USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 662 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 150 GLN : amide:sc= 0.97 K(o=2,f=0.41) USER MOD Set 1.2: A 196 HIS : no HE2:sc= 1.05 K(o=2,f=-7.3!) USER MOD Set 2.1: A 173 SER OG : rot 76:sc= 0.323 USER MOD Set 2.2: A 174 ASN : amide:sc= 0.486 K(o=0.81,f=-2.2!) USER MOD Set 3.1: A 149 TYR OH : rot 165:sc= -0.324 USER MOD Set 3.2: A 202 HIS : no HD1:sc= -0.647 K(o=-0.97,f=1.7) USER MOD Single : A 147 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.1) USER MOD Single : A 155 CYS SG : rot 69:sc= 0.781 USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 THR OG1 : rot -30:sc= 1.25 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 166 HIS : no HD1:sc= -0.24 X(o=-0.24,f=0) USER MOD Single : A 169 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 THR OG1 : rot -95:sc= -0.177! USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 183 THR OG1 : rot -150:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -2.87! C(o=-2.9!,f=-8.6!) USER MOD Single : A 192 THR OG1 : rot 180:sc= -0.245 USER MOD Single : A 194 THR OG1 : rot 180:sc= 0 USER MOD Single : A 199 MET CE :methyl 163:sc= -0.166 (180deg=-0.806) USER MOD Single : A 203 THR OG1 : rot 180:sc= 0 USER MOD Single : A 206 LYS NZ :NH3+ -174:sc= 1.22 (180deg=1.08) USER MOD Single : A 215 SER OG : rot -80:sc= 1.18 USER MOD Single : A 217 GLN : amide:sc= -1.26 K(o=-1.3,f=-3.1!) USER MOD Single : A 221 TYR OH : rot 52:sc= 0.675 USER MOD Single : A 224 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 146 5.191 14.496 -1.849 1.00 33.02 N ATOM 66 CA LEU A 146 4.019 13.712 -1.936 1.00 11.12 C ATOM 67 C LEU A 146 3.921 13.085 -0.574 1.00 25.41 C ATOM 68 O LEU A 146 4.947 12.690 -0.023 1.00 51.33 O ATOM 69 CB LEU A 146 4.127 12.630 -3.029 1.00 60.30 C ATOM 70 CG LEU A 146 4.185 13.089 -4.507 1.00 62.42 C ATOM 71 CD1 LEU A 146 5.495 13.786 -4.859 1.00 53.31 C ATOM 72 CD2 LEU A 146 3.935 11.918 -5.441 1.00 34.43 C ATOM 0 HA LEU A 146 3.144 14.303 -2.208 1.00 11.12 H new ATOM 0 HB2 LEU A 146 5.022 12.041 -2.828 1.00 60.30 H new ATOM 0 HB3 LEU A 146 3.274 11.961 -2.921 1.00 60.30 H new ATOM 0 HG LEU A 146 3.392 13.826 -4.638 1.00 62.42 H new ATOM 0 HD11 LEU A 146 5.478 14.085 -5.907 1.00 53.31 H new ATOM 0 HD12 LEU A 146 5.617 14.669 -4.232 1.00 53.31 H new ATOM 0 HD13 LEU A 146 6.327 13.103 -4.690 1.00 53.31 H new ATOM 0 HD21 LEU A 146 3.980 12.261 -6.475 1.00 34.43 H new ATOM 0 HD22 LEU A 146 4.696 11.154 -5.279 1.00 34.43 H new ATOM 0 HD23 LEU A 146 2.950 11.497 -5.241 1.00 34.43 H new ATOM 84 N GLN A 147 2.755 13.030 -0.010 1.00 34.23 N ATOM 85 CA GLN A 147 2.624 12.574 1.350 1.00 34.02 C ATOM 86 C GLN A 147 2.586 11.061 1.403 1.00 51.24 C ATOM 87 O GLN A 147 1.745 10.431 0.744 1.00 3.14 O ATOM 88 CB GLN A 147 1.406 13.206 2.026 1.00 20.42 C ATOM 89 CG GLN A 147 1.477 14.737 2.110 1.00 43.51 C ATOM 90 CD GLN A 147 2.666 15.251 2.934 1.00 34.55 C ATOM 91 OE1 GLN A 147 2.559 15.446 4.149 1.00 74.03 O ATOM 92 NE2 GLN A 147 3.787 15.503 2.284 1.00 63.14 N ATOM 0 H GLN A 147 1.880 13.293 -0.463 1.00 34.23 H new ATOM 0 HA GLN A 147 3.501 12.897 1.911 1.00 34.02 H new ATOM 0 HB2 GLN A 147 0.508 12.922 1.478 1.00 20.42 H new ATOM 0 HB3 GLN A 147 1.307 12.799 3.032 1.00 20.42 H new ATOM 0 HG2 GLN A 147 1.540 15.146 1.101 1.00 43.51 H new ATOM 0 HG3 GLN A 147 0.552 15.112 2.548 1.00 43.51 H new ATOM 0 HE21 GLN A 147 3.844 15.331 1.280 1.00 63.14 H new ATOM 0 HE22 GLN A 147 4.596 15.869 2.786 1.00 63.14 H new ATOM 101 N PRO A 148 3.540 10.459 2.130 1.00 31.31 N ATOM 102 CA PRO A 148 3.649 9.020 2.248 1.00 71.40 C ATOM 103 C PRO A 148 2.633 8.404 3.200 1.00 22.42 C ATOM 104 O PRO A 148 2.700 8.586 4.400 1.00 71.21 O ATOM 105 CB PRO A 148 5.073 8.797 2.769 1.00 3.00 C ATOM 106 CG PRO A 148 5.418 10.046 3.503 1.00 52.21 C ATOM 107 CD PRO A 148 4.623 11.156 2.869 1.00 15.54 C ATOM 0 HA PRO A 148 3.447 8.539 1.291 1.00 71.40 H new ATOM 0 HB2 PRO A 148 5.121 7.928 3.425 1.00 3.00 H new ATOM 0 HB3 PRO A 148 5.769 8.616 1.950 1.00 3.00 H new ATOM 0 HG2 PRO A 148 5.175 9.952 4.561 1.00 52.21 H new ATOM 0 HG3 PRO A 148 6.487 10.250 3.438 1.00 52.21 H new ATOM 0 HD2 PRO A 148 4.219 11.834 3.620 1.00 15.54 H new ATOM 0 HD3 PRO A 148 5.240 11.754 2.199 1.00 15.54 H new ATOM 115 N TYR A 149 1.692 7.733 2.644 1.00 32.54 N ATOM 116 CA TYR A 149 0.730 6.949 3.375 1.00 74.30 C ATOM 117 C TYR A 149 1.236 5.518 3.413 1.00 4.41 C ATOM 118 O TYR A 149 1.802 5.041 2.436 1.00 14.51 O ATOM 119 CB TYR A 149 -0.634 6.980 2.673 1.00 63.11 C ATOM 120 CG TYR A 149 -1.250 8.346 2.619 1.00 62.32 C ATOM 121 CD1 TYR A 149 -1.931 8.845 3.708 1.00 1.42 C ATOM 122 CD2 TYR A 149 -1.143 9.145 1.488 1.00 12.44 C ATOM 123 CE1 TYR A 149 -2.484 10.096 3.688 1.00 5.41 C ATOM 124 CE2 TYR A 149 -1.705 10.403 1.463 1.00 40.51 C ATOM 125 CZ TYR A 149 -2.365 10.870 2.555 1.00 40.23 C ATOM 126 OH TYR A 149 -2.893 12.119 2.522 1.00 2.20 O ATOM 0 H TYR A 149 1.554 7.705 1.634 1.00 32.54 H new ATOM 0 HA TYR A 149 0.610 7.353 4.380 1.00 74.30 H new ATOM 0 HB2 TYR A 149 -0.519 6.602 1.657 1.00 63.11 H new ATOM 0 HB3 TYR A 149 -1.315 6.304 3.190 1.00 63.11 H new ATOM 0 HD1 TYR A 149 -2.030 8.236 4.595 1.00 1.42 H new ATOM 0 HD2 TYR A 149 -0.615 8.777 0.621 1.00 12.44 H new ATOM 0 HE1 TYR A 149 -3.009 10.473 4.553 1.00 5.41 H new ATOM 0 HE2 TYR A 149 -1.621 11.016 0.578 1.00 40.51 H new ATOM 0 HH TYR A 149 -2.522 12.611 1.760 1.00 2.20 H new ATOM 136 N GLN A 150 1.046 4.846 4.503 1.00 20.14 N ATOM 137 CA GLN A 150 1.499 3.484 4.624 1.00 72.31 C ATOM 138 C GLN A 150 0.269 2.625 4.634 1.00 42.34 C ATOM 139 O GLN A 150 -0.552 2.725 5.541 1.00 72.32 O ATOM 140 CB GLN A 150 2.289 3.223 5.947 1.00 41.44 C ATOM 141 CG GLN A 150 2.712 4.459 6.752 1.00 50.45 C ATOM 142 CD GLN A 150 3.636 5.409 6.013 1.00 32.12 C ATOM 143 OE1 GLN A 150 4.448 5.017 5.177 1.00 73.35 O ATOM 144 NE2 GLN A 150 3.490 6.662 6.295 1.00 2.44 N ATOM 0 H GLN A 150 0.578 5.215 5.331 1.00 20.14 H new ATOM 0 HA GLN A 150 2.175 3.263 3.798 1.00 72.31 H new ATOM 0 HB2 GLN A 150 1.676 2.591 6.590 1.00 41.44 H new ATOM 0 HB3 GLN A 150 3.185 2.654 5.701 1.00 41.44 H new ATOM 0 HG2 GLN A 150 1.817 5.004 7.053 1.00 50.45 H new ATOM 0 HG3 GLN A 150 3.207 4.129 7.666 1.00 50.45 H new ATOM 0 HE21 GLN A 150 2.806 6.951 6.994 1.00 2.44 H new ATOM 0 HE22 GLN A 150 4.059 7.362 5.818 1.00 2.44 H new ATOM 153 N VAL A 151 0.120 1.814 3.642 1.00 51.02 N ATOM 154 CA VAL A 151 -1.027 0.963 3.544 1.00 3.43 C ATOM 155 C VAL A 151 -0.593 -0.451 3.841 1.00 43.31 C ATOM 156 O VAL A 151 0.076 -1.083 3.034 1.00 3.32 O ATOM 157 CB VAL A 151 -1.660 1.027 2.123 1.00 30.43 C ATOM 158 CG1 VAL A 151 -2.912 0.169 2.032 1.00 24.04 C ATOM 159 CG2 VAL A 151 -1.969 2.465 1.728 1.00 20.11 C ATOM 0 H VAL A 151 0.786 1.719 2.875 1.00 51.02 H new ATOM 0 HA VAL A 151 -1.780 1.296 4.258 1.00 3.43 H new ATOM 0 HB VAL A 151 -0.928 0.627 1.422 1.00 30.43 H new ATOM 0 HG11 VAL A 151 -3.328 0.237 1.027 1.00 24.04 H new ATOM 0 HG12 VAL A 151 -2.659 -0.868 2.250 1.00 24.04 H new ATOM 0 HG13 VAL A 151 -3.648 0.522 2.754 1.00 24.04 H new ATOM 0 HG21 VAL A 151 -2.410 2.482 0.731 1.00 20.11 H new ATOM 0 HG22 VAL A 151 -2.670 2.896 2.443 1.00 20.11 H new ATOM 0 HG23 VAL A 151 -1.048 3.048 1.727 1.00 20.11 H new ATOM 169 N ARG A 152 -0.923 -0.924 5.009 1.00 53.54 N ATOM 170 CA ARG A 152 -0.532 -2.249 5.397 1.00 61.35 C ATOM 171 C ARG A 152 -1.682 -3.228 5.271 1.00 31.12 C ATOM 172 O ARG A 152 -2.699 -3.132 5.972 1.00 1.44 O ATOM 173 CB ARG A 152 0.165 -2.280 6.781 1.00 22.51 C ATOM 174 CG ARG A 152 -0.584 -1.598 7.918 1.00 62.01 C ATOM 175 CD ARG A 152 0.228 -1.608 9.216 1.00 64.24 C ATOM 176 NE ARG A 152 1.551 -0.948 9.070 1.00 42.43 N ATOM 177 CZ ARG A 152 1.919 0.218 9.641 1.00 71.33 C ATOM 178 NH1 ARG A 152 1.058 0.912 10.370 1.00 53.24 N ATOM 179 NH2 ARG A 152 3.152 0.677 9.479 1.00 1.43 N ATOM 0 H ARG A 152 -1.461 -0.413 5.708 1.00 53.54 H new ATOM 0 HA ARG A 152 0.228 -2.585 4.692 1.00 61.35 H new ATOM 0 HB2 ARG A 152 0.336 -3.321 7.057 1.00 22.51 H new ATOM 0 HB3 ARG A 152 1.144 -1.811 6.684 1.00 22.51 H new ATOM 0 HG2 ARG A 152 -0.811 -0.569 7.639 1.00 62.01 H new ATOM 0 HG3 ARG A 152 -1.537 -2.102 8.081 1.00 62.01 H new ATOM 0 HD2 ARG A 152 -0.340 -1.105 9.999 1.00 64.24 H new ATOM 0 HD3 ARG A 152 0.374 -2.638 9.540 1.00 64.24 H new ATOM 0 HE ARG A 152 2.243 -1.418 8.486 1.00 42.43 H new ATOM 0 HH11 ARG A 152 0.108 0.566 10.504 1.00 53.24 H new ATOM 0 HH12 ARG A 152 1.345 1.792 10.798 1.00 53.24 H new ATOM 0 HH21 ARG A 152 3.824 0.149 8.922 1.00 1.43 H new ATOM 0 HH22 ARG A 152 3.429 1.558 9.911 1.00 1.43 H new ATOM 193 N VAL A 153 -1.533 -4.119 4.331 1.00 74.21 N ATOM 194 CA VAL A 153 -2.509 -5.143 4.041 1.00 53.21 C ATOM 195 C VAL A 153 -1.951 -6.510 4.416 1.00 23.23 C ATOM 196 O VAL A 153 -0.841 -6.865 4.039 1.00 4.23 O ATOM 197 CB VAL A 153 -2.987 -5.124 2.527 1.00 20.12 C ATOM 198 CG1 VAL A 153 -1.823 -4.937 1.576 1.00 71.31 C ATOM 199 CG2 VAL A 153 -3.683 -6.423 2.174 1.00 0.22 C ATOM 0 H VAL A 153 -0.711 -4.158 3.728 1.00 74.21 H new ATOM 0 HA VAL A 153 -3.392 -4.933 4.645 1.00 53.21 H new ATOM 0 HB VAL A 153 -3.674 -4.284 2.423 1.00 20.12 H new ATOM 0 HG11 VAL A 153 -2.189 -4.929 0.549 1.00 71.31 H new ATOM 0 HG12 VAL A 153 -1.326 -3.991 1.791 1.00 71.31 H new ATOM 0 HG13 VAL A 153 -1.115 -5.756 1.702 1.00 71.31 H new ATOM 0 HG21 VAL A 153 -4.004 -6.393 1.133 1.00 0.22 H new ATOM 0 HG22 VAL A 153 -2.994 -7.255 2.317 1.00 0.22 H new ATOM 0 HG23 VAL A 153 -4.552 -6.557 2.818 1.00 0.22 H new ATOM 209 N ILE A 154 -2.697 -7.232 5.186 1.00 31.11 N ATOM 210 CA ILE A 154 -2.341 -8.561 5.587 1.00 42.33 C ATOM 211 C ILE A 154 -3.144 -9.553 4.740 1.00 75.14 C ATOM 212 O ILE A 154 -4.374 -9.461 4.676 1.00 54.34 O ATOM 213 CB ILE A 154 -2.602 -8.763 7.118 1.00 23.21 C ATOM 214 CG1 ILE A 154 -2.459 -10.233 7.547 1.00 21.44 C ATOM 215 CG2 ILE A 154 -3.943 -8.165 7.564 1.00 13.23 C ATOM 216 CD1 ILE A 154 -2.757 -10.471 9.017 1.00 10.53 C ATOM 0 H ILE A 154 -3.589 -6.912 5.563 1.00 31.11 H new ATOM 0 HA ILE A 154 -1.277 -8.732 5.423 1.00 42.33 H new ATOM 0 HB ILE A 154 -1.821 -8.207 7.637 1.00 23.21 H new ATOM 0 HG12 ILE A 154 -3.131 -10.845 6.945 1.00 21.44 H new ATOM 0 HG13 ILE A 154 -1.444 -10.568 7.332 1.00 21.44 H new ATOM 0 HG21 ILE A 154 -4.078 -8.331 8.633 1.00 13.23 H new ATOM 0 HG22 ILE A 154 -3.950 -7.094 7.359 1.00 13.23 H new ATOM 0 HG23 ILE A 154 -4.755 -8.644 7.017 1.00 13.23 H new ATOM 0 HD11 ILE A 154 -2.636 -11.530 9.246 1.00 10.53 H new ATOM 0 HD12 ILE A 154 -2.068 -9.887 9.627 1.00 10.53 H new ATOM 0 HD13 ILE A 154 -3.781 -10.168 9.234 1.00 10.53 H new ATOM 228 N CYS A 155 -2.477 -10.468 4.074 1.00 55.12 N ATOM 229 CA CYS A 155 -3.147 -11.386 3.206 1.00 70.34 C ATOM 230 C CYS A 155 -2.429 -12.705 3.214 1.00 1.20 C ATOM 231 O CYS A 155 -1.428 -12.876 3.932 1.00 14.44 O ATOM 232 CB CYS A 155 -3.180 -10.826 1.773 1.00 61.34 C ATOM 233 SG CYS A 155 -1.560 -10.668 0.999 1.00 22.51 S ATOM 0 H CYS A 155 -1.465 -10.590 4.123 1.00 55.12 H new ATOM 0 HA CYS A 155 -4.169 -11.527 3.558 1.00 70.34 H new ATOM 0 HB2 CYS A 155 -3.802 -11.475 1.156 1.00 61.34 H new ATOM 0 HB3 CYS A 155 -3.659 -9.847 1.789 1.00 61.34 H new ATOM 0 HG CYS A 155 -1.076 -11.851 0.759 1.00 22.51 H new ATOM 239 N ARG A 156 -2.960 -13.634 2.462 1.00 11.31 N ATOM 240 CA ARG A 156 -2.315 -14.922 2.224 1.00 12.31 C ATOM 241 C ARG A 156 -0.998 -14.689 1.449 1.00 24.40 C ATOM 242 O ARG A 156 -0.904 -13.738 0.657 1.00 2.21 O ATOM 243 CB ARG A 156 -3.235 -15.835 1.395 1.00 34.51 C ATOM 244 CG ARG A 156 -4.527 -16.253 2.083 1.00 55.33 C ATOM 245 CD ARG A 156 -4.267 -17.178 3.260 1.00 64.00 C ATOM 246 NE ARG A 156 -5.515 -17.569 3.925 1.00 2.24 N ATOM 247 CZ ARG A 156 -5.649 -18.576 4.801 1.00 73.32 C ATOM 248 NH1 ARG A 156 -4.623 -19.341 5.101 1.00 51.30 N ATOM 249 NH2 ARG A 156 -6.821 -18.812 5.363 1.00 42.02 N ATOM 0 H ARG A 156 -3.858 -13.528 1.989 1.00 11.31 H new ATOM 0 HA ARG A 156 -2.110 -15.402 3.181 1.00 12.31 H new ATOM 0 HB2 ARG A 156 -3.486 -15.323 0.466 1.00 34.51 H new ATOM 0 HB3 ARG A 156 -2.680 -16.733 1.124 1.00 34.51 H new ATOM 0 HG2 ARG A 156 -5.058 -15.366 2.428 1.00 55.33 H new ATOM 0 HG3 ARG A 156 -5.176 -16.753 1.364 1.00 55.33 H new ATOM 0 HD2 ARG A 156 -3.743 -18.069 2.914 1.00 64.00 H new ATOM 0 HD3 ARG A 156 -3.612 -16.681 3.976 1.00 64.00 H new ATOM 0 HE ARG A 156 -6.352 -17.029 3.702 1.00 2.24 H new ATOM 0 HH11 ARG A 156 -3.716 -19.171 4.667 1.00 51.30 H new ATOM 0 HH12 ARG A 156 -4.734 -20.104 5.768 1.00 51.30 H new ATOM 0 HH21 ARG A 156 -7.625 -18.228 5.131 1.00 42.02 H new ATOM 0 HH22 ARG A 156 -6.922 -19.578 6.029 1.00 42.02 H new ATOM 263 N PRO A 157 0.035 -15.508 1.684 1.00 71.52 N ATOM 264 CA PRO A 157 1.336 -15.382 0.998 1.00 54.50 C ATOM 265 C PRO A 157 1.255 -15.393 -0.527 1.00 22.45 C ATOM 266 O PRO A 157 1.844 -14.528 -1.177 1.00 23.20 O ATOM 267 CB PRO A 157 2.141 -16.564 1.512 1.00 14.51 C ATOM 268 CG PRO A 157 1.532 -16.878 2.828 1.00 44.21 C ATOM 269 CD PRO A 157 0.069 -16.583 2.693 1.00 10.05 C ATOM 0 HA PRO A 157 1.786 -14.414 1.216 1.00 54.50 H new ATOM 0 HB2 PRO A 157 2.079 -17.414 0.832 1.00 14.51 H new ATOM 0 HB3 PRO A 157 3.197 -16.313 1.612 1.00 14.51 H new ATOM 0 HG2 PRO A 157 1.696 -17.922 3.093 1.00 44.21 H new ATOM 0 HG3 PRO A 157 1.979 -16.275 3.618 1.00 44.21 H new ATOM 0 HD2 PRO A 157 -0.490 -17.460 2.367 1.00 10.05 H new ATOM 0 HD3 PRO A 157 -0.366 -16.261 3.639 1.00 10.05 H new ATOM 277 N LYS A 158 0.512 -16.331 -1.092 1.00 65.22 N ATOM 278 CA LYS A 158 0.353 -16.417 -2.546 1.00 73.12 C ATOM 279 C LYS A 158 -0.468 -15.248 -3.074 1.00 3.45 C ATOM 280 O LYS A 158 -0.476 -14.966 -4.270 1.00 71.20 O ATOM 281 CB LYS A 158 -0.309 -17.736 -2.956 1.00 12.11 C ATOM 282 CG LYS A 158 0.516 -18.977 -2.665 1.00 25.23 C ATOM 283 CD LYS A 158 -0.274 -20.240 -2.971 1.00 44.11 C ATOM 284 CE LYS A 158 0.546 -21.493 -2.708 1.00 51.25 C ATOM 285 NZ LYS A 158 -0.264 -22.717 -2.856 1.00 23.15 N ATOM 0 H LYS A 158 0.006 -17.047 -0.570 1.00 65.22 H new ATOM 0 HA LYS A 158 1.351 -16.377 -2.983 1.00 73.12 H new ATOM 0 HB2 LYS A 158 -1.265 -17.823 -2.440 1.00 12.11 H new ATOM 0 HB3 LYS A 158 -0.525 -17.702 -4.024 1.00 12.11 H new ATOM 0 HG2 LYS A 158 1.428 -18.960 -3.262 1.00 25.23 H new ATOM 0 HG3 LYS A 158 0.820 -18.979 -1.618 1.00 25.23 H new ATOM 0 HD2 LYS A 158 -1.177 -20.261 -2.361 1.00 44.11 H new ATOM 0 HD3 LYS A 158 -0.593 -20.226 -4.013 1.00 44.11 H new ATOM 0 HE2 LYS A 158 1.388 -21.528 -3.399 1.00 51.25 H new ATOM 0 HE3 LYS A 158 0.961 -21.451 -1.701 1.00 51.25 H new ATOM 0 HZ1 LYS A 158 0.329 -23.551 -2.669 1.00 23.15 H new ATOM 0 HZ2 LYS A 158 -1.053 -22.695 -2.179 1.00 23.15 H new ATOM 0 HZ3 LYS A 158 -0.640 -22.770 -3.824 1.00 23.15 H new ATOM 299 N ALA A 159 -1.116 -14.540 -2.171 1.00 32.12 N ATOM 300 CA ALA A 159 -1.974 -13.454 -2.550 1.00 43.53 C ATOM 301 C ALA A 159 -1.165 -12.203 -2.737 1.00 25.30 C ATOM 302 O ALA A 159 -1.440 -11.420 -3.635 1.00 61.35 O ATOM 303 CB ALA A 159 -3.100 -13.244 -1.544 1.00 43.25 C ATOM 0 H ALA A 159 -1.059 -14.705 -1.166 1.00 32.12 H new ATOM 0 HA ALA A 159 -2.446 -13.708 -3.499 1.00 43.53 H new ATOM 0 HB1 ALA A 159 -3.727 -12.413 -1.868 1.00 43.25 H new ATOM 0 HB2 ALA A 159 -3.703 -14.149 -1.479 1.00 43.25 H new ATOM 0 HB3 ALA A 159 -2.676 -13.019 -0.565 1.00 43.25 H new ATOM 309 N GLU A 160 -0.114 -12.082 -1.925 1.00 32.25 N ATOM 310 CA GLU A 160 0.818 -10.950 -1.906 1.00 40.52 C ATOM 311 C GLU A 160 1.223 -10.556 -3.291 1.00 40.43 C ATOM 312 O GLU A 160 1.057 -9.411 -3.682 1.00 34.43 O ATOM 313 CB GLU A 160 2.047 -11.340 -1.018 1.00 62.22 C ATOM 314 CG GLU A 160 3.275 -10.387 -0.959 1.00 42.41 C ATOM 315 CD GLU A 160 4.175 -10.398 -2.198 1.00 14.13 C ATOM 316 OE1 GLU A 160 4.416 -11.491 -2.766 1.00 31.44 O ATOM 317 OE2 GLU A 160 4.687 -9.332 -2.582 1.00 32.14 O ATOM 0 H GLU A 160 0.122 -12.796 -1.236 1.00 32.25 H new ATOM 0 HA GLU A 160 0.332 -10.074 -1.476 1.00 40.52 H new ATOM 0 HB2 GLU A 160 1.686 -11.473 0.002 1.00 62.22 H new ATOM 0 HB3 GLU A 160 2.403 -12.312 -1.359 1.00 62.22 H new ATOM 0 HG2 GLU A 160 2.917 -9.370 -0.800 1.00 42.41 H new ATOM 0 HG3 GLU A 160 3.878 -10.652 -0.090 1.00 42.41 H new ATOM 324 N THR A 161 1.654 -11.516 -4.044 1.00 51.12 N ATOM 325 CA THR A 161 2.197 -11.252 -5.343 1.00 53.25 C ATOM 326 C THR A 161 1.139 -10.666 -6.325 1.00 72.32 C ATOM 327 O THR A 161 1.452 -9.773 -7.131 1.00 62.03 O ATOM 328 CB THR A 161 2.892 -12.509 -5.891 1.00 73.13 C ATOM 329 OG1 THR A 161 3.746 -13.042 -4.844 1.00 72.11 O ATOM 330 CG2 THR A 161 3.760 -12.173 -7.099 1.00 23.41 C ATOM 0 H THR A 161 1.641 -12.501 -3.781 1.00 51.12 H new ATOM 0 HA THR A 161 2.952 -10.472 -5.243 1.00 53.25 H new ATOM 0 HB THR A 161 2.134 -13.230 -6.197 1.00 73.13 H new ATOM 0 HG1 THR A 161 4.065 -12.309 -4.278 1.00 72.11 H new ATOM 0 HG21 THR A 161 4.240 -13.080 -7.466 1.00 23.41 H new ATOM 0 HG22 THR A 161 3.138 -11.747 -7.887 1.00 23.41 H new ATOM 0 HG23 THR A 161 4.523 -11.451 -6.809 1.00 23.41 H new ATOM 338 N TYR A 162 -0.114 -11.104 -6.238 1.00 34.35 N ATOM 339 CA TYR A 162 -1.118 -10.527 -7.102 1.00 54.42 C ATOM 340 C TYR A 162 -1.754 -9.275 -6.513 1.00 35.33 C ATOM 341 O TYR A 162 -2.181 -8.394 -7.252 1.00 63.20 O ATOM 342 CB TYR A 162 -2.151 -11.533 -7.674 1.00 30.22 C ATOM 343 CG TYR A 162 -2.963 -12.355 -6.689 1.00 40.22 C ATOM 344 CD1 TYR A 162 -4.053 -11.814 -6.017 1.00 43.34 C ATOM 345 CD2 TYR A 162 -2.672 -13.698 -6.483 1.00 52.15 C ATOM 346 CE1 TYR A 162 -4.821 -12.586 -5.167 1.00 21.34 C ATOM 347 CE2 TYR A 162 -3.430 -14.472 -5.629 1.00 11.42 C ATOM 348 CZ TYR A 162 -4.503 -13.915 -4.977 1.00 65.31 C ATOM 349 OH TYR A 162 -5.281 -14.695 -4.140 1.00 30.23 O ATOM 0 H TYR A 162 -0.443 -11.829 -5.601 1.00 34.35 H new ATOM 0 HA TYR A 162 -0.562 -10.204 -7.983 1.00 54.42 H new ATOM 0 HB2 TYR A 162 -2.849 -10.976 -8.300 1.00 30.22 H new ATOM 0 HB3 TYR A 162 -1.618 -12.224 -8.327 1.00 30.22 H new ATOM 0 HD1 TYR A 162 -4.303 -10.773 -6.162 1.00 43.34 H new ATOM 0 HD2 TYR A 162 -1.836 -14.144 -7.001 1.00 52.15 H new ATOM 0 HE1 TYR A 162 -5.666 -12.151 -4.654 1.00 21.34 H new ATOM 0 HE2 TYR A 162 -3.181 -15.511 -5.474 1.00 11.42 H new ATOM 0 HH TYR A 162 -4.923 -15.607 -4.116 1.00 30.23 H new ATOM 359 N VAL A 163 -1.769 -9.169 -5.184 1.00 15.33 N ATOM 360 CA VAL A 163 -2.317 -7.988 -4.530 1.00 44.22 C ATOM 361 C VAL A 163 -1.392 -6.814 -4.797 1.00 71.02 C ATOM 362 O VAL A 163 -1.831 -5.718 -5.116 1.00 4.33 O ATOM 363 CB VAL A 163 -2.509 -8.213 -2.992 1.00 71.11 C ATOM 364 CG1 VAL A 163 -2.914 -6.930 -2.285 1.00 14.21 C ATOM 365 CG2 VAL A 163 -3.567 -9.279 -2.740 1.00 2.42 C ATOM 0 H VAL A 163 -1.411 -9.881 -4.547 1.00 15.33 H new ATOM 0 HA VAL A 163 -3.306 -7.781 -4.939 1.00 44.22 H new ATOM 0 HB VAL A 163 -1.551 -8.542 -2.590 1.00 71.11 H new ATOM 0 HG11 VAL A 163 -3.038 -7.125 -1.220 1.00 14.21 H new ATOM 0 HG12 VAL A 163 -2.140 -6.176 -2.428 1.00 14.21 H new ATOM 0 HG13 VAL A 163 -3.855 -6.568 -2.699 1.00 14.21 H new ATOM 0 HG21 VAL A 163 -3.689 -9.424 -1.667 1.00 2.42 H new ATOM 0 HG22 VAL A 163 -4.515 -8.960 -3.173 1.00 2.42 H new ATOM 0 HG23 VAL A 163 -3.255 -10.217 -3.200 1.00 2.42 H new ATOM 375 N ARG A 164 -0.113 -7.099 -4.732 1.00 24.13 N ATOM 376 CA ARG A 164 0.946 -6.142 -4.978 1.00 33.23 C ATOM 377 C ARG A 164 0.828 -5.558 -6.376 1.00 21.01 C ATOM 378 O ARG A 164 0.883 -4.342 -6.554 1.00 23.21 O ATOM 379 CB ARG A 164 2.264 -6.862 -4.819 1.00 54.20 C ATOM 380 CG ARG A 164 3.491 -6.012 -4.858 1.00 24.22 C ATOM 381 CD ARG A 164 4.681 -6.881 -4.605 1.00 53.41 C ATOM 382 NE ARG A 164 5.904 -6.127 -4.443 1.00 53.25 N ATOM 383 CZ ARG A 164 6.928 -6.542 -3.713 1.00 72.41 C ATOM 384 NH1 ARG A 164 6.837 -7.678 -3.004 1.00 20.42 N ATOM 385 NH2 ARG A 164 8.041 -5.820 -3.671 1.00 11.41 N ATOM 0 H ARG A 164 0.232 -8.030 -4.500 1.00 24.13 H new ATOM 0 HA ARG A 164 0.876 -5.316 -4.271 1.00 33.23 H new ATOM 0 HB2 ARG A 164 2.249 -7.398 -3.870 1.00 54.20 H new ATOM 0 HB3 ARG A 164 2.342 -7.611 -5.607 1.00 54.20 H new ATOM 0 HG2 ARG A 164 3.580 -5.521 -5.827 1.00 24.22 H new ATOM 0 HG3 ARG A 164 3.430 -5.225 -4.106 1.00 24.22 H new ATOM 0 HD2 ARG A 164 4.506 -7.476 -3.709 1.00 53.41 H new ATOM 0 HD3 ARG A 164 4.798 -7.579 -5.434 1.00 53.41 H new ATOM 0 HE ARG A 164 5.982 -5.227 -4.916 1.00 53.25 H new ATOM 0 HH11 ARG A 164 5.977 -8.225 -3.026 1.00 20.42 H new ATOM 0 HH12 ARG A 164 7.628 -7.994 -2.443 1.00 20.42 H new ATOM 0 HH21 ARG A 164 8.105 -4.950 -4.199 1.00 11.41 H new ATOM 0 HH22 ARG A 164 8.833 -6.135 -3.110 1.00 11.41 H new ATOM 399 N ALA A 165 0.620 -6.428 -7.352 1.00 22.23 N ATOM 400 CA ALA A 165 0.469 -6.014 -8.737 1.00 21.23 C ATOM 401 C ALA A 165 -0.758 -5.123 -8.893 1.00 0.41 C ATOM 402 O ALA A 165 -0.706 -4.089 -9.566 1.00 31.25 O ATOM 403 CB ALA A 165 0.374 -7.230 -9.648 1.00 15.31 C ATOM 0 H ALA A 165 0.551 -7.435 -7.207 1.00 22.23 H new ATOM 0 HA ALA A 165 1.348 -5.439 -9.027 1.00 21.23 H new ATOM 0 HB1 ALA A 165 0.261 -6.902 -10.681 1.00 15.31 H new ATOM 0 HB2 ALA A 165 1.281 -7.827 -9.553 1.00 15.31 H new ATOM 0 HB3 ALA A 165 -0.488 -7.832 -9.362 1.00 15.31 H new ATOM 409 N HIS A 166 -1.834 -5.500 -8.211 1.00 15.32 N ATOM 410 CA HIS A 166 -3.080 -4.749 -8.250 1.00 50.34 C ATOM 411 C HIS A 166 -2.875 -3.363 -7.645 1.00 40.55 C ATOM 412 O HIS A 166 -3.368 -2.362 -8.176 1.00 62.12 O ATOM 413 CB HIS A 166 -4.211 -5.525 -7.529 1.00 55.21 C ATOM 414 CG HIS A 166 -5.557 -4.834 -7.520 1.00 23.11 C ATOM 415 ND1 HIS A 166 -6.531 -5.022 -8.474 1.00 42.53 N ATOM 416 CD2 HIS A 166 -6.073 -3.951 -6.633 1.00 43.35 C ATOM 417 CE1 HIS A 166 -7.584 -4.267 -8.152 1.00 64.42 C ATOM 418 NE2 HIS A 166 -7.357 -3.588 -7.033 1.00 13.51 N ATOM 0 H HIS A 166 -1.866 -6.330 -7.619 1.00 15.32 H new ATOM 0 HA HIS A 166 -3.385 -4.622 -9.289 1.00 50.34 H new ATOM 0 HB2 HIS A 166 -4.323 -6.499 -8.005 1.00 55.21 H new ATOM 0 HB3 HIS A 166 -3.906 -5.707 -6.498 1.00 55.21 H new ATOM 0 HD2 HIS A 166 -5.567 -3.585 -5.752 1.00 43.35 H new ATOM 0 HE1 HIS A 166 -8.498 -4.215 -8.725 1.00 64.42 H new ATOM 0 HE2 HIS A 166 -7.989 -2.938 -6.566 1.00 13.51 H new ATOM 426 N ILE A 167 -2.123 -3.310 -6.556 1.00 25.23 N ATOM 427 CA ILE A 167 -1.809 -2.051 -5.907 1.00 44.40 C ATOM 428 C ILE A 167 -1.070 -1.144 -6.864 1.00 14.33 C ATOM 429 O ILE A 167 -1.456 -0.002 -7.041 1.00 5.43 O ATOM 430 CB ILE A 167 -0.984 -2.230 -4.589 1.00 43.41 C ATOM 431 CG1 ILE A 167 -1.783 -3.030 -3.552 1.00 10.02 C ATOM 432 CG2 ILE A 167 -0.565 -0.871 -4.009 1.00 41.10 C ATOM 433 CD1 ILE A 167 -1.021 -3.342 -2.275 1.00 1.42 C ATOM 0 H ILE A 167 -1.718 -4.130 -6.103 1.00 25.23 H new ATOM 0 HA ILE A 167 -2.759 -1.597 -5.624 1.00 44.40 H new ATOM 0 HB ILE A 167 -0.080 -2.787 -4.836 1.00 43.41 H new ATOM 0 HG12 ILE A 167 -2.683 -2.472 -3.296 1.00 10.02 H new ATOM 0 HG13 ILE A 167 -2.107 -3.967 -4.005 1.00 10.02 H new ATOM 0 HG21 ILE A 167 0.007 -1.027 -3.094 1.00 41.10 H new ATOM 0 HG22 ILE A 167 0.050 -0.340 -4.735 1.00 41.10 H new ATOM 0 HG23 ILE A 167 -1.454 -0.281 -3.786 1.00 41.10 H new ATOM 0 HD11 ILE A 167 -1.661 -3.909 -1.599 1.00 1.42 H new ATOM 0 HD12 ILE A 167 -0.135 -3.930 -2.514 1.00 1.42 H new ATOM 0 HD13 ILE A 167 -0.720 -2.411 -1.794 1.00 1.42 H new ATOM 445 N VAL A 168 -0.062 -1.676 -7.529 1.00 40.33 N ATOM 446 CA VAL A 168 0.755 -0.881 -8.452 1.00 30.41 C ATOM 447 C VAL A 168 -0.086 -0.340 -9.604 1.00 30.33 C ATOM 448 O VAL A 168 0.023 0.831 -9.971 1.00 50.44 O ATOM 449 CB VAL A 168 1.982 -1.675 -9.008 1.00 72.31 C ATOM 450 CG1 VAL A 168 2.836 -0.809 -9.933 1.00 70.44 C ATOM 451 CG2 VAL A 168 2.837 -2.233 -7.881 1.00 11.34 C ATOM 0 H VAL A 168 0.218 -2.654 -7.453 1.00 40.33 H new ATOM 0 HA VAL A 168 1.145 -0.044 -7.872 1.00 30.41 H new ATOM 0 HB VAL A 168 1.585 -2.509 -9.587 1.00 72.31 H new ATOM 0 HG11 VAL A 168 3.680 -1.392 -10.301 1.00 70.44 H new ATOM 0 HG12 VAL A 168 2.232 -0.472 -10.776 1.00 70.44 H new ATOM 0 HG13 VAL A 168 3.206 0.056 -9.383 1.00 70.44 H new ATOM 0 HG21 VAL A 168 3.681 -2.779 -8.301 1.00 11.34 H new ATOM 0 HG22 VAL A 168 3.206 -1.414 -7.264 1.00 11.34 H new ATOM 0 HG23 VAL A 168 2.237 -2.907 -7.269 1.00 11.34 H new ATOM 461 N GLN A 169 -0.953 -1.164 -10.126 1.00 35.14 N ATOM 462 CA GLN A 169 -1.774 -0.766 -11.241 1.00 14.53 C ATOM 463 C GLN A 169 -2.788 0.263 -10.837 1.00 12.44 C ATOM 464 O GLN A 169 -2.992 1.258 -11.547 1.00 3.40 O ATOM 465 CB GLN A 169 -2.480 -1.953 -11.879 1.00 33.32 C ATOM 466 CG GLN A 169 -1.567 -3.003 -12.464 1.00 42.14 C ATOM 467 CD GLN A 169 -2.349 -4.144 -13.076 1.00 0.14 C ATOM 468 OE1 GLN A 169 -2.654 -5.140 -12.411 1.00 21.43 O ATOM 469 NE2 GLN A 169 -2.684 -4.014 -14.335 1.00 43.14 N ATOM 0 H GLN A 169 -1.111 -2.117 -9.798 1.00 35.14 H new ATOM 0 HA GLN A 169 -1.101 -0.328 -11.978 1.00 14.53 H new ATOM 0 HB2 GLN A 169 -3.116 -2.424 -11.129 1.00 33.32 H new ATOM 0 HB3 GLN A 169 -3.136 -1.585 -12.667 1.00 33.32 H new ATOM 0 HG2 GLN A 169 -0.930 -2.550 -13.223 1.00 42.14 H new ATOM 0 HG3 GLN A 169 -0.909 -3.389 -11.685 1.00 42.14 H new ATOM 0 HE21 GLN A 169 -2.414 -3.177 -14.851 1.00 43.14 H new ATOM 0 HE22 GLN A 169 -3.215 -4.750 -14.800 1.00 43.14 H new ATOM 478 N ARG A 170 -3.390 0.075 -9.692 1.00 43.15 N ATOM 479 CA ARG A 170 -4.455 0.936 -9.326 1.00 21.20 C ATOM 480 C ARG A 170 -3.944 2.227 -8.693 1.00 44.40 C ATOM 481 O ARG A 170 -4.654 3.221 -8.640 1.00 65.22 O ATOM 482 CB ARG A 170 -5.499 0.213 -8.487 1.00 20.10 C ATOM 483 CG ARG A 170 -6.844 0.906 -8.490 1.00 74.41 C ATOM 484 CD ARG A 170 -7.906 0.055 -7.843 1.00 2.22 C ATOM 485 NE ARG A 170 -9.217 0.689 -7.928 1.00 3.31 N ATOM 486 CZ ARG A 170 -10.286 0.331 -7.228 1.00 65.14 C ATOM 487 NH1 ARG A 170 -10.228 -0.681 -6.366 1.00 51.52 N ATOM 488 NH2 ARG A 170 -11.420 0.972 -7.390 1.00 63.32 N ATOM 0 H ARG A 170 -3.159 -0.654 -9.017 1.00 43.15 H new ATOM 0 HA ARG A 170 -4.970 1.240 -10.237 1.00 21.20 H new ATOM 0 HB2 ARG A 170 -5.619 -0.803 -8.863 1.00 20.10 H new ATOM 0 HB3 ARG A 170 -5.140 0.133 -7.461 1.00 20.10 H new ATOM 0 HG2 ARG A 170 -6.766 1.856 -7.962 1.00 74.41 H new ATOM 0 HG3 ARG A 170 -7.134 1.135 -9.515 1.00 74.41 H new ATOM 0 HD2 ARG A 170 -7.939 -0.920 -8.328 1.00 2.22 H new ATOM 0 HD3 ARG A 170 -7.650 -0.118 -6.798 1.00 2.22 H new ATOM 0 HE ARG A 170 -9.320 1.469 -8.577 1.00 3.31 H new ATOM 0 HH11 ARG A 170 -9.355 -1.192 -6.237 1.00 51.52 H new ATOM 0 HH12 ARG A 170 -11.057 -0.946 -5.834 1.00 51.52 H new ATOM 0 HH21 ARG A 170 -11.479 1.744 -8.053 1.00 63.32 H new ATOM 0 HH22 ARG A 170 -12.242 0.698 -6.852 1.00 63.32 H new ATOM 502 N THR A 171 -2.708 2.234 -8.243 1.00 54.13 N ATOM 503 CA THR A 171 -2.142 3.455 -7.765 1.00 21.22 C ATOM 504 C THR A 171 -1.676 4.289 -8.942 1.00 65.53 C ATOM 505 O THR A 171 -1.857 5.517 -8.954 1.00 45.04 O ATOM 506 CB THR A 171 -1.010 3.215 -6.762 1.00 41.24 C ATOM 507 OG1 THR A 171 -0.126 2.231 -7.277 1.00 51.32 O ATOM 508 CG2 THR A 171 -1.570 2.763 -5.426 1.00 55.34 C ATOM 0 H THR A 171 -2.094 1.420 -8.202 1.00 54.13 H new ATOM 0 HA THR A 171 -2.914 4.003 -7.224 1.00 21.22 H new ATOM 0 HB THR A 171 -0.467 4.148 -6.608 1.00 41.24 H new ATOM 0 HG1 THR A 171 -0.372 1.352 -6.921 1.00 51.32 H new ATOM 0 HG21 THR A 171 -0.751 2.597 -4.726 1.00 55.34 H new ATOM 0 HG22 THR A 171 -2.235 3.531 -5.032 1.00 55.34 H new ATOM 0 HG23 THR A 171 -2.126 1.835 -5.560 1.00 55.34 H new ATOM 516 N SER A 172 -1.162 3.601 -9.974 1.00 12.53 N ATOM 517 CA SER A 172 -0.699 4.237 -11.178 1.00 71.41 C ATOM 518 C SER A 172 -1.846 5.019 -11.831 1.00 1.12 C ATOM 519 O SER A 172 -1.685 6.191 -12.200 1.00 45.24 O ATOM 520 CB SER A 172 -0.139 3.176 -12.142 1.00 31.02 C ATOM 521 OG SER A 172 0.432 3.763 -13.292 1.00 20.24 O ATOM 0 H SER A 172 -1.064 2.586 -9.979 1.00 12.53 H new ATOM 0 HA SER A 172 0.098 4.940 -10.935 1.00 71.41 H new ATOM 0 HB2 SER A 172 0.613 2.578 -11.627 1.00 31.02 H new ATOM 0 HB3 SER A 172 -0.938 2.497 -12.439 1.00 31.02 H new ATOM 0 HG SER A 172 0.779 3.060 -13.880 1.00 20.24 H new ATOM 527 N SER A 173 -3.009 4.392 -11.917 1.00 4.23 N ATOM 528 CA SER A 173 -4.169 5.019 -12.505 1.00 41.10 C ATOM 529 C SER A 173 -4.712 6.171 -11.640 1.00 52.23 C ATOM 530 O SER A 173 -5.197 7.182 -12.163 1.00 13.21 O ATOM 531 CB SER A 173 -5.254 3.958 -12.751 1.00 25.20 C ATOM 532 OG SER A 173 -5.489 3.174 -11.574 1.00 72.13 O ATOM 0 H SER A 173 -3.169 3.442 -11.582 1.00 4.23 H new ATOM 0 HA SER A 173 -3.869 5.461 -13.455 1.00 41.10 H new ATOM 0 HB2 SER A 173 -6.180 4.445 -13.057 1.00 25.20 H new ATOM 0 HB3 SER A 173 -4.950 3.307 -13.570 1.00 25.20 H new ATOM 0 HG SER A 173 -6.021 3.694 -10.936 1.00 72.13 H new ATOM 538 N ASN A 174 -4.571 6.046 -10.335 1.00 43.41 N ATOM 539 CA ASN A 174 -5.190 6.977 -9.403 1.00 2.20 C ATOM 540 C ASN A 174 -4.245 8.084 -8.921 1.00 70.44 C ATOM 541 O ASN A 174 -4.522 8.721 -7.906 1.00 0.41 O ATOM 542 CB ASN A 174 -5.825 6.233 -8.198 1.00 24.24 C ATOM 543 CG ASN A 174 -7.026 5.347 -8.575 1.00 12.11 C ATOM 544 OD1 ASN A 174 -7.104 4.799 -9.687 1.00 63.51 O ATOM 545 ND2 ASN A 174 -7.965 5.198 -7.662 1.00 44.10 N ATOM 0 H ASN A 174 -4.030 5.304 -9.891 1.00 43.41 H new ATOM 0 HA ASN A 174 -5.981 7.473 -9.966 1.00 2.20 H new ATOM 0 HB2 ASN A 174 -5.064 5.614 -7.724 1.00 24.24 H new ATOM 0 HB3 ASN A 174 -6.145 6.967 -7.458 1.00 24.24 H new ATOM 0 HD21 ASN A 174 -8.782 4.621 -7.860 1.00 44.10 H new ATOM 0 HD22 ASN A 174 -7.874 5.660 -6.757 1.00 44.10 H new ATOM 552 N ASP A 175 -3.148 8.321 -9.660 1.00 5.22 N ATOM 553 CA ASP A 175 -2.161 9.433 -9.367 1.00 3.53 C ATOM 554 C ASP A 175 -1.316 9.184 -8.133 1.00 64.21 C ATOM 555 O ASP A 175 -0.604 10.076 -7.664 1.00 71.34 O ATOM 556 CB ASP A 175 -2.832 10.824 -9.234 1.00 20.02 C ATOM 557 CG ASP A 175 -3.226 11.451 -10.535 1.00 52.21 C ATOM 558 OD1 ASP A 175 -4.269 11.077 -11.103 1.00 43.13 O ATOM 559 OD2 ASP A 175 -2.522 12.376 -10.995 1.00 61.24 O ATOM 0 H ASP A 175 -2.900 7.764 -10.478 1.00 5.22 H new ATOM 0 HA ASP A 175 -1.509 9.434 -10.241 1.00 3.53 H new ATOM 0 HB2 ASP A 175 -3.720 10.727 -8.609 1.00 20.02 H new ATOM 0 HB3 ASP A 175 -2.148 11.495 -8.714 1.00 20.02 H new ATOM 564 N ILE A 176 -1.342 7.992 -7.636 1.00 44.44 N ATOM 565 CA ILE A 176 -0.613 7.678 -6.446 1.00 40.14 C ATOM 566 C ILE A 176 0.720 7.061 -6.850 1.00 72.55 C ATOM 567 O ILE A 176 0.763 6.139 -7.660 1.00 5.22 O ATOM 568 CB ILE A 176 -1.413 6.702 -5.545 1.00 72.15 C ATOM 569 CG1 ILE A 176 -2.803 7.287 -5.223 1.00 61.12 C ATOM 570 CG2 ILE A 176 -0.648 6.431 -4.258 1.00 63.24 C ATOM 571 CD1 ILE A 176 -3.700 6.366 -4.414 1.00 11.50 C ATOM 0 H ILE A 176 -1.863 7.212 -8.037 1.00 44.44 H new ATOM 0 HA ILE A 176 -0.445 8.588 -5.870 1.00 40.14 H new ATOM 0 HB ILE A 176 -1.546 5.762 -6.081 1.00 72.15 H new ATOM 0 HG12 ILE A 176 -2.673 8.220 -4.675 1.00 61.12 H new ATOM 0 HG13 ILE A 176 -3.305 7.534 -6.158 1.00 61.12 H new ATOM 0 HG21 ILE A 176 -1.219 5.744 -3.633 1.00 63.24 H new ATOM 0 HG22 ILE A 176 0.318 5.987 -4.496 1.00 63.24 H new ATOM 0 HG23 ILE A 176 -0.495 7.368 -3.722 1.00 63.24 H new ATOM 0 HD11 ILE A 176 -4.656 6.856 -4.233 1.00 11.50 H new ATOM 0 HD12 ILE A 176 -3.865 5.441 -4.967 1.00 11.50 H new ATOM 0 HD13 ILE A 176 -3.223 6.139 -3.461 1.00 11.50 H new ATOM 583 N THR A 177 1.785 7.589 -6.329 1.00 44.54 N ATOM 584 CA THR A 177 3.102 7.106 -6.648 1.00 72.31 C ATOM 585 C THR A 177 3.539 6.169 -5.526 1.00 4.13 C ATOM 586 O THR A 177 3.127 6.350 -4.392 1.00 33.33 O ATOM 587 CB THR A 177 4.057 8.309 -6.764 1.00 0.51 C ATOM 588 OG1 THR A 177 3.453 9.277 -7.645 1.00 31.05 O ATOM 589 CG2 THR A 177 5.412 7.892 -7.329 1.00 71.43 C ATOM 0 H THR A 177 1.770 8.367 -5.670 1.00 44.54 H new ATOM 0 HA THR A 177 3.112 6.566 -7.595 1.00 72.31 H new ATOM 0 HB THR A 177 4.223 8.728 -5.772 1.00 0.51 H new ATOM 0 HG1 THR A 177 4.044 10.054 -7.732 1.00 31.05 H new ATOM 0 HG21 THR A 177 6.062 8.765 -7.398 1.00 71.43 H new ATOM 0 HG22 THR A 177 5.868 7.151 -6.672 1.00 71.43 H new ATOM 0 HG23 THR A 177 5.276 7.462 -8.321 1.00 71.43 H new ATOM 597 N LEU A 178 4.309 5.169 -5.820 1.00 75.53 N ATOM 598 CA LEU A 178 4.717 4.248 -4.794 1.00 55.14 C ATOM 599 C LEU A 178 6.101 4.589 -4.286 1.00 41.40 C ATOM 600 O LEU A 178 7.014 4.884 -5.066 1.00 4.53 O ATOM 601 CB LEU A 178 4.692 2.775 -5.263 1.00 43.34 C ATOM 602 CG LEU A 178 3.347 2.191 -5.736 1.00 42.42 C ATOM 603 CD1 LEU A 178 2.974 2.670 -7.132 1.00 70.53 C ATOM 604 CD2 LEU A 178 3.378 0.683 -5.677 1.00 24.55 C ATOM 0 H LEU A 178 4.668 4.966 -6.753 1.00 75.53 H new ATOM 0 HA LEU A 178 3.990 4.351 -3.988 1.00 55.14 H new ATOM 0 HB2 LEU A 178 5.407 2.672 -6.079 1.00 43.34 H new ATOM 0 HB3 LEU A 178 5.055 2.157 -4.442 1.00 43.34 H new ATOM 0 HG LEU A 178 2.576 2.554 -5.057 1.00 42.42 H new ATOM 0 HD11 LEU A 178 2.019 2.233 -7.424 1.00 70.53 H new ATOM 0 HD12 LEU A 178 2.891 3.757 -7.134 1.00 70.53 H new ATOM 0 HD13 LEU A 178 3.744 2.364 -7.840 1.00 70.53 H new ATOM 0 HD21 LEU A 178 2.421 0.286 -6.014 1.00 24.55 H new ATOM 0 HD22 LEU A 178 4.173 0.310 -6.322 1.00 24.55 H new ATOM 0 HD23 LEU A 178 3.563 0.363 -4.652 1.00 24.55 H new ATOM 616 N ARG A 179 6.248 4.570 -2.987 1.00 13.03 N ATOM 617 CA ARG A 179 7.529 4.767 -2.342 1.00 34.34 C ATOM 618 C ARG A 179 8.238 3.430 -2.409 1.00 75.41 C ATOM 619 O ARG A 179 9.420 3.331 -2.738 1.00 10.03 O ATOM 620 CB ARG A 179 7.311 5.155 -0.877 1.00 63.42 C ATOM 621 CG ARG A 179 8.548 5.591 -0.115 1.00 14.12 C ATOM 622 CD ARG A 179 8.268 5.643 1.389 1.00 60.54 C ATOM 623 NE ARG A 179 9.260 6.435 2.106 1.00 23.12 N ATOM 624 CZ ARG A 179 10.088 6.045 3.070 1.00 14.52 C ATOM 625 NH1 ARG A 179 10.124 4.777 3.473 1.00 2.32 N ATOM 626 NH2 ARG A 179 10.893 6.945 3.619 1.00 14.45 N ATOM 0 H ARG A 179 5.477 4.416 -2.337 1.00 13.03 H new ATOM 0 HA ARG A 179 8.106 5.556 -2.824 1.00 34.34 H new ATOM 0 HB2 ARG A 179 6.582 5.964 -0.840 1.00 63.42 H new ATOM 0 HB3 ARG A 179 6.869 4.304 -0.358 1.00 63.42 H new ATOM 0 HG2 ARG A 179 9.366 4.899 -0.314 1.00 14.12 H new ATOM 0 HG3 ARG A 179 8.869 6.572 -0.464 1.00 14.12 H new ATOM 0 HD2 ARG A 179 7.277 6.065 1.558 1.00 60.54 H new ATOM 0 HD3 ARG A 179 8.256 4.630 1.790 1.00 60.54 H new ATOM 0 HE ARG A 179 9.327 7.415 1.833 1.00 23.12 H new ATOM 0 HH11 ARG A 179 9.510 4.087 3.041 1.00 2.32 H new ATOM 0 HH12 ARG A 179 10.766 4.495 4.214 1.00 2.32 H new ATOM 0 HH21 ARG A 179 10.868 7.913 3.300 1.00 14.45 H new ATOM 0 HH22 ARG A 179 11.537 6.669 4.360 1.00 14.45 H new ATOM 640 N GLY A 180 7.468 2.416 -2.120 1.00 3.34 N ATOM 641 CA GLY A 180 7.909 1.061 -2.164 1.00 20.23 C ATOM 642 C GLY A 180 6.919 0.195 -1.457 1.00 24.04 C ATOM 643 O GLY A 180 6.007 0.712 -0.794 1.00 72.31 O ATOM 0 H GLY A 180 6.492 2.519 -1.841 1.00 3.34 H new ATOM 0 HA2 GLY A 180 8.020 0.736 -3.199 1.00 20.23 H new ATOM 0 HA3 GLY A 180 8.889 0.970 -1.695 1.00 20.23 H new ATOM 647 N ILE A 181 7.058 -1.086 -1.599 1.00 11.52 N ATOM 648 CA ILE A 181 6.180 -2.024 -0.955 1.00 4.02 C ATOM 649 C ILE A 181 7.007 -2.945 -0.089 1.00 53.14 C ATOM 650 O ILE A 181 7.833 -3.725 -0.584 1.00 34.52 O ATOM 651 CB ILE A 181 5.322 -2.848 -1.971 1.00 22.54 C ATOM 652 CG1 ILE A 181 4.451 -1.895 -2.818 1.00 3.10 C ATOM 653 CG2 ILE A 181 4.441 -3.868 -1.233 1.00 71.53 C ATOM 654 CD1 ILE A 181 3.580 -2.583 -3.849 1.00 53.14 C ATOM 0 H ILE A 181 7.787 -1.517 -2.167 1.00 11.52 H new ATOM 0 HA ILE A 181 5.472 -1.462 -0.346 1.00 4.02 H new ATOM 0 HB ILE A 181 5.993 -3.395 -2.633 1.00 22.54 H new ATOM 0 HG12 ILE A 181 3.812 -1.318 -2.150 1.00 3.10 H new ATOM 0 HG13 ILE A 181 5.103 -1.185 -3.328 1.00 3.10 H new ATOM 0 HG21 ILE A 181 3.852 -4.431 -1.957 1.00 71.53 H new ATOM 0 HG22 ILE A 181 5.073 -4.553 -0.668 1.00 71.53 H new ATOM 0 HG23 ILE A 181 3.772 -3.344 -0.550 1.00 71.53 H new ATOM 0 HD11 ILE A 181 3.004 -1.836 -4.396 1.00 53.14 H new ATOM 0 HD12 ILE A 181 4.209 -3.137 -4.545 1.00 53.14 H new ATOM 0 HD13 ILE A 181 2.899 -3.271 -3.349 1.00 53.14 H new ATOM 666 N ARG A 182 6.799 -2.845 1.186 1.00 54.45 N ATOM 667 CA ARG A 182 7.528 -3.613 2.138 1.00 24.35 C ATOM 668 C ARG A 182 6.718 -4.844 2.474 1.00 1.45 C ATOM 669 O ARG A 182 5.646 -4.746 3.052 1.00 41.24 O ATOM 670 CB ARG A 182 7.757 -2.767 3.394 1.00 12.32 C ATOM 671 CG ARG A 182 8.679 -3.385 4.433 1.00 74.42 C ATOM 672 CD ARG A 182 10.067 -3.611 3.862 1.00 53.20 C ATOM 673 NE ARG A 182 10.650 -2.376 3.313 1.00 54.03 N ATOM 674 CZ ARG A 182 11.717 -2.327 2.507 1.00 34.35 C ATOM 675 NH1 ARG A 182 12.315 -3.457 2.130 1.00 11.25 N ATOM 676 NH2 ARG A 182 12.184 -1.155 2.076 1.00 45.33 N ATOM 0 H ARG A 182 6.108 -2.218 1.598 1.00 54.45 H new ATOM 0 HA ARG A 182 8.496 -3.912 1.735 1.00 24.35 H new ATOM 0 HB2 ARG A 182 8.169 -1.804 3.093 1.00 12.32 H new ATOM 0 HB3 ARG A 182 6.792 -2.569 3.860 1.00 12.32 H new ATOM 0 HG2 ARG A 182 8.742 -2.732 5.303 1.00 74.42 H new ATOM 0 HG3 ARG A 182 8.264 -4.333 4.775 1.00 74.42 H new ATOM 0 HD2 ARG A 182 10.719 -4.003 4.642 1.00 53.20 H new ATOM 0 HD3 ARG A 182 10.017 -4.367 3.078 1.00 53.20 H new ATOM 0 HE ARG A 182 10.208 -1.492 3.566 1.00 54.03 H new ATOM 0 HH11 ARG A 182 11.959 -4.356 2.456 1.00 11.25 H new ATOM 0 HH12 ARG A 182 13.129 -3.423 1.516 1.00 11.25 H new ATOM 0 HH21 ARG A 182 11.728 -0.288 2.360 1.00 45.33 H new ATOM 0 HH22 ARG A 182 12.998 -1.125 1.462 1.00 45.33 H new ATOM 690 N THR A 183 7.207 -5.976 2.084 1.00 3.25 N ATOM 691 CA THR A 183 6.516 -7.212 2.328 1.00 72.51 C ATOM 692 C THR A 183 7.240 -8.023 3.411 1.00 21.51 C ATOM 693 O THR A 183 8.488 -8.172 3.380 1.00 21.22 O ATOM 694 CB THR A 183 6.327 -8.036 1.009 1.00 33.24 C ATOM 695 OG1 THR A 183 5.597 -9.231 1.263 1.00 54.45 O ATOM 696 CG2 THR A 183 7.659 -8.389 0.349 1.00 3.13 C ATOM 0 H THR A 183 8.093 -6.076 1.589 1.00 3.25 H new ATOM 0 HA THR A 183 5.517 -6.979 2.695 1.00 72.51 H new ATOM 0 HB THR A 183 5.768 -7.400 0.323 1.00 33.24 H new ATOM 0 HG1 THR A 183 5.875 -9.925 0.630 1.00 54.45 H new ATOM 0 HG21 THR A 183 7.474 -8.960 -0.561 1.00 3.13 H new ATOM 0 HG22 THR A 183 8.196 -7.473 0.100 1.00 3.13 H new ATOM 0 HG23 THR A 183 8.259 -8.986 1.036 1.00 3.13 H new ATOM 704 N GLY A 184 6.491 -8.456 4.397 1.00 12.50 N ATOM 705 CA GLY A 184 7.037 -9.253 5.458 1.00 33.41 C ATOM 706 C GLY A 184 6.030 -10.261 5.968 1.00 53.42 C ATOM 707 O GLY A 184 4.823 -10.023 5.855 1.00 23.44 O ATOM 0 H GLY A 184 5.493 -8.265 4.482 1.00 12.50 H new ATOM 0 HA2 GLY A 184 7.927 -9.773 5.103 1.00 33.41 H new ATOM 0 HA3 GLY A 184 7.352 -8.605 6.276 1.00 33.41 H new ATOM 711 N PRO A 185 6.485 -11.408 6.506 1.00 12.12 N ATOM 712 CA PRO A 185 5.594 -12.416 7.099 1.00 22.24 C ATOM 713 C PRO A 185 4.860 -11.844 8.313 1.00 15.15 C ATOM 714 O PRO A 185 5.362 -10.926 8.980 1.00 54.02 O ATOM 715 CB PRO A 185 6.551 -13.543 7.521 1.00 52.14 C ATOM 716 CG PRO A 185 7.889 -12.902 7.610 1.00 41.24 C ATOM 717 CD PRO A 185 7.898 -11.821 6.573 1.00 4.10 C ATOM 0 HA PRO A 185 4.819 -12.754 6.411 1.00 22.24 H new ATOM 0 HB2 PRO A 185 6.256 -13.973 8.478 1.00 52.14 H new ATOM 0 HB3 PRO A 185 6.550 -14.354 6.793 1.00 52.14 H new ATOM 0 HG2 PRO A 185 8.059 -12.490 8.605 1.00 41.24 H new ATOM 0 HG3 PRO A 185 8.682 -13.627 7.425 1.00 41.24 H new ATOM 0 HD2 PRO A 185 8.546 -10.993 6.860 1.00 4.10 H new ATOM 0 HD3 PRO A 185 8.256 -12.188 5.611 1.00 4.10 H new ATOM 725 N ALA A 186 3.677 -12.344 8.593 1.00 63.25 N ATOM 726 CA ALA A 186 2.911 -11.803 9.690 1.00 51.11 C ATOM 727 C ALA A 186 2.608 -12.832 10.766 1.00 71.22 C ATOM 728 O ALA A 186 2.100 -12.479 11.836 1.00 14.23 O ATOM 729 CB ALA A 186 1.634 -11.158 9.180 1.00 71.02 C ATOM 0 H ALA A 186 3.232 -13.110 8.087 1.00 63.25 H new ATOM 0 HA ALA A 186 3.530 -11.040 10.161 1.00 51.11 H new ATOM 0 HB1 ALA A 186 1.069 -10.755 10.021 1.00 71.02 H new ATOM 0 HB2 ALA A 186 1.884 -10.351 8.491 1.00 71.02 H new ATOM 0 HB3 ALA A 186 1.031 -11.904 8.662 1.00 71.02 H new ATOM 735 N GLY A 187 2.933 -14.083 10.520 1.00 2.11 N ATOM 736 CA GLY A 187 2.629 -15.089 11.472 1.00 43.11 C ATOM 737 C GLY A 187 2.823 -16.480 10.954 1.00 33.11 C ATOM 738 O GLY A 187 3.832 -17.120 11.245 1.00 3.35 O ATOM 0 H GLY A 187 3.402 -14.409 9.675 1.00 2.11 H new ATOM 0 HA2 GLY A 187 3.256 -14.947 12.352 1.00 43.11 H new ATOM 0 HA3 GLY A 187 1.595 -14.971 11.795 1.00 43.11 H new ATOM 742 N ASP A 188 1.888 -16.950 10.178 1.00 1.04 N ATOM 743 CA ASP A 188 1.936 -18.329 9.709 1.00 23.13 C ATOM 744 C ASP A 188 1.618 -18.411 8.249 1.00 64.13 C ATOM 745 O ASP A 188 2.493 -18.692 7.418 1.00 73.41 O ATOM 746 CB ASP A 188 0.939 -19.174 10.487 1.00 62.22 C ATOM 747 CG ASP A 188 1.028 -20.666 10.180 1.00 62.23 C ATOM 748 OD1 ASP A 188 0.410 -21.135 9.201 1.00 24.33 O ATOM 749 OD2 ASP A 188 1.695 -21.416 10.940 1.00 34.02 O ATOM 0 H ASP A 188 1.084 -16.413 9.852 1.00 1.04 H new ATOM 0 HA ASP A 188 2.946 -18.706 9.869 1.00 23.13 H new ATOM 0 HB2 ASP A 188 1.101 -19.021 11.554 1.00 62.22 H new ATOM 0 HB3 ASP A 188 -0.070 -18.826 10.265 1.00 62.22 H new ATOM 754 N ASP A 189 0.384 -18.122 7.920 1.00 74.33 N ATOM 755 CA ASP A 189 -0.088 -18.223 6.561 1.00 53.33 C ATOM 756 C ASP A 189 -0.559 -16.857 6.144 1.00 72.10 C ATOM 757 O ASP A 189 -1.549 -16.662 5.430 1.00 73.11 O ATOM 758 CB ASP A 189 -1.207 -19.254 6.445 1.00 44.11 C ATOM 759 CG ASP A 189 -1.331 -19.797 5.037 1.00 45.34 C ATOM 760 OD1 ASP A 189 -0.613 -20.755 4.714 1.00 53.14 O ATOM 761 OD2 ASP A 189 -2.143 -19.304 4.249 1.00 21.03 O ATOM 0 H ASP A 189 -0.322 -17.810 8.587 1.00 74.33 H new ATOM 0 HA ASP A 189 0.714 -18.560 5.904 1.00 53.33 H new ATOM 0 HB2 ASP A 189 -1.017 -20.076 7.135 1.00 44.11 H new ATOM 0 HB3 ASP A 189 -2.152 -18.799 6.743 1.00 44.11 H new ATOM 766 N ASN A 190 0.157 -15.907 6.630 1.00 22.41 N ATOM 767 CA ASN A 190 -0.072 -14.530 6.345 1.00 35.11 C ATOM 768 C ASN A 190 1.170 -13.772 6.134 1.00 70.43 C ATOM 769 O ASN A 190 2.233 -14.103 6.656 1.00 41.34 O ATOM 770 CB ASN A 190 -0.942 -13.817 7.381 1.00 64.44 C ATOM 771 CG ASN A 190 -0.635 -14.143 8.865 1.00 5.31 C ATOM 772 OD1 ASN A 190 -0.120 -15.212 9.213 1.00 2.11 O ATOM 773 ND2 ASN A 190 -0.960 -13.242 9.737 1.00 15.32 N ATOM 0 H ASN A 190 0.945 -16.069 7.258 1.00 22.41 H new ATOM 0 HA ASN A 190 -0.629 -14.550 5.408 1.00 35.11 H new ATOM 0 HB2 ASN A 190 -0.837 -12.742 7.236 1.00 64.44 H new ATOM 0 HB3 ASN A 190 -1.985 -14.065 7.183 1.00 64.44 H new ATOM 0 HD21 ASN A 190 -0.792 -13.408 10.729 1.00 15.32 H new ATOM 0 HD22 ASN A 190 -1.384 -12.366 9.431 1.00 15.32 H new ATOM 780 N ILE A 191 1.016 -12.752 5.389 1.00 53.45 N ATOM 781 CA ILE A 191 2.067 -11.838 5.017 1.00 5.50 C ATOM 782 C ILE A 191 1.452 -10.446 4.963 1.00 52.41 C ATOM 783 O ILE A 191 0.280 -10.308 4.607 1.00 73.53 O ATOM 784 CB ILE A 191 2.708 -12.244 3.624 1.00 11.02 C ATOM 785 CG1 ILE A 191 3.856 -13.253 3.835 1.00 4.24 C ATOM 786 CG2 ILE A 191 3.206 -11.033 2.826 1.00 71.53 C ATOM 787 CD1 ILE A 191 4.515 -13.740 2.557 1.00 23.14 C ATOM 0 H ILE A 191 0.112 -12.500 4.990 1.00 53.45 H new ATOM 0 HA ILE A 191 2.877 -11.865 5.746 1.00 5.50 H new ATOM 0 HB ILE A 191 1.917 -12.710 3.036 1.00 11.02 H new ATOM 0 HG12 ILE A 191 4.615 -12.792 4.466 1.00 4.24 H new ATOM 0 HG13 ILE A 191 3.469 -14.114 4.379 1.00 4.24 H new ATOM 0 HG21 ILE A 191 3.635 -11.370 1.882 1.00 71.53 H new ATOM 0 HG22 ILE A 191 2.371 -10.361 2.626 1.00 71.53 H new ATOM 0 HG23 ILE A 191 3.966 -10.506 3.402 1.00 71.53 H new ATOM 0 HD11 ILE A 191 5.309 -14.445 2.803 1.00 23.14 H new ATOM 0 HD12 ILE A 191 3.773 -14.234 1.930 1.00 23.14 H new ATOM 0 HD13 ILE A 191 4.937 -12.891 2.019 1.00 23.14 H new ATOM 799 N THR A 192 2.185 -9.454 5.378 1.00 50.21 N ATOM 800 CA THR A 192 1.709 -8.110 5.354 1.00 61.32 C ATOM 801 C THR A 192 2.514 -7.280 4.374 1.00 75.33 C ATOM 802 O THR A 192 3.751 -7.226 4.442 1.00 74.54 O ATOM 803 CB THR A 192 1.751 -7.484 6.758 1.00 23.23 C ATOM 804 OG1 THR A 192 0.967 -8.297 7.640 1.00 5.43 O ATOM 805 CG2 THR A 192 1.192 -6.065 6.754 1.00 1.43 C ATOM 0 H THR A 192 3.132 -9.559 5.743 1.00 50.21 H new ATOM 0 HA THR A 192 0.670 -8.124 5.024 1.00 61.32 H new ATOM 0 HB THR A 192 2.788 -7.435 7.089 1.00 23.23 H new ATOM 0 HG1 THR A 192 0.984 -7.913 8.541 1.00 5.43 H new ATOM 0 HG21 THR A 192 1.237 -5.653 7.762 1.00 1.43 H new ATOM 0 HG22 THR A 192 1.783 -5.443 6.081 1.00 1.43 H new ATOM 0 HG23 THR A 192 0.156 -6.083 6.415 1.00 1.43 H new ATOM 813 N LEU A 193 1.820 -6.683 3.455 1.00 24.33 N ATOM 814 CA LEU A 193 2.416 -5.810 2.496 1.00 21.13 C ATOM 815 C LEU A 193 2.163 -4.414 2.953 1.00 22.23 C ATOM 816 O LEU A 193 1.015 -4.017 3.132 1.00 10.14 O ATOM 817 CB LEU A 193 1.804 -5.944 1.080 1.00 21.40 C ATOM 818 CG LEU A 193 1.861 -7.297 0.363 1.00 71.11 C ATOM 819 CD1 LEU A 193 0.951 -8.321 1.021 1.00 51.03 C ATOM 820 CD2 LEU A 193 1.484 -7.115 -1.098 1.00 31.44 C ATOM 0 H LEU A 193 0.811 -6.791 3.350 1.00 24.33 H new ATOM 0 HA LEU A 193 3.473 -6.066 2.427 1.00 21.13 H new ATOM 0 HB2 LEU A 193 0.756 -5.653 1.147 1.00 21.40 H new ATOM 0 HB3 LEU A 193 2.297 -5.213 0.439 1.00 21.40 H new ATOM 0 HG LEU A 193 2.880 -7.676 0.433 1.00 71.11 H new ATOM 0 HD11 LEU A 193 1.019 -9.267 0.484 1.00 51.03 H new ATOM 0 HD12 LEU A 193 1.258 -8.469 2.056 1.00 51.03 H new ATOM 0 HD13 LEU A 193 -0.078 -7.963 0.995 1.00 51.03 H new ATOM 0 HD21 LEU A 193 1.525 -8.078 -1.607 1.00 31.44 H new ATOM 0 HD22 LEU A 193 0.474 -6.711 -1.166 1.00 31.44 H new ATOM 0 HD23 LEU A 193 2.183 -6.425 -1.571 1.00 31.44 H new ATOM 832 N THR A 194 3.185 -3.700 3.212 1.00 14.42 N ATOM 833 CA THR A 194 3.034 -2.334 3.522 1.00 34.24 C ATOM 834 C THR A 194 3.410 -1.551 2.295 1.00 62.13 C ATOM 835 O THR A 194 4.579 -1.479 1.918 1.00 24.10 O ATOM 836 CB THR A 194 3.902 -1.937 4.712 1.00 62.23 C ATOM 837 OG1 THR A 194 3.655 -2.878 5.769 1.00 50.41 O ATOM 838 CG2 THR A 194 3.532 -0.538 5.196 1.00 31.22 C ATOM 0 H THR A 194 4.146 -4.041 3.216 1.00 14.42 H new ATOM 0 HA THR A 194 2.003 -2.124 3.807 1.00 34.24 H new ATOM 0 HB THR A 194 4.952 -1.939 4.421 1.00 62.23 H new ATOM 0 HG1 THR A 194 4.203 -2.647 6.548 1.00 50.41 H new ATOM 0 HG21 THR A 194 4.160 -0.269 6.045 1.00 31.22 H new ATOM 0 HG22 THR A 194 3.686 0.179 4.389 1.00 31.22 H new ATOM 0 HG23 THR A 194 2.485 -0.523 5.499 1.00 31.22 H new ATOM 846 N ALA A 195 2.431 -1.028 1.653 1.00 10.41 N ATOM 847 CA ALA A 195 2.636 -0.276 0.479 1.00 72.10 C ATOM 848 C ALA A 195 2.714 1.152 0.875 1.00 13.41 C ATOM 849 O ALA A 195 1.738 1.732 1.356 1.00 63.20 O ATOM 850 CB ALA A 195 1.505 -0.507 -0.512 1.00 53.01 C ATOM 0 H ALA A 195 1.454 -1.113 1.934 1.00 10.41 H new ATOM 0 HA ALA A 195 3.558 -0.581 -0.016 1.00 72.10 H new ATOM 0 HB1 ALA A 195 1.683 0.083 -1.411 1.00 53.01 H new ATOM 0 HB2 ALA A 195 1.461 -1.564 -0.774 1.00 53.01 H new ATOM 0 HB3 ALA A 195 0.559 -0.206 -0.062 1.00 53.01 H new ATOM 856 N HIS A 196 3.874 1.696 0.756 1.00 24.42 N ATOM 857 CA HIS A 196 4.087 3.050 1.110 1.00 15.14 C ATOM 858 C HIS A 196 3.782 3.856 -0.121 1.00 73.35 C ATOM 859 O HIS A 196 4.485 3.761 -1.129 1.00 1.34 O ATOM 860 CB HIS A 196 5.528 3.267 1.596 1.00 5.43 C ATOM 861 CG HIS A 196 5.924 2.455 2.808 1.00 12.03 C ATOM 862 ND1 HIS A 196 5.805 2.895 4.108 1.00 54.31 N ATOM 863 CD2 HIS A 196 6.479 1.219 2.887 1.00 24.05 C ATOM 864 CE1 HIS A 196 6.282 1.948 4.916 1.00 15.52 C ATOM 865 NE2 HIS A 196 6.707 0.902 4.225 1.00 1.01 N ATOM 0 H HIS A 196 4.702 1.211 0.409 1.00 24.42 H new ATOM 0 HA HIS A 196 3.445 3.356 1.936 1.00 15.14 H new ATOM 0 HB2 HIS A 196 6.210 3.029 0.780 1.00 5.43 H new ATOM 0 HB3 HIS A 196 5.662 4.324 1.826 1.00 5.43 H new ATOM 0 HD1 HIS A 196 5.418 3.792 4.402 1.00 54.31 H new ATOM 0 HD2 HIS A 196 6.708 0.582 2.046 1.00 24.05 H new ATOM 0 HE1 HIS A 196 6.317 2.024 5.993 1.00 15.52 H new ATOM 873 N LEU A 197 2.720 4.573 -0.070 1.00 3.15 N ATOM 874 CA LEU A 197 2.225 5.284 -1.205 1.00 13.24 C ATOM 875 C LEU A 197 2.395 6.768 -1.003 1.00 51.40 C ATOM 876 O LEU A 197 2.192 7.276 0.074 1.00 63.31 O ATOM 877 CB LEU A 197 0.749 4.947 -1.411 1.00 43.02 C ATOM 878 CG LEU A 197 0.408 3.463 -1.605 1.00 35.31 C ATOM 879 CD1 LEU A 197 -1.086 3.279 -1.789 1.00 43.14 C ATOM 880 CD2 LEU A 197 1.167 2.879 -2.790 1.00 72.12 C ATOM 0 H LEU A 197 2.156 4.688 0.772 1.00 3.15 H new ATOM 0 HA LEU A 197 2.789 4.988 -2.089 1.00 13.24 H new ATOM 0 HB2 LEU A 197 0.191 5.316 -0.550 1.00 43.02 H new ATOM 0 HB3 LEU A 197 0.392 5.496 -2.282 1.00 43.02 H new ATOM 0 HG LEU A 197 0.716 2.926 -0.708 1.00 35.31 H new ATOM 0 HD11 LEU A 197 -1.308 2.221 -1.925 1.00 43.14 H new ATOM 0 HD12 LEU A 197 -1.609 3.649 -0.908 1.00 43.14 H new ATOM 0 HD13 LEU A 197 -1.416 3.835 -2.667 1.00 43.14 H new ATOM 0 HD21 LEU A 197 0.907 1.827 -2.905 1.00 72.12 H new ATOM 0 HD22 LEU A 197 0.898 3.421 -3.697 1.00 72.12 H new ATOM 0 HD23 LEU A 197 2.239 2.971 -2.617 1.00 72.12 H new ATOM 892 N LEU A 198 2.744 7.437 -2.035 1.00 53.22 N ATOM 893 CA LEU A 198 2.983 8.846 -2.004 1.00 32.24 C ATOM 894 C LEU A 198 1.889 9.520 -2.817 1.00 64.21 C ATOM 895 O LEU A 198 1.793 9.306 -4.037 1.00 45.34 O ATOM 896 CB LEU A 198 4.337 9.144 -2.669 1.00 14.54 C ATOM 897 CG LEU A 198 5.575 8.428 -2.121 1.00 50.22 C ATOM 898 CD1 LEU A 198 6.789 8.739 -2.983 1.00 64.14 C ATOM 899 CD2 LEU A 198 5.838 8.838 -0.694 1.00 51.40 C ATOM 0 H LEU A 198 2.878 7.017 -2.955 1.00 53.22 H new ATOM 0 HA LEU A 198 2.989 9.208 -0.976 1.00 32.24 H new ATOM 0 HB2 LEU A 198 4.251 8.901 -3.728 1.00 14.54 H new ATOM 0 HB3 LEU A 198 4.514 10.217 -2.602 1.00 14.54 H new ATOM 0 HG LEU A 198 5.388 7.354 -2.146 1.00 50.22 H new ATOM 0 HD11 LEU A 198 7.662 8.224 -2.582 1.00 64.14 H new ATOM 0 HD12 LEU A 198 6.606 8.403 -4.004 1.00 64.14 H new ATOM 0 HD13 LEU A 198 6.970 9.814 -2.982 1.00 64.14 H new ATOM 0 HD21 LEU A 198 6.721 8.318 -0.323 1.00 51.40 H new ATOM 0 HD22 LEU A 198 6.005 9.914 -0.649 1.00 51.40 H new ATOM 0 HD23 LEU A 198 4.978 8.578 -0.076 1.00 51.40 H new ATOM 911 N MET A 199 1.062 10.293 -2.177 1.00 45.30 N ATOM 912 CA MET A 199 -0.007 10.980 -2.878 1.00 21.00 C ATOM 913 C MET A 199 0.087 12.475 -2.660 1.00 24.14 C ATOM 914 O MET A 199 0.415 12.939 -1.563 1.00 3.30 O ATOM 915 CB MET A 199 -1.396 10.400 -2.502 1.00 24.12 C ATOM 916 CG MET A 199 -2.588 11.086 -3.182 1.00 61.14 C ATOM 917 SD MET A 199 -4.158 10.189 -2.990 1.00 53.44 S ATOM 918 CE MET A 199 -4.307 10.057 -1.210 1.00 34.54 C ATOM 0 H MET A 199 1.098 10.470 -1.173 1.00 45.30 H new ATOM 0 HA MET A 199 0.112 10.807 -3.948 1.00 21.00 H new ATOM 0 HB2 MET A 199 -1.412 9.340 -2.756 1.00 24.12 H new ATOM 0 HB3 MET A 199 -1.523 10.471 -1.422 1.00 24.12 H new ATOM 0 HG2 MET A 199 -2.701 12.089 -2.771 1.00 61.14 H new ATOM 0 HG3 MET A 199 -2.373 11.199 -4.244 1.00 61.14 H new ATOM 0 HE1 MET A 199 -5.336 9.811 -0.948 1.00 34.54 H new ATOM 0 HE2 MET A 199 -3.643 9.273 -0.846 1.00 34.54 H new ATOM 0 HE3 MET A 199 -4.033 11.007 -0.751 1.00 34.54 H new ATOM 928 N VAL A 200 -0.118 13.214 -3.727 1.00 25.24 N ATOM 929 CA VAL A 200 -0.059 14.659 -3.697 1.00 10.35 C ATOM 930 C VAL A 200 -1.303 15.194 -3.006 1.00 25.11 C ATOM 931 O VAL A 200 -2.423 14.783 -3.328 1.00 52.55 O ATOM 932 CB VAL A 200 -0.021 15.248 -5.134 1.00 73.12 C ATOM 933 CG1 VAL A 200 0.122 16.767 -5.108 1.00 15.41 C ATOM 934 CG2 VAL A 200 1.088 14.625 -5.959 1.00 13.52 C ATOM 0 H VAL A 200 -0.332 12.827 -4.646 1.00 25.24 H new ATOM 0 HA VAL A 200 0.846 14.950 -3.164 1.00 10.35 H new ATOM 0 HB VAL A 200 -0.972 15.004 -5.607 1.00 73.12 H new ATOM 0 HG11 VAL A 200 0.145 17.148 -6.129 1.00 15.41 H new ATOM 0 HG12 VAL A 200 -0.724 17.203 -4.577 1.00 15.41 H new ATOM 0 HG13 VAL A 200 1.047 17.037 -4.599 1.00 15.41 H new ATOM 0 HG21 VAL A 200 1.086 15.060 -6.959 1.00 13.52 H new ATOM 0 HG22 VAL A 200 2.049 14.817 -5.481 1.00 13.52 H new ATOM 0 HG23 VAL A 200 0.928 13.549 -6.031 1.00 13.52 H new ATOM 944 N GLY A 201 -1.107 16.077 -2.073 1.00 65.52 N ATOM 945 CA GLY A 201 -2.211 16.696 -1.391 1.00 73.53 C ATOM 946 C GLY A 201 -2.771 15.820 -0.312 1.00 63.15 C ATOM 947 O GLY A 201 -2.109 15.579 0.705 1.00 62.25 O ATOM 0 H GLY A 201 -0.187 16.389 -1.763 1.00 65.52 H new ATOM 0 HA2 GLY A 201 -1.884 17.641 -0.957 1.00 73.53 H new ATOM 0 HA3 GLY A 201 -2.996 16.930 -2.111 1.00 73.53 H new ATOM 951 N HIS A 202 -3.976 15.351 -0.552 1.00 23.55 N ATOM 952 CA HIS A 202 -4.727 14.483 0.346 1.00 55.55 C ATOM 953 C HIS A 202 -6.098 14.235 -0.259 1.00 21.10 C ATOM 954 O HIS A 202 -6.998 15.074 -0.159 1.00 44.54 O ATOM 955 CB HIS A 202 -4.878 15.091 1.772 1.00 41.41 C ATOM 956 CG HIS A 202 -5.621 14.232 2.772 1.00 63.40 C ATOM 957 ND1 HIS A 202 -6.356 14.737 3.827 1.00 22.11 N ATOM 958 CD2 HIS A 202 -5.700 12.882 2.878 1.00 21.45 C ATOM 959 CE1 HIS A 202 -6.846 13.706 4.521 1.00 32.44 C ATOM 960 NE2 HIS A 202 -6.478 12.553 3.984 1.00 43.24 N ATOM 0 H HIS A 202 -4.484 15.569 -1.409 1.00 23.55 H new ATOM 0 HA HIS A 202 -4.177 13.549 0.458 1.00 55.55 H new ATOM 0 HB2 HIS A 202 -3.883 15.299 2.166 1.00 41.41 H new ATOM 0 HB3 HIS A 202 -5.394 16.048 1.687 1.00 41.41 H new ATOM 0 HD2 HIS A 202 -5.233 12.174 2.209 1.00 21.45 H new ATOM 0 HE1 HIS A 202 -7.461 13.800 5.404 1.00 32.44 H new ATOM 0 HE2 HIS A 202 -6.716 11.617 4.313 1.00 43.24 H new ATOM 968 N THR A 203 -6.234 13.142 -0.940 1.00 1.45 N ATOM 969 CA THR A 203 -7.490 12.751 -1.490 1.00 71.14 C ATOM 970 C THR A 203 -7.945 11.439 -0.804 1.00 42.02 C ATOM 971 O THR A 203 -7.709 10.339 -1.328 1.00 23.21 O ATOM 972 CB THR A 203 -7.387 12.523 -3.013 1.00 4.43 C ATOM 973 OG1 THR A 203 -6.582 13.558 -3.612 1.00 12.22 O ATOM 974 CG2 THR A 203 -8.771 12.550 -3.650 1.00 12.24 C ATOM 0 H THR A 203 -5.471 12.492 -1.131 1.00 1.45 H new ATOM 0 HA THR A 203 -8.213 13.548 -1.315 1.00 71.14 H new ATOM 0 HB THR A 203 -6.928 11.549 -3.182 1.00 4.43 H new ATOM 0 HG1 THR A 203 -6.520 13.406 -4.578 1.00 12.22 H new ATOM 0 HG21 THR A 203 -8.680 12.388 -4.724 1.00 12.24 H new ATOM 0 HG22 THR A 203 -9.387 11.763 -3.215 1.00 12.24 H new ATOM 0 HG23 THR A 203 -9.237 13.518 -3.467 1.00 12.24 H new ATOM 982 N PRO A 204 -8.546 11.530 0.399 1.00 73.42 N ATOM 983 CA PRO A 204 -8.926 10.353 1.187 1.00 13.35 C ATOM 984 C PRO A 204 -10.026 9.515 0.551 1.00 43.12 C ATOM 985 O PRO A 204 -10.116 8.330 0.808 1.00 20.13 O ATOM 986 CB PRO A 204 -9.394 10.933 2.526 1.00 43.33 C ATOM 987 CG PRO A 204 -9.774 12.341 2.222 1.00 74.53 C ATOM 988 CD PRO A 204 -8.870 12.786 1.109 1.00 74.02 C ATOM 0 HA PRO A 204 -8.086 9.664 1.276 1.00 13.35 H new ATOM 0 HB2 PRO A 204 -10.240 10.373 2.925 1.00 43.33 H new ATOM 0 HB3 PRO A 204 -8.602 10.890 3.274 1.00 43.33 H new ATOM 0 HG2 PRO A 204 -10.820 12.406 1.924 1.00 74.53 H new ATOM 0 HG3 PRO A 204 -9.653 12.976 3.100 1.00 74.53 H new ATOM 0 HD2 PRO A 204 -9.365 13.501 0.452 1.00 74.02 H new ATOM 0 HD3 PRO A 204 -7.973 13.273 1.492 1.00 74.02 H new ATOM 996 N ALA A 205 -10.812 10.124 -0.316 1.00 43.20 N ATOM 997 CA ALA A 205 -11.946 9.448 -0.942 1.00 31.33 C ATOM 998 C ALA A 205 -11.508 8.249 -1.766 1.00 2.30 C ATOM 999 O ALA A 205 -11.963 7.121 -1.539 1.00 61.12 O ATOM 1000 CB ALA A 205 -12.735 10.414 -1.797 1.00 42.14 C ATOM 0 H ALA A 205 -10.689 11.093 -0.608 1.00 43.20 H new ATOM 0 HA ALA A 205 -12.586 9.079 -0.141 1.00 31.33 H new ATOM 0 HB1 ALA A 205 -13.575 9.892 -2.255 1.00 42.14 H new ATOM 0 HB2 ALA A 205 -13.108 11.228 -1.176 1.00 42.14 H new ATOM 0 HB3 ALA A 205 -12.091 10.819 -2.577 1.00 42.14 H new ATOM 1006 N LYS A 206 -10.589 8.475 -2.682 1.00 32.33 N ATOM 1007 CA LYS A 206 -10.129 7.406 -3.537 1.00 45.32 C ATOM 1008 C LYS A 206 -9.279 6.416 -2.769 1.00 24.51 C ATOM 1009 O LYS A 206 -9.228 5.246 -3.110 1.00 13.13 O ATOM 1010 CB LYS A 206 -9.424 7.922 -4.806 1.00 21.42 C ATOM 1011 CG LYS A 206 -8.220 8.823 -4.573 1.00 52.32 C ATOM 1012 CD LYS A 206 -7.640 9.292 -5.901 1.00 70.01 C ATOM 1013 CE LYS A 206 -6.507 10.287 -5.706 1.00 74.01 C ATOM 1014 NZ LYS A 206 -5.987 10.805 -6.986 1.00 62.31 N ATOM 0 H LYS A 206 -10.151 9.380 -2.851 1.00 32.33 H new ATOM 0 HA LYS A 206 -11.014 6.874 -3.885 1.00 45.32 H new ATOM 0 HB2 LYS A 206 -9.103 7.063 -5.396 1.00 21.42 H new ATOM 0 HB3 LYS A 206 -10.152 8.467 -5.407 1.00 21.42 H new ATOM 0 HG2 LYS A 206 -8.514 9.684 -3.973 1.00 52.32 H new ATOM 0 HG3 LYS A 206 -7.460 8.285 -4.007 1.00 52.32 H new ATOM 0 HD2 LYS A 206 -7.275 8.431 -6.462 1.00 70.01 H new ATOM 0 HD3 LYS A 206 -8.427 9.751 -6.499 1.00 70.01 H new ATOM 0 HE2 LYS A 206 -6.859 11.119 -5.096 1.00 74.01 H new ATOM 0 HE3 LYS A 206 -5.697 9.808 -5.155 1.00 74.01 H new ATOM 0 HZ1 LYS A 206 -5.152 11.399 -6.807 1.00 62.31 H new ATOM 0 HZ2 LYS A 206 -5.720 10.009 -7.600 1.00 62.31 H new ATOM 0 HZ3 LYS A 206 -6.722 11.372 -7.455 1.00 62.31 H new ATOM 1028 N LEU A 207 -8.674 6.883 -1.695 1.00 65.11 N ATOM 1029 CA LEU A 207 -7.847 6.043 -0.870 1.00 54.41 C ATOM 1030 C LEU A 207 -8.729 5.088 -0.056 1.00 51.35 C ATOM 1031 O LEU A 207 -8.448 3.890 0.028 1.00 64.34 O ATOM 1032 CB LEU A 207 -6.950 6.908 0.029 1.00 61.12 C ATOM 1033 CG LEU A 207 -5.926 6.178 0.912 1.00 20.21 C ATOM 1034 CD1 LEU A 207 -4.981 5.326 0.069 1.00 53.21 C ATOM 1035 CD2 LEU A 207 -5.132 7.191 1.718 1.00 20.01 C ATOM 0 H LEU A 207 -8.744 7.849 -1.376 1.00 65.11 H new ATOM 0 HA LEU A 207 -7.193 5.437 -1.497 1.00 54.41 H new ATOM 0 HB2 LEU A 207 -6.409 7.608 -0.608 1.00 61.12 H new ATOM 0 HB3 LEU A 207 -7.594 7.501 0.679 1.00 61.12 H new ATOM 0 HG LEU A 207 -6.466 5.515 1.589 1.00 20.21 H new ATOM 0 HD11 LEU A 207 -4.267 4.821 0.720 1.00 53.21 H new ATOM 0 HD12 LEU A 207 -5.556 4.583 -0.484 1.00 53.21 H new ATOM 0 HD13 LEU A 207 -4.444 5.964 -0.632 1.00 53.21 H new ATOM 0 HD21 LEU A 207 -4.407 6.670 2.343 1.00 20.01 H new ATOM 0 HD22 LEU A 207 -4.609 7.866 1.040 1.00 20.01 H new ATOM 0 HD23 LEU A 207 -5.810 7.765 2.350 1.00 20.01 H new ATOM 1047 N GLU A 208 -9.828 5.613 0.482 1.00 70.14 N ATOM 1048 CA GLU A 208 -10.777 4.811 1.248 1.00 32.53 C ATOM 1049 C GLU A 208 -11.417 3.741 0.395 1.00 34.21 C ATOM 1050 O GLU A 208 -11.588 2.596 0.845 1.00 43.20 O ATOM 1051 CB GLU A 208 -11.845 5.686 1.904 1.00 72.33 C ATOM 1052 CG GLU A 208 -11.391 6.376 3.174 1.00 34.12 C ATOM 1053 CD GLU A 208 -11.173 5.390 4.294 1.00 51.53 C ATOM 1054 OE1 GLU A 208 -12.152 5.015 4.968 1.00 42.30 O ATOM 1055 OE2 GLU A 208 -10.039 4.955 4.525 1.00 42.55 O ATOM 0 H GLU A 208 -10.083 6.597 0.400 1.00 70.14 H new ATOM 0 HA GLU A 208 -10.212 4.316 2.038 1.00 32.53 H new ATOM 0 HB2 GLU A 208 -12.168 6.442 1.189 1.00 72.33 H new ATOM 0 HB3 GLU A 208 -12.715 5.069 2.130 1.00 72.33 H new ATOM 0 HG2 GLU A 208 -10.466 6.920 2.982 1.00 34.12 H new ATOM 0 HG3 GLU A 208 -12.137 7.111 3.476 1.00 34.12 H new ATOM 1062 N ARG A 209 -11.748 4.088 -0.834 1.00 22.53 N ATOM 1063 CA ARG A 209 -12.330 3.125 -1.734 1.00 3.14 C ATOM 1064 C ARG A 209 -11.294 2.083 -2.126 1.00 44.44 C ATOM 1065 O ARG A 209 -11.583 0.879 -2.162 1.00 32.43 O ATOM 1066 CB ARG A 209 -12.920 3.777 -2.988 1.00 34.21 C ATOM 1067 CG ARG A 209 -13.463 2.743 -3.952 1.00 13.14 C ATOM 1068 CD ARG A 209 -13.941 3.323 -5.255 1.00 30.00 C ATOM 1069 NE ARG A 209 -14.279 2.234 -6.172 1.00 13.35 N ATOM 1070 CZ ARG A 209 -14.835 2.345 -7.371 1.00 14.03 C ATOM 1071 NH1 ARG A 209 -15.244 3.524 -7.825 1.00 63.41 N ATOM 1072 NH2 ARG A 209 -15.009 1.248 -8.105 1.00 70.22 N ATOM 0 H ARG A 209 -11.623 5.022 -1.225 1.00 22.53 H new ATOM 0 HA ARG A 209 -13.152 2.645 -1.203 1.00 3.14 H new ATOM 0 HB2 ARG A 209 -13.718 4.462 -2.701 1.00 34.21 H new ATOM 0 HB3 ARG A 209 -12.153 4.371 -3.485 1.00 34.21 H new ATOM 0 HG2 ARG A 209 -12.686 2.006 -4.156 1.00 13.14 H new ATOM 0 HG3 ARG A 209 -14.288 2.213 -3.476 1.00 13.14 H new ATOM 0 HD2 ARG A 209 -14.812 3.956 -5.087 1.00 30.00 H new ATOM 0 HD3 ARG A 209 -13.167 3.955 -5.691 1.00 30.00 H new ATOM 0 HE ARG A 209 -14.064 1.289 -5.855 1.00 13.35 H new ATOM 0 HH11 ARG A 209 -15.132 4.359 -7.250 1.00 63.41 H new ATOM 0 HH12 ARG A 209 -15.670 3.595 -8.749 1.00 63.41 H new ATOM 0 HH21 ARG A 209 -14.716 0.340 -7.743 1.00 70.22 H new ATOM 0 HH22 ARG A 209 -15.435 1.315 -9.029 1.00 70.22 H new ATOM 1086 N LEU A 210 -10.087 2.547 -2.383 1.00 12.20 N ATOM 1087 CA LEU A 210 -8.994 1.687 -2.782 1.00 31.22 C ATOM 1088 C LEU A 210 -8.730 0.637 -1.740 1.00 13.44 C ATOM 1089 O LEU A 210 -8.685 -0.535 -2.062 1.00 34.43 O ATOM 1090 CB LEU A 210 -7.721 2.503 -3.073 1.00 41.21 C ATOM 1091 CG LEU A 210 -6.432 1.715 -3.367 1.00 65.41 C ATOM 1092 CD1 LEU A 210 -6.575 0.860 -4.613 1.00 62.21 C ATOM 1093 CD2 LEU A 210 -5.250 2.662 -3.502 1.00 60.11 C ATOM 0 H LEU A 210 -9.837 3.534 -2.320 1.00 12.20 H new ATOM 0 HA LEU A 210 -9.286 1.184 -3.704 1.00 31.22 H new ATOM 0 HB2 LEU A 210 -7.923 3.151 -3.926 1.00 41.21 H new ATOM 0 HB3 LEU A 210 -7.533 3.152 -2.218 1.00 41.21 H new ATOM 0 HG LEU A 210 -6.251 1.046 -2.526 1.00 65.41 H new ATOM 0 HD11 LEU A 210 -5.646 0.318 -4.791 1.00 62.21 H new ATOM 0 HD12 LEU A 210 -7.390 0.149 -4.475 1.00 62.21 H new ATOM 0 HD13 LEU A 210 -6.792 1.498 -5.469 1.00 62.21 H new ATOM 0 HD21 LEU A 210 -4.346 2.089 -3.710 1.00 60.11 H new ATOM 0 HD22 LEU A 210 -5.434 3.359 -4.320 1.00 60.11 H new ATOM 0 HD23 LEU A 210 -5.121 3.218 -2.573 1.00 60.11 H new ATOM 1105 N VAL A 211 -8.639 1.038 -0.490 1.00 51.32 N ATOM 1106 CA VAL A 211 -8.316 0.089 0.550 1.00 62.44 C ATOM 1107 C VAL A 211 -9.476 -0.861 0.813 1.00 12.31 C ATOM 1108 O VAL A 211 -9.271 -2.032 1.140 1.00 52.45 O ATOM 1109 CB VAL A 211 -7.806 0.750 1.860 1.00 22.00 C ATOM 1110 CG1 VAL A 211 -6.514 1.507 1.600 1.00 24.25 C ATOM 1111 CG2 VAL A 211 -8.852 1.670 2.463 1.00 55.10 C ATOM 0 H VAL A 211 -8.781 1.997 -0.174 1.00 51.32 H new ATOM 0 HA VAL A 211 -7.477 -0.496 0.172 1.00 62.44 H new ATOM 0 HB VAL A 211 -7.610 -0.043 2.581 1.00 22.00 H new ATOM 0 HG11 VAL A 211 -6.168 1.965 2.527 1.00 24.25 H new ATOM 0 HG12 VAL A 211 -5.756 0.816 1.231 1.00 24.25 H new ATOM 0 HG13 VAL A 211 -6.691 2.283 0.855 1.00 24.25 H new ATOM 0 HG21 VAL A 211 -8.461 2.115 3.378 1.00 55.10 H new ATOM 0 HG22 VAL A 211 -9.096 2.459 1.752 1.00 55.10 H new ATOM 0 HG23 VAL A 211 -9.751 1.098 2.693 1.00 55.10 H new ATOM 1121 N ALA A 212 -10.682 -0.381 0.598 1.00 20.51 N ATOM 1122 CA ALA A 212 -11.857 -1.192 0.785 1.00 13.03 C ATOM 1123 C ALA A 212 -11.931 -2.272 -0.273 1.00 24.43 C ATOM 1124 O ALA A 212 -12.168 -3.426 0.038 1.00 35.30 O ATOM 1125 CB ALA A 212 -13.119 -0.351 0.791 1.00 20.22 C ATOM 0 H ALA A 212 -10.871 0.573 0.292 1.00 20.51 H new ATOM 0 HA ALA A 212 -11.780 -1.671 1.761 1.00 13.03 H new ATOM 0 HB1 ALA A 212 -13.986 -0.996 0.934 1.00 20.22 H new ATOM 0 HB2 ALA A 212 -13.069 0.375 1.603 1.00 20.22 H new ATOM 0 HB3 ALA A 212 -13.211 0.174 -0.160 1.00 20.22 H new ATOM 1131 N GLU A 213 -11.663 -1.923 -1.517 1.00 54.42 N ATOM 1132 CA GLU A 213 -11.743 -2.913 -2.563 1.00 22.44 C ATOM 1133 C GLU A 213 -10.491 -3.769 -2.610 1.00 23.11 C ATOM 1134 O GLU A 213 -10.512 -4.889 -3.119 1.00 52.43 O ATOM 1135 CB GLU A 213 -12.089 -2.298 -3.909 1.00 72.40 C ATOM 1136 CG GLU A 213 -13.419 -1.557 -3.896 1.00 32.03 C ATOM 1137 CD GLU A 213 -13.825 -1.060 -5.253 1.00 12.22 C ATOM 1138 OE1 GLU A 213 -13.183 -0.142 -5.774 1.00 75.23 O ATOM 1139 OE2 GLU A 213 -14.788 -1.593 -5.833 1.00 64.35 O ATOM 0 H GLU A 213 -11.395 -0.986 -1.819 1.00 54.42 H new ATOM 0 HA GLU A 213 -12.570 -3.580 -2.320 1.00 22.44 H new ATOM 0 HB2 GLU A 213 -11.297 -1.609 -4.202 1.00 72.40 H new ATOM 0 HB3 GLU A 213 -12.124 -3.084 -4.664 1.00 72.40 H new ATOM 0 HG2 GLU A 213 -14.194 -2.219 -3.510 1.00 32.03 H new ATOM 0 HG3 GLU A 213 -13.352 -0.712 -3.211 1.00 32.03 H new ATOM 1146 N LEU A 214 -9.417 -3.250 -2.059 1.00 3.22 N ATOM 1147 CA LEU A 214 -8.178 -3.985 -1.952 1.00 53.34 C ATOM 1148 C LEU A 214 -8.359 -5.085 -0.920 1.00 21.32 C ATOM 1149 O LEU A 214 -7.957 -6.214 -1.143 1.00 10.42 O ATOM 1150 CB LEU A 214 -7.015 -3.014 -1.589 1.00 23.13 C ATOM 1151 CG LEU A 214 -5.549 -3.518 -1.652 1.00 42.32 C ATOM 1152 CD1 LEU A 214 -5.222 -4.515 -0.560 1.00 31.23 C ATOM 1153 CD2 LEU A 214 -5.245 -4.096 -3.020 1.00 70.31 C ATOM 0 H LEU A 214 -9.378 -2.307 -1.673 1.00 3.22 H new ATOM 0 HA LEU A 214 -7.917 -4.448 -2.903 1.00 53.34 H new ATOM 0 HB2 LEU A 214 -7.092 -2.151 -2.250 1.00 23.13 H new ATOM 0 HB3 LEU A 214 -7.194 -2.656 -0.575 1.00 23.13 H new ATOM 0 HG LEU A 214 -4.909 -2.652 -1.482 1.00 42.32 H new ATOM 0 HD11 LEU A 214 -4.183 -4.832 -0.655 1.00 31.23 H new ATOM 0 HD12 LEU A 214 -5.372 -4.050 0.414 1.00 31.23 H new ATOM 0 HD13 LEU A 214 -5.876 -5.383 -0.652 1.00 31.23 H new ATOM 0 HD21 LEU A 214 -4.213 -4.445 -3.046 1.00 70.31 H new ATOM 0 HD22 LEU A 214 -5.916 -4.932 -3.219 1.00 70.31 H new ATOM 0 HD23 LEU A 214 -5.388 -3.328 -3.780 1.00 70.31 H new ATOM 1165 N SER A 215 -9.000 -4.770 0.189 1.00 12.40 N ATOM 1166 CA SER A 215 -9.217 -5.772 1.190 1.00 4.02 C ATOM 1167 C SER A 215 -10.360 -6.714 0.786 1.00 33.31 C ATOM 1168 O SER A 215 -10.442 -7.858 1.247 1.00 21.45 O ATOM 1169 CB SER A 215 -9.468 -5.135 2.548 1.00 41.50 C ATOM 1170 OG SER A 215 -10.463 -4.120 2.476 1.00 11.24 O ATOM 0 H SER A 215 -9.369 -3.845 0.409 1.00 12.40 H new ATOM 0 HA SER A 215 -8.312 -6.374 1.272 1.00 4.02 H new ATOM 0 HB2 SER A 215 -9.780 -5.901 3.258 1.00 41.50 H new ATOM 0 HB3 SER A 215 -8.539 -4.708 2.927 1.00 41.50 H new ATOM 0 HG SER A 215 -10.065 -3.296 2.125 1.00 11.24 H new ATOM 1176 N LEU A 216 -11.240 -6.221 -0.081 1.00 3.03 N ATOM 1177 CA LEU A 216 -12.360 -6.996 -0.593 1.00 42.24 C ATOM 1178 C LEU A 216 -11.869 -8.065 -1.579 1.00 64.40 C ATOM 1179 O LEU A 216 -12.613 -8.997 -1.919 1.00 21.11 O ATOM 1180 CB LEU A 216 -13.393 -6.073 -1.261 1.00 71.11 C ATOM 1181 CG LEU A 216 -14.714 -6.713 -1.717 1.00 61.31 C ATOM 1182 CD1 LEU A 216 -15.481 -7.284 -0.532 1.00 11.03 C ATOM 1183 CD2 LEU A 216 -15.564 -5.700 -2.464 1.00 74.12 C ATOM 0 H LEU A 216 -11.194 -5.270 -0.448 1.00 3.03 H new ATOM 0 HA LEU A 216 -12.843 -7.500 0.244 1.00 42.24 H new ATOM 0 HB2 LEU A 216 -13.630 -5.270 -0.563 1.00 71.11 H new ATOM 0 HB3 LEU A 216 -12.923 -5.612 -2.130 1.00 71.11 H new ATOM 0 HG LEU A 216 -14.477 -7.535 -2.393 1.00 61.31 H new ATOM 0 HD11 LEU A 216 -16.412 -7.731 -0.882 1.00 11.03 H new ATOM 0 HD12 LEU A 216 -14.876 -8.045 -0.039 1.00 11.03 H new ATOM 0 HD13 LEU A 216 -15.706 -6.485 0.175 1.00 11.03 H new ATOM 0 HD21 LEU A 216 -16.496 -6.169 -2.780 1.00 74.12 H new ATOM 0 HD22 LEU A 216 -15.786 -4.858 -1.809 1.00 74.12 H new ATOM 0 HD23 LEU A 216 -15.021 -5.345 -3.340 1.00 74.12 H new ATOM 1195 N GLN A 217 -10.633 -7.900 -2.059 1.00 54.31 N ATOM 1196 CA GLN A 217 -9.981 -8.882 -2.912 1.00 22.11 C ATOM 1197 C GLN A 217 -9.826 -10.184 -2.107 1.00 25.23 C ATOM 1198 O GLN A 217 -9.108 -10.199 -1.096 1.00 75.14 O ATOM 1199 CB GLN A 217 -8.595 -8.349 -3.338 1.00 31.21 C ATOM 1200 CG GLN A 217 -7.778 -9.258 -4.255 1.00 63.42 C ATOM 1201 CD GLN A 217 -8.418 -9.476 -5.613 1.00 12.45 C ATOM 1202 OE1 GLN A 217 -9.188 -10.416 -5.809 1.00 2.40 O ATOM 1203 NE2 GLN A 217 -8.109 -8.620 -6.551 1.00 52.55 N ATOM 0 H GLN A 217 -10.061 -7.079 -1.863 1.00 54.31 H new ATOM 0 HA GLN A 217 -10.572 -9.069 -3.808 1.00 22.11 H new ATOM 0 HB2 GLN A 217 -8.735 -7.392 -3.840 1.00 31.21 H new ATOM 0 HB3 GLN A 217 -8.011 -8.155 -2.438 1.00 31.21 H new ATOM 0 HG2 GLN A 217 -6.787 -8.826 -4.394 1.00 63.42 H new ATOM 0 HG3 GLN A 217 -7.639 -10.223 -3.768 1.00 63.42 H new ATOM 0 HE21 GLN A 217 -7.467 -7.853 -6.350 1.00 52.55 H new ATOM 0 HE22 GLN A 217 -8.510 -8.719 -7.484 1.00 52.55 H new ATOM 1212 N PRO A 218 -10.526 -11.271 -2.510 1.00 3.33 N ATOM 1213 CA PRO A 218 -10.508 -12.539 -1.778 1.00 21.11 C ATOM 1214 C PRO A 218 -9.110 -13.112 -1.646 1.00 72.42 C ATOM 1215 O PRO A 218 -8.485 -13.538 -2.642 1.00 34.14 O ATOM 1216 CB PRO A 218 -11.408 -13.466 -2.593 1.00 71.14 C ATOM 1217 CG PRO A 218 -11.536 -12.816 -3.927 1.00 34.00 C ATOM 1218 CD PRO A 218 -11.386 -11.345 -3.699 1.00 54.24 C ATOM 0 HA PRO A 218 -10.855 -12.410 -0.753 1.00 21.11 H new ATOM 0 HB2 PRO A 218 -10.972 -14.461 -2.680 1.00 71.14 H new ATOM 0 HB3 PRO A 218 -12.382 -13.586 -2.119 1.00 71.14 H new ATOM 0 HG2 PRO A 218 -10.771 -13.182 -4.612 1.00 34.00 H new ATOM 0 HG3 PRO A 218 -12.502 -13.042 -4.378 1.00 34.00 H new ATOM 0 HD2 PRO A 218 -10.930 -10.850 -4.556 1.00 54.24 H new ATOM 0 HD3 PRO A 218 -12.349 -10.864 -3.529 1.00 54.24 H new ATOM 1226 N GLY A 219 -8.627 -13.079 -0.436 1.00 0.13 N ATOM 1227 CA GLY A 219 -7.296 -13.534 -0.121 1.00 61.41 C ATOM 1228 C GLY A 219 -6.669 -12.630 0.906 1.00 33.13 C ATOM 1229 O GLY A 219 -5.713 -13.005 1.608 1.00 45.03 O ATOM 0 H GLY A 219 -9.149 -12.733 0.369 1.00 0.13 H new ATOM 0 HA2 GLY A 219 -7.333 -14.556 0.257 1.00 61.41 H new ATOM 0 HA3 GLY A 219 -6.686 -13.550 -1.024 1.00 61.41 H new ATOM 1233 N VAL A 220 -7.192 -11.426 0.972 1.00 63.25 N ATOM 1234 CA VAL A 220 -6.779 -10.448 1.936 1.00 4.41 C ATOM 1235 C VAL A 220 -7.544 -10.643 3.240 1.00 34.21 C ATOM 1236 O VAL A 220 -8.762 -10.854 3.232 1.00 44.43 O ATOM 1237 CB VAL A 220 -7.010 -9.011 1.397 1.00 1.31 C ATOM 1238 CG1 VAL A 220 -6.664 -7.978 2.445 1.00 13.25 C ATOM 1239 CG2 VAL A 220 -6.198 -8.776 0.132 1.00 72.31 C ATOM 0 H VAL A 220 -7.927 -11.100 0.345 1.00 63.25 H new ATOM 0 HA VAL A 220 -5.713 -10.580 2.122 1.00 4.41 H new ATOM 0 HB VAL A 220 -8.068 -8.909 1.154 1.00 1.31 H new ATOM 0 HG11 VAL A 220 -6.835 -6.980 2.042 1.00 13.25 H new ATOM 0 HG12 VAL A 220 -7.292 -8.127 3.324 1.00 13.25 H new ATOM 0 HG13 VAL A 220 -5.616 -8.082 2.726 1.00 13.25 H new ATOM 0 HG21 VAL A 220 -6.374 -7.763 -0.230 1.00 72.31 H new ATOM 0 HG22 VAL A 220 -5.138 -8.904 0.351 1.00 72.31 H new ATOM 0 HG23 VAL A 220 -6.500 -9.492 -0.632 1.00 72.31 H new ATOM 1249 N TYR A 221 -6.831 -10.592 4.343 1.00 43.31 N ATOM 1250 CA TYR A 221 -7.422 -10.717 5.654 1.00 34.42 C ATOM 1251 C TYR A 221 -8.017 -9.376 6.025 1.00 55.24 C ATOM 1252 O TYR A 221 -9.188 -9.277 6.393 1.00 72.51 O ATOM 1253 CB TYR A 221 -6.358 -11.092 6.715 1.00 32.11 C ATOM 1254 CG TYR A 221 -5.792 -12.507 6.682 1.00 32.04 C ATOM 1255 CD1 TYR A 221 -5.367 -13.110 5.507 1.00 43.24 C ATOM 1256 CD2 TYR A 221 -5.642 -13.218 7.862 1.00 30.02 C ATOM 1257 CE1 TYR A 221 -4.818 -14.380 5.513 1.00 65.24 C ATOM 1258 CE2 TYR A 221 -5.099 -14.484 7.875 1.00 1.33 C ATOM 1259 CZ TYR A 221 -4.687 -15.061 6.703 1.00 55.43 C ATOM 1260 OH TYR A 221 -4.142 -16.331 6.725 1.00 2.45 O ATOM 0 H TYR A 221 -5.819 -10.462 4.354 1.00 43.31 H new ATOM 0 HA TYR A 221 -8.178 -11.502 5.630 1.00 34.42 H new ATOM 0 HB2 TYR A 221 -5.525 -10.395 6.616 1.00 32.11 H new ATOM 0 HB3 TYR A 221 -6.795 -10.928 7.700 1.00 32.11 H new ATOM 0 HD1 TYR A 221 -5.466 -12.579 4.572 1.00 43.24 H new ATOM 0 HD2 TYR A 221 -5.958 -12.770 8.792 1.00 30.02 H new ATOM 0 HE1 TYR A 221 -4.494 -14.835 4.589 1.00 65.24 H new ATOM 0 HE2 TYR A 221 -4.998 -15.020 8.807 1.00 1.33 H new ATOM 0 HH TYR A 221 -3.285 -16.328 6.250 1.00 2.45 H new ATOM 1270 N ALA A 222 -7.200 -8.343 5.890 1.00 61.23 N ATOM 1271 CA ALA A 222 -7.581 -6.979 6.262 1.00 2.20 C ATOM 1272 C ALA A 222 -6.550 -5.994 5.751 1.00 12.15 C ATOM 1273 O ALA A 222 -5.470 -6.398 5.299 1.00 30.54 O ATOM 1274 CB ALA A 222 -7.702 -6.848 7.781 1.00 70.11 C ATOM 0 H ALA A 222 -6.253 -8.421 5.520 1.00 61.23 H new ATOM 0 HA ALA A 222 -8.549 -6.759 5.811 1.00 2.20 H new ATOM 0 HB1 ALA A 222 -7.986 -5.827 8.037 1.00 70.11 H new ATOM 0 HB2 ALA A 222 -8.462 -7.538 8.146 1.00 70.11 H new ATOM 0 HB3 ALA A 222 -6.744 -7.085 8.244 1.00 70.11 H new ATOM 1280 N VAL A 223 -6.878 -4.731 5.805 1.00 74.13 N ATOM 1281 CA VAL A 223 -5.977 -3.673 5.404 1.00 2.41 C ATOM 1282 C VAL A 223 -6.202 -2.469 6.309 1.00 2.20 C ATOM 1283 O VAL A 223 -7.289 -2.315 6.883 1.00 41.44 O ATOM 1284 CB VAL A 223 -6.215 -3.246 3.913 1.00 75.41 C ATOM 1285 CG1 VAL A 223 -7.554 -2.546 3.749 1.00 53.32 C ATOM 1286 CG2 VAL A 223 -5.095 -2.350 3.401 1.00 15.32 C ATOM 0 H VAL A 223 -7.786 -4.400 6.131 1.00 74.13 H new ATOM 0 HA VAL A 223 -4.954 -4.040 5.491 1.00 2.41 H new ATOM 0 HB VAL A 223 -6.222 -4.159 3.318 1.00 75.41 H new ATOM 0 HG11 VAL A 223 -7.691 -2.262 2.706 1.00 53.32 H new ATOM 0 HG12 VAL A 223 -8.356 -3.220 4.050 1.00 53.32 H new ATOM 0 HG13 VAL A 223 -7.577 -1.653 4.374 1.00 53.32 H new ATOM 0 HG21 VAL A 223 -5.294 -2.075 2.365 1.00 15.32 H new ATOM 0 HG22 VAL A 223 -5.042 -1.449 4.012 1.00 15.32 H new ATOM 0 HG23 VAL A 223 -4.147 -2.884 3.458 1.00 15.32 H new ATOM 1296 N HIS A 224 -5.188 -1.674 6.482 1.00 44.20 N ATOM 1297 CA HIS A 224 -5.309 -0.428 7.196 1.00 60.25 C ATOM 1298 C HIS A 224 -4.247 0.530 6.692 1.00 12.55 C ATOM 1299 O HIS A 224 -3.086 0.136 6.520 1.00 52.40 O ATOM 1300 CB HIS A 224 -5.171 -0.635 8.721 1.00 62.13 C ATOM 1301 CG HIS A 224 -5.401 0.617 9.525 1.00 74.21 C ATOM 1302 ND1 HIS A 224 -4.401 1.337 10.137 1.00 20.54 N ATOM 1303 CD2 HIS A 224 -6.550 1.273 9.802 1.00 42.23 C ATOM 1304 CE1 HIS A 224 -4.953 2.382 10.751 1.00 44.32 C ATOM 1305 NE2 HIS A 224 -6.265 2.393 10.578 1.00 11.22 N ATOM 0 H HIS A 224 -4.249 -1.868 6.133 1.00 44.20 H new ATOM 0 HA HIS A 224 -6.300 -0.012 7.015 1.00 60.25 H new ATOM 0 HB2 HIS A 224 -5.881 -1.397 9.041 1.00 62.13 H new ATOM 0 HB3 HIS A 224 -4.174 -1.017 8.938 1.00 62.13 H new ATOM 0 HD2 HIS A 224 -7.535 0.975 9.473 1.00 42.23 H new ATOM 0 HE1 HIS A 224 -4.404 3.121 11.315 1.00 44.32 H new ATOM 0 HE2 HIS A 224 -6.929 3.079 10.938 1.00 11.22 H new ATOM 1313 N TRP A 225 -4.632 1.753 6.411 1.00 72.23 N ATOM 1314 CA TRP A 225 -3.666 2.738 6.001 1.00 45.20 C ATOM 1315 C TRP A 225 -3.432 3.723 7.092 1.00 52.21 C ATOM 1316 O TRP A 225 -4.302 3.973 7.932 1.00 30.01 O ATOM 1317 CB TRP A 225 -4.032 3.469 4.699 1.00 54.35 C ATOM 1318 CG TRP A 225 -5.284 4.300 4.750 1.00 20.23 C ATOM 1319 CD1 TRP A 225 -6.545 3.879 4.496 1.00 42.10 C ATOM 1320 CD2 TRP A 225 -5.389 5.710 5.059 1.00 63.11 C ATOM 1321 NE1 TRP A 225 -7.424 4.916 4.627 1.00 21.51 N ATOM 1322 CE2 TRP A 225 -6.746 6.045 4.973 1.00 21.40 C ATOM 1323 CE3 TRP A 225 -4.468 6.717 5.405 1.00 21.51 C ATOM 1324 CZ2 TRP A 225 -7.219 7.332 5.213 1.00 40.20 C ATOM 1325 CZ3 TRP A 225 -4.941 7.993 5.643 1.00 62.52 C ATOM 1326 CH2 TRP A 225 -6.304 8.289 5.547 1.00 25.21 C ATOM 0 H TRP A 225 -5.595 2.084 6.459 1.00 72.23 H new ATOM 0 HA TRP A 225 -2.749 2.186 5.793 1.00 45.20 H new ATOM 0 HB2 TRP A 225 -3.200 4.115 4.420 1.00 54.35 H new ATOM 0 HB3 TRP A 225 -4.141 2.729 3.906 1.00 54.35 H new ATOM 0 HD1 TRP A 225 -6.817 2.869 4.228 1.00 42.10 H new ATOM 0 HE1 TRP A 225 -8.432 4.854 4.487 1.00 21.51 H new ATOM 0 HE3 TRP A 225 -3.414 6.497 5.483 1.00 21.51 H new ATOM 0 HZ2 TRP A 225 -8.271 7.565 5.138 1.00 40.20 H new ATOM 0 HZ3 TRP A 225 -4.246 8.776 5.908 1.00 62.52 H new ATOM 0 HH2 TRP A 225 -6.641 9.297 5.741 1.00 25.21 H new ATOM 1337 N TYR A 226 -2.288 4.267 7.073 1.00 21.54 N ATOM 1338 CA TYR A 226 -1.885 5.244 8.020 1.00 22.24 C ATOM 1339 C TYR A 226 -1.144 6.325 7.263 1.00 75.22 C ATOM 1340 O TYR A 226 -0.528 6.043 6.251 1.00 72.32 O ATOM 1341 CB TYR A 226 -0.993 4.586 9.087 1.00 14.43 C ATOM 1342 CG TYR A 226 -0.655 5.482 10.248 1.00 12.33 C ATOM 1343 CD1 TYR A 226 -1.641 5.891 11.128 1.00 32.24 C ATOM 1344 CD2 TYR A 226 0.639 5.926 10.463 1.00 53.10 C ATOM 1345 CE1 TYR A 226 -1.353 6.717 12.187 1.00 61.43 C ATOM 1346 CE2 TYR A 226 0.936 6.753 11.523 1.00 14.14 C ATOM 1347 CZ TYR A 226 -0.069 7.145 12.383 1.00 62.30 C ATOM 1348 OH TYR A 226 0.214 7.972 13.448 1.00 55.02 O ATOM 0 H TYR A 226 -1.573 4.046 6.380 1.00 21.54 H new ATOM 0 HA TYR A 226 -2.740 5.681 8.536 1.00 22.24 H new ATOM 0 HB2 TYR A 226 -1.495 3.695 9.464 1.00 14.43 H new ATOM 0 HB3 TYR A 226 -0.067 4.255 8.616 1.00 14.43 H new ATOM 0 HD1 TYR A 226 -2.656 5.554 10.980 1.00 32.24 H new ATOM 0 HD2 TYR A 226 1.426 5.619 9.790 1.00 53.10 H new ATOM 0 HE1 TYR A 226 -2.137 7.027 12.862 1.00 61.43 H new ATOM 0 HE2 TYR A 226 1.949 7.093 11.680 1.00 14.14 H new ATOM 0 HH TYR A 226 1.170 8.186 13.451 1.00 55.02 H new ATOM 1358 N ALA A 227 -1.245 7.542 7.702 1.00 45.44 N ATOM 1359 CA ALA A 227 -0.569 8.648 7.050 1.00 44.31 C ATOM 1360 C ALA A 227 0.919 8.667 7.379 1.00 25.54 C ATOM 1361 O ALA A 227 1.434 7.761 8.045 1.00 74.31 O ATOM 1362 CB ALA A 227 -1.227 9.971 7.423 1.00 3.51 C ATOM 0 H ALA A 227 -1.794 7.808 8.519 1.00 45.44 H new ATOM 0 HA ALA A 227 -0.662 8.508 5.973 1.00 44.31 H new ATOM 0 HB1 ALA A 227 -0.707 10.789 6.925 1.00 3.51 H new ATOM 0 HB2 ALA A 227 -2.271 9.960 7.109 1.00 3.51 H new ATOM 0 HB3 ALA A 227 -1.175 10.112 8.503 1.00 3.51 H new ATOM 1368 N GLY A 228 1.606 9.647 6.805 1.00 64.44 N ATOM 1369 CA GLY A 228 3.029 9.890 7.048 1.00 31.14 C ATOM 1370 C GLY A 228 3.469 9.665 8.476 1.00 20.14 C ATOM 1371 O GLY A 228 3.088 10.399 9.391 1.00 22.41 O ATOM 0 H GLY A 228 1.188 10.306 6.148 1.00 64.44 H new ATOM 0 HA2 GLY A 228 3.612 9.241 6.395 1.00 31.14 H new ATOM 0 HA3 GLY A 228 3.262 10.917 6.767 1.00 31.14 H new