621 O LEU A 159 -5.589 7.093 5.590 1.00 0.00 O ATOM 622 CB LEU A 159 -2.290 5.854 5.322 1.00 0.00 C ATOM 623 CG LEU A 159 -2.800 4.425 4.996 1.00 0.00 C ATOM 624 CD1 LEU A 159 -3.586 4.349 3.679 1.00 0.00 C ATOM 625 CD2 LEU A 159 -1.652 3.399 4.968 1.00 0.00 C ATOM 0 H LEU A 159 -4.888 5.982 7.064 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.649 7.642 6.352 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.998 6.332 4.387 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.389 5.763 5.928 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.485 4.175 5.807 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -3.914 3.323 3.510 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -4.456 5.004 3.736 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -2.947 4.666 2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.052 2.412 4.736 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.927 3.685 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -1.163 3.373 5.942 1.00 0.00 H new ATOM 637 N THR A 160 -4.140 7.799 4.001 1.00 0.00 N ATOM 638 CA THR A 160 -5.157 8.245 3.074 1.00 0.00 C ATOM 639 C THR A 160 -5.286 7.197 1.996 1.00 0.00 C ATOM 640 O THR A 160 -4.326 6.893 1.291 1.00 0.00 O ATOM 641 CB THR A 160 -4.868 9.616 2.468 1.00 0.00 C ATOM 642 OG1 THR A 160 -3.563 9.692 1.905 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.995 10.676 3.584 1.00 0.00 C ATOM 0 H THR A 160 -3.187 7.948 3.669 1.00 0.00 H new ATOM 0 HA THR A 160 -6.093 8.366 3.620 1.00 0.00 H new ATOM 0 HB THR A 160 -5.584 9.792 1.665 1.00 0.00 H new ATOM 0 HG1 THR A 160 -3.443 10.564 1.475 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.792 11.664 3.172 1.00 0.00 H new ATOM 0 HG22 THR A 160 -6.005 10.654 3.994 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.278 10.459 4.375 1.00 0.00 H new ATOM 651 N GLU A 161 -6.497 6.608 1.853 1.00 0.00 N ATOM 652 CA GLU A 161 -6.753 5.601 0.853 1.00 0.00 C ATOM 653 C GLU A 161 -7.464 6.268 -0.286 1.00 0.00 C ATOM 654 O GLU A 161 -8.529 6.858 -0.113 1.00 0.00 O ATOM 655 CB GLU A 161 -7.638 4.411 1.313 1.00 0.00 C ATOM 656 CG GLU A 161 -6.959 3.450 2.311 1.00 0.00 C ATOM 657 CD GLU A 161 -7.352 3.736 3.763 1.00 0.00 C ATOM 658 OE1 GLU A 161 -7.072 4.858 4.258 1.00 0.00 O ATOM 659 OE2 GLU A 161 -7.941 2.821 4.400 1.00 0.00 O ATOM 0 H GLU A 161 -7.305 6.831 2.435 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.782 5.179 0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.545 4.806 1.770 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -7.945 3.843 0.435 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -7.227 2.423 2.061 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -5.877 3.531 2.209 1.00 0.00 H new ATOM 666 N LYS A 162 -6.874 6.138 -1.495 1.00 0.00 N ATOM 667 CA LYS A 162 -7.540 6.359 -2.753 1.00 0.00 C ATOM 668 C LYS A 162 -7.845 4.961 -3.204 1.00 0.00 C ATOM 669 O LYS A 162 -7.078 4.048 -2.908 1.00 0.00 O ATOM 670 CB LYS A 162 -6.630 7.064 -3.790 1.00 0.00 C ATOM 671 CG LYS A 162 -7.261 7.289 -5.175 1.00 0.00 C ATOM 672 CD LYS A 162 -6.309 7.991 -6.154 1.00 0.00 C ATOM 673 CE LYS A 162 -6.908 8.160 -7.556 1.00 0.00 C ATOM 674 NZ LYS A 162 -5.944 8.820 -8.466 1.00 0.00 N ATOM 0 H LYS A 162 -5.896 5.869 -1.602 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.411 7.007 -2.654 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -6.328 8.030 -3.386 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -5.723 6.472 -3.914 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -7.561 6.328 -5.593 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -8.166 7.886 -5.064 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -6.046 8.971 -5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.384 7.418 -6.227 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -7.185 7.185 -7.958 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -7.822 8.751 -7.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -6.371 8.924 -9.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -5.700 9.759 -8.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -5.083 8.242 -8.538 1.00 0.00 H new ATOM 688 N GLU A 163 -8.981 4.746 -3.910 1.00 0.00 N ATOM 689 CA GLU A 163 -9.408 3.432 -4.340 1.00 0.00 C ATOM 690 C GLU A 163 -8.560 2.990 -5.504 1.00 0.00 C ATOM 691 O GLU A 163 -8.808 3.362 -6.649 1.00 0.00 O ATOM 692 CB GLU A 163 -10.898 3.385 -4.746 1.00 0.00 C ATOM 693 CG GLU A 163 -11.838 3.728 -3.577 1.00 0.00 C ATOM 694 CD GLU A 163 -13.292 3.643 -4.039 1.00 0.00 C ATOM 695 OE1 GLU A 163 -13.729 2.523 -4.419 1.00 0.00 O ATOM 696 OE2 GLU A 163 -13.986 4.694 -4.016 1.00 0.00 O ATOM 0 H GLU A 163 -9.615 5.495 -4.188 1.00 0.00 H new ATOM 0 HA GLU A 163 -9.286 2.760 -3.491 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -11.071 4.084 -5.564 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -11.138 2.390 -5.121 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -11.669 3.040 -2.749 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -11.622 4.730 -3.207 1.00 0.00 H new ATOM 703 N GLY A 164 -7.506 2.201 -5.197 1.00 0.00 N ATOM 704 CA GLY A 164 -6.523 1.787 -6.155 1.00 0.00 C ATOM 705 C GLY A 164 -5.196 1.769 -5.464 1.00 0.00 C ATOM 706 O GLY A 164 -4.508 0.749 -5.479 1.00 0.00 O ATOM 0 H GLY A 164 -7.335 1.843 -4.257 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -6.764 0.799 -6.548 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -6.504 2.471 -7.003 1.00 0.00 H new ATOM 710 N GLU A 165 -4.795 2.922 -4.867 1.00 0.00 N ATOM 711 CA GLU A 165 -3.452 3.126 -4.372 1.00 0.00 C ATOM 712 C GLU A 165 -3.516 3.737 -3.005 1.00 0.00 C ATOM 713 O GLU A 165 -4.281 4.671 -2.774 1.00 0.00 O ATOM 714 CB GLU A 165 -2.633 4.090 -5.264 1.00 0.00 C ATOM 715 CG GLU A 165 -2.380 3.541 -6.680 1.00 0.00 C ATOM 716 CD GLU A 165 -1.617 4.574 -7.507 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.452 4.885 -7.142 1.00 0.00 O ATOM 718 OE2 GLU A 165 -2.189 5.065 -8.516 1.00 0.00 O ATOM 0 H GLU A 165 -5.411 3.723 -4.726 1.00 0.00 H new ATOM 0 HA GLU A 165 -2.967 2.150 -4.365 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -3.160 5.041 -5.339 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -1.676 4.293 -4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -1.810 2.614 -6.624 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -3.328 3.304 -7.163 1.00 0.00 H new ATOM 725 N ILE A 166 -2.672 3.240 -2.062 1.00 0.00 N ATOM 726 CA ILE A 166 -2.531 3.833 -0.750 1.00 0.00 C ATOM 727 C ILE A 166 -1.439 4.858 -0.853 1.00 0.00 C ATOM 728 O ILE A 166 -0.508 4.710 -1.640 1.00 0.00 O ATOM 729 CB ILE A 166 -2.225 2.864 0.391 1.00 0.00 C ATOM 730 CG1 ILE A 166 -0.888 2.101 0.239 1.00 0.00 C ATOM 731 CG2 ILE A 166 -3.423 1.905 0.539 1.00 0.00 C ATOM 732 CD1 ILE A 166 -0.590 1.196 1.438 1.00 0.00 C ATOM 0 H ILE A 166 -2.083 2.421 -2.211 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.500 4.255 -0.483 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.088 3.448 1.301 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -0.919 1.498 -0.669 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.076 2.818 0.118 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -3.228 1.202 1.349 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -4.322 2.478 0.764 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.567 1.356 -0.392 1.00 0.00 H new ATOM 0 HD11 ILE A 166 0.359 0.684 1.280 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -0.531 1.800 2.344 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -1.386 0.459 1.545 1.00 0.00 H new ATOM 744 N TYR A 167 -1.563 5.944 -0.066 1.00 0.00 N ATOM 745 CA TYR A 167 -0.647 7.057 -0.055 1.00 0.00 C ATOM 746 C TYR A 167 -0.612 7.422 1.393 1.00 0.00 C ATOM 747 O TYR A 167 -1.640 7.308 2.056 1.00 0.00 O ATOM 748 CB TYR A 167 -1.136 8.335 -0.789 1.00 0.00 C ATOM 749 CG TYR A 167 -1.522 8.093 -2.222 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.651 7.459 -3.122 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.758 8.568 -2.696 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.998 7.319 -4.473 1.00 0.00 C ATOM 753 CE2 TYR A 167 -3.108 8.430 -4.044 1.00 0.00 C ATOM 754 CZ TYR A 167 -2.226 7.808 -4.936 1.00 0.00 C ATOM 755 OH TYR A 167 -2.571 7.686 -6.300 1.00 0.00 O ATOM 0 H TYR A 167 -2.333 6.056 0.593 1.00 0.00 H new ATOM 0 HA TYR A 167 0.281 6.761 -0.545 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -1.993 8.746 -0.255 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.348 9.088 -0.755 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.295 7.075 -2.770 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -3.445 9.045 -2.012 1.00 0.00 H new ATOM 0 HE1 TYR A 167 -0.318 6.834 -5.157 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -4.058 8.803 -4.396 1.00 0.00 H new ATOM 0 HH TYR A 167 -1.845 7.239 -6.782 1.00 0.00 H new ATOM 765 N CYS A 168 0.554 7.814 1.969 1.00 0.00 N ATOM 766 CA CYS A 168 0.610 7.945 3.406 1.00 0.00 C ATOM 767 C CYS A 168 0.254 9.359 3.738 1.00 0.00 C ATOM 768 O CYS A 168 0.347 10.240 2.886 1.00 0.00 O ATOM 769 CB CYS A 168 1.925 7.458 4.059 1.00 0.00 C ATOM 770 SG CYS A 168 3.428 8.420 3.751 1.00 0.00 S ATOM 0 H CYS A 168 1.417 8.030 1.470 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.115 7.262 3.850 1.00 0.00 H new ATOM 0 HB2 CYS A 168 1.769 7.417 5.137 1.00 0.00 H new ATOM 0 HB3 CYS A 168 2.107 6.437 3.725 1.00 0.00 H new ATOM 0 HG CYS A 168 3.297 9.086 2.642 1.00 0.00 H new ATOM 775 N LYS A 169 -0.206 9.594 4.986 1.00 0.00 N ATOM 776 CA LYS A 169 -0.812 10.839 5.400 1.00 0.00 C ATOM 777 C LYS A 169 0.187 11.962 5.516 1.00 0.00 C ATOM 778 O LYS A 169 -0.197 13.130 5.529 1.00 0.00 O ATOM 779 CB LYS A 169 -1.576 10.681 6.737 1.00 0.00 C ATOM 780 CG LYS A 169 -0.725 10.158 7.907 1.00 0.00 C ATOM 781 CD LYS A 169 -1.550 9.927 9.184 1.00 0.00 C ATOM 782 CE LYS A 169 -0.713 9.479 10.392 1.00 0.00 C ATOM 783 NZ LYS A 169 -0.052 8.176 10.144 1.00 0.00 N ATOM 0 H LYS A 169 -0.157 8.901 5.732 1.00 0.00 H new ATOM 0 HA LYS A 169 -1.519 11.102 4.614 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -1.997 11.647 7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -2.414 10.001 6.583 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -0.247 9.223 7.614 1.00 0.00 H new ATOM 0 HG3 LYS A 169 0.072 10.871 8.118 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -2.073 10.849 9.439 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -2.311 9.173 8.982 1.00 0.00 H new ATOM 0 HE2 LYS A 169 0.041 10.234 10.613 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -1.353 9.401 11.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 0.183 7.727 11.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -0.694 7.558 9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 0.820 8.327 9.597 1.00 0.00 H new ATOM 797 N GLY A 170 1.502 11.633 5.567 1.00 0.00 N ATOM 798 CA GLY A 170 2.567 12.599 5.647 1.00 0.00 C ATOM 799 C GLY A 170 2.830 13.212 4.302 1.00 0.00 C ATOM 800 O GLY A 170 2.967 14.430 4.194 1.00 0.00 O ATOM 0 H GLY A 170 1.831 10.668 5.552 1.00 0.00 H new ATOM 0 HA2 GLY A 170 2.305 13.378 6.362 1.00 0.00 H new ATOM 0 HA3 GLY A 170 3.473 12.119 6.017 1.00 0.00 H new ATOM 804 N CYS A 171 2.914 12.370 3.242 1.00 0.00 N ATOM 805 CA CYS A 171 3.264 12.808 1.909 1.00 0.00 C ATOM 806 C CYS A 171 2.060 13.325 1.159 1.00 0.00 C ATOM 807 O CYS A 171 2.210 14.023 0.160 1.00 0.00 O ATOM 808 CB CYS A 171 3.972 11.702 1.076 1.00 0.00 C ATOM 809 SG CYS A 171 2.983 10.277 0.608 1.00 0.00 S ATOM 0 H CYS A 171 2.736 11.368 3.310 1.00 0.00 H new ATOM 0 HA CYS A 171 3.974 13.624 2.043 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.360 12.159 0.166 1.00 0.00 H new ATOM 0 HB3 CYS A 171 4.831 11.346 1.645 1.00 0.00 H new ATOM 0 HG CYS A 171 1.952 10.187 1.395 1.00 0.00 H new ATOM 814 N TYR A 172 0.836 12.989 1.632 1.00 0.00 N ATOM 815 CA TYR A 172 -0.410 13.376 1.011 1.00 0.00 C ATOM 816 C TYR A 172 -0.753 14.767 1.476 1.00 0.00 C ATOM 817 O TYR A 172 -1.261 15.577 0.701 1.00 0.00 O ATOM 818 CB TYR A 172 -1.549 12.394 1.390 1.00 0.00 C ATOM 819 CG TYR A 172 -2.761 12.557 0.512 1.00 0.00 C ATOM 820 CD1 TYR A 172 -2.814 11.921 -0.740 1.00 0.00 C ATOM 821 CD2 TYR A 172 -3.865 13.316 0.936 1.00 0.00 C ATOM 822 CE1 TYR A 172 -3.946 12.041 -1.556 1.00 0.00 C ATOM 823 CE2 TYR A 172 -5.000 13.438 0.125 1.00 0.00 C ATOM 824 CZ TYR A 172 -5.042 12.800 -1.123 1.00 0.00 C ATOM 825 OH TYR A 172 -6.187 12.918 -1.942 1.00 0.00 O ATOM 0 H TYR A 172 0.707 12.429 2.475 1.00 0.00 H new ATOM 0 HA TYR A 172 -0.300 13.351 -0.073 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -1.183 11.370 1.314 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.833 12.554 2.430 1.00 0.00 H new ATOM 0 HD1 TYR A 172 -1.973 11.333 -1.077 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.838 13.810 1.896 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -3.974 11.550 -2.517 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -5.843 14.024 0.461 1.00 0.00 H new ATOM 0 HH TYR A 172 -6.854 13.477 -1.493 1.00 0.00 H new ATOM 835 N ALA A 173 -0.448 15.073 2.763 1.00 0.00 N ATOM 836 CA ALA A 173 -0.658 16.369 3.365 1.00 0.00 C ATOM 837 C ALA A 173 0.342 17.368 2.843 1.00 0.00 C ATOM 838 O ALA A 173 0.053 18.562 2.777 1.00 0.00 O ATOM 839 CB ALA A 173 -0.514 16.322 4.897 1.00 0.00 C ATOM 0 H ALA A 173 -0.041 14.394 3.406 1.00 0.00 H new ATOM 0 HA ALA A 173 -1.673 16.667 3.104 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -0.680 17.318 5.309 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -1.249 15.631 5.311 1.00 0.00 H new ATOM 0 HB3 ALA A 173 0.489 15.984 5.158 1.00 0.00 H new ATOM 845 N LYS A 174 1.541 16.881 2.435 1.00 0.00 N ATOM 846 CA LYS A 174 2.593 17.682 1.855 1.00 0.00 C ATOM 847 C LYS A 174 2.201 18.051 0.447 1.00 0.00 C ATOM 848 O LYS A 174 2.215 19.225 0.079 1.00 0.00 O ATOM 849 CB LYS A 174 3.933 16.905 1.830 1.00 0.00 C ATOM 850 CG LYS A 174 5.156 17.622 1.217 1.00 0.00 C ATOM 851 CD LYS A 174 5.761 18.764 2.059 1.00 0.00 C ATOM 852 CE LYS A 174 5.127 20.155 1.881 1.00 0.00 C ATOM 853 NZ LYS A 174 5.228 20.623 0.478 1.00 0.00 N ATOM 0 H LYS A 174 1.786 15.894 2.512 1.00 0.00 H new ATOM 0 HA LYS A 174 2.730 18.578 2.461 1.00 0.00 H new ATOM 0 HB2 LYS A 174 4.182 16.629 2.855 1.00 0.00 H new ATOM 0 HB3 LYS A 174 3.775 15.977 1.280 1.00 0.00 H new ATOM 0 HG2 LYS A 174 5.934 16.880 1.035 1.00 0.00 H new ATOM 0 HG3 LYS A 174 4.867 18.026 0.247 1.00 0.00 H new ATOM 0 HD2 LYS A 174 5.689 18.488 3.111 1.00 0.00 H new ATOM 0 HD3 LYS A 174 6.822 18.839 1.821 1.00 0.00 H new ATOM 0 HE2 LYS A 174 4.079 20.119 2.179 1.00 0.00 H new ATOM 0 HE3 LYS A 174 5.622 20.868 2.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 5.064 21.649 0.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 6.177 20.411 0.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 4.514 20.137 -0.102 1.00 0.00 H new ATOM 867 N ASN A 175 1.813 17.038 -0.361 1.00 0.00 N ATOM 868 CA ASN A 175 1.401 17.220 -1.731 1.00 0.00 C ATOM 869 C ASN A 175 -0.085 17.592 -1.713 1.00 0.00 C ATOM 870 O ASN A 175 -0.426 18.725 -2.146 1.00 0.00 O ATOM 871 CB ASN A 175 1.542 15.935 -2.583 1.00 0.00 C ATOM 872 CG ASN A 175 3.017 15.516 -2.694 1.00 0.00 C ATOM 873 OD1 ASN A 175 3.933 16.328 -2.522 1.00 0.00 O ATOM 874 ND2 ASN A 175 3.233 14.201 -3.001 1.00 0.00 N ATOM 0 H ASN A 175 1.784 16.065 -0.055 1.00 0.00 H new ATOM 0 HA ASN A 175 2.038 17.986 -2.173 1.00 0.00 H new ATOM 0 HB2 ASN A 175 0.963 15.129 -2.133 1.00 0.00 H new ATOM 0 HB3 ASN A 175 1.131 16.106 -3.578 1.00 0.00 H new ATOM 0 HD21 ASN A 175 4.186 13.850 -3.098 1.00 0.00 H new ATOM 0 HD22 ASN A 175 2.441 13.571 -3.133 1.00 0.00 H new