USER MOD reduce.3.24.130724 H: found=0, std=0, add=1118, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1129 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 130 THR OG1 : rot 70:sc= 1.29 USER MOD Set 1.2: A 134 TYR OH : rot -4:sc= 2.15 USER MOD Set 2.1: A 78 ASN : amide:sc= -1.03 K(o=0.78,f=-4.6!) USER MOD Set 2.2: A 112 SER OG : rot -166:sc= 1.81 USER MOD Set 3.1: A 80 ASN : amide:sc= -1.04 X(o=-1.5,f=-1.7) USER MOD Set 3.2: A 85 HIS : no HE2:sc= -0.017 K(o=-1.5,f=-3.7) USER MOD Set 3.3: A 138 CYS SG : rot -139:sc= -0.455 USER MOD Set 3.4: A 143 HIS : no HD1:sc= 0.0383 K(o=-1.5,f=-2.8) USER MOD Set 4.1: A 39 HIS : +bothHN:sc= 1.81 K(o=3.8,f=-7.5!) USER MOD Set 4.2: A 75 THR OG1 : rot -78:sc= 1.98 USER MOD Set 5.1: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 128 HIS : no HE2:sc= 1.06 K(o=1.1,f=-2.9!) USER MOD Set 6.1: A 33 TYR OH : rot 162:sc= 1.12 USER MOD Set 6.2: A 57 HIS : no HE2:sc= -1.5 K(o=-0.38,f=-2.9!) USER MOD Set 7.1: A 27 SER OG : rot 151:sc= 1.09 USER MOD Set 7.2: A 32 THR OG1 : rot -115:sc= 1.71 USER MOD Set 8.1: A 5 THR OG1 : rot -31:sc= 0.41 USER MOD Set 8.2: A 6 THR OG1 : rot 180:sc= 0.00142 USER MOD Single : A 8 LYS NZ :NH3+ 169:sc= 0.737 (180deg=0.555) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -0.106 K(o=-0.11,f=-1) USER MOD Single : A 16 LYS NZ :NH3+ 173:sc=-0.00102 (180deg=-0.0566) USER MOD Single : A 18 MET CE :methyl -172:sc= -0.0038 (180deg=-0.101) USER MOD Single : A 21 LYS NZ :NH3+ -171:sc= 0.897 (180deg=0.848) USER MOD Single : A 23 THR OG1 : rot 174:sc= 1.99 USER MOD Single : A 25 LYS NZ :NH3+ -168:sc= 0.869 (180deg=0.604) USER MOD Single : A 30 THR OG1 : rot 69:sc= 0.97 USER MOD Single : A 34 SER OG : rot 180:sc= -0.0903 USER MOD Single : A 36 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0172) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 42:sc= 0.45 USER MOD Single : A 59 LYS NZ :NH3+ -158:sc= 1.23 (180deg=0.74) USER MOD Single : A 60 LYS NZ :NH3+ 147:sc= -0.076 (180deg=-0.872) USER MOD Single : A 61 ASN : amide:sc= -0.665 K(o=-0.67,f=-6.5!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 110:sc= -0.175 USER MOD Single : A 81 LYS NZ :NH3+ 151:sc= 1.12 (180deg=0.552) USER MOD Single : A 86 SER OG : rot 115:sc= 1.93 USER MOD Single : A 90 THR OG1 : rot 106:sc= 1.47 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 160:sc= 0.82 (180deg=0.564) USER MOD Single : A 96 TYR OH : rot -143:sc= 1.55 USER MOD Single : A 99 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 162:sc= 1.86 USER MOD Single : A 116 LYS NZ :NH3+ 173:sc= -0.0689 (180deg=-0.127) USER MOD Single : A 119 LYS NZ :NH3+ -155:sc= 0.489 (180deg=0.16) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot -119:sc= 1.84 USER MOD Single : A 126 THR OG1 : rot -120:sc= 1.15 USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 135 TYR OH : rot 150:sc= 0 USER MOD Single : A 136 TYR OH : rot -152:sc= 1.25 USER MOD Single : A 139 GLN : amide:sc= -0.0313 K(o=-0.031,f=-1) USER MOD Single : A 146 THR OG1 : rot -73:sc= 0.965 USER MOD Single : A 148 MET CE :methyl 168:sc= -1.59 (180deg=-2.1) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 173:sc= -0.0214 (180deg=-0.122) USER MOD ----------------------------------------------------------------- ATOM 54 N THR A 5 -5.687 -3.951 12.633 1.00 0.00 N ATOM 55 CA THR A 5 -6.005 -3.074 13.762 1.00 0.00 C ATOM 56 C THR A 5 -6.491 -1.687 13.328 1.00 0.00 C ATOM 57 O THR A 5 -7.688 -1.408 13.364 1.00 0.00 O ATOM 58 CB THR A 5 -4.782 -2.930 14.683 1.00 0.00 C ATOM 59 OG1 THR A 5 -3.633 -2.706 13.891 1.00 0.00 O ATOM 60 CG2 THR A 5 -4.564 -4.157 15.574 1.00 0.00 C ATOM 0 HA THR A 5 -6.827 -3.547 14.300 1.00 0.00 H new ATOM 0 HB THR A 5 -4.966 -2.085 15.346 1.00 0.00 H new ATOM 0 HG1 THR A 5 -3.734 -3.165 13.031 1.00 0.00 H new ATOM 0 HG21 THR A 5 -3.687 -3.999 16.202 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.440 -4.309 16.205 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.409 -5.037 14.950 1.00 0.00 H new ATOM 68 N THR A 6 -5.570 -0.811 12.914 1.00 0.00 N ATOM 69 CA THR A 6 -5.849 0.605 12.689 1.00 0.00 C ATOM 70 C THR A 6 -6.577 0.892 11.371 1.00 0.00 C ATOM 71 O THR A 6 -6.056 1.592 10.500 1.00 0.00 O ATOM 72 CB THR A 6 -4.532 1.389 12.819 1.00 0.00 C ATOM 73 OG1 THR A 6 -3.755 0.814 13.853 1.00 0.00 O ATOM 74 CG2 THR A 6 -4.831 2.849 13.168 1.00 0.00 C ATOM 0 H THR A 6 -4.602 -1.070 12.725 1.00 0.00 H new ATOM 0 HA THR A 6 -6.552 0.940 13.452 1.00 0.00 H new ATOM 0 HB THR A 6 -3.989 1.348 11.875 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.913 1.307 13.942 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.895 3.400 13.259 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.439 3.294 12.381 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.372 2.894 14.113 1.00 0.00 H new ATOM 82 N TRP A 7 -7.804 0.378 11.269 1.00 0.00 N ATOM 83 CA TRP A 7 -8.743 0.577 10.170 1.00 0.00 C ATOM 84 C TRP A 7 -9.675 1.752 10.460 1.00 0.00 C ATOM 85 O TRP A 7 -9.915 2.075 11.621 1.00 0.00 O ATOM 86 CB TRP A 7 -9.626 -0.666 10.026 1.00 0.00 C ATOM 87 CG TRP A 7 -8.910 -1.969 9.890 1.00 0.00 C ATOM 88 CD1 TRP A 7 -8.856 -2.936 10.829 1.00 0.00 C ATOM 89 CD2 TRP A 7 -8.160 -2.474 8.751 1.00 0.00 C ATOM 90 NE1 TRP A 7 -8.125 -3.998 10.349 1.00 0.00 N ATOM 91 CE2 TRP A 7 -7.641 -3.758 9.080 1.00 0.00 C ATOM 92 CE3 TRP A 7 -7.913 -1.996 7.450 1.00 0.00 C ATOM 93 CZ2 TRP A 7 -6.870 -4.504 8.174 1.00 0.00 C ATOM 94 CZ3 TRP A 7 -7.112 -2.720 6.547 1.00 0.00 C ATOM 95 CH2 TRP A 7 -6.588 -3.968 6.908 1.00 0.00 C ATOM 0 H TRP A 7 -8.189 -0.224 11.997 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.165 0.767 9.266 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -10.281 -0.724 10.895 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -10.265 -0.533 9.153 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -9.315 -2.885 11.805 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -7.961 -4.860 10.869 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.346 -1.057 7.139 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.498 -5.480 8.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -6.900 -2.311 5.570 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -5.969 -4.516 6.214 1.00 0.00 H new ATOM 106 N LYS A 8 -10.231 2.357 9.407 1.00 0.00 N ATOM 107 CA LYS A 8 -11.264 3.386 9.475 1.00 0.00 C ATOM 108 C LYS A 8 -12.031 3.328 8.152 1.00 0.00 C ATOM 109 O LYS A 8 -11.683 2.509 7.303 1.00 0.00 O ATOM 110 CB LYS A 8 -10.645 4.785 9.652 1.00 0.00 C ATOM 111 CG LYS A 8 -9.743 4.944 10.882 1.00 0.00 C ATOM 112 CD LYS A 8 -9.311 6.408 11.032 1.00 0.00 C ATOM 113 CE LYS A 8 -8.295 6.594 12.163 1.00 0.00 C ATOM 114 NZ LYS A 8 -7.009 5.946 11.850 1.00 0.00 N ATOM 0 H LYS A 8 -9.962 2.133 8.449 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.917 3.208 10.329 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -10.064 5.024 8.761 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.450 5.517 9.714 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -10.274 4.620 11.777 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.865 4.306 10.784 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -8.877 6.756 10.094 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -10.187 7.026 11.227 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.134 7.658 12.337 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.698 6.178 13.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -6.292 6.245 12.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.121 4.913 11.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -6.705 6.222 10.895 1.00 0.00 H new ATOM 128 N GLU A 9 -13.057 4.166 7.945 1.00 0.00 N ATOM 129 CA GLU A 9 -13.702 4.272 6.639 1.00 0.00 C ATOM 130 C GLU A 9 -14.034 5.720 6.305 1.00 0.00 C ATOM 131 O GLU A 9 -14.300 6.522 7.197 1.00 0.00 O ATOM 132 CB GLU A 9 -14.965 3.420 6.460 1.00 0.00 C ATOM 133 CG GLU A 9 -14.974 2.113 7.267 1.00 0.00 C ATOM 134 CD GLU A 9 -16.262 1.324 7.092 1.00 0.00 C ATOM 135 OE1 GLU A 9 -17.166 1.762 6.388 1.00 0.00 O ATOM 136 OE2 GLU A 9 -16.316 0.136 7.748 1.00 0.00 O ATOM 0 H GLU A 9 -13.452 4.774 8.663 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.960 3.872 5.948 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -15.832 4.015 6.747 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -15.079 3.180 5.403 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -14.130 1.495 6.960 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -14.834 2.342 8.323 1.00 0.00 H new ATOM 144 N ALA A 10 -14.028 6.010 5.007 1.00 0.00 N ATOM 145 CA ALA A 10 -14.410 7.265 4.392 1.00 0.00 C ATOM 146 C ALA A 10 -15.382 6.937 3.253 1.00 0.00 C ATOM 147 O ALA A 10 -16.012 5.879 3.286 1.00 0.00 O ATOM 148 CB ALA A 10 -13.140 7.952 3.893 1.00 0.00 C ATOM 0 H ALA A 10 -13.734 5.322 4.314 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.906 7.943 5.086 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -13.400 8.901 3.425 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -12.470 8.133 4.734 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -12.642 7.312 3.164 1.00 0.00 H new ATOM 154 N THR A 11 -15.485 7.790 2.231 1.00 0.00 N ATOM 155 CA THR A 11 -16.316 7.545 1.058 1.00 0.00 C ATOM 156 C THR A 11 -15.551 7.915 -0.220 1.00 0.00 C ATOM 157 O THR A 11 -14.474 8.504 -0.144 1.00 0.00 O ATOM 158 CB THR A 11 -17.639 8.317 1.174 1.00 0.00 C ATOM 159 OG1 THR A 11 -17.378 9.706 1.166 1.00 0.00 O ATOM 160 CG2 THR A 11 -18.412 7.969 2.450 1.00 0.00 C ATOM 0 H THR A 11 -14.987 8.679 2.198 1.00 0.00 H new ATOM 0 HA THR A 11 -16.557 6.483 1.003 1.00 0.00 H new ATOM 0 HB THR A 11 -18.253 8.030 0.321 1.00 0.00 H new ATOM 0 HG1 THR A 11 -18.222 10.198 1.238 1.00 0.00 H new ATOM 0 HG21 THR A 11 -19.339 8.542 2.482 1.00 0.00 H new ATOM 0 HG22 THR A 11 -18.644 6.904 2.456 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.804 8.213 3.321 1.00 0.00 H new ATOM 168 N LEU A 12 -16.108 7.585 -1.391 1.00 0.00 N ATOM 169 CA LEU A 12 -15.463 7.755 -2.694 1.00 0.00 C ATOM 170 C LEU A 12 -14.633 9.043 -2.854 1.00 0.00 C ATOM 171 O LEU A 12 -13.431 8.939 -3.100 1.00 0.00 O ATOM 172 CB LEU A 12 -16.504 7.565 -3.807 1.00 0.00 C ATOM 173 CG LEU A 12 -15.883 7.513 -5.216 1.00 0.00 C ATOM 174 CD1 LEU A 12 -16.638 6.492 -6.076 1.00 0.00 C ATOM 175 CD2 LEU A 12 -15.943 8.877 -5.914 1.00 0.00 C ATOM 0 H LEU A 12 -17.043 7.183 -1.458 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.705 6.976 -2.774 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -17.056 6.643 -3.626 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -17.225 8.381 -3.765 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.838 7.225 -5.103 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -16.196 6.458 -7.072 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -16.570 5.507 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -17.685 6.785 -6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -15.495 8.799 -6.905 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.982 9.192 -6.009 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -15.394 9.612 -5.325 1.00 0.00 H new ATOM 187 N PRO A 13 -15.191 10.259 -2.725 1.00 0.00 N ATOM 188 CA PRO A 13 -14.404 11.474 -2.913 1.00 0.00 C ATOM 189 C PRO A 13 -13.233 11.557 -1.927 1.00 0.00 C ATOM 190 O PRO A 13 -12.172 12.097 -2.248 1.00 0.00 O ATOM 191 CB PRO A 13 -15.387 12.635 -2.732 1.00 0.00 C ATOM 192 CG PRO A 13 -16.502 12.034 -1.877 1.00 0.00 C ATOM 193 CD PRO A 13 -16.562 10.592 -2.375 1.00 0.00 C ATOM 0 HA PRO A 13 -13.942 11.497 -3.900 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -14.917 13.485 -2.237 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -15.765 12.993 -3.690 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -16.270 12.086 -0.813 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.449 12.553 -2.023 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.946 9.924 -1.604 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.223 10.499 -3.236 1.00 0.00 H new ATOM 201 N GLN A 14 -13.399 10.991 -0.730 1.00 0.00 N ATOM 202 CA GLN A 14 -12.354 11.008 0.272 1.00 0.00 C ATOM 203 C GLN A 14 -11.158 10.168 -0.162 1.00 0.00 C ATOM 204 O GLN A 14 -10.057 10.402 0.327 1.00 0.00 O ATOM 205 CB GLN A 14 -12.883 10.535 1.625 1.00 0.00 C ATOM 206 CG GLN A 14 -14.179 11.253 2.032 1.00 0.00 C ATOM 207 CD GLN A 14 -14.063 12.770 1.938 1.00 0.00 C ATOM 208 OE1 GLN A 14 -14.762 13.407 1.158 1.00 0.00 O ATOM 209 NE2 GLN A 14 -13.169 13.364 2.723 1.00 0.00 N ATOM 0 H GLN A 14 -14.253 10.516 -0.439 1.00 0.00 H new ATOM 0 HA GLN A 14 -12.019 12.040 0.380 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -13.063 9.461 1.586 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -12.123 10.703 2.388 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -14.994 10.914 1.392 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -14.439 10.975 3.053 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -12.602 12.807 3.362 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -13.051 14.376 2.686 1.00 0.00 H new ATOM 218 N VAL A 15 -11.347 9.203 -1.066 1.00 0.00 N ATOM 219 CA VAL A 15 -10.222 8.459 -1.615 1.00 0.00 C ATOM 220 C VAL A 15 -9.283 9.456 -2.297 1.00 0.00 C ATOM 221 O VAL A 15 -8.089 9.502 -2.007 1.00 0.00 O ATOM 222 CB VAL A 15 -10.714 7.374 -2.587 1.00 0.00 C ATOM 223 CG1 VAL A 15 -9.536 6.574 -3.155 1.00 0.00 C ATOM 224 CG2 VAL A 15 -11.690 6.426 -1.881 1.00 0.00 C ATOM 0 H VAL A 15 -12.259 8.924 -1.427 1.00 0.00 H new ATOM 0 HA VAL A 15 -9.681 7.942 -0.822 1.00 0.00 H new ATOM 0 HB VAL A 15 -11.229 7.869 -3.410 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -9.910 5.813 -3.840 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.865 7.245 -3.690 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.995 6.094 -2.339 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -12.029 5.664 -2.583 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -11.188 5.947 -1.040 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -12.548 6.992 -1.517 1.00 0.00 H new ATOM 234 N LYS A 16 -9.847 10.286 -3.177 1.00 0.00 N ATOM 235 CA LYS A 16 -9.102 11.321 -3.875 1.00 0.00 C ATOM 236 C LYS A 16 -8.490 12.281 -2.855 1.00 0.00 C ATOM 237 O LYS A 16 -7.292 12.563 -2.914 1.00 0.00 O ATOM 238 CB LYS A 16 -10.007 12.044 -4.883 1.00 0.00 C ATOM 239 CG LYS A 16 -10.618 11.056 -5.886 1.00 0.00 C ATOM 240 CD LYS A 16 -11.426 11.806 -6.952 1.00 0.00 C ATOM 241 CE LYS A 16 -11.965 10.852 -8.025 1.00 0.00 C ATOM 242 NZ LYS A 16 -12.905 9.864 -7.466 1.00 0.00 N ATOM 0 H LYS A 16 -10.837 10.254 -3.422 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.288 10.872 -4.445 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.803 12.567 -4.352 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -9.431 12.799 -5.417 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.827 10.475 -6.362 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -11.262 10.349 -5.363 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -12.257 12.329 -6.479 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.797 12.564 -7.420 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.465 11.428 -8.803 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.132 10.332 -8.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.335 9.317 -8.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.394 9.220 -6.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -13.651 10.357 -6.934 1.00 0.00 H new ATOM 256 N ALA A 17 -9.306 12.754 -1.903 1.00 0.00 N ATOM 257 CA ALA A 17 -8.834 13.640 -0.846 1.00 0.00 C ATOM 258 C ALA A 17 -7.578 13.075 -0.177 1.00 0.00 C ATOM 259 O ALA A 17 -6.549 13.744 -0.141 1.00 0.00 O ATOM 260 CB ALA A 17 -9.939 13.898 0.185 1.00 0.00 C ATOM 0 H ALA A 17 -10.300 12.533 -1.849 1.00 0.00 H new ATOM 0 HA ALA A 17 -8.569 14.595 -1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -9.563 14.562 0.963 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -10.794 14.363 -0.306 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.248 12.953 0.632 1.00 0.00 H new ATOM 266 N MET A 18 -7.654 11.843 0.333 1.00 0.00 N ATOM 267 CA MET A 18 -6.535 11.179 0.982 1.00 0.00 C ATOM 268 C MET A 18 -5.341 11.082 0.033 1.00 0.00 C ATOM 269 O MET A 18 -4.245 11.502 0.399 1.00 0.00 O ATOM 270 CB MET A 18 -6.952 9.809 1.529 1.00 0.00 C ATOM 271 CG MET A 18 -7.768 9.975 2.821 1.00 0.00 C ATOM 272 SD MET A 18 -8.296 8.443 3.630 1.00 0.00 S ATOM 273 CE MET A 18 -9.488 7.866 2.411 1.00 0.00 C ATOM 0 H MET A 18 -8.503 11.279 0.304 1.00 0.00 H new ATOM 0 HA MET A 18 -6.222 11.780 1.836 1.00 0.00 H new ATOM 0 HB2 MET A 18 -7.543 9.277 0.784 1.00 0.00 H new ATOM 0 HB3 MET A 18 -6.067 9.204 1.725 1.00 0.00 H new ATOM 0 HG2 MET A 18 -7.174 10.551 3.531 1.00 0.00 H new ATOM 0 HG3 MET A 18 -8.655 10.566 2.593 1.00 0.00 H new ATOM 0 HE1 MET A 18 -10.023 7.002 2.806 1.00 0.00 H new ATOM 0 HE2 MET A 18 -10.198 8.663 2.191 1.00 0.00 H new ATOM 0 HE3 MET A 18 -8.966 7.583 1.497 1.00 0.00 H new ATOM 283 N LEU A 19 -5.535 10.549 -1.179 1.00 0.00 N ATOM 284 CA LEU A 19 -4.453 10.405 -2.152 1.00 0.00 C ATOM 285 C LEU A 19 -3.696 11.725 -2.333 1.00 0.00 C ATOM 286 O LEU A 19 -2.462 11.738 -2.316 1.00 0.00 O ATOM 287 CB LEU A 19 -4.990 9.863 -3.487 1.00 0.00 C ATOM 288 CG LEU A 19 -5.441 8.390 -3.407 1.00 0.00 C ATOM 289 CD1 LEU A 19 -6.337 8.066 -4.607 1.00 0.00 C ATOM 290 CD2 LEU A 19 -4.263 7.408 -3.423 1.00 0.00 C ATOM 0 H LEU A 19 -6.439 10.209 -1.508 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.739 9.677 -1.767 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.831 10.477 -3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.216 9.958 -4.248 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.972 8.275 -2.462 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.657 7.025 -4.552 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.212 8.716 -4.593 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.780 8.226 -5.530 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.640 6.387 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.697 7.534 -4.346 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.614 7.605 -2.570 1.00 0.00 H new ATOM 302 N GLU A 20 -4.418 12.842 -2.456 1.00 0.00 N ATOM 303 CA GLU A 20 -3.801 14.156 -2.592 1.00 0.00 C ATOM 304 C GLU A 20 -2.887 14.530 -1.414 1.00 0.00 C ATOM 305 O GLU A 20 -1.982 15.336 -1.604 1.00 0.00 O ATOM 306 CB GLU A 20 -4.879 15.224 -2.824 1.00 0.00 C ATOM 307 CG GLU A 20 -5.565 15.077 -4.190 1.00 0.00 C ATOM 308 CD GLU A 20 -4.628 15.409 -5.342 1.00 0.00 C ATOM 309 OE1 GLU A 20 -4.306 14.534 -6.138 1.00 0.00 O ATOM 310 OE2 GLU A 20 -4.199 16.695 -5.405 1.00 0.00 O ATOM 0 H GLU A 20 -5.438 12.858 -2.464 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.148 14.110 -3.464 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -5.628 15.157 -2.035 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -4.428 16.214 -2.752 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -5.930 14.056 -4.303 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -6.435 15.733 -4.231 1.00 0.00 H new ATOM 318 N LYS A 21 -3.089 13.978 -0.209 1.00 0.00 N ATOM 319 CA LYS A 21 -2.210 14.258 0.927 1.00 0.00 C ATOM 320 C LYS A 21 -0.911 13.437 0.869 1.00 0.00 C ATOM 321 O LYS A 21 -0.084 13.562 1.773 1.00 0.00 O ATOM 322 CB LYS A 21 -2.933 14.035 2.272 1.00 0.00 C ATOM 323 CG LYS A 21 -3.682 15.253 2.839 1.00 0.00 C ATOM 324 CD LYS A 21 -5.052 15.508 2.202 1.00 0.00 C ATOM 325 CE LYS A 21 -4.991 16.516 1.049 1.00 0.00 C ATOM 326 NZ LYS A 21 -6.279 16.572 0.338 1.00 0.00 N ATOM 0 H LYS A 21 -3.854 13.336 0.000 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.938 15.311 0.857 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -3.645 13.219 2.149 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -2.198 13.709 3.008 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -3.814 15.115 3.912 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.062 16.140 2.705 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -5.458 14.566 1.834 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.740 15.875 2.964 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.740 17.504 1.436 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.199 16.235 0.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.174 17.141 -0.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.578 15.609 0.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -6.997 17.006 0.953 1.00 0.00 H new ATOM 340 N ASP A 22 -0.705 12.572 -0.134 1.00 0.00 N ATOM 341 CA ASP A 22 0.570 11.865 -0.252 1.00 0.00 C ATOM 342 C ASP A 22 1.730 12.858 -0.428 1.00 0.00 C ATOM 343 O ASP A 22 1.528 13.940 -0.974 1.00 0.00 O ATOM 344 CB ASP A 22 0.548 10.857 -1.410 1.00 0.00 C ATOM 345 CG ASP A 22 0.971 11.490 -2.730 1.00 0.00 C ATOM 346 OD1 ASP A 22 2.172 11.548 -2.985 1.00 0.00 O ATOM 347 OD2 ASP A 22 -0.020 11.936 -3.549 1.00 0.00 O ATOM 0 H ASP A 22 -1.389 12.351 -0.858 1.00 0.00 H new ATOM 0 HA ASP A 22 0.724 11.310 0.673 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.213 10.025 -1.178 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -0.456 10.444 -1.512 1.00 0.00 H new ATOM 353 N THR A 23 2.943 12.475 -0.019 1.00 0.00 N ATOM 354 CA THR A 23 4.131 13.325 -0.122 1.00 0.00 C ATOM 355 C THR A 23 5.215 12.716 -1.030 1.00 0.00 C ATOM 356 O THR A 23 6.401 13.003 -0.862 1.00 0.00 O ATOM 357 CB THR A 23 4.635 13.637 1.301 1.00 0.00 C ATOM 358 OG1 THR A 23 4.693 12.469 2.100 1.00 0.00 O ATOM 359 CG2 THR A 23 3.690 14.623 1.997 1.00 0.00 C ATOM 0 H THR A 23 3.129 11.561 0.395 1.00 0.00 H new ATOM 0 HA THR A 23 3.865 14.262 -0.611 1.00 0.00 H new ATOM 0 HB THR A 23 5.633 14.062 1.196 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.100 12.684 2.965 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.059 14.834 3.001 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.645 15.550 1.425 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.693 14.188 2.061 1.00 0.00 H new ATOM 367 N GLY A 24 4.825 11.895 -2.011 1.00 0.00 N ATOM 368 CA GLY A 24 5.739 11.229 -2.931 1.00 0.00 C ATOM 369 C GLY A 24 5.898 12.045 -4.210 1.00 0.00 C ATOM 370 O GLY A 24 4.941 12.220 -4.961 1.00 0.00 O ATOM 0 H GLY A 24 3.845 11.674 -2.187 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.710 11.095 -2.455 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.362 10.235 -3.171 1.00 0.00 H new ATOM 374 N LYS A 25 7.114 12.523 -4.471 1.00 0.00 N ATOM 375 CA LYS A 25 7.465 13.224 -5.694 1.00 0.00 C ATOM 376 C LYS A 25 7.678 12.179 -6.794 1.00 0.00 C ATOM 377 O LYS A 25 7.997 11.028 -6.499 1.00 0.00 O ATOM 378 CB LYS A 25 8.739 14.062 -5.488 1.00 0.00 C ATOM 379 CG LYS A 25 8.873 14.735 -4.111 1.00 0.00 C ATOM 380 CD LYS A 25 7.658 15.590 -3.720 1.00 0.00 C ATOM 381 CE LYS A 25 7.865 16.260 -2.354 1.00 0.00 C ATOM 382 NZ LYS A 25 8.105 15.278 -1.279 1.00 0.00 N ATOM 0 H LYS A 25 7.895 12.429 -3.821 1.00 0.00 H new ATOM 0 HA LYS A 25 6.665 13.908 -5.978 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.605 13.419 -5.645 1.00 0.00 H new ATOM 0 HB3 LYS A 25 8.773 14.835 -6.256 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.023 13.966 -3.354 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.764 15.363 -4.109 1.00 0.00 H new ATOM 0 HD2 LYS A 25 7.488 16.353 -4.480 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.765 14.965 -3.690 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.711 16.945 -2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 25 6.987 16.857 -2.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.037 15.751 -0.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.393 14.522 -1.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 9.055 14.868 -1.389 1.00 0.00 H new ATOM 396 N VAL A 26 7.491 12.558 -8.059 1.00 0.00 N ATOM 397 CA VAL A 26 7.567 11.629 -9.181 1.00 0.00 C ATOM 398 C VAL A 26 9.032 11.368 -9.548 1.00 0.00 C ATOM 399 O VAL A 26 9.874 12.258 -9.425 1.00 0.00 O ATOM 400 CB VAL A 26 6.765 12.193 -10.371 1.00 0.00 C ATOM 401 CG1 VAL A 26 6.633 11.149 -11.489 1.00 0.00 C ATOM 402 CG2 VAL A 26 5.361 12.623 -9.922 1.00 0.00 C ATOM 0 H VAL A 26 7.283 13.519 -8.332 1.00 0.00 H new ATOM 0 HA VAL A 26 7.126 10.672 -8.903 1.00 0.00 H new ATOM 0 HB VAL A 26 7.308 13.059 -10.751 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.063 11.572 -12.316 1.00 0.00 H new ATOM 0 HG12 VAL A 26 7.625 10.864 -11.840 1.00 0.00 H new ATOM 0 HG13 VAL A 26 6.117 10.269 -11.106 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.811 13.018 -10.776 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.830 11.763 -9.515 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.444 13.394 -9.156 1.00 0.00 H new ATOM 412 N SER A 27 9.362 10.152 -9.992 1.00 0.00 N ATOM 413 CA SER A 27 10.688 9.797 -10.477 1.00 0.00 C ATOM 414 C SER A 27 10.563 8.712 -11.555 1.00 0.00 C ATOM 415 O SER A 27 11.023 7.583 -11.388 1.00 0.00 O ATOM 416 CB SER A 27 11.578 9.367 -9.302 1.00 0.00 C ATOM 417 OG SER A 27 11.545 10.344 -8.275 1.00 0.00 O ATOM 0 H SER A 27 8.700 9.377 -10.023 1.00 0.00 H new ATOM 0 HA SER A 27 11.168 10.661 -10.937 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.238 8.408 -8.912 1.00 0.00 H new ATOM 0 HB3 SER A 27 12.603 9.226 -9.646 1.00 0.00 H new ATOM 0 HG SER A 27 11.699 9.913 -7.408 1.00 0.00 H new ATOM 423 N GLY A 28 9.926 9.063 -12.673 1.00 0.00 N ATOM 424 CA GLY A 28 9.703 8.148 -13.781 1.00 0.00 C ATOM 425 C GLY A 28 8.777 7.011 -13.352 1.00 0.00 C ATOM 426 O GLY A 28 7.615 7.253 -13.040 1.00 0.00 O ATOM 0 H GLY A 28 9.550 9.998 -12.831 1.00 0.00 H new ATOM 0 HA2 GLY A 28 9.265 8.685 -14.622 1.00 0.00 H new ATOM 0 HA3 GLY A 28 10.655 7.742 -14.123 1.00 0.00 H new ATOM 430 N ASP A 29 9.294 5.777 -13.315 1.00 0.00 N ATOM 431 CA ASP A 29 8.554 4.613 -12.826 1.00 0.00 C ATOM 432 C ASP A 29 8.545 4.564 -11.294 1.00 0.00 C ATOM 433 O ASP A 29 7.772 3.816 -10.698 1.00 0.00 O ATOM 434 CB ASP A 29 9.161 3.316 -13.381 1.00 0.00 C ATOM 435 CG ASP A 29 10.460 2.917 -12.688 1.00 0.00 C ATOM 436 OD1 ASP A 29 11.266 3.783 -12.355 1.00 0.00 O ATOM 437 OD2 ASP A 29 10.634 1.591 -12.463 1.00 0.00 O ATOM 0 H ASP A 29 10.241 5.560 -13.625 1.00 0.00 H new ATOM 0 HA ASP A 29 7.526 4.706 -13.175 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.437 2.509 -13.274 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.348 3.437 -14.448 1.00 0.00 H new ATOM 443 N THR A 30 9.450 5.315 -10.671 1.00 0.00 N ATOM 444 CA THR A 30 9.671 5.343 -9.244 1.00 0.00 C ATOM 445 C THR A 30 9.032 6.623 -8.695 1.00 0.00 C ATOM 446 O THR A 30 8.734 7.555 -9.444 1.00 0.00 O ATOM 447 CB THR A 30 11.194 5.234 -9.033 1.00 0.00 C ATOM 448 OG1 THR A 30 11.638 4.005 -9.573 1.00 0.00 O ATOM 449 CG2 THR A 30 11.693 5.345 -7.597 1.00 0.00 C ATOM 0 H THR A 30 10.072 5.945 -11.178 1.00 0.00 H new ATOM 0 HA THR A 30 9.209 4.520 -8.699 1.00 0.00 H new ATOM 0 HB THR A 30 11.610 6.104 -9.541 1.00 0.00 H new ATOM 0 HG1 THR A 30 11.566 4.032 -10.550 1.00 0.00 H new ATOM 0 HG21 THR A 30 12.779 5.253 -7.581 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.405 6.312 -7.185 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.252 4.549 -6.996 1.00 0.00 H new ATOM 457 N VAL A 31 8.792 6.658 -7.388 1.00 0.00 N ATOM 458 CA VAL A 31 8.314 7.806 -6.638 1.00 0.00 C ATOM 459 C VAL A 31 9.337 7.989 -5.511 1.00 0.00 C ATOM 460 O VAL A 31 9.954 7.016 -5.076 1.00 0.00 O ATOM 461 CB VAL A 31 6.851 7.552 -6.212 1.00 0.00 C ATOM 462 CG1 VAL A 31 6.436 8.263 -4.919 1.00 0.00 C ATOM 463 CG2 VAL A 31 5.913 8.028 -7.328 1.00 0.00 C ATOM 0 H VAL A 31 8.935 5.840 -6.795 1.00 0.00 H new ATOM 0 HA VAL A 31 8.259 8.743 -7.192 1.00 0.00 H new ATOM 0 HB VAL A 31 6.777 6.480 -6.029 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.395 8.030 -4.694 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.069 7.925 -4.099 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.548 9.340 -5.044 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.878 7.852 -7.034 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.064 9.094 -7.501 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.129 7.478 -8.244 1.00 0.00 H new ATOM 473 N THR A 32 9.569 9.226 -5.070 1.00 0.00 N ATOM 474 CA THR A 32 10.629 9.552 -4.133 1.00 0.00 C ATOM 475 C THR A 32 10.079 10.495 -3.079 1.00 0.00 C ATOM 476 O THR A 32 9.420 11.474 -3.417 1.00 0.00 O ATOM 477 CB THR A 32 11.790 10.191 -4.906 1.00 0.00 C ATOM 478 OG1 THR A 32 12.281 9.264 -5.853 1.00 0.00 O ATOM 479 CG2 THR A 32 12.935 10.622 -3.986 1.00 0.00 C ATOM 0 H THR A 32 9.017 10.033 -5.360 1.00 0.00 H new ATOM 0 HA THR A 32 10.999 8.657 -3.633 1.00 0.00 H new ATOM 0 HB THR A 32 11.407 11.085 -5.398 1.00 0.00 H new ATOM 0 HG1 THR A 32 13.198 9.011 -5.618 1.00 0.00 H new ATOM 0 HG21 THR A 32 13.732 11.068 -4.581 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.567 11.353 -3.266 1.00 0.00 H new ATOM 0 HG23 THR A 32 13.322 9.752 -3.455 1.00 0.00 H new ATOM 487 N TYR A 33 10.333 10.194 -1.811 1.00 0.00 N ATOM 488 CA TYR A 33 9.873 11.001 -0.698 1.00 0.00 C ATOM 489 C TYR A 33 10.999 11.891 -0.176 1.00 0.00 C ATOM 490 O TYR A 33 12.163 11.736 -0.547 1.00 0.00 O ATOM 491 CB TYR A 33 9.339 10.068 0.384 1.00 0.00 C ATOM 492 CG TYR A 33 7.944 9.576 0.078 1.00 0.00 C ATOM 493 CD1 TYR A 33 7.726 8.488 -0.787 1.00 0.00 C ATOM 494 CD2 TYR A 33 6.850 10.271 0.620 1.00 0.00 C ATOM 495 CE1 TYR A 33 6.412 8.111 -1.119 1.00 0.00 C ATOM 496 CE2 TYR A 33 5.547 9.829 0.364 1.00 0.00 C ATOM 497 CZ TYR A 33 5.324 8.787 -0.544 1.00 0.00 C ATOM 498 OH TYR A 33 4.049 8.476 -0.904 1.00 0.00 O ATOM 0 H TYR A 33 10.870 9.374 -1.529 1.00 0.00 H new ATOM 0 HA TYR A 33 9.072 11.667 -1.020 1.00 0.00 H new ATOM 0 HB2 TYR A 33 10.009 9.214 0.488 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.336 10.589 1.341 1.00 0.00 H new ATOM 0 HD1 TYR A 33 8.565 7.944 -1.195 1.00 0.00 H new ATOM 0 HD2 TYR A 33 7.014 11.145 1.233 1.00 0.00 H new ATOM 0 HE1 TYR A 33 6.240 7.303 -1.815 1.00 0.00 H new ATOM 0 HE2 TYR A 33 4.712 10.293 0.868 1.00 0.00 H new ATOM 0 HH TYR A 33 3.426 8.811 -0.226 1.00 0.00 H new ATOM 508 N SER A 34 10.652 12.843 0.691 1.00 0.00 N ATOM 509 CA SER A 34 11.589 13.733 1.354 1.00 0.00 C ATOM 510 C SER A 34 10.935 14.199 2.654 1.00 0.00 C ATOM 511 O SER A 34 9.707 14.203 2.744 1.00 0.00 O ATOM 512 CB SER A 34 11.921 14.923 0.444 1.00 0.00 C ATOM 513 OG SER A 34 12.389 14.483 -0.818 1.00 0.00 O ATOM 0 H SER A 34 9.682 13.016 0.955 1.00 0.00 H new ATOM 0 HA SER A 34 12.526 13.221 1.571 1.00 0.00 H new ATOM 0 HB2 SER A 34 11.034 15.542 0.311 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.678 15.548 0.918 1.00 0.00 H new ATOM 0 HG SER A 34 12.592 15.259 -1.380 1.00 0.00 H new ATOM 519 N GLY A 35 11.740 14.583 3.646 1.00 0.00 N ATOM 520 CA GLY A 35 11.240 14.940 4.966 1.00 0.00 C ATOM 521 C GLY A 35 10.829 13.692 5.753 1.00 0.00 C ATOM 522 O GLY A 35 10.863 12.579 5.232 1.00 0.00 O ATOM 0 H GLY A 35 12.753 14.654 3.553 1.00 0.00 H new ATOM 0 HA2 GLY A 35 12.009 15.484 5.515 1.00 0.00 H new ATOM 0 HA3 GLY A 35 10.386 15.609 4.866 1.00 0.00 H new ATOM 526 N LYS A 36 10.461 13.873 7.026 1.00 0.00 N ATOM 527 CA LYS A 36 10.088 12.753 7.881 1.00 0.00 C ATOM 528 C LYS A 36 8.668 12.261 7.586 1.00 0.00 C ATOM 529 O LYS A 36 8.381 11.084 7.776 1.00 0.00 O ATOM 530 CB LYS A 36 10.250 13.103 9.362 1.00 0.00 C ATOM 531 CG LYS A 36 11.712 13.400 9.723 1.00 0.00 C ATOM 532 CD LYS A 36 11.835 13.618 11.237 1.00 0.00 C ATOM 533 CE LYS A 36 13.296 13.774 11.678 1.00 0.00 C ATOM 534 NZ LYS A 36 13.936 14.955 11.071 1.00 0.00 N ATOM 0 H LYS A 36 10.415 14.784 7.482 1.00 0.00 H new ATOM 0 HA LYS A 36 10.772 11.936 7.653 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.634 13.970 9.600 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.886 12.277 9.972 1.00 0.00 H new ATOM 0 HG2 LYS A 36 12.349 12.572 9.412 1.00 0.00 H new ATOM 0 HG3 LYS A 36 12.056 14.286 9.189 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.273 14.508 11.522 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.386 12.775 11.762 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.339 13.857 12.764 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.854 12.879 11.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.905 15.050 11.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.964 14.842 10.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.390 15.807 11.311 1.00 0.00 H new ATOM 548 N THR A 37 7.766 13.143 7.151 1.00 0.00 N ATOM 549 CA THR A 37 6.366 12.804 6.940 1.00 0.00 C ATOM 550 C THR A 37 6.202 12.062 5.609 1.00 0.00 C ATOM 551 O THR A 37 5.719 12.621 4.624 1.00 0.00 O ATOM 552 CB THR A 37 5.539 14.096 7.001 1.00 0.00 C ATOM 553 OG1 THR A 37 6.010 14.896 8.069 1.00 0.00 O ATOM 554 CG2 THR A 37 4.053 13.794 7.210 1.00 0.00 C ATOM 0 H THR A 37 7.991 14.114 6.936 1.00 0.00 H new ATOM 0 HA THR A 37 6.006 12.132 7.719 1.00 0.00 H new ATOM 0 HB THR A 37 5.649 14.623 6.053 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.487 15.724 8.113 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.494 14.729 7.249 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.686 13.186 6.384 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.920 13.252 8.146 1.00 0.00 H new ATOM 562 N VAL A 38 6.615 10.796 5.576 1.00 0.00 N ATOM 563 CA VAL A 38 6.576 9.961 4.387 1.00 0.00 C ATOM 564 C VAL A 38 5.177 9.350 4.290 1.00 0.00 C ATOM 565 O VAL A 38 4.921 8.284 4.845 1.00 0.00 O ATOM 566 CB VAL A 38 7.739 8.957 4.444 1.00 0.00 C ATOM 567 CG1 VAL A 38 7.671 7.918 3.319 1.00 0.00 C ATOM 568 CG2 VAL A 38 9.066 9.716 4.348 1.00 0.00 C ATOM 0 H VAL A 38 6.993 10.317 6.394 1.00 0.00 H new ATOM 0 HA VAL A 38 6.729 10.519 3.463 1.00 0.00 H new ATOM 0 HB VAL A 38 7.665 8.422 5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.515 7.233 3.405 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.739 7.358 3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.711 8.423 2.354 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.894 9.008 4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 38 9.104 10.266 3.407 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.146 10.415 5.180 1.00 0.00 H new ATOM 578 N HIS A 39 4.255 10.049 3.618 1.00 0.00 N ATOM 579 CA HIS A 39 2.857 9.652 3.547 1.00 0.00 C ATOM 580 C HIS A 39 2.593 8.830 2.283 1.00 0.00 C ATOM 581 O HIS A 39 2.469 9.377 1.182 1.00 0.00 O ATOM 582 CB HIS A 39 1.954 10.886 3.648 1.00 0.00 C ATOM 583 CG HIS A 39 0.492 10.563 3.837 1.00 0.00 C ATOM 584 ND1 HIS A 39 -0.557 11.402 3.518 1.00 0.00 N ATOM 585 CD2 HIS A 39 -0.031 9.450 4.441 1.00 0.00 C ATOM 586 CE1 HIS A 39 -1.698 10.807 3.914 1.00 0.00 C ATOM 587 NE2 HIS A 39 -1.398 9.620 4.478 1.00 0.00 N ATOM 0 H HIS A 39 4.465 10.908 3.109 1.00 0.00 H new ATOM 0 HA HIS A 39 2.620 9.008 4.394 1.00 0.00 H new ATOM 0 HB2 HIS A 39 2.290 11.502 4.482 1.00 0.00 H new ATOM 0 HB3 HIS A 39 2.070 11.483 2.743 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -0.481 12.312 3.063 1.00 0.00 H new ATOM 0 HD2 HIS A 39 0.522 8.602 4.816 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.692 11.214 3.799 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -2.070 8.959 4.867 1.00 0.00 H new ATOM 596 N VAL A 40 2.523 7.508 2.441 1.00 0.00 N ATOM 597 CA VAL A 40 2.265 6.555 1.373 1.00 0.00 C ATOM 598 C VAL A 40 0.768 6.245 1.357 1.00 0.00 C ATOM 599 O VAL A 40 0.289 5.451 2.165 1.00 0.00 O ATOM 600 CB VAL A 40 3.124 5.296 1.577 1.00 0.00 C ATOM 601 CG1 VAL A 40 2.876 4.271 0.461 1.00 0.00 C ATOM 602 CG2 VAL A 40 4.616 5.657 1.603 1.00 0.00 C ATOM 0 H VAL A 40 2.649 7.061 3.349 1.00 0.00 H new ATOM 0 HA VAL A 40 2.540 6.970 0.403 1.00 0.00 H new ATOM 0 HB VAL A 40 2.838 4.858 2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.496 3.391 0.631 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.826 3.980 0.461 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.130 4.713 -0.502 1.00 0.00 H new ATOM 0 HG21 VAL A 40 5.207 4.753 1.748 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.894 6.124 0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 40 4.808 6.351 2.421 1.00 0.00 H new ATOM 612 N VAL A 41 0.021 6.870 0.444 1.00 0.00 N ATOM 613 CA VAL A 41 -1.400 6.596 0.281 1.00 0.00 C ATOM 614 C VAL A 41 -1.576 5.568 -0.840 1.00 0.00 C ATOM 615 O VAL A 41 -1.109 5.820 -1.952 1.00 0.00 O ATOM 616 CB VAL A 41 -2.187 7.888 0.028 1.00 0.00 C ATOM 617 CG1 VAL A 41 -3.680 7.591 0.233 1.00 0.00 C ATOM 618 CG2 VAL A 41 -1.762 8.997 0.999 1.00 0.00 C ATOM 0 H VAL A 41 0.385 7.575 -0.197 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.807 6.175 1.200 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.989 8.229 -0.988 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.259 8.498 0.058 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -3.997 6.818 -0.467 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.846 7.246 1.254 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.338 9.900 0.795 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.946 8.674 2.024 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.700 9.207 0.870 1.00 0.00 H new ATOM 628 N ALA A 42 -2.217 4.425 -0.567 1.00 0.00 N ATOM 629 CA ALA A 42 -2.322 3.317 -1.519 1.00 0.00 C ATOM 630 C ALA A 42 -3.749 2.764 -1.621 1.00 0.00 C ATOM 631 O ALA A 42 -4.278 2.209 -0.658 1.00 0.00 O ATOM 632 CB ALA A 42 -1.333 2.221 -1.111 1.00 0.00 C ATOM 0 H ALA A 42 -2.679 4.244 0.324 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.073 3.691 -2.512 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.401 1.390 -1.813 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.320 2.623 -1.122 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -1.573 1.870 -0.107 1.00 0.00 H new ATOM 638 N ALA A 43 -4.365 2.880 -2.800 1.00 0.00 N ATOM 639 CA ALA A 43 -5.679 2.326 -3.089 1.00 0.00 C ATOM 640 C ALA A 43 -5.537 0.922 -3.676 1.00 0.00 C ATOM 641 O ALA A 43 -5.034 0.759 -4.786 1.00 0.00 O ATOM 642 CB ALA A 43 -6.435 3.253 -4.043 1.00 0.00 C ATOM 0 H ALA A 43 -3.952 3.372 -3.592 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.252 2.248 -2.165 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.418 2.833 -4.256 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.552 4.234 -3.581 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.875 3.354 -4.973 1.00 0.00 H new ATOM 648 N ALA A 44 -5.970 -0.107 -2.948 1.00 0.00 N ATOM 649 CA ALA A 44 -5.820 -1.482 -3.401 1.00 0.00 C ATOM 650 C ALA A 44 -6.988 -1.865 -4.305 1.00 0.00 C ATOM 651 O ALA A 44 -8.004 -2.347 -3.810 1.00 0.00 O ATOM 652 CB ALA A 44 -5.684 -2.428 -2.208 1.00 0.00 C ATOM 0 H ALA A 44 -6.427 -0.010 -2.042 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.905 -1.570 -3.987 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.573 -3.451 -2.566 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.807 -2.151 -1.622 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.575 -2.357 -1.584 1.00 0.00 H new ATOM 658 N VAL A 45 -6.813 -1.676 -5.619 1.00 0.00 N ATOM 659 CA VAL A 45 -7.755 -2.078 -6.660 1.00 0.00 C ATOM 660 C VAL A 45 -9.084 -1.327 -6.529 1.00 0.00 C ATOM 661 O VAL A 45 -9.998 -1.752 -5.817 1.00 0.00 O ATOM 662 CB VAL A 45 -7.953 -3.607 -6.669 1.00 0.00 C ATOM 663 CG1 VAL A 45 -8.709 -4.047 -7.920 1.00 0.00 C ATOM 664 CG2 VAL A 45 -6.621 -4.349 -6.646 1.00 0.00 C ATOM 0 H VAL A 45 -5.980 -1.222 -5.995 1.00 0.00 H new ATOM 0 HA VAL A 45 -7.328 -1.803 -7.624 1.00 0.00 H new ATOM 0 HB VAL A 45 -8.522 -3.851 -5.772 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -8.838 -5.129 -7.906 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -9.687 -3.566 -7.942 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -8.143 -3.761 -8.807 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -6.803 -5.424 -6.653 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.036 -4.074 -7.524 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.070 -4.080 -5.745 1.00 0.00 H new ATOM 674 N LEU A 46 -9.248 -0.251 -7.298 1.00 0.00 N ATOM 675 CA LEU A 46 -10.430 0.586 -7.152 1.00 0.00 C ATOM 676 C LEU A 46 -11.618 -0.151 -7.784 1.00 0.00 C ATOM 677 O LEU A 46 -11.437 -0.812 -8.809 1.00 0.00 O ATOM 678 CB LEU A 46 -10.213 1.923 -7.874 1.00 0.00 C ATOM 679 CG LEU A 46 -9.147 2.817 -7.221 1.00 0.00 C ATOM 680 CD1 LEU A 46 -8.770 3.943 -8.191 1.00 0.00 C ATOM 681 CD2 LEU A 46 -9.660 3.438 -5.915 1.00 0.00 C ATOM 0 H LEU A 46 -8.589 0.055 -8.014 1.00 0.00 H new ATOM 0 HA LEU A 46 -10.622 0.784 -6.097 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -9.924 1.725 -8.906 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -11.158 2.465 -7.906 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.279 2.198 -6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.014 4.580 -7.732 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -8.373 3.513 -9.111 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.655 4.537 -8.420 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.881 4.064 -5.479 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.541 4.046 -6.122 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.923 2.646 -5.214 1.00 0.00 H new ATOM 693 N PRO A 47 -12.816 -0.086 -7.174 1.00 0.00 N ATOM 694 CA PRO A 47 -14.022 -0.716 -7.695 1.00 0.00 C ATOM 695 C PRO A 47 -14.172 -0.476 -9.197 1.00 0.00 C ATOM 696 O PRO A 47 -14.275 0.667 -9.634 1.00 0.00 O ATOM 697 CB PRO A 47 -15.178 -0.121 -6.889 1.00 0.00 C ATOM 698 CG PRO A 47 -14.521 0.150 -5.537 1.00 0.00 C ATOM 699 CD PRO A 47 -13.111 0.593 -5.919 1.00 0.00 C ATOM 0 HA PRO A 47 -13.993 -1.800 -7.586 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -15.565 0.791 -7.344 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -16.015 -0.815 -6.804 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -15.049 0.924 -4.980 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -14.507 -0.741 -4.910 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -13.058 1.675 -6.037 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -12.391 0.321 -5.147 1.00 0.00 H new ATOM 748 N PHE A 51 -8.940 -6.674 -10.155 1.00 0.00 N ATOM 749 CA PHE A 51 -7.563 -6.915 -9.709 1.00 0.00 C ATOM 750 C PHE A 51 -6.588 -6.349 -10.762 1.00 0.00 C ATOM 751 O PHE A 51 -7.030 -5.868 -11.806 1.00 0.00 O ATOM 752 CB PHE A 51 -7.326 -8.421 -9.436 1.00 0.00 C ATOM 753 CG PHE A 51 -8.287 -9.147 -8.512 1.00 0.00 C ATOM 754 CD1 PHE A 51 -9.017 -8.463 -7.521 1.00 0.00 C ATOM 755 CD2 PHE A 51 -8.353 -10.553 -8.573 1.00 0.00 C ATOM 756 CE1 PHE A 51 -9.831 -9.177 -6.627 1.00 0.00 C ATOM 757 CE2 PHE A 51 -9.167 -11.267 -7.678 1.00 0.00 C ATOM 758 CZ PHE A 51 -9.908 -10.577 -6.705 1.00 0.00 C ATOM 0 HA PHE A 51 -7.384 -6.401 -8.765 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -7.334 -8.938 -10.396 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -6.323 -8.530 -9.024 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -8.951 -7.387 -7.448 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.774 -11.086 -9.313 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -10.400 -8.648 -5.877 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.223 -12.344 -7.738 1.00 0.00 H new ATOM 0 HZ PHE A 51 -10.537 -11.123 -6.017 1.00 0.00 H new ATOM 768 N PRO A 52 -5.260 -6.353 -10.542 1.00 0.00 N ATOM 769 CA PRO A 52 -4.526 -6.709 -9.335 1.00 0.00 C ATOM 770 C PRO A 52 -3.614 -5.546 -8.912 1.00 0.00 C ATOM 771 O PRO A 52 -2.546 -5.782 -8.365 1.00 0.00 O ATOM 772 CB PRO A 52 -3.657 -7.874 -9.821 1.00 0.00 C ATOM 773 CG PRO A 52 -3.191 -7.352 -11.188 1.00 0.00 C ATOM 774 CD PRO A 52 -4.348 -6.469 -11.672 1.00 0.00 C ATOM 0 HA PRO A 52 -5.167 -6.944 -8.485 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -2.821 -8.071 -9.150 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -4.223 -8.801 -9.906 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -2.265 -6.783 -11.102 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.998 -8.170 -11.882 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -3.987 -5.489 -11.985 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -4.847 -6.915 -12.532 1.00 0.00 H new ATOM 782 N SER A 53 -3.983 -4.297 -9.205 1.00 0.00 N ATOM 783 CA SER A 53 -3.121 -3.142 -9.020 1.00 0.00 C ATOM 784 C SER A 53 -3.226 -2.403 -7.677 1.00 0.00 C ATOM 785 O SER A 53 -4.305 -1.914 -7.336 1.00 0.00 O ATOM 786 CB SER A 53 -3.491 -2.167 -10.144 1.00 0.00 C ATOM 787 OG SER A 53 -4.892 -1.968 -10.118 1.00 0.00 O ATOM 0 H SER A 53 -4.902 -4.063 -9.582 1.00 0.00 H new ATOM 0 HA SER A 53 -2.094 -3.508 -9.036 1.00 0.00 H new ATOM 0 HB2 SER A 53 -2.970 -1.219 -10.010 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.182 -2.567 -11.110 1.00 0.00 H new ATOM 0 HG SER A 53 -5.193 -1.882 -9.189 1.00 0.00 H new ATOM 793 N PHE A 54 -2.097 -2.235 -6.972 1.00 0.00 N ATOM 794 CA PHE A 54 -2.013 -1.316 -5.842 1.00 0.00 C ATOM 795 C PHE A 54 -1.842 0.060 -6.485 1.00 0.00 C ATOM 796 O PHE A 54 -0.763 0.366 -6.989 1.00 0.00 O ATOM 797 CB PHE A 54 -0.775 -1.569 -4.962 1.00 0.00 C ATOM 798 CG PHE A 54 -0.834 -2.728 -3.986 1.00 0.00 C ATOM 799 CD1 PHE A 54 -1.921 -2.839 -3.096 1.00 0.00 C ATOM 800 CD2 PHE A 54 0.312 -3.521 -3.780 1.00 0.00 C ATOM 801 CE1 PHE A 54 -1.893 -3.782 -2.055 1.00 0.00 C ATOM 802 CE2 PHE A 54 0.362 -4.424 -2.703 1.00 0.00 C ATOM 803 CZ PHE A 54 -0.737 -4.546 -1.838 1.00 0.00 C ATOM 0 H PHE A 54 -1.228 -2.730 -7.172 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.890 -1.424 -5.204 1.00 0.00 H new ATOM 0 HB2 PHE A 54 0.079 -1.727 -5.621 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.575 -0.661 -4.394 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.780 -2.196 -3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 54 1.154 -3.435 -4.451 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.759 -3.918 -1.424 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.246 -5.023 -2.541 1.00 0.00 H new ATOM 0 HZ PHE A 54 -0.692 -5.230 -1.003 1.00 0.00 H new ATOM 813 N GLU A 55 -2.890 0.876 -6.522 1.00 0.00 N ATOM 814 CA GLU A 55 -2.841 2.166 -7.184 1.00 0.00 C ATOM 815 C GLU A 55 -2.335 3.191 -6.156 1.00 0.00 C ATOM 816 O GLU A 55 -3.011 3.456 -5.162 1.00 0.00 O ATOM 817 CB GLU A 55 -4.193 2.480 -7.838 1.00 0.00 C ATOM 818 CG GLU A 55 -4.960 1.209 -8.264 1.00 0.00 C ATOM 819 CD GLU A 55 -6.112 1.484 -9.218 1.00 0.00 C ATOM 820 OE1 GLU A 55 -6.013 2.393 -10.034 1.00 0.00 O ATOM 821 OE2 GLU A 55 -7.191 0.658 -9.110 1.00 0.00 O ATOM 0 H GLU A 55 -3.791 0.660 -6.095 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.141 2.187 -8.019 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.805 3.052 -7.140 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -4.031 3.111 -8.712 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.264 0.517 -8.738 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -5.347 0.713 -7.374 1.00 0.00 H new ATOM 829 N VAL A 56 -1.129 3.724 -6.360 1.00 0.00 N ATOM 830 CA VAL A 56 -0.412 4.565 -5.410 1.00 0.00 C ATOM 831 C VAL A 56 -0.328 5.997 -5.946 1.00 0.00 C ATOM 832 O VAL A 56 0.670 6.397 -6.545 1.00 0.00 O ATOM 833 CB VAL A 56 0.963 3.926 -5.132 1.00 0.00 C ATOM 834 CG1 VAL A 56 1.808 4.729 -4.138 1.00 0.00 C ATOM 835 CG2 VAL A 56 0.796 2.510 -4.558 1.00 0.00 C ATOM 0 H VAL A 56 -0.609 3.574 -7.224 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.939 4.630 -4.458 1.00 0.00 H new ATOM 0 HB VAL A 56 1.476 3.906 -6.094 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.763 4.227 -3.984 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.983 5.729 -4.534 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.280 4.802 -3.187 1.00 0.00 H new ATOM 0 HG21 VAL A 56 1.778 2.076 -4.369 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.235 2.560 -3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.257 1.889 -5.273 1.00 0.00 H new ATOM 845 N HIS A 57 -1.390 6.770 -5.691 1.00 0.00 N ATOM 846 CA HIS A 57 -1.517 8.185 -6.029 1.00 0.00 C ATOM 847 C HIS A 57 -1.093 8.494 -7.465 1.00 0.00 C ATOM 848 O HIS A 57 -1.883 8.318 -8.389 1.00 0.00 O ATOM 849 CB HIS A 57 -0.869 9.095 -4.962 1.00 0.00 C ATOM 850 CG HIS A 57 0.396 8.591 -4.312 1.00 0.00 C ATOM 851 ND1 HIS A 57 0.444 7.741 -3.224 1.00 0.00 N ATOM 852 CD2 HIS A 57 1.668 9.028 -4.564 1.00 0.00 C ATOM 853 CE1 HIS A 57 1.722 7.670 -2.815 1.00 0.00 C ATOM 854 NE2 HIS A 57 2.482 8.443 -3.612 1.00 0.00 N ATOM 0 H HIS A 57 -2.220 6.406 -5.222 1.00 0.00 H new ATOM 0 HA HIS A 57 -2.580 8.426 -6.006 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -0.652 10.058 -5.424 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -1.605 9.276 -4.178 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -0.349 7.254 -2.806 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.976 9.699 -5.352 1.00 0.00 H new ATOM 0 HE1 HIS A 57 2.081 7.086 -1.981 1.00 0.00 H new ATOM 863 N ASP A 58 0.134 8.982 -7.656 1.00 0.00 N ATOM 864 CA ASP A 58 0.620 9.389 -8.966 1.00 0.00 C ATOM 865 C ASP A 58 0.859 8.188 -9.884 1.00 0.00 C ATOM 866 O ASP A 58 0.869 8.343 -11.102 1.00 0.00 O ATOM 867 CB ASP A 58 1.912 10.200 -8.806 1.00 0.00 C ATOM 868 CG ASP A 58 2.470 10.599 -10.164 1.00 0.00 C ATOM 869 OD1 ASP A 58 3.465 10.030 -10.601 1.00 0.00 O ATOM 870 OD2 ASP A 58 1.815 11.599 -10.806 1.00 0.00 O ATOM 0 H ASP A 58 0.814 9.104 -6.906 1.00 0.00 H new ATOM 0 HA ASP A 58 -0.147 10.007 -9.433 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.715 11.092 -8.212 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.651 9.612 -8.262 1.00 0.00 H new ATOM 876 N LYS A 59 1.101 7.012 -9.302 1.00 0.00 N ATOM 877 CA LYS A 59 1.489 5.810 -10.019 1.00 0.00 C ATOM 878 C LYS A 59 0.623 4.626 -9.595 1.00 0.00 C ATOM 879 O LYS A 59 -0.273 4.741 -8.762 1.00 0.00 O ATOM 880 CB LYS A 59 2.950 5.509 -9.659 1.00 0.00 C ATOM 881 CG LYS A 59 3.942 6.643 -9.951 1.00 0.00 C ATOM 882 CD LYS A 59 4.128 6.949 -11.439 1.00 0.00 C ATOM 883 CE LYS A 59 4.768 5.759 -12.157 1.00 0.00 C ATOM 884 NZ LYS A 59 5.122 6.105 -13.543 1.00 0.00 N ATOM 0 H LYS A 59 1.029 6.872 -8.294 1.00 0.00 H new ATOM 0 HA LYS A 59 1.363 5.963 -11.091 1.00 0.00 H new ATOM 0 HB2 LYS A 59 3.003 5.266 -8.598 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.267 4.621 -10.206 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.602 7.547 -9.446 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.910 6.383 -9.522 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.164 7.178 -11.892 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.755 7.833 -11.559 1.00 0.00 H new ATOM 0 HE2 LYS A 59 5.661 5.443 -11.618 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.078 4.915 -12.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.197 5.236 -14.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.386 6.719 -13.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 6.034 6.605 -13.554 1.00 0.00 H new ATOM 898 N LYS A 60 0.918 3.457 -10.162 1.00 0.00 N ATOM 899 CA LYS A 60 0.327 2.193 -9.776 1.00 0.00 C ATOM 900 C LYS A 60 1.490 1.234 -9.575 1.00 0.00 C ATOM 901 O LYS A 60 2.288 1.042 -10.487 1.00 0.00 O ATOM 902 CB LYS A 60 -0.674 1.706 -10.834 1.00 0.00 C ATOM 903 CG LYS A 60 -1.745 2.766 -11.125 1.00 0.00 C ATOM 904 CD LYS A 60 -3.016 2.204 -11.781 1.00 0.00 C ATOM 905 CE LYS A 60 -2.790 1.625 -13.184 1.00 0.00 C ATOM 906 NZ LYS A 60 -2.271 0.246 -13.148 1.00 0.00 N ATOM 0 H LYS A 60 1.593 3.369 -10.922 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.254 2.276 -8.858 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.143 1.462 -11.754 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -1.152 0.789 -10.489 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -2.017 3.259 -10.192 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.319 3.529 -11.776 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -3.430 1.425 -11.140 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -3.762 2.996 -11.842 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -3.730 1.642 -13.736 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -2.090 2.259 -13.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -2.637 -0.284 -13.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -1.232 0.265 -13.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -2.577 -0.217 -12.269 1.00 0.00 H new ATOM 920 N ASN A 61 1.593 0.663 -8.374 1.00 0.00 N ATOM 921 CA ASN A 61 2.607 -0.313 -8.005 1.00 0.00 C ATOM 922 C ASN A 61 4.036 0.208 -8.251 1.00 0.00 C ATOM 923 O ASN A 61 4.863 -0.517 -8.800 1.00 0.00 O ATOM 924 CB ASN A 61 2.329 -1.624 -8.761 1.00 0.00 C ATOM 925 CG ASN A 61 0.874 -2.068 -8.638 1.00 0.00 C ATOM 926 OD1 ASN A 61 0.534 -2.877 -7.785 1.00 0.00 O ATOM 927 ND2 ASN A 61 -0.038 -1.527 -9.448 1.00 0.00 N ATOM 0 H ASN A 61 0.951 0.877 -7.611 1.00 0.00 H new ATOM 0 HA ASN A 61 2.548 -0.499 -6.933 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.579 -1.493 -9.814 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.980 -2.408 -8.374 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.020 -1.788 -9.357 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.247 -0.853 -10.158 1.00 0.00 H new ATOM 934 N PRO A 62 4.354 1.464 -7.880 1.00 0.00 N ATOM 935 CA PRO A 62 5.654 2.051 -8.150 1.00 0.00 C ATOM 936 C PRO A 62 6.705 1.564 -7.160 1.00 0.00 C ATOM 937 O PRO A 62 6.410 0.929 -6.147 1.00 0.00 O ATOM 938 CB PRO A 62 5.460 3.556 -7.945 1.00 0.00 C ATOM 939 CG PRO A 62 4.437 3.583 -6.809 1.00 0.00 C ATOM 940 CD PRO A 62 3.510 2.437 -7.203 1.00 0.00 C ATOM 0 HA PRO A 62 5.997 1.784 -9.150 1.00 0.00 H new ATOM 0 HB2 PRO A 62 6.389 4.055 -7.671 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.087 4.047 -8.844 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.901 3.419 -5.836 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.910 4.536 -6.755 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.034 1.999 -6.326 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.712 2.786 -7.858 1.00 0.00 H new ATOM 948 N THR A 63 7.948 1.934 -7.453 1.00 0.00 N ATOM 949 CA THR A 63 9.075 1.752 -6.562 1.00 0.00 C ATOM 950 C THR A 63 9.184 3.042 -5.739 1.00 0.00 C ATOM 951 O THR A 63 8.970 4.122 -6.286 1.00 0.00 O ATOM 952 CB THR A 63 10.307 1.471 -7.425 1.00 0.00 C ATOM 953 OG1 THR A 63 10.138 0.206 -8.033 1.00 0.00 O ATOM 954 CG2 THR A 63 11.589 1.471 -6.601 1.00 0.00 C ATOM 0 H THR A 63 8.199 2.378 -8.337 1.00 0.00 H new ATOM 0 HA THR A 63 8.970 0.913 -5.874 1.00 0.00 H new ATOM 0 HB THR A 63 10.399 2.259 -8.172 1.00 0.00 H new ATOM 0 HG1 THR A 63 10.917 0.006 -8.593 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.440 1.268 -7.252 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.718 2.445 -6.129 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.528 0.700 -5.833 1.00 0.00 H new ATOM 962 N LEU A 64 9.457 2.952 -4.434 1.00 0.00 N ATOM 963 CA LEU A 64 9.514 4.101 -3.534 1.00 0.00 C ATOM 964 C LEU A 64 10.948 4.327 -3.055 1.00 0.00 C ATOM 965 O LEU A 64 11.559 3.396 -2.538 1.00 0.00 O ATOM 966 CB LEU A 64 8.611 3.864 -2.313 1.00 0.00 C ATOM 967 CG LEU A 64 7.154 4.304 -2.522 1.00 0.00 C ATOM 968 CD1 LEU A 64 6.453 3.515 -3.628 1.00 0.00 C ATOM 969 CD2 LEU A 64 6.386 4.130 -1.209 1.00 0.00 C ATOM 0 H LEU A 64 9.647 2.064 -3.969 1.00 0.00 H new ATOM 0 HA LEU A 64 9.169 4.980 -4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.628 2.804 -2.061 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.023 4.401 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 64 7.167 5.349 -2.830 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.427 3.868 -3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.983 3.658 -4.569 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.448 2.455 -3.372 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.351 4.440 -1.349 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.413 3.083 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.847 4.743 -0.434 1.00 0.00 H new ATOM 981 N GLU A 65 11.481 5.545 -3.208 1.00 0.00 N ATOM 982 CA GLU A 65 12.767 5.947 -2.640 1.00 0.00 C ATOM 983 C GLU A 65 12.474 6.746 -1.367 1.00 0.00 C ATOM 984 O GLU A 65 11.799 7.776 -1.429 1.00 0.00 O ATOM 985 CB GLU A 65 13.585 6.754 -3.653 1.00 0.00 C ATOM 986 CG GLU A 65 13.934 5.880 -4.861 1.00 0.00 C ATOM 987 CD GLU A 65 14.876 6.570 -5.837 1.00 0.00 C ATOM 988 OE1 GLU A 65 15.959 6.046 -6.076 1.00 0.00 O ATOM 989 OE2 GLU A 65 14.450 7.737 -6.393 1.00 0.00 O ATOM 0 H GLU A 65 11.023 6.287 -3.737 1.00 0.00 H new ATOM 0 HA GLU A 65 13.372 5.075 -2.394 1.00 0.00 H new ATOM 0 HB2 GLU A 65 13.018 7.627 -3.977 1.00 0.00 H new ATOM 0 HB3 GLU A 65 14.498 7.122 -3.185 1.00 0.00 H new ATOM 0 HG2 GLU A 65 14.393 4.954 -4.513 1.00 0.00 H new ATOM 0 HG3 GLU A 65 13.017 5.605 -5.382 1.00 0.00 H new ATOM 997 N ILE A 66 12.960 6.264 -0.220 1.00 0.00 N ATOM 998 CA ILE A 66 12.625 6.785 1.100 1.00 0.00 C ATOM 999 C ILE A 66 13.863 7.208 1.910 1.00 0.00 C ATOM 1000 O ILE A 66 14.892 6.530 1.866 1.00 0.00 O ATOM 1001 CB ILE A 66 11.846 5.663 1.815 1.00 0.00 C ATOM 1002 CG1 ILE A 66 10.458 5.517 1.156 1.00 0.00 C ATOM 1003 CG2 ILE A 66 11.715 5.882 3.331 1.00 0.00 C ATOM 1004 CD1 ILE A 66 9.517 4.577 1.912 1.00 0.00 C ATOM 0 H ILE A 66 13.613 5.481 -0.187 1.00 0.00 H new ATOM 0 HA ILE A 66 12.031 7.694 1.005 1.00 0.00 H new ATOM 0 HB ILE A 66 12.416 4.741 1.702 1.00 0.00 H new ATOM 0 HG12 ILE A 66 9.994 6.501 1.083 1.00 0.00 H new ATOM 0 HG13 ILE A 66 10.585 5.149 0.138 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.156 5.056 3.771 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.708 5.928 3.779 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.188 6.817 3.519 1.00 0.00 H new ATOM 0 HD11 ILE A 66 8.561 4.523 1.391 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.959 3.582 1.962 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.359 4.955 2.922 1.00 0.00 H new ATOM 1016 N PRO A 67 13.772 8.308 2.681 1.00 0.00 N ATOM 1017 CA PRO A 67 14.811 8.707 3.612 1.00 0.00 C ATOM 1018 C PRO A 67 14.692 7.853 4.888 1.00 0.00 C ATOM 1019 O PRO A 67 13.667 7.871 5.567 1.00 0.00 O ATOM 1020 CB PRO A 67 14.574 10.196 3.878 1.00 0.00 C ATOM 1021 CG PRO A 67 13.071 10.375 3.666 1.00 0.00 C ATOM 1022 CD PRO A 67 12.703 9.297 2.649 1.00 0.00 C ATOM 0 HA PRO A 67 15.820 8.555 3.228 1.00 0.00 H new ATOM 0 HB2 PRO A 67 14.870 10.473 4.890 1.00 0.00 H new ATOM 0 HB3 PRO A 67 15.151 10.820 3.195 1.00 0.00 H new ATOM 0 HG2 PRO A 67 12.520 10.248 4.598 1.00 0.00 H new ATOM 0 HG3 PRO A 67 12.838 11.372 3.291 1.00 0.00 H new ATOM 0 HD2 PRO A 67 11.746 8.840 2.899 1.00 0.00 H new ATOM 0 HD3 PRO A 67 12.601 9.725 1.652 1.00 0.00 H new ATOM 1030 N ALA A 68 15.737 7.083 5.200 1.00 0.00 N ATOM 1031 CA ALA A 68 15.833 6.224 6.375 1.00 0.00 C ATOM 1032 C ALA A 68 15.402 6.941 7.655 1.00 0.00 C ATOM 1033 O ALA A 68 15.660 8.132 7.826 1.00 0.00 O ATOM 1034 CB ALA A 68 17.270 5.706 6.510 1.00 0.00 C ATOM 0 H ALA A 68 16.572 7.042 4.615 1.00 0.00 H new ATOM 0 HA ALA A 68 15.148 5.387 6.236 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.344 5.064 7.388 1.00 0.00 H new ATOM 0 HB2 ALA A 68 17.537 5.136 5.620 1.00 0.00 H new ATOM 0 HB3 ALA A 68 17.952 6.549 6.619 1.00 0.00 H new ATOM 1040 N GLY A 69 14.735 6.221 8.559 1.00 0.00 N ATOM 1041 CA GLY A 69 14.316 6.763 9.844 1.00 0.00 C ATOM 1042 C GLY A 69 13.036 7.601 9.771 1.00 0.00 C ATOM 1043 O GLY A 69 12.367 7.758 10.792 1.00 0.00 O ATOM 0 H GLY A 69 14.472 5.246 8.417 1.00 0.00 H new ATOM 0 HA2 GLY A 69 14.162 5.940 10.542 1.00 0.00 H new ATOM 0 HA3 GLY A 69 15.120 7.378 10.248 1.00 0.00 H new ATOM 1047 N ALA A 70 12.676 8.140 8.599 1.00 0.00 N ATOM 1048 CA ALA A 70 11.471 8.943 8.442 1.00 0.00 C ATOM 1049 C ALA A 70 10.214 8.178 8.864 1.00 0.00 C ATOM 1050 O ALA A 70 10.187 6.951 8.874 1.00 0.00 O ATOM 1051 CB ALA A 70 11.363 9.357 6.981 1.00 0.00 C ATOM 0 H ALA A 70 13.214 8.028 7.740 1.00 0.00 H new ATOM 0 HA ALA A 70 11.544 9.817 9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 70 10.466 9.960 6.839 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.241 9.940 6.702 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.304 8.467 6.354 1.00 0.00 H new ATOM 1057 N THR A 71 9.153 8.910 9.190 1.00 0.00 N ATOM 1058 CA THR A 71 7.880 8.329 9.556 1.00 0.00 C ATOM 1059 C THR A 71 7.152 7.926 8.275 1.00 0.00 C ATOM 1060 O THR A 71 6.494 8.746 7.636 1.00 0.00 O ATOM 1061 CB THR A 71 7.072 9.334 10.389 1.00 0.00 C ATOM 1062 OG1 THR A 71 7.912 9.988 11.322 1.00 0.00 O ATOM 1063 CG2 THR A 71 5.971 8.587 11.143 1.00 0.00 C ATOM 0 H THR A 71 9.160 9.930 9.206 1.00 0.00 H new ATOM 0 HA THR A 71 8.018 7.440 10.172 1.00 0.00 H new ATOM 0 HB THR A 71 6.635 10.078 9.723 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.385 10.627 11.845 1.00 0.00 H new ATOM 0 HG21 THR A 71 5.393 9.294 11.737 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.314 8.090 10.429 1.00 0.00 H new ATOM 0 HG23 THR A 71 6.421 7.843 11.801 1.00 0.00 H new ATOM 1071 N VAL A 72 7.266 6.652 7.904 1.00 0.00 N ATOM 1072 CA VAL A 72 6.544 6.083 6.782 1.00 0.00 C ATOM 1073 C VAL A 72 5.129 5.818 7.272 1.00 0.00 C ATOM 1074 O VAL A 72 4.851 4.759 7.827 1.00 0.00 O ATOM 1075 CB VAL A 72 7.254 4.824 6.256 1.00 0.00 C ATOM 1076 CG1 VAL A 72 6.493 4.265 5.048 1.00 0.00 C ATOM 1077 CG2 VAL A 72 8.661 5.184 5.773 1.00 0.00 C ATOM 0 H VAL A 72 7.870 5.984 8.383 1.00 0.00 H new ATOM 0 HA VAL A 72 6.511 6.762 5.930 1.00 0.00 H new ATOM 0 HB VAL A 72 7.295 4.093 7.064 1.00 0.00 H new ATOM 0 HG11 VAL A 72 7.000 3.373 4.679 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.477 4.007 5.346 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.461 5.016 4.259 1.00 0.00 H new ATOM 0 HG21 VAL A 72 9.159 4.288 5.402 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.593 5.920 4.972 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.234 5.601 6.601 1.00 0.00 H new ATOM 1087 N ASP A 73 4.252 6.811 7.108 1.00 0.00 N ATOM 1088 CA ASP A 73 2.836 6.705 7.414 1.00 0.00 C ATOM 1089 C ASP A 73 2.171 6.085 6.193 1.00 0.00 C ATOM 1090 O ASP A 73 2.251 6.663 5.111 1.00 0.00 O ATOM 1091 CB ASP A 73 2.232 8.087 7.701 1.00 0.00 C ATOM 1092 CG ASP A 73 2.908 8.836 8.841 1.00 0.00 C ATOM 1093 OD1 ASP A 73 3.523 9.868 8.589 1.00 0.00 O ATOM 1094 OD2 ASP A 73 2.767 8.323 10.095 1.00 0.00 O ATOM 0 H ASP A 73 4.519 7.728 6.751 1.00 0.00 H new ATOM 0 HA ASP A 73 2.680 6.095 8.304 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.292 8.693 6.797 1.00 0.00 H new ATOM 0 HB3 ASP A 73 1.174 7.968 7.936 1.00 0.00 H new ATOM 1100 N VAL A 74 1.540 4.920 6.342 1.00 0.00 N ATOM 1101 CA VAL A 74 0.933 4.217 5.224 1.00 0.00 C ATOM 1102 C VAL A 74 -0.586 4.241 5.394 1.00 0.00 C ATOM 1103 O VAL A 74 -1.121 3.654 6.340 1.00 0.00 O ATOM 1104 CB VAL A 74 1.493 2.796 5.102 1.00 0.00 C ATOM 1105 CG1 VAL A 74 0.989 2.151 3.800 1.00 0.00 C ATOM 1106 CG2 VAL A 74 3.026 2.783 5.106 1.00 0.00 C ATOM 0 H VAL A 74 1.438 4.444 7.238 1.00 0.00 H new ATOM 0 HA VAL A 74 1.179 4.718 4.288 1.00 0.00 H new ATOM 0 HB VAL A 74 1.146 2.231 5.967 1.00 0.00 H new ATOM 0 HG11 VAL A 74 1.389 1.141 3.716 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.100 2.110 3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.321 2.744 2.948 1.00 0.00 H new ATOM 0 HG21 VAL A 74 3.381 1.756 5.018 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.397 3.369 4.265 1.00 0.00 H new ATOM 0 HG23 VAL A 74 3.391 3.214 6.038 1.00 0.00 H new ATOM 1116 N THR A 75 -1.263 4.933 4.472 1.00 0.00 N ATOM 1117 CA THR A 75 -2.708 5.074 4.445 1.00 0.00 C ATOM 1118 C THR A 75 -3.281 4.236 3.300 1.00 0.00 C ATOM 1119 O THR A 75 -3.190 4.612 2.132 1.00 0.00 O ATOM 1120 CB THR A 75 -3.103 6.556 4.341 1.00 0.00 C ATOM 1121 OG1 THR A 75 -2.597 7.269 5.457 1.00 0.00 O ATOM 1122 CG2 THR A 75 -4.622 6.754 4.300 1.00 0.00 C ATOM 0 H THR A 75 -0.800 5.421 3.705 1.00 0.00 H new ATOM 0 HA THR A 75 -3.133 4.701 5.377 1.00 0.00 H new ATOM 0 HB THR A 75 -2.678 6.929 3.409 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.165 7.101 6.238 1.00 0.00 H new ATOM 0 HG21 THR A 75 -4.848 7.818 4.226 1.00 0.00 H new ATOM 0 HG22 THR A 75 -5.033 6.235 3.434 1.00 0.00 H new ATOM 0 HG23 THR A 75 -5.066 6.351 5.210 1.00 0.00 H new ATOM 1130 N PHE A 76 -3.881 3.092 3.621 1.00 0.00 N ATOM 1131 CA PHE A 76 -4.556 2.301 2.603 1.00 0.00 C ATOM 1132 C PHE A 76 -5.931 2.842 2.268 1.00 0.00 C ATOM 1133 O PHE A 76 -6.528 3.561 3.054 1.00 0.00 O ATOM 1134 CB PHE A 76 -4.862 0.879 3.107 1.00 0.00 C ATOM 1135 CG PHE A 76 -3.893 -0.250 2.853 1.00 0.00 C ATOM 1136 CD1 PHE A 76 -3.329 -0.329 1.563 1.00 0.00 C ATOM 1137 CD2 PHE A 76 -4.212 -1.455 3.511 1.00 0.00 C ATOM 1138 CE1 PHE A 76 -3.422 -1.515 0.823 1.00 0.00 C ATOM 1139 CE2 PHE A 76 -4.243 -2.665 2.796 1.00 0.00 C ATOM 1140 CZ PHE A 76 -3.911 -2.681 1.431 1.00 0.00 C ATOM 0 H PHE A 76 -3.912 2.700 4.562 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.877 2.325 1.751 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -5.004 0.944 4.186 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.819 0.584 2.676 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.823 0.528 1.144 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.433 -1.449 4.568 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.118 -1.532 -0.213 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -4.522 -3.581 3.295 1.00 0.00 H new ATOM 0 HZ PHE A 76 -4.031 -3.585 0.853 1.00 0.00 H new ATOM 1150 N ILE A 77 -6.432 2.390 1.121 1.00 0.00 N ATOM 1151 CA ILE A 77 -7.816 2.455 0.701 1.00 0.00 C ATOM 1152 C ILE A 77 -8.020 1.063 0.090 1.00 0.00 C ATOM 1153 O ILE A 77 -7.915 0.876 -1.122 1.00 0.00 O ATOM 1154 CB ILE A 77 -8.147 3.638 -0.234 1.00 0.00 C ATOM 1155 CG1 ILE A 77 -8.088 4.989 0.502 1.00 0.00 C ATOM 1156 CG2 ILE A 77 -9.586 3.479 -0.738 1.00 0.00 C ATOM 1157 CD1 ILE A 77 -6.740 5.692 0.311 1.00 0.00 C ATOM 0 H ILE A 77 -5.840 1.942 0.422 1.00 0.00 H new ATOM 0 HA ILE A 77 -8.510 2.667 1.515 1.00 0.00 H new ATOM 0 HB ILE A 77 -7.414 3.630 -1.041 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -8.888 5.634 0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.266 4.830 1.566 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -9.833 4.309 -1.400 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -9.679 2.540 -1.283 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -10.270 3.475 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -6.745 6.641 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.942 5.060 0.699 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.573 5.877 -0.750 1.00 0.00 H new ATOM 1169 N ASN A 78 -8.216 0.053 0.944 1.00 0.00 N ATOM 1170 CA ASN A 78 -8.513 -1.301 0.496 1.00 0.00 C ATOM 1171 C ASN A 78 -10.018 -1.489 0.630 1.00 0.00 C ATOM 1172 O ASN A 78 -10.535 -1.783 1.706 1.00 0.00 O ATOM 1173 CB ASN A 78 -7.683 -2.378 1.226 1.00 0.00 C ATOM 1174 CG ASN A 78 -8.415 -3.725 1.254 1.00 0.00 C ATOM 1175 OD1 ASN A 78 -8.582 -4.323 2.312 1.00 0.00 O ATOM 1176 ND2 ASN A 78 -8.913 -4.181 0.100 1.00 0.00 N ATOM 0 H ASN A 78 -8.172 0.155 1.958 1.00 0.00 H new ATOM 0 HA ASN A 78 -8.217 -1.431 -0.545 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.720 -2.496 0.729 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.478 -2.052 2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -9.449 -5.049 0.083 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -8.757 -3.661 -0.764 1.00 0.00 H new ATOM 1183 N THR A 79 -10.733 -1.288 -0.476 1.00 0.00 N ATOM 1184 CA THR A 79 -12.162 -1.540 -0.558 1.00 0.00 C ATOM 1185 C THR A 79 -12.485 -1.994 -1.969 1.00 0.00 C ATOM 1186 O THR A 79 -13.280 -1.386 -2.683 1.00 0.00 O ATOM 1187 CB THR A 79 -12.967 -0.307 -0.137 1.00 0.00 C ATOM 1188 OG1 THR A 79 -12.495 0.135 1.113 1.00 0.00 O ATOM 1189 CG2 THR A 79 -14.456 -0.631 -0.003 1.00 0.00 C ATOM 0 H THR A 79 -10.328 -0.942 -1.346 1.00 0.00 H new ATOM 0 HA THR A 79 -12.446 -2.329 0.138 1.00 0.00 H new ATOM 0 HB THR A 79 -12.844 0.460 -0.902 1.00 0.00 H new ATOM 0 HG1 THR A 79 -12.019 0.984 1.001 1.00 0.00 H new ATOM 0 HG21 THR A 79 -14.998 0.266 0.297 1.00 0.00 H new ATOM 0 HG22 THR A 79 -14.839 -0.983 -0.961 1.00 0.00 H new ATOM 0 HG23 THR A 79 -14.593 -1.407 0.750 1.00 0.00 H new ATOM 1197 N ASN A 80 -11.861 -3.095 -2.378 1.00 0.00 N ATOM 1198 CA ASN A 80 -12.184 -3.712 -3.648 1.00 0.00 C ATOM 1199 C ASN A 80 -13.426 -4.573 -3.409 1.00 0.00 C ATOM 1200 O ASN A 80 -13.360 -5.799 -3.430 1.00 0.00 O ATOM 1201 CB ASN A 80 -10.976 -4.494 -4.146 1.00 0.00 C ATOM 1202 CG ASN A 80 -11.227 -4.989 -5.557 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -11.143 -6.181 -5.831 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -11.523 -4.060 -6.459 1.00 0.00 N ATOM 0 H ASN A 80 -11.133 -3.572 -1.847 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.411 -2.990 -4.432 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.089 -3.861 -4.126 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.781 -5.338 -3.485 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -11.692 -4.326 -7.429 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -11.581 -3.080 -6.182 1.00 0.00 H new ATOM 1211 N LYS A 81 -14.522 -3.865 -3.112 1.00 0.00 N ATOM 1212 CA LYS A 81 -15.839 -4.322 -2.664 1.00 0.00 C ATOM 1213 C LYS A 81 -15.895 -5.815 -2.319 1.00 0.00 C ATOM 1214 O LYS A 81 -16.503 -6.599 -3.044 1.00 0.00 O ATOM 1215 CB LYS A 81 -16.923 -3.909 -3.673 1.00 0.00 C ATOM 1216 CG LYS A 81 -17.048 -2.381 -3.757 1.00 0.00 C ATOM 1217 CD LYS A 81 -18.297 -1.982 -4.552 1.00 0.00 C ATOM 1218 CE LYS A 81 -18.483 -0.461 -4.524 1.00 0.00 C ATOM 1219 NZ LYS A 81 -19.687 -0.053 -5.270 1.00 0.00 N ATOM 0 H LYS A 81 -14.503 -2.848 -3.189 1.00 0.00 H new ATOM 0 HA LYS A 81 -16.041 -3.818 -1.719 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.681 -4.312 -4.657 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -17.880 -4.340 -3.379 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.100 -1.960 -2.753 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.160 -1.964 -4.232 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -18.205 -2.325 -5.583 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -19.176 -2.470 -4.131 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -18.560 -0.121 -3.491 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -17.606 0.022 -4.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -20.067 0.825 -4.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -19.440 0.107 -6.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -20.405 -0.803 -5.207 1.00 0.00 H new ATOM 1233 N GLY A 82 -15.290 -6.188 -1.187 1.00 0.00 N ATOM 1234 CA GLY A 82 -15.267 -7.555 -0.679 1.00 0.00 C ATOM 1235 C GLY A 82 -13.837 -8.065 -0.518 1.00 0.00 C ATOM 1236 O GLY A 82 -13.498 -8.670 0.495 1.00 0.00 O ATOM 0 H GLY A 82 -14.792 -5.529 -0.588 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -15.780 -7.596 0.282 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -15.813 -8.207 -1.360 1.00 0.00 H new ATOM 1240 N PHE A 83 -12.983 -7.826 -1.515 1.00 0.00 N ATOM 1241 CA PHE A 83 -11.621 -8.340 -1.508 1.00 0.00 C ATOM 1242 C PHE A 83 -10.735 -7.466 -0.623 1.00 0.00 C ATOM 1243 O PHE A 83 -10.198 -6.441 -1.050 1.00 0.00 O ATOM 1244 CB PHE A 83 -11.098 -8.478 -2.938 1.00 0.00 C ATOM 1245 CG PHE A 83 -11.888 -9.486 -3.748 1.00 0.00 C ATOM 1246 CD1 PHE A 83 -11.727 -10.862 -3.502 1.00 0.00 C ATOM 1247 CD2 PHE A 83 -12.864 -9.050 -4.664 1.00 0.00 C ATOM 1248 CE1 PHE A 83 -12.526 -11.799 -4.181 1.00 0.00 C ATOM 1249 CE2 PHE A 83 -13.646 -9.988 -5.360 1.00 0.00 C ATOM 1250 CZ PHE A 83 -13.477 -11.362 -5.119 1.00 0.00 C ATOM 0 H PHE A 83 -13.217 -7.275 -2.341 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.605 -9.341 -1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -11.139 -7.507 -3.432 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -10.051 -8.778 -2.911 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.988 -11.199 -2.790 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -13.012 -7.994 -4.832 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -12.409 -12.854 -3.982 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -14.377 -9.652 -6.080 1.00 0.00 H new ATOM 0 HZ PHE A 83 -14.078 -12.082 -5.655 1.00 0.00 H new ATOM 1260 N GLY A 84 -10.566 -7.883 0.631 1.00 0.00 N ATOM 1261 CA GLY A 84 -9.760 -7.170 1.605 1.00 0.00 C ATOM 1262 C GLY A 84 -8.262 -7.343 1.360 1.00 0.00 C ATOM 1263 O GLY A 84 -7.567 -7.894 2.205 1.00 0.00 O ATOM 0 H GLY A 84 -10.992 -8.735 0.997 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.010 -6.110 1.573 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -10.005 -7.526 2.606 1.00 0.00 H new ATOM 1267 N HIS A 85 -7.770 -6.902 0.200 1.00 0.00 N ATOM 1268 CA HIS A 85 -6.355 -6.876 -0.132 1.00 0.00 C ATOM 1269 C HIS A 85 -5.535 -6.315 1.027 1.00 0.00 C ATOM 1270 O HIS A 85 -5.780 -5.194 1.466 1.00 0.00 O ATOM 1271 CB HIS A 85 -6.132 -5.979 -1.352 1.00 0.00 C ATOM 1272 CG HIS A 85 -6.862 -6.425 -2.589 1.00 0.00 C ATOM 1273 ND1 HIS A 85 -6.484 -7.469 -3.429 1.00 0.00 N ATOM 1274 CD2 HIS A 85 -7.967 -5.810 -3.106 1.00 0.00 C ATOM 1275 CE1 HIS A 85 -7.366 -7.454 -4.439 1.00 0.00 C ATOM 1276 NE2 HIS A 85 -8.280 -6.487 -4.261 1.00 0.00 N ATOM 0 H HIS A 85 -8.364 -6.546 -0.549 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.038 -7.898 -0.340 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -6.446 -4.965 -1.105 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -5.065 -5.939 -1.569 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -5.701 -8.110 -3.303 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.490 -4.961 -2.690 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.344 -8.129 -5.282 1.00 0.00 H new ATOM 1284 N SER A 86 -4.548 -7.076 1.487 1.00 0.00 N ATOM 1285 CA SER A 86 -3.620 -6.623 2.502 1.00 0.00 C ATOM 1286 C SER A 86 -2.459 -5.892 1.827 1.00 0.00 C ATOM 1287 O SER A 86 -2.309 -5.965 0.607 1.00 0.00 O ATOM 1288 CB SER A 86 -3.134 -7.845 3.286 1.00 0.00 C ATOM 1289 OG SER A 86 -2.352 -8.702 2.475 1.00 0.00 O ATOM 0 H SER A 86 -4.373 -8.027 1.162 1.00 0.00 H new ATOM 0 HA SER A 86 -4.098 -5.929 3.193 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.547 -7.518 4.144 1.00 0.00 H new ATOM 0 HB3 SER A 86 -3.991 -8.393 3.676 1.00 0.00 H new ATOM 0 HG SER A 86 -1.431 -8.718 2.809 1.00 0.00 H new ATOM 1295 N PHE A 87 -1.651 -5.181 2.614 1.00 0.00 N ATOM 1296 CA PHE A 87 -0.407 -4.550 2.198 1.00 0.00 C ATOM 1297 C PHE A 87 0.591 -4.905 3.282 1.00 0.00 C ATOM 1298 O PHE A 87 0.404 -4.476 4.420 1.00 0.00 O ATOM 1299 CB PHE A 87 -0.557 -3.032 2.113 1.00 0.00 C ATOM 1300 CG PHE A 87 0.581 -2.288 1.440 1.00 0.00 C ATOM 1301 CD1 PHE A 87 1.748 -1.974 2.161 1.00 0.00 C ATOM 1302 CD2 PHE A 87 0.418 -1.793 0.131 1.00 0.00 C ATOM 1303 CE1 PHE A 87 2.718 -1.125 1.596 1.00 0.00 C ATOM 1304 CE2 PHE A 87 1.392 -0.954 -0.435 1.00 0.00 C ATOM 1305 CZ PHE A 87 2.536 -0.608 0.302 1.00 0.00 C ATOM 0 H PHE A 87 -1.858 -5.025 3.600 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.099 -4.891 1.209 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.479 -2.807 1.577 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.673 -2.641 3.124 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.899 -2.385 3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -0.459 -2.060 -0.440 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.604 -0.870 2.158 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.261 -0.575 -1.438 1.00 0.00 H new ATOM 0 HZ PHE A 87 3.275 0.054 -0.125 1.00 0.00 H new ATOM 1315 N ASP A 88 1.594 -5.719 2.966 1.00 0.00 N ATOM 1316 CA ASP A 88 2.539 -6.240 3.937 1.00 0.00 C ATOM 1317 C ASP A 88 3.948 -6.030 3.404 1.00 0.00 C ATOM 1318 O ASP A 88 4.228 -6.394 2.261 1.00 0.00 O ATOM 1319 CB ASP A 88 2.225 -7.715 4.200 1.00 0.00 C ATOM 1320 CG ASP A 88 0.808 -7.872 4.724 1.00 0.00 C ATOM 1321 OD1 ASP A 88 -0.079 -8.241 3.959 1.00 0.00 O ATOM 1322 OD2 ASP A 88 0.617 -7.546 6.026 1.00 0.00 O ATOM 0 H ASP A 88 1.772 -6.037 2.013 1.00 0.00 H new ATOM 0 HA ASP A 88 2.460 -5.716 4.889 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.345 -8.288 3.280 1.00 0.00 H new ATOM 0 HB3 ASP A 88 2.933 -8.120 4.923 1.00 0.00 H new ATOM 1328 N ILE A 89 4.797 -5.410 4.226 1.00 0.00 N ATOM 1329 CA ILE A 89 6.153 -5.008 3.901 1.00 0.00 C ATOM 1330 C ILE A 89 7.115 -6.052 4.463 1.00 0.00 C ATOM 1331 O ILE A 89 7.052 -6.399 5.644 1.00 0.00 O ATOM 1332 CB ILE A 89 6.449 -3.604 4.464 1.00 0.00 C ATOM 1333 CG1 ILE A 89 5.418 -2.588 3.934 1.00 0.00 C ATOM 1334 CG2 ILE A 89 7.882 -3.204 4.081 1.00 0.00 C ATOM 1335 CD1 ILE A 89 5.670 -1.149 4.400 1.00 0.00 C ATOM 0 H ILE A 89 4.538 -5.166 5.182 1.00 0.00 H new ATOM 0 HA ILE A 89 6.280 -4.952 2.820 1.00 0.00 H new ATOM 0 HB ILE A 89 6.367 -3.614 5.551 1.00 0.00 H new ATOM 0 HG12 ILE A 89 5.424 -2.613 2.844 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.422 -2.894 4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 89 8.100 -2.212 4.475 1.00 0.00 H new ATOM 0 HG22 ILE A 89 8.585 -3.924 4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 89 7.979 -3.192 2.995 1.00 0.00 H new ATOM 0 HD11 ILE A 89 4.904 -0.493 3.986 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.634 -1.108 5.489 1.00 0.00 H new ATOM 0 HD13 ILE A 89 6.651 -0.822 4.057 1.00 0.00 H new ATOM 1347 N THR A 90 8.004 -6.556 3.611 1.00 0.00 N ATOM 1348 CA THR A 90 8.991 -7.562 3.961 1.00 0.00 C ATOM 1349 C THR A 90 10.093 -7.511 2.904 1.00 0.00 C ATOM 1350 O THR A 90 10.348 -6.436 2.373 1.00 0.00 O ATOM 1351 CB THR A 90 8.286 -8.914 4.129 1.00 0.00 C ATOM 1352 OG1 THR A 90 9.206 -9.953 4.404 1.00 0.00 O ATOM 1353 CG2 THR A 90 7.430 -9.305 2.918 1.00 0.00 C ATOM 0 H THR A 90 8.055 -6.266 2.635 1.00 0.00 H new ATOM 0 HA THR A 90 9.478 -7.381 4.919 1.00 0.00 H new ATOM 0 HB THR A 90 7.619 -8.783 4.981 1.00 0.00 H new ATOM 0 HG1 THR A 90 9.137 -10.210 5.347 1.00 0.00 H new ATOM 0 HG21 THR A 90 6.959 -10.271 3.102 1.00 0.00 H new ATOM 0 HG22 THR A 90 6.660 -8.551 2.758 1.00 0.00 H new ATOM 0 HG23 THR A 90 8.062 -9.372 2.032 1.00 0.00 H new ATOM 1361 N LYS A 91 10.757 -8.623 2.588 1.00 0.00 N ATOM 1362 CA LYS A 91 11.851 -8.641 1.617 1.00 0.00 C ATOM 1363 C LYS A 91 11.661 -9.732 0.559 1.00 0.00 C ATOM 1364 O LYS A 91 12.627 -10.190 -0.048 1.00 0.00 O ATOM 1365 CB LYS A 91 13.194 -8.768 2.349 1.00 0.00 C ATOM 1366 CG LYS A 91 13.396 -7.618 3.349 1.00 0.00 C ATOM 1367 CD LYS A 91 14.841 -7.520 3.857 1.00 0.00 C ATOM 1368 CE LYS A 91 15.265 -8.776 4.628 1.00 0.00 C ATOM 1369 NZ LYS A 91 16.613 -8.621 5.200 1.00 0.00 N ATOM 0 H LYS A 91 10.552 -9.535 2.997 1.00 0.00 H new ATOM 0 HA LYS A 91 11.847 -7.696 1.074 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.235 -9.722 2.875 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.007 -8.769 1.623 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.118 -6.677 2.875 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.726 -7.758 4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.513 -7.369 3.012 1.00 0.00 H new ATOM 0 HD3 LYS A 91 14.940 -6.647 4.503 1.00 0.00 H new ATOM 0 HE2 LYS A 91 14.549 -8.975 5.426 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.247 -9.638 3.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.873 -9.486 5.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.298 -8.455 4.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.622 -7.812 5.854 1.00 0.00 H new ATOM 1383 N LYS A 92 10.414 -10.138 0.310 1.00 0.00 N ATOM 1384 CA LYS A 92 10.117 -11.071 -0.762 1.00 0.00 C ATOM 1385 C LYS A 92 10.239 -10.340 -2.098 1.00 0.00 C ATOM 1386 O LYS A 92 9.293 -9.682 -2.521 1.00 0.00 O ATOM 1387 CB LYS A 92 8.713 -11.666 -0.599 1.00 0.00 C ATOM 1388 CG LYS A 92 8.635 -12.612 0.605 1.00 0.00 C ATOM 1389 CD LYS A 92 7.435 -13.560 0.482 1.00 0.00 C ATOM 1390 CE LYS A 92 6.089 -12.841 0.589 1.00 0.00 C ATOM 1391 NZ LYS A 92 4.974 -13.803 0.509 1.00 0.00 N ATOM 0 H LYS A 92 9.598 -9.831 0.840 1.00 0.00 H new ATOM 0 HA LYS A 92 10.828 -11.897 -0.728 1.00 0.00 H new ATOM 0 HB2 LYS A 92 7.988 -10.861 -0.477 1.00 0.00 H new ATOM 0 HB3 LYS A 92 8.439 -12.207 -1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.555 -13.192 0.677 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.552 -12.031 1.524 1.00 0.00 H new ATOM 0 HD2 LYS A 92 7.487 -14.080 -0.474 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.498 -14.319 1.262 1.00 0.00 H new ATOM 0 HE2 LYS A 92 6.037 -12.295 1.531 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.999 -12.106 -0.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 4.116 -13.374 0.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 4.802 -14.053 -0.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 5.216 -14.661 1.045 1.00 0.00 H new ATOM 1405 N GLY A 93 11.403 -10.429 -2.741 1.00 0.00 N ATOM 1406 CA GLY A 93 11.593 -9.892 -4.080 1.00 0.00 C ATOM 1407 C GLY A 93 10.889 -10.766 -5.122 1.00 0.00 C ATOM 1408 O GLY A 93 10.413 -11.854 -4.796 1.00 0.00 O ATOM 0 H GLY A 93 12.233 -10.873 -2.348 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.202 -8.876 -4.128 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.658 -9.835 -4.306 1.00 0.00 H new ATOM 1412 N PRO A 94 10.817 -10.315 -6.384 1.00 0.00 N ATOM 1413 CA PRO A 94 10.266 -11.114 -7.462 1.00 0.00 C ATOM 1414 C PRO A 94 11.181 -12.319 -7.732 1.00 0.00 C ATOM 1415 O PRO A 94 12.393 -12.207 -7.551 1.00 0.00 O ATOM 1416 CB PRO A 94 10.186 -10.181 -8.672 1.00 0.00 C ATOM 1417 CG PRO A 94 11.254 -9.122 -8.400 1.00 0.00 C ATOM 1418 CD PRO A 94 11.307 -9.039 -6.872 1.00 0.00 C ATOM 0 HA PRO A 94 9.281 -11.516 -7.224 1.00 0.00 H new ATOM 0 HB2 PRO A 94 10.383 -10.716 -9.601 1.00 0.00 H new ATOM 0 HB3 PRO A 94 9.196 -9.734 -8.765 1.00 0.00 H new ATOM 0 HG2 PRO A 94 12.218 -9.410 -8.818 1.00 0.00 H new ATOM 0 HG3 PRO A 94 10.988 -8.163 -8.844 1.00 0.00 H new ATOM 0 HD2 PRO A 94 12.324 -8.854 -6.527 1.00 0.00 H new ATOM 0 HD3 PRO A 94 10.691 -8.218 -6.504 1.00 0.00 H new ATOM 1426 N PRO A 95 10.643 -13.458 -8.198 1.00 0.00 N ATOM 1427 CA PRO A 95 9.229 -13.711 -8.425 1.00 0.00 C ATOM 1428 C PRO A 95 8.518 -13.939 -7.088 1.00 0.00 C ATOM 1429 O PRO A 95 8.966 -14.737 -6.266 1.00 0.00 O ATOM 1430 CB PRO A 95 9.190 -14.966 -9.302 1.00 0.00 C ATOM 1431 CG PRO A 95 10.443 -15.733 -8.878 1.00 0.00 C ATOM 1432 CD PRO A 95 11.440 -14.619 -8.556 1.00 0.00 C ATOM 0 HA PRO A 95 8.721 -12.875 -8.906 1.00 0.00 H new ATOM 0 HB2 PRO A 95 8.285 -15.548 -9.130 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.212 -14.716 -10.363 1.00 0.00 H new ATOM 0 HG2 PRO A 95 10.254 -16.367 -8.012 1.00 0.00 H new ATOM 0 HG3 PRO A 95 10.807 -16.382 -9.675 1.00 0.00 H new ATOM 0 HD2 PRO A 95 12.097 -14.909 -7.736 1.00 0.00 H new ATOM 0 HD3 PRO A 95 12.077 -14.405 -9.415 1.00 0.00 H new ATOM 1440 N TYR A 96 7.397 -13.249 -6.871 1.00 0.00 N ATOM 1441 CA TYR A 96 6.620 -13.409 -5.651 1.00 0.00 C ATOM 1442 C TYR A 96 5.807 -14.693 -5.804 1.00 0.00 C ATOM 1443 O TYR A 96 5.406 -15.042 -6.914 1.00 0.00 O ATOM 1444 CB TYR A 96 5.711 -12.196 -5.416 1.00 0.00 C ATOM 1445 CG TYR A 96 6.337 -10.858 -5.754 1.00 0.00 C ATOM 1446 CD1 TYR A 96 7.124 -10.179 -4.806 1.00 0.00 C ATOM 1447 CD2 TYR A 96 6.204 -10.332 -7.053 1.00 0.00 C ATOM 1448 CE1 TYR A 96 7.751 -8.969 -5.149 1.00 0.00 C ATOM 1449 CE2 TYR A 96 6.897 -9.168 -7.414 1.00 0.00 C ATOM 1450 CZ TYR A 96 7.646 -8.470 -6.455 1.00 0.00 C ATOM 1451 OH TYR A 96 8.289 -7.318 -6.793 1.00 0.00 O ATOM 0 H TYR A 96 7.010 -12.573 -7.530 1.00 0.00 H new ATOM 0 HA TYR A 96 7.274 -13.476 -4.782 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.805 -12.318 -6.010 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.407 -12.185 -4.369 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.246 -10.588 -3.814 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.567 -10.826 -7.772 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.314 -8.423 -4.406 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.854 -8.808 -8.431 1.00 0.00 H new ATOM 0 HH TYR A 96 7.735 -6.806 -7.419 1.00 0.00 H new ATOM 1461 N ALA A 97 5.588 -15.420 -4.711 1.00 0.00 N ATOM 1462 CA ALA A 97 4.934 -16.715 -4.784 1.00 0.00 C ATOM 1463 C ALA A 97 3.427 -16.585 -4.983 1.00 0.00 C ATOM 1464 O ALA A 97 2.791 -15.665 -4.473 1.00 0.00 O ATOM 1465 CB ALA A 97 5.261 -17.532 -3.531 1.00 0.00 C ATOM 0 H ALA A 97 5.854 -15.132 -3.769 1.00 0.00 H new ATOM 0 HA ALA A 97 5.318 -17.240 -5.659 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.768 -18.502 -3.591 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.339 -17.676 -3.462 1.00 0.00 H new ATOM 0 HB3 ALA A 97 4.909 -17.000 -2.647 1.00 0.00 H new ATOM 1471 N VAL A 98 2.860 -17.533 -5.735 1.00 0.00 N ATOM 1472 CA VAL A 98 1.424 -17.650 -5.934 1.00 0.00 C ATOM 1473 C VAL A 98 0.782 -18.047 -4.603 1.00 0.00 C ATOM 1474 O VAL A 98 -0.248 -17.500 -4.216 1.00 0.00 O ATOM 1475 CB VAL A 98 1.140 -18.675 -7.048 1.00 0.00 C ATOM 1476 CG1 VAL A 98 -0.362 -18.951 -7.209 1.00 0.00 C ATOM 1477 CG2 VAL A 98 1.698 -18.180 -8.389 1.00 0.00 C ATOM 0 H VAL A 98 3.398 -18.247 -6.226 1.00 0.00 H new ATOM 0 HA VAL A 98 0.993 -16.701 -6.253 1.00 0.00 H new ATOM 0 HB VAL A 98 1.633 -19.602 -6.755 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.515 -19.679 -8.005 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -0.762 -19.346 -6.275 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.877 -18.024 -7.461 1.00 0.00 H new ATOM 0 HG21 VAL A 98 1.488 -18.917 -9.165 1.00 0.00 H new ATOM 0 HG22 VAL A 98 1.227 -17.233 -8.652 1.00 0.00 H new ATOM 0 HG23 VAL A 98 2.776 -18.039 -8.305 1.00 0.00 H new ATOM 1487 N MET A 99 1.398 -18.994 -3.895 1.00 0.00 N ATOM 1488 CA MET A 99 0.920 -19.433 -2.596 1.00 0.00 C ATOM 1489 C MET A 99 1.355 -18.395 -1.549 1.00 0.00 C ATOM 1490 O MET A 99 2.443 -17.837 -1.690 1.00 0.00 O ATOM 1491 CB MET A 99 1.494 -20.818 -2.260 1.00 0.00 C ATOM 1492 CG MET A 99 0.910 -21.936 -3.137 1.00 0.00 C ATOM 1493 SD MET A 99 1.462 -21.989 -4.864 1.00 0.00 S ATOM 1494 CE MET A 99 0.490 -23.389 -5.463 1.00 0.00 C ATOM 0 H MET A 99 2.241 -19.474 -4.211 1.00 0.00 H new ATOM 0 HA MET A 99 -0.167 -19.517 -2.602 1.00 0.00 H new ATOM 0 HB2 MET A 99 2.577 -20.796 -2.381 1.00 0.00 H new ATOM 0 HB3 MET A 99 1.295 -21.044 -1.212 1.00 0.00 H new ATOM 0 HG2 MET A 99 1.150 -22.893 -2.673 1.00 0.00 H new ATOM 0 HG3 MET A 99 -0.176 -21.842 -3.130 1.00 0.00 H new ATOM 0 HE1 MET A 99 0.710 -23.560 -6.517 1.00 0.00 H new ATOM 0 HE2 MET A 99 0.744 -24.280 -4.890 1.00 0.00 H new ATOM 0 HE3 MET A 99 -0.572 -23.172 -5.344 1.00 0.00 H new ATOM 1504 N PRO A 100 0.550 -18.125 -0.505 1.00 0.00 N ATOM 1505 CA PRO A 100 0.919 -17.234 0.592 1.00 0.00 C ATOM 1506 C PRO A 100 2.114 -17.737 1.422 1.00 0.00 C ATOM 1507 O PRO A 100 1.972 -18.056 2.601 1.00 0.00 O ATOM 1508 CB PRO A 100 -0.350 -17.083 1.449 1.00 0.00 C ATOM 1509 CG PRO A 100 -1.477 -17.383 0.470 1.00 0.00 C ATOM 1510 CD PRO A 100 -0.863 -18.462 -0.417 1.00 0.00 C ATOM 0 HA PRO A 100 1.262 -16.277 0.198 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -0.352 -17.778 2.289 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -0.436 -16.079 1.865 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.373 -17.737 0.979 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.763 -16.501 -0.103 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.005 -19.453 0.013 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -1.327 -18.473 -1.403 1.00 0.00 H new ATOM 1518 N VAL A 101 3.320 -17.752 0.848 1.00 0.00 N ATOM 1519 CA VAL A 101 4.530 -18.105 1.580 1.00 0.00 C ATOM 1520 C VAL A 101 4.913 -16.867 2.397 1.00 0.00 C ATOM 1521 O VAL A 101 5.848 -16.128 2.072 1.00 0.00 O ATOM 1522 CB VAL A 101 5.640 -18.581 0.620 1.00 0.00 C ATOM 1523 CG1 VAL A 101 6.829 -19.143 1.413 1.00 0.00 C ATOM 1524 CG2 VAL A 101 5.141 -19.698 -0.308 1.00 0.00 C ATOM 0 H VAL A 101 3.480 -17.520 -0.132 1.00 0.00 H new ATOM 0 HA VAL A 101 4.372 -18.948 2.252 1.00 0.00 H new ATOM 0 HB VAL A 101 5.938 -17.714 0.030 1.00 0.00 H new ATOM 0 HG11 VAL A 101 7.604 -19.475 0.721 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.232 -18.367 2.064 1.00 0.00 H new ATOM 0 HG13 VAL A 101 6.497 -19.987 2.017 1.00 0.00 H new ATOM 0 HG21 VAL A 101 5.949 -20.009 -0.970 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.814 -20.549 0.290 1.00 0.00 H new ATOM 0 HG23 VAL A 101 4.305 -19.330 -0.903 1.00 0.00 H new ATOM 1534 N ILE A 102 4.171 -16.637 3.482 1.00 0.00 N ATOM 1535 CA ILE A 102 4.294 -15.425 4.268 1.00 0.00 C ATOM 1536 C ILE A 102 5.544 -15.470 5.142 1.00 0.00 C ATOM 1537 O ILE A 102 5.541 -15.848 6.311 1.00 0.00 O ATOM 1538 CB ILE A 102 3.022 -15.121 5.069 1.00 0.00 C ATOM 1539 CG1 ILE A 102 2.492 -16.327 5.871 1.00 0.00 C ATOM 1540 CG2 ILE A 102 1.933 -14.585 4.129 1.00 0.00 C ATOM 1541 CD1 ILE A 102 1.540 -15.895 6.991 1.00 0.00 C ATOM 0 H ILE A 102 3.471 -17.290 3.834 1.00 0.00 H new ATOM 0 HA ILE A 102 4.413 -14.591 3.577 1.00 0.00 H new ATOM 0 HB ILE A 102 3.290 -14.364 5.806 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.974 -17.011 5.198 1.00 0.00 H new ATOM 0 HG13 ILE A 102 3.331 -16.875 6.299 1.00 0.00 H new ATOM 0 HG21 ILE A 102 1.031 -14.370 4.702 1.00 0.00 H new ATOM 0 HG22 ILE A 102 2.284 -13.671 3.649 1.00 0.00 H new ATOM 0 HG23 ILE A 102 1.710 -15.332 3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.190 -16.775 7.531 1.00 0.00 H new ATOM 0 HD12 ILE A 102 2.065 -15.232 7.679 1.00 0.00 H new ATOM 0 HD13 ILE A 102 0.687 -15.370 6.561 1.00 0.00 H new ATOM 1553 N ASP A 103 6.635 -15.047 4.514 1.00 0.00 N ATOM 1554 CA ASP A 103 7.918 -14.843 5.163 1.00 0.00 C ATOM 1555 C ASP A 103 7.734 -13.695 6.165 1.00 0.00 C ATOM 1556 O ASP A 103 6.822 -12.891 5.967 1.00 0.00 O ATOM 1557 CB ASP A 103 8.979 -14.502 4.109 1.00 0.00 C ATOM 1558 CG ASP A 103 9.468 -15.728 3.348 1.00 0.00 C ATOM 1559 OD1 ASP A 103 10.616 -16.112 3.542 1.00 0.00 O ATOM 1560 OD2 ASP A 103 8.602 -16.317 2.477 1.00 0.00 O ATOM 0 H ASP A 103 6.649 -14.832 3.517 1.00 0.00 H new ATOM 0 HA ASP A 103 8.255 -15.740 5.683 1.00 0.00 H new ATOM 0 HB2 ASP A 103 8.565 -13.782 3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 103 9.827 -14.020 4.596 1.00 0.00 H new ATOM 1566 N PRO A 104 8.558 -13.605 7.225 1.00 0.00 N ATOM 1567 CA PRO A 104 8.423 -12.606 8.277 1.00 0.00 C ATOM 1568 C PRO A 104 8.030 -11.214 7.768 1.00 0.00 C ATOM 1569 O PRO A 104 8.808 -10.553 7.078 1.00 0.00 O ATOM 1570 CB PRO A 104 9.768 -12.608 9.005 1.00 0.00 C ATOM 1571 CG PRO A 104 10.170 -14.079 8.915 1.00 0.00 C ATOM 1572 CD PRO A 104 9.679 -14.487 7.525 1.00 0.00 C ATOM 0 HA PRO A 104 7.598 -12.860 8.943 1.00 0.00 H new ATOM 0 HB2 PRO A 104 10.495 -11.955 8.522 1.00 0.00 H new ATOM 0 HB3 PRO A 104 9.674 -12.272 10.038 1.00 0.00 H new ATOM 0 HG2 PRO A 104 11.247 -14.210 9.017 1.00 0.00 H new ATOM 0 HG3 PRO A 104 9.701 -14.674 9.699 1.00 0.00 H new ATOM 0 HD2 PRO A 104 10.471 -14.379 6.783 1.00 0.00 H new ATOM 0 HD3 PRO A 104 9.369 -15.532 7.511 1.00 0.00 H new ATOM 1580 N ILE A 105 6.815 -10.777 8.109 1.00 0.00 N ATOM 1581 CA ILE A 105 6.337 -9.446 7.783 1.00 0.00 C ATOM 1582 C ILE A 105 6.939 -8.473 8.787 1.00 0.00 C ATOM 1583 O ILE A 105 6.918 -8.734 9.988 1.00 0.00 O ATOM 1584 CB ILE A 105 4.800 -9.410 7.757 1.00 0.00 C ATOM 1585 CG1 ILE A 105 4.229 -10.310 6.644 1.00 0.00 C ATOM 1586 CG2 ILE A 105 4.271 -7.977 7.593 1.00 0.00 C ATOM 1587 CD1 ILE A 105 4.852 -10.070 5.262 1.00 0.00 C ATOM 0 H ILE A 105 6.139 -11.344 8.620 1.00 0.00 H new ATOM 0 HA ILE A 105 6.654 -9.152 6.782 1.00 0.00 H new ATOM 0 HB ILE A 105 4.463 -9.795 8.719 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.379 -11.353 6.922 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.153 -10.150 6.578 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.181 -7.991 7.579 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.615 -7.364 8.426 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.641 -7.558 6.657 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.396 -10.743 4.536 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.679 -9.037 4.959 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.924 -10.260 5.308 1.00 0.00 H new ATOM 1599 N VAL A 106 7.490 -7.367 8.284 1.00 0.00 N ATOM 1600 CA VAL A 106 8.002 -6.308 9.127 1.00 0.00 C ATOM 1601 C VAL A 106 6.790 -5.461 9.515 1.00 0.00 C ATOM 1602 O VAL A 106 6.199 -5.665 10.572 1.00 0.00 O ATOM 1603 CB VAL A 106 9.116 -5.540 8.383 1.00 0.00 C ATOM 1604 CG1 VAL A 106 9.659 -4.376 9.224 1.00 0.00 C ATOM 1605 CG2 VAL A 106 10.281 -6.484 8.053 1.00 0.00 C ATOM 0 H VAL A 106 7.589 -7.189 7.285 1.00 0.00 H new ATOM 0 HA VAL A 106 8.480 -6.667 10.038 1.00 0.00 H new ATOM 0 HB VAL A 106 8.677 -5.142 7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 106 10.441 -3.859 8.668 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.851 -3.679 9.446 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.071 -4.762 10.156 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.060 -5.931 7.529 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.688 -6.897 8.976 1.00 0.00 H new ATOM 0 HG23 VAL A 106 9.923 -7.296 7.420 1.00 0.00 H new ATOM 1615 N ALA A 107 6.449 -4.483 8.675 1.00 0.00 N ATOM 1616 CA ALA A 107 5.241 -3.680 8.826 1.00 0.00 C ATOM 1617 C ALA A 107 4.138 -4.256 7.946 1.00 0.00 C ATOM 1618 O ALA A 107 4.454 -4.890 6.941 1.00 0.00 O ATOM 1619 CB ALA A 107 5.554 -2.214 8.527 1.00 0.00 C ATOM 0 H ALA A 107 7.011 -4.226 7.864 1.00 0.00 H new ATOM 0 HA ALA A 107 4.878 -3.716 9.853 1.00 0.00 H new ATOM 0 HB1 ALA A 107 4.649 -1.618 8.641 1.00 0.00 H new ATOM 0 HB2 ALA A 107 6.314 -1.855 9.221 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.923 -2.122 7.505 1.00 0.00 H new ATOM 1625 N GLY A 108 2.858 -4.023 8.246 1.00 0.00 N ATOM 1626 CA GLY A 108 1.826 -4.472 7.325 1.00 0.00 C ATOM 1627 C GLY A 108 0.410 -4.246 7.829 1.00 0.00 C ATOM 1628 O GLY A 108 0.205 -3.762 8.942 1.00 0.00 O ATOM 0 H GLY A 108 2.526 -3.546 9.084 1.00 0.00 H new ATOM 0 HA2 GLY A 108 1.950 -3.953 6.375 1.00 0.00 H new ATOM 0 HA3 GLY A 108 1.966 -5.535 7.128 1.00 0.00 H new ATOM 1632 N THR A 109 -0.558 -4.615 6.987 1.00 0.00 N ATOM 1633 CA THR A 109 -1.989 -4.590 7.250 1.00 0.00 C ATOM 1634 C THR A 109 -2.559 -5.997 7.091 1.00 0.00 C ATOM 1635 O THR A 109 -1.971 -6.823 6.392 1.00 0.00 O ATOM 1636 CB THR A 109 -2.664 -3.620 6.280 1.00 0.00 C ATOM 1637 OG1 THR A 109 -2.201 -3.856 4.969 1.00 0.00 O ATOM 1638 CG2 THR A 109 -2.315 -2.192 6.685 1.00 0.00 C ATOM 0 H THR A 109 -0.346 -4.958 6.050 1.00 0.00 H new ATOM 0 HA THR A 109 -2.176 -4.252 8.269 1.00 0.00 H new ATOM 0 HB THR A 109 -3.744 -3.766 6.312 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.824 -3.458 4.326 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.792 -1.492 5.999 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.669 -2.004 7.699 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.234 -2.057 6.647 1.00 0.00 H new ATOM 1646 N GLY A 110 -3.683 -6.273 7.757 1.00 0.00 N ATOM 1647 CA GLY A 110 -4.412 -7.522 7.598 1.00 0.00 C ATOM 1648 C GLY A 110 -5.438 -7.346 6.474 1.00 0.00 C ATOM 1649 O GLY A 110 -5.072 -6.881 5.398 1.00 0.00 O ATOM 0 H GLY A 110 -4.110 -5.630 8.423 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.725 -8.334 7.360 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -4.912 -7.790 8.529 1.00 0.00 H new ATOM 1653 N PHE A 111 -6.717 -7.660 6.721 1.00 0.00 N ATOM 1654 CA PHE A 111 -7.805 -7.471 5.757 1.00 0.00 C ATOM 1655 C PHE A 111 -8.791 -6.444 6.327 1.00 0.00 C ATOM 1656 O PHE A 111 -9.115 -6.512 7.514 1.00 0.00 O ATOM 1657 CB PHE A 111 -8.486 -8.813 5.451 1.00 0.00 C ATOM 1658 CG PHE A 111 -7.544 -9.993 5.250 1.00 0.00 C ATOM 1659 CD1 PHE A 111 -6.423 -9.870 4.407 1.00 0.00 C ATOM 1660 CD2 PHE A 111 -7.774 -11.211 5.919 1.00 0.00 C ATOM 1661 CE1 PHE A 111 -5.534 -10.945 4.239 1.00 0.00 C ATOM 1662 CE2 PHE A 111 -6.888 -12.291 5.747 1.00 0.00 C ATOM 1663 CZ PHE A 111 -5.769 -12.158 4.906 1.00 0.00 C ATOM 0 H PHE A 111 -7.027 -8.057 7.608 1.00 0.00 H new ATOM 0 HA PHE A 111 -7.414 -7.092 4.813 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -9.168 -9.049 6.268 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -9.092 -8.697 4.553 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -6.245 -8.941 3.885 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -8.633 -11.316 6.566 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -4.671 -10.838 3.598 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -7.068 -13.223 6.262 1.00 0.00 H new ATOM 0 HZ PHE A 111 -5.091 -12.988 4.773 1.00 0.00 H new ATOM 1673 N SER A 112 -9.236 -5.483 5.509 1.00 0.00 N ATOM 1674 CA SER A 112 -10.043 -4.358 5.975 1.00 0.00 C ATOM 1675 C SER A 112 -11.507 -4.721 6.247 1.00 0.00 C ATOM 1676 O SER A 112 -11.925 -5.846 5.975 1.00 0.00 O ATOM 1677 CB SER A 112 -9.937 -3.224 4.940 1.00 0.00 C ATOM 1678 OG SER A 112 -10.937 -3.361 3.945 1.00 0.00 O ATOM 0 H SER A 112 -9.045 -5.467 4.507 1.00 0.00 H new ATOM 0 HA SER A 112 -9.648 -4.038 6.939 1.00 0.00 H new ATOM 0 HB2 SER A 112 -10.041 -2.260 5.437 1.00 0.00 H new ATOM 0 HB3 SER A 112 -8.951 -3.239 4.476 1.00 0.00 H new ATOM 0 HG SER A 112 -10.728 -2.774 3.188 1.00 0.00 H new ATOM 1684 N PRO A 113 -12.315 -3.755 6.729 1.00 0.00 N ATOM 1685 CA PRO A 113 -13.753 -3.918 6.878 1.00 0.00 C ATOM 1686 C PRO A 113 -14.480 -4.105 5.534 1.00 0.00 C ATOM 1687 O PRO A 113 -15.686 -4.334 5.541 1.00 0.00 O ATOM 1688 CB PRO A 113 -14.245 -2.640 7.581 1.00 0.00 C ATOM 1689 CG PRO A 113 -13.000 -2.084 8.274 1.00 0.00 C ATOM 1690 CD PRO A 113 -11.903 -2.472 7.286 1.00 0.00 C ATOM 0 HA PRO A 113 -13.969 -4.821 7.449 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -14.654 -1.926 6.866 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -15.035 -2.860 8.299 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -13.059 -1.005 8.419 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -12.844 -2.530 9.256 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -11.796 -1.721 6.503 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.937 -2.553 7.784 1.00 0.00 H new ATOM 1698 N VAL A 114 -13.783 -3.958 4.394 1.00 0.00 N ATOM 1699 CA VAL A 114 -14.314 -4.061 3.036 1.00 0.00 C ATOM 1700 C VAL A 114 -15.748 -3.537 2.834 1.00 0.00 C ATOM 1701 O VAL A 114 -16.648 -4.310 2.504 1.00 0.00 O ATOM 1702 CB VAL A 114 -14.114 -5.488 2.495 1.00 0.00 C ATOM 1703 CG1 VAL A 114 -12.627 -5.746 2.261 1.00 0.00 C ATOM 1704 CG2 VAL A 114 -14.657 -6.586 3.420 1.00 0.00 C ATOM 0 H VAL A 114 -12.784 -3.754 4.402 1.00 0.00 H new ATOM 0 HA VAL A 114 -13.725 -3.367 2.436 1.00 0.00 H new ATOM 0 HB VAL A 114 -14.682 -5.538 1.566 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -12.489 -6.757 1.878 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -12.243 -5.028 1.537 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -12.086 -5.637 3.201 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -14.478 -7.562 2.970 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -14.151 -6.533 4.384 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -15.728 -6.443 3.564 1.00 0.00 H new ATOM 1714 N PRO A 115 -15.965 -2.218 2.967 1.00 0.00 N ATOM 1715 CA PRO A 115 -17.251 -1.598 2.676 1.00 0.00 C ATOM 1716 C PRO A 115 -17.708 -1.774 1.223 1.00 0.00 C ATOM 1717 O PRO A 115 -17.005 -2.348 0.391 1.00 0.00 O ATOM 1718 CB PRO A 115 -17.061 -0.115 2.981 1.00 0.00 C ATOM 1719 CG PRO A 115 -15.932 -0.097 3.999 1.00 0.00 C ATOM 1720 CD PRO A 115 -15.042 -1.234 3.514 1.00 0.00 C ATOM 0 HA PRO A 115 -18.028 -2.071 3.277 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -16.801 0.448 2.085 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -17.971 0.330 3.384 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -15.405 0.857 4.006 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -16.295 -0.268 5.012 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -14.336 -0.890 2.758 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.455 -1.653 4.331 1.00 0.00 H new ATOM 1728 N LYS A 116 -18.899 -1.246 0.915 1.00 0.00 N ATOM 1729 CA LYS A 116 -19.521 -1.349 -0.396 1.00 0.00 C ATOM 1730 C LYS A 116 -20.251 -0.041 -0.741 1.00 0.00 C ATOM 1731 O LYS A 116 -20.145 0.960 -0.023 1.00 0.00 O ATOM 1732 CB LYS A 116 -20.464 -2.569 -0.433 1.00 0.00 C ATOM 1733 CG LYS A 116 -19.807 -3.856 0.098 1.00 0.00 C ATOM 1734 CD LYS A 116 -20.695 -5.092 -0.112 1.00 0.00 C ATOM 1735 CE LYS A 116 -20.600 -5.675 -1.529 1.00 0.00 C ATOM 1736 NZ LYS A 116 -19.285 -6.294 -1.778 1.00 0.00 N ATOM 0 H LYS A 116 -19.462 -0.727 1.588 1.00 0.00 H new ATOM 0 HA LYS A 116 -18.754 -1.501 -1.156 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -21.353 -2.351 0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -20.795 -2.734 -1.458 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -18.852 -4.008 -0.404 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -19.593 -3.741 1.161 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -20.413 -5.860 0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -21.731 -4.825 0.095 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -21.385 -6.419 -1.670 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -20.775 -4.885 -2.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -19.298 -6.779 -2.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -18.551 -5.558 -1.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -19.077 -6.982 -1.027 1.00 0.00 H new ATOM 1750 N ASP A 117 -21.004 -0.066 -1.848 1.00 0.00 N ATOM 1751 CA ASP A 117 -21.765 1.045 -2.416 1.00 0.00 C ATOM 1752 C ASP A 117 -20.849 2.195 -2.840 1.00 0.00 C ATOM 1753 O ASP A 117 -20.567 2.355 -4.023 1.00 0.00 O ATOM 1754 CB ASP A 117 -22.899 1.491 -1.480 1.00 0.00 C ATOM 1755 CG ASP A 117 -23.640 2.686 -2.058 1.00 0.00 C ATOM 1756 OD1 ASP A 117 -24.481 2.514 -2.931 1.00 0.00 O ATOM 1757 OD2 ASP A 117 -23.300 3.898 -1.548 1.00 0.00 O ATOM 0 H ASP A 117 -21.102 -0.917 -2.402 1.00 0.00 H new ATOM 0 HA ASP A 117 -22.247 0.689 -3.327 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -23.595 0.666 -1.326 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -22.490 1.749 -0.503 1.00 0.00 H new ATOM 1763 N GLY A 118 -20.383 2.980 -1.871 1.00 0.00 N ATOM 1764 CA GLY A 118 -19.467 4.090 -2.093 1.00 0.00 C ATOM 1765 C GLY A 118 -18.694 4.452 -0.826 1.00 0.00 C ATOM 1766 O GLY A 118 -18.104 5.535 -0.759 1.00 0.00 O ATOM 0 H GLY A 118 -20.638 2.858 -0.891 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -18.765 3.829 -2.885 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.027 4.959 -2.438 1.00 0.00 H new ATOM 1770 N LYS A 119 -18.696 3.557 0.172 1.00 0.00 N ATOM 1771 CA LYS A 119 -17.915 3.697 1.390 1.00 0.00 C ATOM 1772 C LYS A 119 -16.535 3.090 1.128 1.00 0.00 C ATOM 1773 O LYS A 119 -16.401 2.242 0.247 1.00 0.00 O ATOM 1774 CB LYS A 119 -18.629 2.984 2.539 1.00 0.00 C ATOM 1775 CG LYS A 119 -19.930 3.701 2.913 1.00 0.00 C ATOM 1776 CD LYS A 119 -20.642 3.013 4.088 1.00 0.00 C ATOM 1777 CE LYS A 119 -21.029 1.551 3.821 1.00 0.00 C ATOM 1778 NZ LYS A 119 -21.701 1.371 2.521 1.00 0.00 N ATOM 0 H LYS A 119 -19.253 2.703 0.146 1.00 0.00 H new ATOM 0 HA LYS A 119 -17.803 4.744 1.671 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.847 1.955 2.252 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -17.972 2.940 3.408 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -19.712 4.736 3.176 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -20.594 3.724 2.049 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -19.994 3.051 4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -21.542 3.576 4.333 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -20.133 0.930 3.852 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -21.686 1.202 4.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -22.300 0.522 2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -22.291 2.203 2.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -20.987 1.261 1.773 1.00 0.00 H new ATOM 1792 N PHE A 120 -15.521 3.523 1.881 1.00 0.00 N ATOM 1793 CA PHE A 120 -14.127 3.176 1.639 1.00 0.00 C ATOM 1794 C PHE A 120 -13.366 2.908 2.924 1.00 0.00 C ATOM 1795 O PHE A 120 -12.986 3.849 3.609 1.00 0.00 O ATOM 1796 CB PHE A 120 -13.482 4.342 0.891 1.00 0.00 C ATOM 1797 CG PHE A 120 -13.688 4.186 -0.605 1.00 0.00 C ATOM 1798 CD1 PHE A 120 -12.882 3.285 -1.325 1.00 0.00 C ATOM 1799 CD2 PHE A 120 -14.887 4.631 -1.183 1.00 0.00 C ATOM 1800 CE1 PHE A 120 -13.171 2.987 -2.668 1.00 0.00 C ATOM 1801 CE2 PHE A 120 -15.216 4.283 -2.502 1.00 0.00 C ATOM 1802 CZ PHE A 120 -14.326 3.517 -3.268 1.00 0.00 C ATOM 0 H PHE A 120 -15.652 4.134 2.687 1.00 0.00 H new ATOM 0 HA PHE A 120 -14.090 2.256 1.055 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -13.915 5.284 1.228 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -12.416 4.382 1.116 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -12.035 2.819 -0.842 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -15.562 5.247 -0.608 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -12.507 2.353 -3.237 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -16.155 4.605 -2.927 1.00 0.00 H new ATOM 0 HZ PHE A 120 -14.527 3.335 -4.313 1.00 0.00 H new ATOM 1812 N GLY A 121 -13.116 1.635 3.214 1.00 0.00 N ATOM 1813 CA GLY A 121 -12.307 1.173 4.321 1.00 0.00 C ATOM 1814 C GLY A 121 -10.850 1.566 4.097 1.00 0.00 C ATOM 1815 O GLY A 121 -10.178 0.998 3.232 1.00 0.00 O ATOM 0 H GLY A 121 -13.491 0.869 2.655 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -12.670 1.605 5.254 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -12.390 0.090 4.417 1.00 0.00 H new ATOM 1819 N TYR A 122 -10.376 2.543 4.871 1.00 0.00 N ATOM 1820 CA TYR A 122 -8.983 2.948 4.884 1.00 0.00 C ATOM 1821 C TYR A 122 -8.309 2.395 6.128 1.00 0.00 C ATOM 1822 O TYR A 122 -8.913 1.685 6.935 1.00 0.00 O ATOM 1823 CB TYR A 122 -8.819 4.467 4.723 1.00 0.00 C ATOM 1824 CG TYR A 122 -9.251 5.373 5.858 1.00 0.00 C ATOM 1825 CD1 TYR A 122 -10.574 5.845 5.910 1.00 0.00 C ATOM 1826 CD2 TYR A 122 -8.261 6.002 6.642 1.00 0.00 C ATOM 1827 CE1 TYR A 122 -10.906 6.914 6.763 1.00 0.00 C ATOM 1828 CE2 TYR A 122 -8.580 7.132 7.412 1.00 0.00 C ATOM 1829 CZ TYR A 122 -9.907 7.579 7.486 1.00 0.00 C ATOM 1830 OH TYR A 122 -10.229 8.655 8.257 1.00 0.00 O ATOM 0 H TYR A 122 -10.962 3.078 5.512 1.00 0.00 H new ATOM 0 HA TYR A 122 -8.479 2.523 4.016 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -7.766 4.666 4.525 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -9.373 4.766 3.833 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -11.335 5.388 5.296 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -7.254 5.613 6.650 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -11.936 7.223 6.861 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -7.803 7.657 7.948 1.00 0.00 H new ATOM 0 HH TYR A 122 -9.421 8.999 8.692 1.00 0.00 H new ATOM 1840 N THR A 123 -7.018 2.665 6.257 1.00 0.00 N ATOM 1841 CA THR A 123 -6.193 2.191 7.339 1.00 0.00 C ATOM 1842 C THR A 123 -5.143 3.261 7.553 1.00 0.00 C ATOM 1843 O THR A 123 -4.897 4.033 6.630 1.00 0.00 O ATOM 1844 CB THR A 123 -5.535 0.867 6.921 1.00 0.00 C ATOM 1845 OG1 THR A 123 -6.370 0.160 6.032 1.00 0.00 O ATOM 1846 CG2 THR A 123 -5.215 -0.026 8.109 1.00 0.00 C ATOM 0 H THR A 123 -6.508 3.239 5.586 1.00 0.00 H new ATOM 0 HA THR A 123 -6.761 2.011 8.252 1.00 0.00 H new ATOM 0 HB THR A 123 -4.597 1.130 6.431 1.00 0.00 H new ATOM 0 HG1 THR A 123 -6.615 -0.702 6.429 1.00 0.00 H new ATOM 0 HG21 THR A 123 -4.752 -0.948 7.757 1.00 0.00 H new ATOM 0 HG22 THR A 123 -4.529 0.492 8.779 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.135 -0.263 8.644 1.00 0.00 H new ATOM 1854 N ASP A 124 -4.540 3.321 8.737 1.00 0.00 N ATOM 1855 CA ASP A 124 -3.425 4.220 8.996 1.00 0.00 C ATOM 1856 C ASP A 124 -2.407 3.475 9.838 1.00 0.00 C ATOM 1857 O ASP A 124 -2.479 3.541 11.063 1.00 0.00 O ATOM 1858 CB ASP A 124 -3.884 5.492 9.720 1.00 0.00 C ATOM 1859 CG ASP A 124 -4.741 6.393 8.851 1.00 0.00 C ATOM 1860 OD1 ASP A 124 -5.889 6.640 9.203 1.00 0.00 O ATOM 1861 OD2 ASP A 124 -4.157 6.897 7.727 1.00 0.00 O ATOM 0 H ASP A 124 -4.810 2.750 9.538 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.985 4.532 8.049 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.447 5.213 10.611 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.009 6.047 10.057 1.00 0.00 H new ATOM 1867 N PHE A 125 -1.487 2.749 9.196 1.00 0.00 N ATOM 1868 CA PHE A 125 -0.378 2.136 9.915 1.00 0.00 C ATOM 1869 C PHE A 125 0.841 3.031 9.695 1.00 0.00 C ATOM 1870 O PHE A 125 0.782 3.980 8.909 1.00 0.00 O ATOM 1871 CB PHE A 125 -0.169 0.669 9.521 1.00 0.00 C ATOM 1872 CG PHE A 125 0.546 0.399 8.212 1.00 0.00 C ATOM 1873 CD1 PHE A 125 -0.197 0.252 7.027 1.00 0.00 C ATOM 1874 CD2 PHE A 125 1.925 0.113 8.209 1.00 0.00 C ATOM 1875 CE1 PHE A 125 0.410 -0.282 5.876 1.00 0.00 C ATOM 1876 CE2 PHE A 125 2.545 -0.354 7.037 1.00 0.00 C ATOM 1877 CZ PHE A 125 1.781 -0.596 5.886 1.00 0.00 C ATOM 0 H PHE A 125 -1.491 2.575 8.191 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.584 2.077 10.984 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.391 0.181 10.319 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -1.146 0.188 9.478 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.235 0.549 7.001 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.507 0.253 9.108 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -0.176 -0.451 4.985 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.611 -0.527 7.023 1.00 0.00 H new ATOM 0 HZ PHE A 125 2.245 -1.023 5.009 1.00 0.00 H new ATOM 1887 N THR A 126 1.931 2.817 10.430 1.00 0.00 N ATOM 1888 CA THR A 126 3.097 3.683 10.345 1.00 0.00 C ATOM 1889 C THR A 126 4.341 2.875 10.695 1.00 0.00 C ATOM 1890 O THR A 126 4.248 1.926 11.472 1.00 0.00 O ATOM 1891 CB THR A 126 2.892 4.922 11.238 1.00 0.00 C ATOM 1892 OG1 THR A 126 1.925 5.780 10.653 1.00 0.00 O ATOM 1893 CG2 THR A 126 4.172 5.738 11.419 1.00 0.00 C ATOM 0 H THR A 126 2.027 2.047 11.092 1.00 0.00 H new ATOM 0 HA THR A 126 3.235 4.059 9.331 1.00 0.00 H new ATOM 0 HB THR A 126 2.570 4.550 12.211 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.327 6.657 10.480 1.00 0.00 H new ATOM 0 HG21 THR A 126 3.968 6.598 12.057 1.00 0.00 H new ATOM 0 HG22 THR A 126 4.938 5.116 11.883 1.00 0.00 H new ATOM 0 HG23 THR A 126 4.524 6.083 10.447 1.00 0.00 H new ATOM 1901 N TRP A 127 5.483 3.231 10.099 1.00 0.00 N ATOM 1902 CA TRP A 127 6.739 2.511 10.224 1.00 0.00 C ATOM 1903 C TRP A 127 7.916 3.486 10.161 1.00 0.00 C ATOM 1904 O TRP A 127 7.826 4.525 9.516 1.00 0.00 O ATOM 1905 CB TRP A 127 6.788 1.482 9.078 1.00 0.00 C ATOM 1906 CG TRP A 127 8.052 0.704 8.844 1.00 0.00 C ATOM 1907 CD1 TRP A 127 8.807 0.115 9.796 1.00 0.00 C ATOM 1908 CD2 TRP A 127 8.693 0.366 7.574 1.00 0.00 C ATOM 1909 NE1 TRP A 127 9.862 -0.556 9.210 1.00 0.00 N ATOM 1910 CE2 TRP A 127 9.831 -0.453 7.835 1.00 0.00 C ATOM 1911 CE3 TRP A 127 8.428 0.669 6.222 1.00 0.00 C ATOM 1912 CZ2 TRP A 127 10.646 -0.960 6.806 1.00 0.00 C ATOM 1913 CZ3 TRP A 127 9.265 0.206 5.191 1.00 0.00 C ATOM 1914 CH2 TRP A 127 10.340 -0.645 5.473 1.00 0.00 C ATOM 0 H TRP A 127 5.554 4.054 9.500 1.00 0.00 H new ATOM 0 HA TRP A 127 6.809 1.999 11.184 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.987 0.763 9.249 1.00 0.00 H new ATOM 0 HB3 TRP A 127 6.551 2.009 8.154 1.00 0.00 H new ATOM 0 HD1 TRP A 127 8.614 0.162 10.858 1.00 0.00 H new ATOM 0 HE1 TRP A 127 10.576 -1.065 9.730 1.00 0.00 H new ATOM 0 HE3 TRP A 127 7.565 1.269 5.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 11.496 -1.584 7.039 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 9.077 0.510 4.172 1.00 0.00 H new ATOM 0 HH2 TRP A 127 10.931 -1.057 4.669 1.00 0.00 H new ATOM 1925 N HIS A 128 9.011 3.149 10.849 1.00 0.00 N ATOM 1926 CA HIS A 128 10.287 3.849 10.790 1.00 0.00 C ATOM 1927 C HIS A 128 11.245 2.854 10.132 1.00 0.00 C ATOM 1928 O HIS A 128 11.570 1.842 10.751 1.00 0.00 O ATOM 1929 CB HIS A 128 10.742 4.260 12.192 1.00 0.00 C ATOM 1930 CG HIS A 128 9.972 5.448 12.706 1.00 0.00 C ATOM 1931 ND1 HIS A 128 10.232 6.769 12.392 1.00 0.00 N ATOM 1932 CD2 HIS A 128 8.869 5.410 13.512 1.00 0.00 C ATOM 1933 CE1 HIS A 128 9.313 7.523 13.017 1.00 0.00 C ATOM 1934 NE2 HIS A 128 8.474 6.720 13.700 1.00 0.00 N ATOM 0 H HIS A 128 9.028 2.351 11.484 1.00 0.00 H new ATOM 0 HA HIS A 128 10.236 4.778 10.223 1.00 0.00 H new ATOM 0 HB2 HIS A 128 10.614 3.421 12.876 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.806 4.497 12.174 1.00 0.00 H new ATOM 0 HD1 HIS A 128 10.985 7.109 11.794 1.00 0.00 H new ATOM 0 HD2 HIS A 128 8.398 4.528 13.922 1.00 0.00 H new ATOM 0 HE1 HIS A 128 9.256 8.601 12.978 1.00 0.00 H new ATOM 1943 N PRO A 129 11.654 3.086 8.877 1.00 0.00 N ATOM 1944 CA PRO A 129 12.402 2.128 8.093 1.00 0.00 C ATOM 1945 C PRO A 129 13.914 2.273 8.270 1.00 0.00 C ATOM 1946 O PRO A 129 14.438 3.382 8.402 1.00 0.00 O ATOM 1947 CB PRO A 129 12.018 2.464 6.657 1.00 0.00 C ATOM 1948 CG PRO A 129 11.934 3.988 6.691 1.00 0.00 C ATOM 1949 CD PRO A 129 11.328 4.245 8.069 1.00 0.00 C ATOM 0 HA PRO A 129 12.172 1.105 8.391 1.00 0.00 H new ATOM 0 HB2 PRO A 129 12.764 2.114 5.944 1.00 0.00 H new ATOM 0 HB3 PRO A 129 11.068 2.011 6.373 1.00 0.00 H new ATOM 0 HG2 PRO A 129 12.914 4.453 6.584 1.00 0.00 H new ATOM 0 HG3 PRO A 129 11.306 4.379 5.890 1.00 0.00 H new ATOM 0 HD2 PRO A 129 11.736 5.154 8.510 1.00 0.00 H new ATOM 0 HD3 PRO A 129 10.249 4.381 8.000 1.00 0.00 H new ATOM 1957 N THR A 130 14.615 1.142 8.221 1.00 0.00 N ATOM 1958 CA THR A 130 16.064 1.061 8.209 1.00 0.00 C ATOM 1959 C THR A 130 16.536 1.103 6.755 1.00 0.00 C ATOM 1960 O THR A 130 15.782 0.733 5.859 1.00 0.00 O ATOM 1961 CB THR A 130 16.453 -0.256 8.897 1.00 0.00 C ATOM 1962 OG1 THR A 130 15.523 -1.271 8.552 1.00 0.00 O ATOM 1963 CG2 THR A 130 16.404 -0.084 10.417 1.00 0.00 C ATOM 0 H THR A 130 14.168 0.226 8.187 1.00 0.00 H new ATOM 0 HA THR A 130 16.532 1.891 8.739 1.00 0.00 H new ATOM 0 HB THR A 130 17.458 -0.528 8.574 1.00 0.00 H new ATOM 0 HG1 THR A 130 15.639 -1.514 7.610 1.00 0.00 H new ATOM 0 HG21 THR A 130 16.681 -1.022 10.898 1.00 0.00 H new ATOM 0 HG22 THR A 130 17.102 0.698 10.717 1.00 0.00 H new ATOM 0 HG23 THR A 130 15.395 0.195 10.719 1.00 0.00 H new ATOM 1971 N ALA A 131 17.771 1.544 6.494 1.00 0.00 N ATOM 1972 CA ALA A 131 18.282 1.644 5.129 1.00 0.00 C ATOM 1973 C ALA A 131 18.279 0.287 4.406 1.00 0.00 C ATOM 1974 O ALA A 131 18.061 -0.757 5.021 1.00 0.00 O ATOM 1975 CB ALA A 131 19.669 2.292 5.128 1.00 0.00 C ATOM 0 H ALA A 131 18.433 1.837 7.213 1.00 0.00 H new ATOM 0 HA ALA A 131 17.607 2.287 4.564 1.00 0.00 H new ATOM 0 HB1 ALA A 131 20.038 2.360 4.105 1.00 0.00 H new ATOM 0 HB2 ALA A 131 19.604 3.292 5.558 1.00 0.00 H new ATOM 0 HB3 ALA A 131 20.354 1.686 5.721 1.00 0.00 H new ATOM 1981 N GLY A 132 18.514 0.312 3.093 1.00 0.00 N ATOM 1982 CA GLY A 132 18.594 -0.858 2.234 1.00 0.00 C ATOM 1983 C GLY A 132 17.367 -0.936 1.337 1.00 0.00 C ATOM 1984 O GLY A 132 17.039 0.042 0.662 1.00 0.00 O ATOM 0 H GLY A 132 18.659 1.184 2.585 1.00 0.00 H new ATOM 0 HA2 GLY A 132 19.497 -0.810 1.625 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.667 -1.760 2.842 1.00 0.00 H new ATOM 1988 N THR A 133 16.706 -2.095 1.268 1.00 0.00 N ATOM 1989 CA THR A 133 15.583 -2.289 0.364 1.00 0.00 C ATOM 1990 C THR A 133 14.617 -3.328 0.931 1.00 0.00 C ATOM 1991 O THR A 133 15.047 -4.284 1.575 1.00 0.00 O ATOM 1992 CB THR A 133 16.081 -2.662 -1.044 1.00 0.00 C ATOM 1993 OG1 THR A 133 17.047 -1.727 -1.481 1.00 0.00 O ATOM 1994 CG2 THR A 133 14.948 -2.683 -2.079 1.00 0.00 C ATOM 0 H THR A 133 16.935 -2.913 1.833 1.00 0.00 H new ATOM 0 HA THR A 133 15.033 -1.352 0.272 1.00 0.00 H new ATOM 0 HB THR A 133 16.506 -3.663 -0.967 1.00 0.00 H new ATOM 0 HG1 THR A 133 17.359 -1.973 -2.377 1.00 0.00 H new ATOM 0 HG21 THR A 133 15.352 -2.951 -3.055 1.00 0.00 H new ATOM 0 HG22 THR A 133 14.198 -3.416 -1.783 1.00 0.00 H new ATOM 0 HG23 THR A 133 14.488 -1.696 -2.135 1.00 0.00 H new ATOM 2002 N TYR A 134 13.321 -3.115 0.695 1.00 0.00 N ATOM 2003 CA TYR A 134 12.221 -3.973 1.104 1.00 0.00 C ATOM 2004 C TYR A 134 11.244 -4.066 -0.066 1.00 0.00 C ATOM 2005 O TYR A 134 11.426 -3.392 -1.082 1.00 0.00 O ATOM 2006 CB TYR A 134 11.549 -3.412 2.369 1.00 0.00 C ATOM 2007 CG TYR A 134 12.527 -2.976 3.438 1.00 0.00 C ATOM 2008 CD1 TYR A 134 13.115 -1.705 3.342 1.00 0.00 C ATOM 2009 CD2 TYR A 134 12.968 -3.880 4.422 1.00 0.00 C ATOM 2010 CE1 TYR A 134 14.196 -1.369 4.162 1.00 0.00 C ATOM 2011 CE2 TYR A 134 14.025 -3.520 5.277 1.00 0.00 C ATOM 2012 CZ TYR A 134 14.672 -2.283 5.115 1.00 0.00 C ATOM 2013 OH TYR A 134 15.765 -1.988 5.875 1.00 0.00 O ATOM 0 H TYR A 134 12.999 -2.292 0.185 1.00 0.00 H new ATOM 0 HA TYR A 134 12.578 -4.972 1.356 1.00 0.00 H new ATOM 0 HB2 TYR A 134 10.926 -2.562 2.091 1.00 0.00 H new ATOM 0 HB3 TYR A 134 10.886 -4.171 2.784 1.00 0.00 H new ATOM 0 HD1 TYR A 134 12.732 -0.986 2.634 1.00 0.00 H new ATOM 0 HD2 TYR A 134 12.497 -4.847 4.520 1.00 0.00 H new ATOM 0 HE1 TYR A 134 14.667 -0.402 4.062 1.00 0.00 H new ATOM 0 HE2 TYR A 134 14.340 -4.195 6.059 1.00 0.00 H new ATOM 0 HH TYR A 134 16.140 -1.129 5.589 1.00 0.00 H new ATOM 2023 N TYR A 135 10.214 -4.896 0.077 1.00 0.00 N ATOM 2024 CA TYR A 135 9.174 -5.122 -0.905 1.00 0.00 C ATOM 2025 C TYR A 135 7.827 -5.131 -0.193 1.00 0.00 C ATOM 2026 O TYR A 135 7.729 -5.689 0.903 1.00 0.00 O ATOM 2027 CB TYR A 135 9.401 -6.465 -1.609 1.00 0.00 C ATOM 2028 CG TYR A 135 10.566 -6.469 -2.575 1.00 0.00 C ATOM 2029 CD1 TYR A 135 11.869 -6.738 -2.117 1.00 0.00 C ATOM 2030 CD2 TYR A 135 10.345 -6.203 -3.938 1.00 0.00 C ATOM 2031 CE1 TYR A 135 12.946 -6.757 -3.020 1.00 0.00 C ATOM 2032 CE2 TYR A 135 11.417 -6.255 -4.844 1.00 0.00 C ATOM 2033 CZ TYR A 135 12.716 -6.522 -4.386 1.00 0.00 C ATOM 2034 OH TYR A 135 13.746 -6.578 -5.277 1.00 0.00 O ATOM 0 H TYR A 135 10.082 -5.452 0.922 1.00 0.00 H new ATOM 0 HA TYR A 135 9.193 -4.330 -1.654 1.00 0.00 H new ATOM 0 HB2 TYR A 135 9.566 -7.235 -0.855 1.00 0.00 H new ATOM 0 HB3 TYR A 135 8.494 -6.737 -2.149 1.00 0.00 H new ATOM 0 HD1 TYR A 135 12.042 -6.930 -1.068 1.00 0.00 H new ATOM 0 HD2 TYR A 135 9.353 -5.959 -4.288 1.00 0.00 H new ATOM 0 HE1 TYR A 135 13.947 -6.952 -2.665 1.00 0.00 H new ATOM 0 HE2 TYR A 135 11.241 -6.089 -5.897 1.00 0.00 H new ATOM 0 HH TYR A 135 13.408 -6.869 -6.150 1.00 0.00 H new ATOM 2044 N TYR A 136 6.809 -4.515 -0.802 1.00 0.00 N ATOM 2045 CA TYR A 136 5.435 -4.567 -0.321 1.00 0.00 C ATOM 2046 C TYR A 136 4.660 -5.542 -1.200 1.00 0.00 C ATOM 2047 O TYR A 136 4.886 -5.555 -2.410 1.00 0.00 O ATOM 2048 CB TYR A 136 4.789 -3.176 -0.292 1.00 0.00 C ATOM 2049 CG TYR A 136 4.722 -2.406 -1.602 1.00 0.00 C ATOM 2050 CD1 TYR A 136 3.576 -2.490 -2.417 1.00 0.00 C ATOM 2051 CD2 TYR A 136 5.701 -1.438 -1.887 1.00 0.00 C ATOM 2052 CE1 TYR A 136 3.387 -1.575 -3.470 1.00 0.00 C ATOM 2053 CE2 TYR A 136 5.514 -0.526 -2.941 1.00 0.00 C ATOM 2054 CZ TYR A 136 4.339 -0.574 -3.710 1.00 0.00 C ATOM 2055 OH TYR A 136 4.164 0.274 -4.761 1.00 0.00 O ATOM 0 H TYR A 136 6.922 -3.962 -1.651 1.00 0.00 H new ATOM 0 HA TYR A 136 5.419 -4.919 0.711 1.00 0.00 H new ATOM 0 HB2 TYR A 136 3.773 -3.285 0.087 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.334 -2.567 0.429 1.00 0.00 H new ATOM 0 HD1 TYR A 136 2.840 -3.259 -2.233 1.00 0.00 H new ATOM 0 HD2 TYR A 136 6.602 -1.395 -1.293 1.00 0.00 H new ATOM 0 HE1 TYR A 136 2.508 -1.644 -4.094 1.00 0.00 H new ATOM 0 HE2 TYR A 136 6.273 0.211 -3.159 1.00 0.00 H new ATOM 0 HH TYR A 136 5.037 0.590 -5.076 1.00 0.00 H new ATOM 2065 N VAL A 137 3.784 -6.363 -0.607 1.00 0.00 N ATOM 2066 CA VAL A 137 2.948 -7.327 -1.320 1.00 0.00 C ATOM 2067 C VAL A 137 1.595 -7.499 -0.614 1.00 0.00 C ATOM 2068 O VAL A 137 1.424 -7.050 0.519 1.00 0.00 O ATOM 2069 CB VAL A 137 3.660 -8.690 -1.447 1.00 0.00 C ATOM 2070 CG1 VAL A 137 4.960 -8.619 -2.257 1.00 0.00 C ATOM 2071 CG2 VAL A 137 3.955 -9.320 -0.077 1.00 0.00 C ATOM 0 H VAL A 137 3.636 -6.373 0.402 1.00 0.00 H new ATOM 0 HA VAL A 137 2.771 -6.938 -2.323 1.00 0.00 H new ATOM 0 HB VAL A 137 2.957 -9.322 -1.989 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.411 -9.610 -2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 137 4.742 -8.267 -3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.653 -7.930 -1.774 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.456 -10.278 -0.217 1.00 0.00 H new ATOM 0 HG22 VAL A 137 4.598 -8.654 0.499 1.00 0.00 H new ATOM 0 HG23 VAL A 137 3.020 -9.476 0.461 1.00 0.00 H new ATOM 2081 N CYS A 138 0.650 -8.168 -1.283 1.00 0.00 N ATOM 2082 CA CYS A 138 -0.662 -8.569 -0.769 1.00 0.00 C ATOM 2083 C CYS A 138 -0.642 -10.076 -0.512 1.00 0.00 C ATOM 2084 O CYS A 138 -0.118 -10.828 -1.331 1.00 0.00 O ATOM 2085 CB CYS A 138 -1.729 -8.228 -1.808 1.00 0.00 C ATOM 2086 SG CYS A 138 -3.392 -8.919 -1.569 1.00 0.00 S ATOM 0 H CYS A 138 0.789 -8.460 -2.251 1.00 0.00 H new ATOM 0 HA CYS A 138 -0.888 -8.043 0.159 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -1.820 -7.143 -1.852 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -1.366 -8.557 -2.782 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.870 -9.305 -2.715 1.00 0.00 H new ATOM 2091 N GLN A 139 -1.197 -10.518 0.619 1.00 0.00 N ATOM 2092 CA GLN A 139 -1.137 -11.909 1.067 1.00 0.00 C ATOM 2093 C GLN A 139 -2.114 -12.822 0.329 1.00 0.00 C ATOM 2094 O GLN A 139 -1.889 -14.028 0.265 1.00 0.00 O ATOM 2095 CB GLN A 139 -1.396 -11.963 2.577 1.00 0.00 C ATOM 2096 CG GLN A 139 -0.199 -11.388 3.345 1.00 0.00 C ATOM 2097 CD GLN A 139 -0.504 -11.144 4.824 1.00 0.00 C ATOM 2098 OE1 GLN A 139 -1.644 -10.900 5.205 1.00 0.00 O ATOM 2099 NE2 GLN A 139 0.516 -11.198 5.675 1.00 0.00 N ATOM 0 H GLN A 139 -1.708 -9.909 1.258 1.00 0.00 H new ATOM 0 HA GLN A 139 -0.139 -12.283 0.837 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -2.297 -11.398 2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -1.573 -12.993 2.886 1.00 0.00 H new ATOM 0 HG2 GLN A 139 0.644 -12.074 3.261 1.00 0.00 H new ATOM 0 HG3 GLN A 139 0.107 -10.450 2.882 1.00 0.00 H new ATOM 0 HE21 GLN A 139 1.455 -11.403 5.333 1.00 0.00 H new ATOM 0 HE22 GLN A 139 0.360 -11.035 6.670 1.00 0.00 H new ATOM 2108 N ILE A 140 -3.218 -12.277 -0.187 1.00 0.00 N ATOM 2109 CA ILE A 140 -4.227 -13.072 -0.877 1.00 0.00 C ATOM 2110 C ILE A 140 -3.551 -13.798 -2.059 1.00 0.00 C ATOM 2111 O ILE A 140 -2.818 -13.145 -2.804 1.00 0.00 O ATOM 2112 CB ILE A 140 -5.403 -12.174 -1.310 1.00 0.00 C ATOM 2113 CG1 ILE A 140 -6.003 -11.465 -0.077 1.00 0.00 C ATOM 2114 CG2 ILE A 140 -6.480 -12.986 -2.045 1.00 0.00 C ATOM 2115 CD1 ILE A 140 -7.212 -10.582 -0.393 1.00 0.00 C ATOM 0 H ILE A 140 -3.433 -11.281 -0.137 1.00 0.00 H new ATOM 0 HA ILE A 140 -4.650 -13.829 -0.216 1.00 0.00 H new ATOM 0 HB ILE A 140 -5.026 -11.422 -2.003 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -6.297 -12.218 0.655 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.231 -10.853 0.389 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -7.297 -12.326 -2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.047 -13.444 -2.934 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.862 -13.765 -1.385 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -7.575 -10.120 0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -6.920 -9.805 -1.100 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -8.003 -11.191 -0.830 1.00 0.00 H new ATOM 2127 N PRO A 141 -3.753 -15.122 -2.221 1.00 0.00 N ATOM 2128 CA PRO A 141 -3.079 -15.935 -3.225 1.00 0.00 C ATOM 2129 C PRO A 141 -2.997 -15.300 -4.615 1.00 0.00 C ATOM 2130 O PRO A 141 -3.922 -14.617 -5.053 1.00 0.00 O ATOM 2131 CB PRO A 141 -3.862 -17.248 -3.286 1.00 0.00 C ATOM 2132 CG PRO A 141 -4.397 -17.406 -1.866 1.00 0.00 C ATOM 2133 CD PRO A 141 -4.615 -15.965 -1.399 1.00 0.00 C ATOM 0 HA PRO A 141 -2.037 -16.065 -2.932 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.669 -17.201 -4.017 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -3.223 -18.084 -3.570 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -5.325 -17.977 -1.849 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -3.687 -17.931 -1.227 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -5.660 -15.676 -1.511 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -4.367 -15.859 -0.343 1.00 0.00 H new ATOM 2141 N GLY A 142 -1.883 -15.523 -5.316 1.00 0.00 N ATOM 2142 CA GLY A 142 -1.686 -15.102 -6.696 1.00 0.00 C ATOM 2143 C GLY A 142 -1.406 -13.609 -6.855 1.00 0.00 C ATOM 2144 O GLY A 142 -0.585 -13.220 -7.680 1.00 0.00 O ATOM 0 H GLY A 142 -1.077 -16.013 -4.927 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -0.855 -15.665 -7.122 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -2.574 -15.358 -7.274 1.00 0.00 H new ATOM 2148 N HIS A 143 -2.087 -12.758 -6.091 1.00 0.00 N ATOM 2149 CA HIS A 143 -2.048 -11.309 -6.230 1.00 0.00 C ATOM 2150 C HIS A 143 -0.629 -10.723 -6.285 1.00 0.00 C ATOM 2151 O HIS A 143 -0.338 -9.901 -7.158 1.00 0.00 O ATOM 2152 CB HIS A 143 -2.853 -10.678 -5.099 1.00 0.00 C ATOM 2153 CG HIS A 143 -4.345 -10.915 -5.127 1.00 0.00 C ATOM 2154 ND1 HIS A 143 -5.251 -10.171 -4.380 1.00 0.00 N ATOM 2155 CD2 HIS A 143 -5.032 -11.819 -5.888 1.00 0.00 C ATOM 2156 CE1 HIS A 143 -6.463 -10.669 -4.671 1.00 0.00 C ATOM 2157 NE2 HIS A 143 -6.363 -11.652 -5.579 1.00 0.00 N ATOM 0 H HIS A 143 -2.699 -13.070 -5.336 1.00 0.00 H new ATOM 0 HA HIS A 143 -2.493 -11.068 -7.196 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -2.465 -11.053 -4.152 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -2.677 -9.602 -5.112 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -4.614 -12.524 -6.591 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -7.390 -10.326 -4.235 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -7.139 -12.184 -5.972 1.00 0.00 H new ATOM 2165 N ALA A 144 0.243 -11.118 -5.351 1.00 0.00 N ATOM 2166 CA ALA A 144 1.626 -10.649 -5.344 1.00 0.00 C ATOM 2167 C ALA A 144 2.345 -11.094 -6.617 1.00 0.00 C ATOM 2168 O ALA A 144 2.985 -10.293 -7.287 1.00 0.00 O ATOM 2169 CB ALA A 144 2.378 -11.150 -4.110 1.00 0.00 C ATOM 0 H ALA A 144 0.013 -11.760 -4.593 1.00 0.00 H new ATOM 0 HA ALA A 144 1.608 -9.560 -5.308 1.00 0.00 H new ATOM 0 HB1 ALA A 144 3.404 -10.783 -4.135 1.00 0.00 H new ATOM 0 HB2 ALA A 144 1.884 -10.784 -3.210 1.00 0.00 H new ATOM 0 HB3 ALA A 144 2.382 -12.240 -4.104 1.00 0.00 H new ATOM 2175 N ALA A 145 2.243 -12.386 -6.944 1.00 0.00 N ATOM 2176 CA ALA A 145 2.890 -12.968 -8.113 1.00 0.00 C ATOM 2177 C ALA A 145 2.431 -12.268 -9.395 1.00 0.00 C ATOM 2178 O ALA A 145 3.237 -12.003 -10.283 1.00 0.00 O ATOM 2179 CB ALA A 145 2.608 -14.474 -8.160 1.00 0.00 C ATOM 0 H ALA A 145 1.704 -13.058 -6.398 1.00 0.00 H new ATOM 0 HA ALA A 145 3.967 -12.822 -8.037 1.00 0.00 H new ATOM 0 HB1 ALA A 145 3.092 -14.908 -9.035 1.00 0.00 H new ATOM 0 HB2 ALA A 145 2.998 -14.946 -7.258 1.00 0.00 H new ATOM 0 HB3 ALA A 145 1.533 -14.641 -8.221 1.00 0.00 H new ATOM 2185 N THR A 146 1.131 -11.985 -9.492 1.00 0.00 N ATOM 2186 CA THR A 146 0.519 -11.434 -10.689 1.00 0.00 C ATOM 2187 C THR A 146 0.730 -9.926 -10.834 1.00 0.00 C ATOM 2188 O THR A 146 0.961 -9.478 -11.956 1.00 0.00 O ATOM 2189 CB THR A 146 -0.970 -11.802 -10.761 1.00 0.00 C ATOM 2190 OG1 THR A 146 -1.630 -11.466 -9.560 1.00 0.00 O ATOM 2191 CG2 THR A 146 -1.156 -13.300 -11.025 1.00 0.00 C ATOM 0 H THR A 146 0.471 -12.136 -8.729 1.00 0.00 H new ATOM 0 HA THR A 146 1.029 -11.890 -11.537 1.00 0.00 H new ATOM 0 HB THR A 146 -1.402 -11.235 -11.585 1.00 0.00 H new ATOM 0 HG1 THR A 146 -1.373 -12.099 -8.857 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.220 -13.532 -11.071 1.00 0.00 H new ATOM 0 HG22 THR A 146 -0.686 -13.564 -11.972 1.00 0.00 H new ATOM 0 HG23 THR A 146 -0.695 -13.871 -10.220 1.00 0.00 H new ATOM 2199 N GLY A 147 0.628 -9.123 -9.764 1.00 0.00 N ATOM 2200 CA GLY A 147 0.709 -7.682 -9.978 1.00 0.00 C ATOM 2201 C GLY A 147 0.840 -6.784 -8.750 1.00 0.00 C ATOM 2202 O GLY A 147 1.588 -5.810 -8.819 1.00 0.00 O ATOM 0 H GLY A 147 0.497 -9.427 -8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 147 1.563 -7.488 -10.627 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -0.183 -7.374 -10.524 1.00 0.00 H new ATOM 2206 N MET A 148 0.126 -7.038 -7.646 1.00 0.00 N ATOM 2207 CA MET A 148 0.171 -6.069 -6.551 1.00 0.00 C ATOM 2208 C MET A 148 1.428 -6.216 -5.704 1.00 0.00 C ATOM 2209 O MET A 148 1.461 -7.002 -4.756 1.00 0.00 O ATOM 2210 CB MET A 148 -1.111 -5.953 -5.726 1.00 0.00 C ATOM 2211 CG MET A 148 -1.938 -7.204 -5.481 1.00 0.00 C ATOM 2212 SD MET A 148 -3.253 -6.888 -4.264 1.00 0.00 S ATOM 2213 CE MET A 148 -4.015 -5.401 -4.930 1.00 0.00 C ATOM 0 H MET A 148 -0.459 -7.860 -7.492 1.00 0.00 H new ATOM 0 HA MET A 148 0.233 -5.099 -7.044 1.00 0.00 H new ATOM 0 HB2 MET A 148 -0.842 -5.539 -4.754 1.00 0.00 H new ATOM 0 HB3 MET A 148 -1.754 -5.222 -6.216 1.00 0.00 H new ATOM 0 HG2 MET A 148 -2.379 -7.542 -6.419 1.00 0.00 H new ATOM 0 HG3 MET A 148 -1.293 -8.007 -5.124 1.00 0.00 H new ATOM 0 HE1 MET A 148 -4.958 -5.214 -4.416 1.00 0.00 H new ATOM 0 HE2 MET A 148 -3.347 -4.553 -4.783 1.00 0.00 H new ATOM 0 HE3 MET A 148 -4.203 -5.534 -5.995 1.00 0.00 H new ATOM 2223 N PHE A 149 2.450 -5.427 -6.044 1.00 0.00 N ATOM 2224 CA PHE A 149 3.724 -5.404 -5.352 1.00 0.00 C ATOM 2225 C PHE A 149 4.443 -4.074 -5.603 1.00 0.00 C ATOM 2226 O PHE A 149 3.914 -3.210 -6.295 1.00 0.00 O ATOM 2227 CB PHE A 149 4.549 -6.608 -5.828 1.00 0.00 C ATOM 2228 CG PHE A 149 4.899 -6.596 -7.312 1.00 0.00 C ATOM 2229 CD1 PHE A 149 5.941 -5.785 -7.809 1.00 0.00 C ATOM 2230 CD2 PHE A 149 4.189 -7.419 -8.205 1.00 0.00 C ATOM 2231 CE1 PHE A 149 6.325 -5.869 -9.159 1.00 0.00 C ATOM 2232 CE2 PHE A 149 4.586 -7.521 -9.550 1.00 0.00 C ATOM 2233 CZ PHE A 149 5.676 -6.769 -10.018 1.00 0.00 C ATOM 0 H PHE A 149 2.405 -4.775 -6.827 1.00 0.00 H new ATOM 0 HA PHE A 149 3.579 -5.481 -4.274 1.00 0.00 H new ATOM 0 HB2 PHE A 149 5.473 -6.648 -5.251 1.00 0.00 H new ATOM 0 HB3 PHE A 149 3.995 -7.520 -5.607 1.00 0.00 H new ATOM 0 HD1 PHE A 149 6.447 -5.096 -7.149 1.00 0.00 H new ATOM 0 HD2 PHE A 149 3.333 -7.977 -7.855 1.00 0.00 H new ATOM 0 HE1 PHE A 149 7.119 -5.241 -9.535 1.00 0.00 H new ATOM 0 HE2 PHE A 149 4.053 -8.177 -10.223 1.00 0.00 H new ATOM 0 HZ PHE A 149 6.014 -6.883 -11.037 1.00 0.00 H new ATOM 2243 N GLY A 150 5.654 -3.909 -5.059 1.00 0.00 N ATOM 2244 CA GLY A 150 6.516 -2.761 -5.322 1.00 0.00 C ATOM 2245 C GLY A 150 7.683 -2.767 -4.348 1.00 0.00 C ATOM 2246 O GLY A 150 7.646 -3.459 -3.330 1.00 0.00 O ATOM 0 H GLY A 150 6.065 -4.583 -4.413 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.884 -2.797 -6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 150 5.948 -1.836 -5.220 1.00 0.00 H new ATOM 2250 N LYS A 151 8.732 -2.029 -4.712 1.00 0.00 N ATOM 2251 CA LYS A 151 9.997 -1.948 -4.003 1.00 0.00 C ATOM 2252 C LYS A 151 9.994 -0.724 -3.091 1.00 0.00 C ATOM 2253 O LYS A 151 9.441 0.316 -3.447 1.00 0.00 O ATOM 2254 CB LYS A 151 11.119 -1.792 -5.037 1.00 0.00 C ATOM 2255 CG LYS A 151 11.438 -3.088 -5.777 1.00 0.00 C ATOM 2256 CD LYS A 151 12.333 -2.787 -6.983 1.00 0.00 C ATOM 2257 CE LYS A 151 12.666 -4.073 -7.744 1.00 0.00 C ATOM 2258 NZ LYS A 151 13.527 -3.799 -8.908 1.00 0.00 N ATOM 0 H LYS A 151 8.716 -1.446 -5.549 1.00 0.00 H new ATOM 0 HA LYS A 151 10.147 -2.847 -3.404 1.00 0.00 H new ATOM 0 HB2 LYS A 151 10.834 -1.028 -5.761 1.00 0.00 H new ATOM 0 HB3 LYS A 151 12.019 -1.436 -4.536 1.00 0.00 H new ATOM 0 HG2 LYS A 151 11.938 -3.787 -5.107 1.00 0.00 H new ATOM 0 HG3 LYS A 151 10.516 -3.566 -6.107 1.00 0.00 H new ATOM 0 HD2 LYS A 151 11.831 -2.084 -7.648 1.00 0.00 H new ATOM 0 HD3 LYS A 151 13.253 -2.308 -6.649 1.00 0.00 H new ATOM 0 HE2 LYS A 151 13.166 -4.774 -7.076 1.00 0.00 H new ATOM 0 HE3 LYS A 151 11.744 -4.551 -8.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 13.735 -4.690 -9.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 13.038 -3.149 -9.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 14.416 -3.365 -8.588 1.00 0.00 H new ATOM 2272 N ILE A 152 10.649 -0.841 -1.938 1.00 0.00 N ATOM 2273 CA ILE A 152 10.879 0.247 -1.007 1.00 0.00 C ATOM 2274 C ILE A 152 12.388 0.346 -0.830 1.00 0.00 C ATOM 2275 O ILE A 152 12.957 -0.464 -0.104 1.00 0.00 O ATOM 2276 CB ILE A 152 10.213 -0.041 0.349 1.00 0.00 C ATOM 2277 CG1 ILE A 152 8.756 -0.496 0.197 1.00 0.00 C ATOM 2278 CG2 ILE A 152 10.313 1.220 1.211 1.00 0.00 C ATOM 2279 CD1 ILE A 152 8.006 -0.548 1.527 1.00 0.00 C ATOM 0 H ILE A 152 11.044 -1.726 -1.621 1.00 0.00 H new ATOM 0 HA ILE A 152 10.454 1.176 -1.386 1.00 0.00 H new ATOM 0 HB ILE A 152 10.735 -0.867 0.832 1.00 0.00 H new ATOM 0 HG12 ILE A 152 8.238 0.183 -0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 152 8.736 -1.483 -0.264 1.00 0.00 H new ATOM 0 HG21 ILE A 152 9.846 1.037 2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 152 11.362 1.478 1.357 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.803 2.044 0.712 1.00 0.00 H new ATOM 0 HD11 ILE A 152 6.981 -0.877 1.354 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.503 -1.248 2.198 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.998 0.444 1.979 1.00 0.00 H new ATOM 2291 N VAL A 153 13.048 1.296 -1.488 1.00 0.00 N ATOM 2292 CA VAL A 153 14.461 1.559 -1.276 1.00 0.00 C ATOM 2293 C VAL A 153 14.542 2.591 -0.158 1.00 0.00 C ATOM 2294 O VAL A 153 13.834 3.596 -0.209 1.00 0.00 O ATOM 2295 CB VAL A 153 15.123 2.126 -2.536 1.00 0.00 C ATOM 2296 CG1 VAL A 153 16.651 2.050 -2.374 1.00 0.00 C ATOM 2297 CG2 VAL A 153 14.715 1.365 -3.805 1.00 0.00 C ATOM 0 H VAL A 153 12.614 1.903 -2.183 1.00 0.00 H new ATOM 0 HA VAL A 153 14.981 0.634 -1.026 1.00 0.00 H new ATOM 0 HB VAL A 153 14.790 3.158 -2.650 1.00 0.00 H new ATOM 0 HG11 VAL A 153 17.132 2.451 -3.266 1.00 0.00 H new ATOM 0 HG12 VAL A 153 16.954 2.633 -1.505 1.00 0.00 H new ATOM 0 HG13 VAL A 153 16.951 1.011 -2.236 1.00 0.00 H new ATOM 0 HG21 VAL A 153 15.211 1.806 -4.669 1.00 0.00 H new ATOM 0 HG22 VAL A 153 15.009 0.319 -3.713 1.00 0.00 H new ATOM 0 HG23 VAL A 153 13.635 1.428 -3.936 1.00 0.00 H new ATOM 2307 N VAL A 154 15.395 2.362 0.838 1.00 0.00 N ATOM 2308 CA VAL A 154 15.540 3.257 1.971 1.00 0.00 C ATOM 2309 C VAL A 154 17.010 3.662 2.051 1.00 0.00 C ATOM 2310 O VAL A 154 17.873 2.788 2.062 1.00 0.00 O ATOM 2311 CB VAL A 154 15.059 2.550 3.244 1.00 0.00 C ATOM 2312 CG1 VAL A 154 15.056 3.545 4.406 1.00 0.00 C ATOM 2313 CG2 VAL A 154 13.642 1.987 3.093 1.00 0.00 C ATOM 0 H VAL A 154 16.005 1.546 0.877 1.00 0.00 H new ATOM 0 HA VAL A 154 14.933 4.155 1.859 1.00 0.00 H new ATOM 0 HB VAL A 154 15.742 1.721 3.432 1.00 0.00 H new ATOM 0 HG11 VAL A 154 14.714 3.045 5.312 1.00 0.00 H new ATOM 0 HG12 VAL A 154 16.065 3.927 4.561 1.00 0.00 H new ATOM 0 HG13 VAL A 154 14.386 4.373 4.174 1.00 0.00 H new ATOM 0 HG21 VAL A 154 13.345 1.496 4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 154 12.949 2.800 2.875 1.00 0.00 H new ATOM 0 HG23 VAL A 154 13.623 1.265 2.277 1.00 0.00 H new ATOM 2323 N LYS A 155 17.322 4.963 2.073 1.00 0.00 N ATOM 2324 CA LYS A 155 18.710 5.426 2.104 1.00 0.00 C ATOM 2325 C LYS A 155 18.867 6.642 3.008 1.00 0.00 C ATOM 2326 O LYS A 155 17.880 7.251 3.412 1.00 0.00 O ATOM 2327 CB LYS A 155 19.214 5.752 0.691 1.00 0.00 C ATOM 2328 CG LYS A 155 18.964 4.624 -0.321 1.00 0.00 C ATOM 2329 CD LYS A 155 19.534 4.938 -1.714 1.00 0.00 C ATOM 2330 CE LYS A 155 21.061 5.088 -1.752 1.00 0.00 C ATOM 2331 NZ LYS A 155 21.749 3.905 -1.205 1.00 0.00 N ATOM 0 H LYS A 155 16.630 5.712 2.070 1.00 0.00 H new ATOM 0 HA LYS A 155 19.314 4.615 2.511 1.00 0.00 H new ATOM 0 HB2 LYS A 155 18.725 6.660 0.339 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.283 5.961 0.734 1.00 0.00 H new ATOM 0 HG2 LYS A 155 19.412 3.702 0.051 1.00 0.00 H new ATOM 0 HG3 LYS A 155 17.892 4.447 -0.403 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.241 4.144 -2.401 1.00 0.00 H new ATOM 0 HD3 LYS A 155 19.081 5.859 -2.080 1.00 0.00 H new ATOM 0 HE2 LYS A 155 21.383 5.251 -2.781 1.00 0.00 H new ATOM 0 HE3 LYS A 155 21.352 5.971 -1.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 22.774 3.998 -1.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 21.556 3.832 -0.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 21.403 3.050 -1.685 1.00 0.00 H new