USER MOD reduce.3.24.130724 H: found=0, std=0, add=883, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 885 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: B 255 THR OG1 : rot 117:sc= 0.31 USER MOD Set 1.2: B 257 SER OG : rot 180:sc= 0.295 USER MOD Set 2.1: B 222 THR OG1 : rot -160:sc= -2.14 USER MOD Set 2.2: B 225 ASN : amide:sc= -0.15 K(o=-2.3,f=-3!) USER MOD Set 3.1: B 207 THR OG1 : rot 169:sc= -0.556 USER MOD Set 3.2: B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot -94:sc= 0.102 USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 74 TYR OH : rot 112:sc= -1.37! USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 150:sc= -0.181 (180deg=-0.922) USER MOD Single : A 89 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.0203) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 201 MET CE :methyl 162:sc= -0.663 (180deg=-1.36) USER MOD Single : B 202 GLN :FLIP amide:sc= -0.0487 F(o=-1.2!,f=-0.049) USER MOD Single : B 206 LYS NZ :NH3+ -129:sc= -1.56 (180deg=-3.63!) USER MOD Single : B 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 212 THR OG1 : rot 180:sc= 0 USER MOD Single : B 214 THR OG1 : rot 180:sc= 0 USER MOD Single : B 220 SER OG : rot 180:sc= 0 USER MOD Single : B 227 LYS NZ :NH3+ -159:sc= 0.468 (180deg=0.302) USER MOD Single : B 229 LYS NZ :NH3+ -132:sc= 0.113 (180deg=-0.0223) USER MOD Single : B 231 GLN :FLIP amide:sc= -0.236 F(o=-1.8,f=-0.24) USER MOD Single : B 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 GLN :FLIP amide:sc= -1.78! C(o=-2.9!,f=-1.8!) USER MOD Single : B 241 GLN : amide:sc= -4.62! C(o=-4.6!,f=-7.9!) USER MOD Single : B 248 LYS NZ :NH3+ -155:sc= -0.965! (180deg=-1.19!) USER MOD Single : B 249 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : B 259 TYR OH : rot 37:sc= -0.382 USER MOD Single : B 260 ASN : amide:sc= -1.69! C(o=-1.7!,f=-3.9!) USER MOD Single : B 262 GLN : amide:sc= -0.028 X(o=-0.028,f=-0.42) USER MOD Single : B 263 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.105) USER MOD Single : B 265 SER OG : rot 90:sc= 0.328 USER MOD Single : B 266 THR OG1 : rot 180:sc= 0 USER MOD Single : B 268 HIS : no HD1:sc= -1.47 K(o=-1.5,f=-2) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 61 -15.339 -0.225 4.238 1.00 0.00 N ATOM 2 CA LYS A 61 -14.971 -1.655 4.026 1.00 0.00 C ATOM 3 C LYS A 61 -13.813 -1.767 3.035 1.00 0.00 C ATOM 4 O LYS A 61 -13.951 -1.500 1.858 1.00 0.00 O ATOM 5 CB LYS A 61 -16.180 -2.425 3.496 1.00 0.00 C ATOM 6 CG LYS A 61 -16.529 -3.557 4.465 1.00 0.00 C ATOM 7 CD LYS A 61 -15.423 -4.618 4.447 1.00 0.00 C ATOM 8 CE LYS A 61 -16.050 -6.010 4.339 1.00 0.00 C ATOM 9 NZ LYS A 61 -14.974 -7.030 4.188 1.00 0.00 N ATOM 0 HA LYS A 61 -14.658 -2.081 4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -17.031 -1.754 3.383 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.961 -2.832 2.509 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.648 -3.161 5.473 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.481 -4.007 4.185 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -14.752 -4.444 3.606 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -14.823 -4.548 5.354 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -16.645 -6.222 5.227 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -16.726 -6.050 3.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -15.400 -7.976 4.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -14.424 -6.830 3.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -14.345 -6.997 5.016 1.00 0.00 H new ATOM 23 N ILE A 62 -12.665 -2.152 3.525 1.00 0.00 N ATOM 24 CA ILE A 62 -11.471 -2.279 2.643 1.00 0.00 C ATOM 25 C ILE A 62 -10.977 -3.729 2.620 1.00 0.00 C ATOM 26 O ILE A 62 -10.842 -4.370 3.643 1.00 0.00 O ATOM 27 CB ILE A 62 -10.357 -1.378 3.172 1.00 0.00 C ATOM 28 CG1 ILE A 62 -10.920 0.023 3.428 1.00 0.00 C ATOM 29 CG2 ILE A 62 -9.237 -1.298 2.131 1.00 0.00 C ATOM 30 CD1 ILE A 62 -9.844 0.898 4.077 1.00 0.00 C ATOM 0 H ILE A 62 -12.503 -2.385 4.505 1.00 0.00 H new ATOM 0 HA ILE A 62 -11.745 -1.982 1.631 1.00 0.00 H new ATOM 0 HB ILE A 62 -9.961 -1.786 4.102 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.250 0.470 2.490 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -11.794 -0.038 4.077 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -8.439 -0.656 2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -8.842 -2.297 1.944 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -9.632 -0.885 1.203 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -10.246 1.895 4.259 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -9.535 0.453 5.023 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -8.983 0.970 3.412 1.00 0.00 H new ATOM 42 N THR A 63 -10.686 -4.235 1.453 1.00 0.00 N ATOM 43 CA THR A 63 -10.176 -5.630 1.331 1.00 0.00 C ATOM 44 C THR A 63 -8.741 -5.575 0.805 1.00 0.00 C ATOM 45 O THR A 63 -8.466 -4.939 -0.194 1.00 0.00 O ATOM 46 CB THR A 63 -11.052 -6.414 0.350 1.00 0.00 C ATOM 47 OG1 THR A 63 -12.407 -6.347 0.770 1.00 0.00 O ATOM 48 CG2 THR A 63 -10.600 -7.874 0.313 1.00 0.00 C ATOM 0 H THR A 63 -10.781 -3.735 0.569 1.00 0.00 H new ATOM 0 HA THR A 63 -10.202 -6.125 2.302 1.00 0.00 H new ATOM 0 HB THR A 63 -10.958 -5.982 -0.646 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.969 -6.847 0.142 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.225 -8.431 -0.386 1.00 0.00 H new ATOM 0 HG22 THR A 63 -9.560 -7.925 -0.010 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.693 -8.309 1.308 1.00 0.00 H new ATOM 56 N PHE A 64 -7.820 -6.216 1.479 1.00 0.00 N ATOM 57 CA PHE A 64 -6.400 -6.177 1.026 1.00 0.00 C ATOM 58 C PHE A 64 -5.943 -7.577 0.566 1.00 0.00 C ATOM 59 O PHE A 64 -6.191 -8.558 1.240 1.00 0.00 O ATOM 60 CB PHE A 64 -5.516 -5.742 2.200 1.00 0.00 C ATOM 61 CG PHE A 64 -5.907 -4.357 2.663 1.00 0.00 C ATOM 62 CD1 PHE A 64 -5.607 -3.243 1.871 1.00 0.00 C ATOM 63 CD2 PHE A 64 -6.558 -4.188 3.890 1.00 0.00 C ATOM 64 CE1 PHE A 64 -5.958 -1.958 2.306 1.00 0.00 C ATOM 65 CE2 PHE A 64 -6.911 -2.904 4.325 1.00 0.00 C ATOM 66 CZ PHE A 64 -6.611 -1.790 3.533 1.00 0.00 C ATOM 0 H PHE A 64 -7.991 -6.764 2.322 1.00 0.00 H new ATOM 0 HA PHE A 64 -6.314 -5.477 0.195 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -5.617 -6.450 3.022 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -4.469 -5.750 1.899 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.105 -3.374 0.924 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -6.788 -5.048 4.502 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -5.725 -1.098 1.695 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.415 -2.774 5.271 1.00 0.00 H new ATOM 0 HZ PHE A 64 -6.883 -0.800 3.868 1.00 0.00 H new ATOM 76 N PRO A 65 -5.245 -7.674 -0.550 1.00 0.00 N ATOM 77 CA PRO A 65 -4.718 -8.978 -1.057 1.00 0.00 C ATOM 78 C PRO A 65 -4.010 -9.798 0.030 1.00 0.00 C ATOM 79 O PRO A 65 -3.673 -9.301 1.086 1.00 0.00 O ATOM 80 CB PRO A 65 -3.699 -8.572 -2.119 1.00 0.00 C ATOM 81 CG PRO A 65 -4.125 -7.230 -2.602 1.00 0.00 C ATOM 82 CD PRO A 65 -4.898 -6.565 -1.463 1.00 0.00 C ATOM 0 HA PRO A 65 -5.528 -9.608 -1.424 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.693 -8.535 -1.701 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.679 -9.293 -2.936 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.260 -6.629 -2.882 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -4.751 -7.321 -3.490 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.292 -5.812 -0.959 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.791 -6.061 -1.832 1.00 0.00 H new ATOM 90 N SER A 66 -3.785 -11.054 -0.238 1.00 0.00 N ATOM 91 CA SER A 66 -3.102 -11.942 0.748 1.00 0.00 C ATOM 92 C SER A 66 -1.632 -11.536 0.917 1.00 0.00 C ATOM 93 O SER A 66 -0.915 -12.127 1.699 1.00 0.00 O ATOM 94 CB SER A 66 -3.169 -13.387 0.255 1.00 0.00 C ATOM 95 OG SER A 66 -3.265 -13.397 -1.163 1.00 0.00 O ATOM 0 H SER A 66 -4.049 -11.511 -1.111 1.00 0.00 H new ATOM 0 HA SER A 66 -3.605 -11.847 1.710 1.00 0.00 H new ATOM 0 HB2 SER A 66 -2.282 -13.934 0.574 1.00 0.00 H new ATOM 0 HB3 SER A 66 -4.030 -13.893 0.693 1.00 0.00 H new ATOM 0 HG SER A 66 -4.208 -13.444 -1.427 1.00 0.00 H new ATOM 101 N ASP A 67 -1.171 -10.548 0.192 1.00 0.00 N ATOM 102 CA ASP A 67 0.262 -10.130 0.327 1.00 0.00 C ATOM 103 C ASP A 67 0.341 -8.650 0.716 1.00 0.00 C ATOM 104 O ASP A 67 1.404 -8.065 0.747 1.00 0.00 O ATOM 105 CB ASP A 67 0.983 -10.342 -1.006 1.00 0.00 C ATOM 106 CG ASP A 67 1.199 -11.838 -1.239 1.00 0.00 C ATOM 107 OD1 ASP A 67 1.850 -12.459 -0.413 1.00 0.00 O ATOM 108 OD2 ASP A 67 0.711 -12.339 -2.239 1.00 0.00 O ATOM 0 H ASP A 67 -1.719 -10.015 -0.483 1.00 0.00 H new ATOM 0 HA ASP A 67 0.737 -10.731 1.102 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.396 -9.918 -1.820 1.00 0.00 H new ATOM 0 HB3 ASP A 67 1.941 -9.822 -1.000 1.00 0.00 H new ATOM 113 N ILE A 68 -0.777 -8.042 0.999 1.00 0.00 N ATOM 114 CA ILE A 68 -0.771 -6.597 1.375 1.00 0.00 C ATOM 115 C ILE A 68 -1.124 -6.420 2.852 1.00 0.00 C ATOM 116 O ILE A 68 -2.100 -6.953 3.342 1.00 0.00 O ATOM 117 CB ILE A 68 -1.796 -5.853 0.518 1.00 0.00 C ATOM 118 CG1 ILE A 68 -1.335 -5.817 -0.949 1.00 0.00 C ATOM 119 CG2 ILE A 68 -1.972 -4.424 1.040 1.00 0.00 C ATOM 120 CD1 ILE A 68 0.046 -5.160 -1.068 1.00 0.00 C ATOM 0 H ILE A 68 -1.697 -8.482 0.987 1.00 0.00 H new ATOM 0 HA ILE A 68 0.227 -6.194 1.205 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.750 -6.377 0.577 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.297 -6.831 -1.348 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.059 -5.265 -1.549 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.703 -3.900 0.425 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.321 -4.454 2.072 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.017 -3.900 0.995 1.00 0.00 H new ATOM 0 HD11 ILE A 68 0.353 -5.145 -2.114 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.003 -4.139 -0.689 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.771 -5.729 -0.485 1.00 0.00 H new ATOM 132 N ASP A 69 -0.331 -5.661 3.556 1.00 0.00 N ATOM 133 CA ASP A 69 -0.603 -5.421 5.001 1.00 0.00 C ATOM 134 C ASP A 69 -1.271 -4.045 5.164 1.00 0.00 C ATOM 135 O ASP A 69 -0.890 -3.093 4.511 1.00 0.00 O ATOM 136 CB ASP A 69 0.719 -5.444 5.773 1.00 0.00 C ATOM 137 CG ASP A 69 0.476 -5.016 7.221 1.00 0.00 C ATOM 138 OD1 ASP A 69 0.286 -3.832 7.445 1.00 0.00 O ATOM 139 OD2 ASP A 69 0.482 -5.881 8.082 1.00 0.00 O ATOM 0 H ASP A 69 0.499 -5.194 3.190 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.263 -6.196 5.389 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.150 -6.445 5.747 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.439 -4.775 5.301 1.00 0.00 H new ATOM 144 N PRO A 70 -2.257 -3.931 6.024 1.00 0.00 N ATOM 145 CA PRO A 70 -2.972 -2.637 6.259 1.00 0.00 C ATOM 146 C PRO A 70 -2.098 -1.615 6.993 1.00 0.00 C ATOM 147 O PRO A 70 -2.031 -0.456 6.637 1.00 0.00 O ATOM 148 CB PRO A 70 -4.163 -3.028 7.138 1.00 0.00 C ATOM 149 CG PRO A 70 -3.761 -4.296 7.812 1.00 0.00 C ATOM 150 CD PRO A 70 -2.801 -5.011 6.865 1.00 0.00 C ATOM 0 HA PRO A 70 -3.255 -2.162 5.319 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -4.385 -2.249 7.867 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -5.063 -3.170 6.539 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.280 -4.090 8.768 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -4.633 -4.916 8.021 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -2.012 -5.527 7.412 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -3.317 -5.762 6.266 1.00 0.00 H new ATOM 158 N GLN A 71 -1.437 -2.053 8.027 1.00 0.00 N ATOM 159 CA GLN A 71 -0.565 -1.143 8.823 1.00 0.00 C ATOM 160 C GLN A 71 0.336 -0.312 7.905 1.00 0.00 C ATOM 161 O GLN A 71 0.444 0.888 8.059 1.00 0.00 O ATOM 162 CB GLN A 71 0.309 -1.987 9.751 1.00 0.00 C ATOM 163 CG GLN A 71 0.947 -1.091 10.811 1.00 0.00 C ATOM 164 CD GLN A 71 1.990 -1.893 11.591 1.00 0.00 C ATOM 165 OE1 GLN A 71 1.847 -3.087 11.769 1.00 0.00 O ATOM 166 NE2 GLN A 71 3.041 -1.285 12.067 1.00 0.00 N ATOM 0 H GLN A 71 -1.464 -3.017 8.360 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.194 -0.465 9.399 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.292 -2.761 10.229 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.083 -2.494 9.176 1.00 0.00 H new ATOM 0 HG2 GLN A 71 1.415 -0.227 10.339 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.183 -0.710 11.489 1.00 0.00 H new ATOM 0 HE21 GLN A 71 3.162 -0.283 11.918 1.00 0.00 H new ATOM 0 HE22 GLN A 71 3.742 -1.811 12.588 1.00 0.00 H new ATOM 175 N VAL A 72 0.997 -0.927 6.967 1.00 0.00 N ATOM 176 CA VAL A 72 1.898 -0.144 6.072 1.00 0.00 C ATOM 177 C VAL A 72 1.090 0.594 5.002 1.00 0.00 C ATOM 178 O VAL A 72 1.518 1.606 4.485 1.00 0.00 O ATOM 179 CB VAL A 72 2.885 -1.086 5.381 1.00 0.00 C ATOM 180 CG1 VAL A 72 3.828 -0.265 4.501 1.00 0.00 C ATOM 181 CG2 VAL A 72 3.697 -1.838 6.434 1.00 0.00 C ATOM 0 H VAL A 72 0.955 -1.929 6.780 1.00 0.00 H new ATOM 0 HA VAL A 72 2.435 0.583 6.681 1.00 0.00 H new ATOM 0 HB VAL A 72 2.339 -1.803 4.767 1.00 0.00 H new ATOM 0 HG11 VAL A 72 4.535 -0.931 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 72 3.249 0.273 3.751 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.374 0.448 5.119 1.00 0.00 H new ATOM 0 HG21 VAL A 72 4.400 -2.509 5.940 1.00 0.00 H new ATOM 0 HG22 VAL A 72 4.246 -1.124 7.048 1.00 0.00 H new ATOM 0 HG23 VAL A 72 3.025 -2.418 7.066 1.00 0.00 H new ATOM 191 N PHE A 73 -0.058 0.091 4.645 1.00 0.00 N ATOM 192 CA PHE A 73 -0.867 0.760 3.586 1.00 0.00 C ATOM 193 C PHE A 73 -1.347 2.137 4.053 1.00 0.00 C ATOM 194 O PHE A 73 -1.164 3.130 3.376 1.00 0.00 O ATOM 195 CB PHE A 73 -2.080 -0.116 3.265 1.00 0.00 C ATOM 196 CG PHE A 73 -2.660 0.292 1.936 1.00 0.00 C ATOM 197 CD1 PHE A 73 -1.897 0.164 0.771 1.00 0.00 C ATOM 198 CD2 PHE A 73 -3.962 0.801 1.868 1.00 0.00 C ATOM 199 CE1 PHE A 73 -2.433 0.550 -0.459 1.00 0.00 C ATOM 200 CE2 PHE A 73 -4.499 1.182 0.634 1.00 0.00 C ATOM 201 CZ PHE A 73 -3.729 1.057 -0.529 1.00 0.00 C ATOM 0 H PHE A 73 -0.472 -0.754 5.040 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.247 0.894 2.700 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -1.787 -1.165 3.238 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -2.832 -0.015 4.048 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.894 -0.233 0.823 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.551 0.899 2.768 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.842 0.455 -1.358 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.505 1.572 0.578 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.141 1.354 -1.482 1.00 0.00 H new ATOM 211 N TYR A 74 -1.978 2.203 5.189 1.00 0.00 N ATOM 212 CA TYR A 74 -2.485 3.517 5.672 1.00 0.00 C ATOM 213 C TYR A 74 -1.316 4.480 5.896 1.00 0.00 C ATOM 214 O TYR A 74 -1.499 5.680 5.954 1.00 0.00 O ATOM 215 CB TYR A 74 -3.271 3.331 6.973 1.00 0.00 C ATOM 216 CG TYR A 74 -4.468 2.442 6.722 1.00 0.00 C ATOM 217 CD1 TYR A 74 -5.441 2.811 5.780 1.00 0.00 C ATOM 218 CD2 TYR A 74 -4.605 1.244 7.432 1.00 0.00 C ATOM 219 CE1 TYR A 74 -6.545 1.981 5.552 1.00 0.00 C ATOM 220 CE2 TYR A 74 -5.709 0.416 7.204 1.00 0.00 C ATOM 221 CZ TYR A 74 -6.680 0.783 6.265 1.00 0.00 C ATOM 222 OH TYR A 74 -7.767 -0.036 6.039 1.00 0.00 O ATOM 0 H TYR A 74 -2.165 1.410 5.802 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.149 3.938 4.917 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.631 2.888 7.736 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.598 4.299 7.353 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.338 3.735 5.231 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.857 0.958 8.157 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -7.293 2.264 4.826 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -5.812 -0.508 7.753 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.469 -0.864 5.607 1.00 0.00 H new ATOM 232 N GLU A 75 -0.118 3.980 6.012 1.00 0.00 N ATOM 233 CA GLU A 75 1.044 4.891 6.221 1.00 0.00 C ATOM 234 C GLU A 75 1.488 5.474 4.874 1.00 0.00 C ATOM 235 O GLU A 75 2.356 6.322 4.810 1.00 0.00 O ATOM 236 CB GLU A 75 2.200 4.106 6.847 1.00 0.00 C ATOM 237 CG GLU A 75 1.936 3.918 8.342 1.00 0.00 C ATOM 238 CD GLU A 75 3.142 3.242 8.996 1.00 0.00 C ATOM 239 OE1 GLU A 75 4.049 2.864 8.273 1.00 0.00 O ATOM 240 OE2 GLU A 75 3.140 3.115 10.210 1.00 0.00 O ATOM 0 H GLU A 75 0.107 2.986 5.972 1.00 0.00 H new ATOM 0 HA GLU A 75 0.754 5.703 6.887 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.302 3.136 6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.139 4.638 6.696 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.748 4.883 8.812 1.00 0.00 H new ATOM 0 HG3 GLU A 75 1.042 3.312 8.490 1.00 0.00 H new ATOM 247 N LEU A 76 0.902 5.025 3.795 1.00 0.00 N ATOM 248 CA LEU A 76 1.293 5.549 2.452 1.00 0.00 C ATOM 249 C LEU A 76 0.430 6.766 2.098 1.00 0.00 C ATOM 250 O LEU A 76 -0.696 6.878 2.538 1.00 0.00 O ATOM 251 CB LEU A 76 1.065 4.456 1.406 1.00 0.00 C ATOM 252 CG LEU A 76 2.042 3.304 1.645 1.00 0.00 C ATOM 253 CD1 LEU A 76 1.742 2.170 0.666 1.00 0.00 C ATOM 254 CD2 LEU A 76 3.475 3.795 1.429 1.00 0.00 C ATOM 0 H LEU A 76 0.168 4.317 3.786 1.00 0.00 H new ATOM 0 HA LEU A 76 2.343 5.842 2.469 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.039 4.093 1.462 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.205 4.863 0.404 1.00 0.00 H new ATOM 0 HG LEU A 76 1.932 2.942 2.667 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.438 1.349 0.836 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.722 1.818 0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.852 2.533 -0.356 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.171 2.973 1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.585 4.158 0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.691 4.604 2.126 1.00 0.00 H new ATOM 266 N PRO A 77 0.946 7.671 1.299 1.00 0.00 N ATOM 267 CA PRO A 77 0.192 8.888 0.879 1.00 0.00 C ATOM 268 C PRO A 77 -1.141 8.532 0.210 1.00 0.00 C ATOM 269 O PRO A 77 -1.315 7.450 -0.313 1.00 0.00 O ATOM 270 CB PRO A 77 1.121 9.596 -0.117 1.00 0.00 C ATOM 271 CG PRO A 77 2.185 8.606 -0.466 1.00 0.00 C ATOM 272 CD PRO A 77 2.293 7.645 0.711 1.00 0.00 C ATOM 0 HA PRO A 77 -0.065 9.513 1.735 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.573 9.909 -1.006 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.554 10.494 0.324 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.930 8.070 -1.381 1.00 0.00 H new ATOM 0 HG3 PRO A 77 3.136 9.107 -0.645 1.00 0.00 H new ATOM 0 HD2 PRO A 77 2.570 6.642 0.386 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.049 7.969 1.426 1.00 0.00 H new ATOM 280 N GLU A 78 -2.081 9.436 0.228 1.00 0.00 N ATOM 281 CA GLU A 78 -3.405 9.159 -0.400 1.00 0.00 C ATOM 282 C GLU A 78 -3.256 8.941 -1.911 1.00 0.00 C ATOM 283 O GLU A 78 -3.728 7.962 -2.451 1.00 0.00 O ATOM 284 CB GLU A 78 -4.341 10.344 -0.151 1.00 0.00 C ATOM 285 CG GLU A 78 -5.747 10.003 -0.648 1.00 0.00 C ATOM 286 CD GLU A 78 -6.736 11.054 -0.139 1.00 0.00 C ATOM 287 OE1 GLU A 78 -6.465 12.230 -0.318 1.00 0.00 O ATOM 288 OE2 GLU A 78 -7.747 10.664 0.422 1.00 0.00 O ATOM 0 H GLU A 78 -1.989 10.359 0.652 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.818 8.254 0.044 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.368 10.581 0.913 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.968 11.229 -0.666 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.762 9.972 -1.737 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.039 9.013 -0.297 1.00 0.00 H new ATOM 295 N ALA A 79 -2.623 9.852 -2.601 1.00 0.00 N ATOM 296 CA ALA A 79 -2.474 9.700 -4.080 1.00 0.00 C ATOM 297 C ALA A 79 -1.999 8.286 -4.425 1.00 0.00 C ATOM 298 O ALA A 79 -2.515 7.649 -5.324 1.00 0.00 O ATOM 299 CB ALA A 79 -1.463 10.723 -4.601 1.00 0.00 C ATOM 0 H ALA A 79 -2.203 10.694 -2.207 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.442 9.870 -4.551 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.355 10.611 -5.680 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.814 11.730 -4.374 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -0.498 10.558 -4.121 1.00 0.00 H new ATOM 305 N VAL A 80 -1.044 7.774 -3.702 1.00 0.00 N ATOM 306 CA VAL A 80 -0.566 6.393 -3.982 1.00 0.00 C ATOM 307 C VAL A 80 -1.606 5.403 -3.466 1.00 0.00 C ATOM 308 O VAL A 80 -1.799 4.339 -4.017 1.00 0.00 O ATOM 309 CB VAL A 80 0.764 6.158 -3.265 1.00 0.00 C ATOM 310 CG1 VAL A 80 1.222 4.718 -3.497 1.00 0.00 C ATOM 311 CG2 VAL A 80 1.816 7.122 -3.819 1.00 0.00 C ATOM 0 H VAL A 80 -0.575 8.250 -2.932 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.423 6.258 -5.054 1.00 0.00 H new ATOM 0 HB VAL A 80 0.637 6.330 -2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.170 4.551 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.472 4.030 -3.105 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.350 4.545 -4.565 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.765 6.957 -3.309 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.942 6.948 -4.888 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.490 8.149 -3.655 1.00 0.00 H new ATOM 321 N GLN A 81 -2.291 5.761 -2.419 1.00 0.00 N ATOM 322 CA GLN A 81 -3.338 4.860 -1.869 1.00 0.00 C ATOM 323 C GLN A 81 -4.398 4.619 -2.946 1.00 0.00 C ATOM 324 O GLN A 81 -4.758 3.497 -3.244 1.00 0.00 O ATOM 325 CB GLN A 81 -3.986 5.531 -0.652 1.00 0.00 C ATOM 326 CG GLN A 81 -4.735 4.488 0.179 1.00 0.00 C ATOM 327 CD GLN A 81 -5.058 5.062 1.558 1.00 0.00 C ATOM 328 OE1 GLN A 81 -5.800 6.018 1.676 1.00 0.00 O ATOM 329 NE2 GLN A 81 -4.527 4.512 2.617 1.00 0.00 N ATOM 0 H GLN A 81 -2.171 6.642 -1.919 1.00 0.00 H new ATOM 0 HA GLN A 81 -2.897 3.910 -1.569 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -3.222 6.014 -0.043 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -4.674 6.311 -0.979 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -5.655 4.197 -0.329 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -4.129 3.588 0.282 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.905 3.710 2.517 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.735 4.884 3.544 1.00 0.00 H new ATOM 338 N LYS A 82 -4.898 5.673 -3.533 1.00 0.00 N ATOM 339 CA LYS A 82 -5.934 5.528 -4.594 1.00 0.00 C ATOM 340 C LYS A 82 -5.408 4.649 -5.730 1.00 0.00 C ATOM 341 O LYS A 82 -6.077 3.741 -6.183 1.00 0.00 O ATOM 342 CB LYS A 82 -6.275 6.910 -5.160 1.00 0.00 C ATOM 343 CG LYS A 82 -6.655 7.856 -4.019 1.00 0.00 C ATOM 344 CD LYS A 82 -7.855 7.291 -3.259 1.00 0.00 C ATOM 345 CE LYS A 82 -8.546 8.418 -2.490 1.00 0.00 C ATOM 346 NZ LYS A 82 -9.140 9.386 -3.455 1.00 0.00 N ATOM 0 H LYS A 82 -4.631 6.634 -3.321 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.821 5.067 -4.160 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.422 7.310 -5.708 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.099 6.830 -5.869 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.810 7.982 -3.342 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.895 8.842 -4.416 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -8.555 6.828 -3.955 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.529 6.512 -2.570 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -9.323 8.009 -1.844 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -7.829 8.925 -1.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -9.983 9.824 -3.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -8.443 10.124 -3.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -9.409 8.886 -4.327 1.00 0.00 H new ATOM 360 N GLU A 83 -4.225 4.921 -6.213 1.00 0.00 N ATOM 361 CA GLU A 83 -3.678 4.107 -7.340 1.00 0.00 C ATOM 362 C GLU A 83 -3.609 2.626 -6.952 1.00 0.00 C ATOM 363 O GLU A 83 -3.959 1.757 -7.729 1.00 0.00 O ATOM 364 CB GLU A 83 -2.273 4.597 -7.696 1.00 0.00 C ATOM 365 CG GLU A 83 -2.342 6.042 -8.191 1.00 0.00 C ATOM 366 CD GLU A 83 -0.970 6.470 -8.715 1.00 0.00 C ATOM 367 OE1 GLU A 83 -0.328 5.663 -9.367 1.00 0.00 O ATOM 368 OE2 GLU A 83 -0.584 7.597 -8.456 1.00 0.00 O ATOM 0 H GLU A 83 -3.616 5.668 -5.879 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.340 4.219 -8.199 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.623 4.532 -6.824 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.839 3.959 -8.466 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.088 6.132 -8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.655 6.700 -7.381 1.00 0.00 H new ATOM 375 N LEU A 84 -3.159 2.323 -5.767 1.00 0.00 N ATOM 376 CA LEU A 84 -3.068 0.892 -5.366 1.00 0.00 C ATOM 377 C LEU A 84 -4.476 0.313 -5.191 1.00 0.00 C ATOM 378 O LEU A 84 -4.732 -0.818 -5.551 1.00 0.00 O ATOM 379 CB LEU A 84 -2.258 0.775 -4.073 1.00 0.00 C ATOM 380 CG LEU A 84 -0.852 1.327 -4.328 1.00 0.00 C ATOM 381 CD1 LEU A 84 -0.039 1.322 -3.034 1.00 0.00 C ATOM 382 CD2 LEU A 84 -0.147 0.460 -5.374 1.00 0.00 C ATOM 0 H LEU A 84 -2.853 2.997 -5.065 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.560 0.321 -6.143 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.743 1.331 -3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.204 -0.266 -3.753 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.934 2.351 -4.691 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.958 1.717 -3.229 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.536 1.944 -2.290 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.042 0.302 -2.659 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.854 0.852 -5.557 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.075 -0.564 -5.009 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.717 0.475 -6.303 1.00 0.00 H new ATOM 394 N LEU A 85 -5.401 1.076 -4.673 1.00 0.00 N ATOM 395 CA LEU A 85 -6.787 0.544 -4.525 1.00 0.00 C ATOM 396 C LEU A 85 -7.418 0.417 -5.913 1.00 0.00 C ATOM 397 O LEU A 85 -8.149 -0.513 -6.189 1.00 0.00 O ATOM 398 CB LEU A 85 -7.633 1.489 -3.665 1.00 0.00 C ATOM 399 CG LEU A 85 -7.307 1.282 -2.187 1.00 0.00 C ATOM 400 CD1 LEU A 85 -7.819 2.474 -1.377 1.00 0.00 C ATOM 401 CD2 LEU A 85 -7.984 0.003 -1.683 1.00 0.00 C ATOM 0 H LEU A 85 -5.260 2.033 -4.349 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.748 -0.430 -4.038 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -7.438 2.524 -3.948 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.693 1.304 -3.842 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.227 1.194 -2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.586 2.325 -0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.338 3.387 -1.729 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.898 2.561 -1.501 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.749 -0.142 -0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.064 0.090 -1.806 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.621 -0.851 -2.256 1.00 0.00 H new ATOM 413 N ALA A 86 -7.138 1.341 -6.792 1.00 0.00 N ATOM 414 CA ALA A 86 -7.722 1.265 -8.161 1.00 0.00 C ATOM 415 C ALA A 86 -7.257 -0.030 -8.830 1.00 0.00 C ATOM 416 O ALA A 86 -7.968 -0.625 -9.614 1.00 0.00 O ATOM 417 CB ALA A 86 -7.257 2.466 -8.987 1.00 0.00 C ATOM 0 H ALA A 86 -6.532 2.143 -6.622 1.00 0.00 H new ATOM 0 HA ALA A 86 -8.810 1.276 -8.097 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.686 2.407 -9.987 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.584 3.387 -8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.169 2.460 -9.057 1.00 0.00 H new ATOM 423 N GLU A 87 -6.071 -0.477 -8.514 1.00 0.00 N ATOM 424 CA GLU A 87 -5.564 -1.744 -9.119 1.00 0.00 C ATOM 425 C GLU A 87 -6.251 -2.934 -8.441 1.00 0.00 C ATOM 426 O GLU A 87 -6.610 -3.904 -9.084 1.00 0.00 O ATOM 427 CB GLU A 87 -4.047 -1.836 -8.916 1.00 0.00 C ATOM 428 CG GLU A 87 -3.497 -3.073 -9.631 1.00 0.00 C ATOM 429 CD GLU A 87 -2.089 -3.375 -9.116 1.00 0.00 C ATOM 430 OE1 GLU A 87 -1.597 -2.607 -8.307 1.00 0.00 O ATOM 431 OE2 GLU A 87 -1.527 -4.372 -9.539 1.00 0.00 O ATOM 0 H GLU A 87 -5.431 -0.020 -7.864 1.00 0.00 H new ATOM 0 HA GLU A 87 -5.783 -1.757 -10.187 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.565 -0.938 -9.303 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -3.817 -1.888 -7.852 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -4.151 -3.928 -9.457 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.474 -2.904 -10.708 1.00 0.00 H new ATOM 438 N TRP A 88 -6.456 -2.867 -7.156 1.00 0.00 N ATOM 439 CA TRP A 88 -7.135 -3.997 -6.466 1.00 0.00 C ATOM 440 C TRP A 88 -8.630 -3.929 -6.758 1.00 0.00 C ATOM 441 O TRP A 88 -9.348 -4.892 -6.593 1.00 0.00 O ATOM 442 CB TRP A 88 -6.901 -3.902 -4.958 1.00 0.00 C ATOM 443 CG TRP A 88 -5.431 -3.874 -4.661 1.00 0.00 C ATOM 444 CD1 TRP A 88 -4.454 -4.436 -5.419 1.00 0.00 C ATOM 445 CD2 TRP A 88 -4.758 -3.263 -3.526 1.00 0.00 C ATOM 446 NE1 TRP A 88 -3.233 -4.205 -4.817 1.00 0.00 N ATOM 447 CE2 TRP A 88 -3.367 -3.486 -3.650 1.00 0.00 C ATOM 448 CE3 TRP A 88 -5.218 -2.542 -2.412 1.00 0.00 C ATOM 449 CZ2 TRP A 88 -2.465 -3.011 -2.702 1.00 0.00 C ATOM 450 CZ3 TRP A 88 -4.312 -2.063 -1.453 1.00 0.00 C ATOM 451 CH2 TRP A 88 -2.938 -2.296 -1.599 1.00 0.00 C ATOM 0 H TRP A 88 -6.186 -2.086 -6.558 1.00 0.00 H new ATOM 0 HA TRP A 88 -6.730 -4.942 -6.827 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -7.376 -3.003 -4.565 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.364 -4.752 -4.457 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.607 -4.976 -6.342 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -2.341 -4.528 -5.191 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.275 -2.355 -2.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -1.407 -3.194 -2.818 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -4.676 -1.512 -0.598 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -2.245 -1.923 -0.859 1.00 0.00 H new ATOM 462 N LYS A 89 -9.105 -2.796 -7.199 1.00 0.00 N ATOM 463 CA LYS A 89 -10.553 -2.665 -7.514 1.00 0.00 C ATOM 464 C LYS A 89 -10.773 -2.978 -8.993 1.00 0.00 C ATOM 465 O LYS A 89 -11.669 -3.720 -9.348 1.00 0.00 O ATOM 466 CB LYS A 89 -11.026 -1.244 -7.210 1.00 0.00 C ATOM 467 CG LYS A 89 -11.033 -1.025 -5.696 1.00 0.00 C ATOM 468 CD LYS A 89 -11.114 0.473 -5.393 1.00 0.00 C ATOM 469 CE LYS A 89 -11.279 0.677 -3.886 1.00 0.00 C ATOM 470 NZ LYS A 89 -12.701 0.445 -3.504 1.00 0.00 N ATOM 0 H LYS A 89 -8.550 -1.954 -7.355 1.00 0.00 H new ATOM 0 HA LYS A 89 -11.123 -3.364 -6.902 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -10.369 -0.519 -7.691 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -12.025 -1.087 -7.616 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -11.881 -1.543 -5.248 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -10.131 -1.447 -5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -10.212 0.976 -5.743 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -11.954 0.918 -5.926 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.629 -0.009 -3.342 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -10.978 1.688 -3.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -12.999 1.169 -2.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -13.302 0.501 -4.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -12.796 -0.497 -3.074 1.00 0.00 H new ATOM 484 N ARG A 90 -9.966 -2.436 -9.864 1.00 0.00 N ATOM 485 CA ARG A 90 -10.150 -2.737 -11.309 1.00 0.00 C ATOM 486 C ARG A 90 -10.154 -4.254 -11.487 1.00 0.00 C ATOM 487 O ARG A 90 -10.934 -4.799 -12.240 1.00 0.00 O ATOM 488 CB ARG A 90 -9.013 -2.108 -12.126 1.00 0.00 C ATOM 489 CG ARG A 90 -7.766 -2.994 -12.074 1.00 0.00 C ATOM 490 CD ARG A 90 -6.588 -2.245 -12.700 1.00 0.00 C ATOM 491 NE ARG A 90 -6.786 -2.161 -14.176 1.00 0.00 N ATOM 492 CZ ARG A 90 -5.760 -1.998 -14.965 1.00 0.00 C ATOM 493 NH1 ARG A 90 -4.558 -1.913 -14.464 1.00 0.00 N ATOM 494 NH2 ARG A 90 -5.935 -1.923 -16.256 1.00 0.00 N ATOM 0 H ARG A 90 -9.196 -1.805 -9.640 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.093 -2.320 -11.662 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.330 -1.976 -13.160 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.780 -1.118 -11.735 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.537 -3.259 -11.042 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.945 -3.926 -12.610 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -6.511 -1.245 -12.274 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.654 -2.760 -12.475 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.725 -2.231 -14.569 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.420 -1.974 -13.455 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.756 -1.786 -15.081 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.874 -1.992 -16.648 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.133 -1.796 -16.873 1.00 0.00 H new ATOM 508 N THR A 91 -9.298 -4.944 -10.777 1.00 0.00 N ATOM 509 CA THR A 91 -9.266 -6.429 -10.884 1.00 0.00 C ATOM 510 C THR A 91 -10.158 -7.026 -9.790 1.00 0.00 C ATOM 511 O THR A 91 -10.823 -8.021 -9.996 1.00 0.00 O ATOM 512 CB THR A 91 -7.828 -6.922 -10.702 1.00 0.00 C ATOM 513 OG1 THR A 91 -7.699 -8.221 -11.261 1.00 0.00 O ATOM 514 CG2 THR A 91 -7.485 -6.968 -9.212 1.00 0.00 C ATOM 0 H THR A 91 -8.621 -4.541 -10.129 1.00 0.00 H new ATOM 0 HA THR A 91 -9.630 -6.738 -11.864 1.00 0.00 H new ATOM 0 HB THR A 91 -7.144 -6.240 -11.207 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.778 -8.537 -11.146 1.00 0.00 H new ATOM 0 HG21 THR A 91 -6.461 -7.319 -9.085 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.582 -5.970 -8.785 1.00 0.00 H new ATOM 0 HG23 THR A 91 -8.168 -7.648 -8.702 1.00 0.00 H new ATOM 522 N GLY A 92 -10.181 -6.424 -8.633 1.00 0.00 N ATOM 523 CA GLY A 92 -11.036 -6.957 -7.531 1.00 0.00 C ATOM 524 C GLY A 92 -12.396 -7.371 -8.096 1.00 0.00 C ATOM 525 O GLY A 92 -12.758 -8.531 -8.084 1.00 0.00 O ATOM 0 H GLY A 92 -9.646 -5.587 -8.402 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.550 -7.812 -7.060 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.166 -6.199 -6.758 1.00 0.00 H new TER 529 GLY A 92 ATOM 530 N MET B 201 25.088 6.367 7.297 1.00 0.00 N ATOM 531 CA MET B 201 23.796 6.280 8.038 1.00 0.00 C ATOM 532 C MET B 201 22.932 5.181 7.416 1.00 0.00 C ATOM 533 O MET B 201 22.830 5.070 6.211 1.00 0.00 O ATOM 534 CB MET B 201 23.073 7.627 7.953 1.00 0.00 C ATOM 535 CG MET B 201 22.492 7.824 6.554 1.00 0.00 C ATOM 536 SD MET B 201 22.309 9.598 6.238 1.00 0.00 S ATOM 537 CE MET B 201 21.541 9.474 4.605 1.00 0.00 C ATOM 0 HA MET B 201 23.983 6.040 9.085 1.00 0.00 H new ATOM 0 HB2 MET B 201 22.276 7.668 8.695 1.00 0.00 H new ATOM 0 HB3 MET B 201 23.766 8.436 8.185 1.00 0.00 H new ATOM 0 HG2 MET B 201 23.146 7.374 5.807 1.00 0.00 H new ATOM 0 HG3 MET B 201 21.526 7.325 6.473 1.00 0.00 H new ATOM 0 HE1 MET B 201 21.056 10.418 4.359 1.00 0.00 H new ATOM 0 HE2 MET B 201 22.305 9.253 3.859 1.00 0.00 H new ATOM 0 HE3 MET B 201 20.799 8.676 4.612 1.00 0.00 H new ATOM 547 N GLN B 202 22.320 4.359 8.225 1.00 0.00 N ATOM 548 CA GLN B 202 21.477 3.258 7.675 1.00 0.00 C ATOM 549 C GLN B 202 20.013 3.687 7.627 1.00 0.00 C ATOM 550 O GLN B 202 19.614 4.654 8.249 1.00 0.00 O ATOM 551 CB GLN B 202 21.616 2.016 8.556 1.00 0.00 C ATOM 552 CG GLN B 202 20.666 2.126 9.750 1.00 0.00 C ATOM 553 CD GLN B 202 21.184 1.257 10.899 1.00 0.00 C ATOM 554 OE1 GLN B 202 22.094 0.352 10.658 1.00 0.00 O flip ATOM 555 NE2 GLN B 202 20.755 1.401 12.026 1.00 0.00 N flip ATOM 0 H GLN B 202 22.367 4.402 9.243 1.00 0.00 H new ATOM 0 HA GLN B 202 21.813 3.029 6.664 1.00 0.00 H new ATOM 0 HB2 GLN B 202 21.388 1.120 7.978 1.00 0.00 H new ATOM 0 HB3 GLN B 202 22.644 1.918 8.904 1.00 0.00 H new ATOM 0 HG2 GLN B 202 20.589 3.164 10.072 1.00 0.00 H new ATOM 0 HG3 GLN B 202 19.665 1.807 9.462 1.00 0.00 H new ATOM 0 HE21 GLN B 202 20.044 2.108 12.215 1.00 0.00 H new ATOM 0 HE22 GLN B 202 21.106 0.815 12.784 1.00 0.00 H new ATOM 564 N ILE B 203 19.205 2.962 6.895 1.00 0.00 N ATOM 565 CA ILE B 203 17.761 3.310 6.798 1.00 0.00 C ATOM 566 C ILE B 203 16.934 2.022 6.707 1.00 0.00 C ATOM 567 O ILE B 203 17.331 1.063 6.073 1.00 0.00 O ATOM 568 CB ILE B 203 17.525 4.157 5.545 1.00 0.00 C ATOM 569 CG1 ILE B 203 18.045 3.406 4.314 1.00 0.00 C ATOM 570 CG2 ILE B 203 18.267 5.487 5.682 1.00 0.00 C ATOM 571 CD1 ILE B 203 16.866 2.806 3.546 1.00 0.00 C ATOM 0 H ILE B 203 19.488 2.141 6.359 1.00 0.00 H new ATOM 0 HA ILE B 203 17.461 3.875 7.680 1.00 0.00 H new ATOM 0 HB ILE B 203 16.458 4.346 5.430 1.00 0.00 H new ATOM 0 HG12 ILE B 203 18.604 4.085 3.670 1.00 0.00 H new ATOM 0 HG13 ILE B 203 18.733 2.617 4.620 1.00 0.00 H new ATOM 0 HG21 ILE B 203 18.099 6.091 4.790 1.00 0.00 H new ATOM 0 HG22 ILE B 203 17.897 6.022 6.557 1.00 0.00 H new ATOM 0 HG23 ILE B 203 19.334 5.298 5.797 1.00 0.00 H new ATOM 0 HD11 ILE B 203 17.236 2.272 2.671 1.00 0.00 H new ATOM 0 HD12 ILE B 203 16.326 2.114 4.192 1.00 0.00 H new ATOM 0 HD13 ILE B 203 16.195 3.604 3.228 1.00 0.00 H new ATOM 583 N PHE B 204 15.790 1.993 7.334 1.00 0.00 N ATOM 584 CA PHE B 204 14.935 0.770 7.287 1.00 0.00 C ATOM 585 C PHE B 204 13.907 0.901 6.160 1.00 0.00 C ATOM 586 O PHE B 204 13.395 1.969 5.898 1.00 0.00 O ATOM 587 CB PHE B 204 14.199 0.615 8.621 1.00 0.00 C ATOM 588 CG PHE B 204 15.151 0.882 9.761 1.00 0.00 C ATOM 589 CD1 PHE B 204 16.373 0.199 9.831 1.00 0.00 C ATOM 590 CD2 PHE B 204 14.810 1.811 10.750 1.00 0.00 C ATOM 591 CE1 PHE B 204 17.253 0.448 10.891 1.00 0.00 C ATOM 592 CE2 PHE B 204 15.690 2.059 11.811 1.00 0.00 C ATOM 593 CZ PHE B 204 16.910 1.378 11.881 1.00 0.00 C ATOM 0 H PHE B 204 15.408 2.766 7.879 1.00 0.00 H new ATOM 0 HA PHE B 204 15.564 -0.102 7.106 1.00 0.00 H new ATOM 0 HB2 PHE B 204 13.359 1.308 8.666 1.00 0.00 H new ATOM 0 HB3 PHE B 204 13.788 -0.391 8.706 1.00 0.00 H new ATOM 0 HD1 PHE B 204 16.635 -0.519 9.068 1.00 0.00 H new ATOM 0 HD2 PHE B 204 13.868 2.337 10.695 1.00 0.00 H new ATOM 0 HE1 PHE B 204 18.196 -0.076 10.945 1.00 0.00 H new ATOM 0 HE2 PHE B 204 15.427 2.776 12.575 1.00 0.00 H new ATOM 0 HZ PHE B 204 17.588 1.569 12.699 1.00 0.00 H new ATOM 603 N VAL B 205 13.607 -0.178 5.484 1.00 0.00 N ATOM 604 CA VAL B 205 12.616 -0.112 4.370 1.00 0.00 C ATOM 605 C VAL B 205 11.463 -1.081 4.648 1.00 0.00 C ATOM 606 O VAL B 205 11.617 -2.285 4.583 1.00 0.00 O ATOM 607 CB VAL B 205 13.310 -0.495 3.058 1.00 0.00 C ATOM 608 CG1 VAL B 205 12.367 -0.259 1.873 1.00 0.00 C ATOM 609 CG2 VAL B 205 14.564 0.364 2.883 1.00 0.00 C ATOM 0 H VAL B 205 14.005 -1.101 5.656 1.00 0.00 H new ATOM 0 HA VAL B 205 12.219 0.900 4.291 1.00 0.00 H new ATOM 0 HB VAL B 205 13.582 -1.550 3.093 1.00 0.00 H new ATOM 0 HG11 VAL B 205 12.871 -0.535 0.947 1.00 0.00 H new ATOM 0 HG12 VAL B 205 11.471 -0.868 1.994 1.00 0.00 H new ATOM 0 HG13 VAL B 205 12.087 0.794 1.835 1.00 0.00 H new ATOM 0 HG21 VAL B 205 15.062 0.096 1.951 1.00 0.00 H new ATOM 0 HG22 VAL B 205 14.283 1.417 2.854 1.00 0.00 H new ATOM 0 HG23 VAL B 205 15.242 0.192 3.719 1.00 0.00 H new ATOM 619 N LYS B 206 10.300 -0.560 4.945 1.00 0.00 N ATOM 620 CA LYS B 206 9.130 -1.447 5.211 1.00 0.00 C ATOM 621 C LYS B 206 8.311 -1.573 3.923 1.00 0.00 C ATOM 622 O LYS B 206 7.960 -0.588 3.303 1.00 0.00 O ATOM 623 CB LYS B 206 8.269 -0.853 6.334 1.00 0.00 C ATOM 624 CG LYS B 206 8.136 0.658 6.147 1.00 0.00 C ATOM 625 CD LYS B 206 7.112 1.212 7.141 1.00 0.00 C ATOM 626 CE LYS B 206 7.490 0.791 8.563 1.00 0.00 C ATOM 627 NZ LYS B 206 6.907 -0.549 8.854 1.00 0.00 N ATOM 0 H LYS B 206 10.111 0.440 5.015 1.00 0.00 H new ATOM 0 HA LYS B 206 9.472 -2.433 5.526 1.00 0.00 H new ATOM 0 HB2 LYS B 206 7.282 -1.316 6.331 1.00 0.00 H new ATOM 0 HB3 LYS B 206 8.720 -1.070 7.302 1.00 0.00 H new ATOM 0 HG2 LYS B 206 9.102 1.139 6.299 1.00 0.00 H new ATOM 0 HG3 LYS B 206 7.825 0.882 5.127 1.00 0.00 H new ATOM 0 HD2 LYS B 206 7.075 2.299 7.071 1.00 0.00 H new ATOM 0 HD3 LYS B 206 6.116 0.843 6.895 1.00 0.00 H new ATOM 0 HE2 LYS B 206 8.574 0.759 8.668 1.00 0.00 H new ATOM 0 HE3 LYS B 206 7.122 1.524 9.281 1.00 0.00 H new ATOM 0 HZ1 LYS B 206 6.386 -0.513 9.753 1.00 0.00 H new ATOM 0 HZ2 LYS B 206 6.257 -0.819 8.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 206 7.670 -1.252 8.924 1.00 0.00 H new ATOM 641 N THR B 207 8.029 -2.776 3.499 1.00 0.00 N ATOM 642 CA THR B 207 7.264 -2.955 2.230 1.00 0.00 C ATOM 643 C THR B 207 5.757 -2.941 2.490 1.00 0.00 C ATOM 644 O THR B 207 5.296 -2.719 3.592 1.00 0.00 O ATOM 645 CB THR B 207 7.642 -4.290 1.582 1.00 0.00 C ATOM 646 OG1 THR B 207 7.083 -5.355 2.338 1.00 0.00 O ATOM 647 CG2 THR B 207 9.164 -4.432 1.538 1.00 0.00 C ATOM 0 H THR B 207 8.294 -3.639 3.974 1.00 0.00 H new ATOM 0 HA THR B 207 7.516 -2.128 1.565 1.00 0.00 H new ATOM 0 HB THR B 207 7.252 -4.322 0.565 1.00 0.00 H new ATOM 0 HG1 THR B 207 7.169 -6.193 1.837 1.00 0.00 H new ATOM 0 HG21 THR B 207 9.427 -5.383 1.076 1.00 0.00 H new ATOM 0 HG22 THR B 207 9.589 -3.615 0.954 1.00 0.00 H new ATOM 0 HG23 THR B 207 9.562 -4.399 2.552 1.00 0.00 H new ATOM 655 N LEU B 208 4.995 -3.180 1.458 1.00 0.00 N ATOM 656 CA LEU B 208 3.513 -3.185 1.603 1.00 0.00 C ATOM 657 C LEU B 208 3.084 -4.431 2.380 1.00 0.00 C ATOM 658 O LEU B 208 1.977 -4.520 2.873 1.00 0.00 O ATOM 659 CB LEU B 208 2.856 -3.192 0.222 1.00 0.00 C ATOM 660 CG LEU B 208 3.527 -2.148 -0.672 1.00 0.00 C ATOM 661 CD1 LEU B 208 2.865 -2.156 -2.051 1.00 0.00 C ATOM 662 CD2 LEU B 208 3.371 -0.763 -0.043 1.00 0.00 C ATOM 0 H LEU B 208 5.337 -3.373 0.517 1.00 0.00 H new ATOM 0 HA LEU B 208 3.200 -2.291 2.143 1.00 0.00 H new ATOM 0 HB2 LEU B 208 2.943 -4.181 -0.228 1.00 0.00 H new ATOM 0 HB3 LEU B 208 1.791 -2.976 0.314 1.00 0.00 H new ATOM 0 HG LEU B 208 4.586 -2.385 -0.775 1.00 0.00 H new ATOM 0 HD11 LEU B 208 3.343 -1.412 -2.688 1.00 0.00 H new ATOM 0 HD12 LEU B 208 2.973 -3.143 -2.501 1.00 0.00 H new ATOM 0 HD13 LEU B 208 1.806 -1.919 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU B 208 3.849 -0.018 -0.680 1.00 0.00 H new ATOM 0 HD22 LEU B 208 2.312 -0.527 0.059 1.00 0.00 H new ATOM 0 HD23 LEU B 208 3.841 -0.755 0.940 1.00 0.00 H new ATOM 674 N THR B 209 3.956 -5.397 2.487 1.00 0.00 N ATOM 675 CA THR B 209 3.603 -6.643 3.225 1.00 0.00 C ATOM 676 C THR B 209 4.160 -6.567 4.649 1.00 0.00 C ATOM 677 O THR B 209 3.922 -7.437 5.463 1.00 0.00 O ATOM 678 CB THR B 209 4.209 -7.853 2.508 1.00 0.00 C ATOM 679 OG1 THR B 209 5.593 -7.933 2.813 1.00 0.00 O ATOM 680 CG2 THR B 209 4.034 -7.705 0.994 1.00 0.00 C ATOM 0 H THR B 209 4.898 -5.377 2.095 1.00 0.00 H new ATOM 0 HA THR B 209 2.519 -6.747 3.261 1.00 0.00 H new ATOM 0 HB THR B 209 3.702 -8.758 2.841 1.00 0.00 H new ATOM 0 HG1 THR B 209 5.984 -8.707 2.357 1.00 0.00 H new ATOM 0 HG21 THR B 209 4.468 -8.570 0.491 1.00 0.00 H new ATOM 0 HG22 THR B 209 2.972 -7.641 0.755 1.00 0.00 H new ATOM 0 HG23 THR B 209 4.537 -6.799 0.656 1.00 0.00 H new ATOM 688 N GLY B 210 4.894 -5.534 4.962 1.00 0.00 N ATOM 689 CA GLY B 210 5.451 -5.411 6.339 1.00 0.00 C ATOM 690 C GLY B 210 6.906 -5.889 6.363 1.00 0.00 C ATOM 691 O GLY B 210 7.543 -5.909 7.397 1.00 0.00 O ATOM 0 H GLY B 210 5.131 -4.773 4.326 1.00 0.00 H new ATOM 0 HA2 GLY B 210 5.395 -4.374 6.671 1.00 0.00 H new ATOM 0 HA3 GLY B 210 4.855 -6.001 7.035 1.00 0.00 H new ATOM 695 N LYS B 211 7.441 -6.267 5.235 1.00 0.00 N ATOM 696 CA LYS B 211 8.856 -6.734 5.203 1.00 0.00 C ATOM 697 C LYS B 211 9.779 -5.559 5.535 1.00 0.00 C ATOM 698 O LYS B 211 9.835 -4.581 4.818 1.00 0.00 O ATOM 699 CB LYS B 211 9.179 -7.274 3.804 1.00 0.00 C ATOM 700 CG LYS B 211 10.680 -7.556 3.679 1.00 0.00 C ATOM 701 CD LYS B 211 11.123 -8.507 4.791 1.00 0.00 C ATOM 702 CE LYS B 211 12.313 -9.337 4.308 1.00 0.00 C ATOM 703 NZ LYS B 211 11.820 -10.520 3.548 1.00 0.00 N ATOM 0 H LYS B 211 6.961 -6.273 4.335 1.00 0.00 H new ATOM 0 HA LYS B 211 9.004 -7.527 5.936 1.00 0.00 H new ATOM 0 HB2 LYS B 211 8.613 -8.187 3.619 1.00 0.00 H new ATOM 0 HB3 LYS B 211 8.873 -6.551 3.048 1.00 0.00 H new ATOM 0 HG2 LYS B 211 10.897 -7.995 2.705 1.00 0.00 H new ATOM 0 HG3 LYS B 211 11.241 -6.623 3.741 1.00 0.00 H new ATOM 0 HD2 LYS B 211 11.398 -7.940 5.680 1.00 0.00 H new ATOM 0 HD3 LYS B 211 10.299 -9.163 5.073 1.00 0.00 H new ATOM 0 HE2 LYS B 211 12.961 -8.730 3.676 1.00 0.00 H new ATOM 0 HE3 LYS B 211 12.912 -9.662 5.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 211 12.630 -11.084 3.220 1.00 0.00 H new ATOM 0 HZ2 LYS B 211 11.219 -11.103 4.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 211 11.266 -10.200 2.728 1.00 0.00 H new ATOM 717 N THR B 212 10.509 -5.646 6.616 1.00 0.00 N ATOM 718 CA THR B 212 11.430 -4.533 6.986 1.00 0.00 C ATOM 719 C THR B 212 12.854 -4.899 6.577 1.00 0.00 C ATOM 720 O THR B 212 13.320 -5.994 6.827 1.00 0.00 O ATOM 721 CB THR B 212 11.376 -4.294 8.498 1.00 0.00 C ATOM 722 OG1 THR B 212 10.029 -4.371 8.940 1.00 0.00 O ATOM 723 CG2 THR B 212 11.943 -2.909 8.815 1.00 0.00 C ATOM 0 H THR B 212 10.507 -6.439 7.257 1.00 0.00 H new ATOM 0 HA THR B 212 11.123 -3.623 6.470 1.00 0.00 H new ATOM 0 HB THR B 212 11.968 -5.053 9.009 1.00 0.00 H new ATOM 0 HG1 THR B 212 9.993 -4.220 9.908 1.00 0.00 H new ATOM 0 HG21 THR B 212 11.905 -2.738 9.891 1.00 0.00 H new ATOM 0 HG22 THR B 212 12.977 -2.853 8.475 1.00 0.00 H new ATOM 0 HG23 THR B 212 11.351 -2.148 8.306 1.00 0.00 H new ATOM 731 N ILE B 213 13.545 -3.995 5.937 1.00 0.00 N ATOM 732 CA ILE B 213 14.936 -4.289 5.491 1.00 0.00 C ATOM 733 C ILE B 213 15.860 -3.150 5.923 1.00 0.00 C ATOM 734 O ILE B 213 15.532 -1.988 5.791 1.00 0.00 O ATOM 735 CB ILE B 213 14.958 -4.413 3.964 1.00 0.00 C ATOM 736 CG1 ILE B 213 13.875 -5.395 3.514 1.00 0.00 C ATOM 737 CG2 ILE B 213 16.325 -4.925 3.501 1.00 0.00 C ATOM 738 CD1 ILE B 213 13.597 -5.195 2.027 1.00 0.00 C ATOM 0 H ILE B 213 13.204 -3.062 5.703 1.00 0.00 H new ATOM 0 HA ILE B 213 15.277 -5.222 5.940 1.00 0.00 H new ATOM 0 HB ILE B 213 14.772 -3.432 3.526 1.00 0.00 H new ATOM 0 HG12 ILE B 213 14.197 -6.419 3.701 1.00 0.00 H new ATOM 0 HG13 ILE B 213 12.963 -5.237 4.090 1.00 0.00 H new ATOM 0 HG21 ILE B 213 16.333 -5.010 2.414 1.00 0.00 H new ATOM 0 HG22 ILE B 213 17.101 -4.227 3.816 1.00 0.00 H new ATOM 0 HG23 ILE B 213 16.516 -5.903 3.943 1.00 0.00 H new ATOM 0 HD11 ILE B 213 12.825 -5.894 1.704 1.00 0.00 H new ATOM 0 HD12 ILE B 213 13.257 -4.174 1.855 1.00 0.00 H new ATOM 0 HD13 ILE B 213 14.510 -5.374 1.459 1.00 0.00 H new ATOM 750 N THR B 214 17.020 -3.474 6.426 1.00 0.00 N ATOM 751 CA THR B 214 17.972 -2.412 6.855 1.00 0.00 C ATOM 752 C THR B 214 19.095 -2.323 5.822 1.00 0.00 C ATOM 753 O THR B 214 19.780 -3.290 5.561 1.00 0.00 O ATOM 754 CB THR B 214 18.556 -2.771 8.224 1.00 0.00 C ATOM 755 OG1 THR B 214 17.497 -2.963 9.150 1.00 0.00 O ATOM 756 CG2 THR B 214 19.464 -1.640 8.709 1.00 0.00 C ATOM 0 H THR B 214 17.349 -4.430 6.558 1.00 0.00 H new ATOM 0 HA THR B 214 17.458 -1.454 6.930 1.00 0.00 H new ATOM 0 HB THR B 214 19.139 -3.688 8.142 1.00 0.00 H new ATOM 0 HG1 THR B 214 17.867 -3.195 10.027 1.00 0.00 H new ATOM 0 HG21 THR B 214 19.878 -1.898 9.684 1.00 0.00 H new ATOM 0 HG22 THR B 214 20.276 -1.495 7.997 1.00 0.00 H new ATOM 0 HG23 THR B 214 18.886 -0.720 8.793 1.00 0.00 H new ATOM 764 N LEU B 215 19.277 -1.177 5.218 1.00 0.00 N ATOM 765 CA LEU B 215 20.345 -1.042 4.187 1.00 0.00 C ATOM 766 C LEU B 215 21.279 0.122 4.539 1.00 0.00 C ATOM 767 O LEU B 215 20.857 1.255 4.684 1.00 0.00 O ATOM 768 CB LEU B 215 19.703 -0.783 2.819 1.00 0.00 C ATOM 769 CG LEU B 215 18.538 -1.753 2.589 1.00 0.00 C ATOM 770 CD1 LEU B 215 17.753 -1.320 1.349 1.00 0.00 C ATOM 771 CD2 LEU B 215 19.085 -3.166 2.370 1.00 0.00 C ATOM 0 H LEU B 215 18.733 -0.332 5.394 1.00 0.00 H new ATOM 0 HA LEU B 215 20.925 -1.965 4.155 1.00 0.00 H new ATOM 0 HB2 LEU B 215 19.346 0.245 2.766 1.00 0.00 H new ATOM 0 HB3 LEU B 215 20.447 -0.903 2.031 1.00 0.00 H new ATOM 0 HG LEU B 215 17.883 -1.745 3.460 1.00 0.00 H new ATOM 0 HD11 LEU B 215 16.924 -2.009 1.184 1.00 0.00 H new ATOM 0 HD12 LEU B 215 17.364 -0.313 1.498 1.00 0.00 H new ATOM 0 HD13 LEU B 215 18.411 -1.330 0.480 1.00 0.00 H new ATOM 0 HD21 LEU B 215 18.257 -3.855 2.207 1.00 0.00 H new ATOM 0 HD22 LEU B 215 19.739 -3.172 1.498 1.00 0.00 H new ATOM 0 HD23 LEU B 215 19.649 -3.478 3.249 1.00 0.00 H new ATOM 783 N GLU B 216 22.547 -0.162 4.684 1.00 0.00 N ATOM 784 CA GLU B 216 23.529 0.908 5.027 1.00 0.00 C ATOM 785 C GLU B 216 23.669 1.870 3.842 1.00 0.00 C ATOM 786 O GLU B 216 23.824 1.455 2.713 1.00 0.00 O ATOM 787 CB GLU B 216 24.887 0.271 5.332 1.00 0.00 C ATOM 788 CG GLU B 216 24.896 -0.247 6.772 1.00 0.00 C ATOM 789 CD GLU B 216 25.649 -1.577 6.831 1.00 0.00 C ATOM 790 OE1 GLU B 216 25.275 -2.480 6.101 1.00 0.00 O ATOM 791 OE2 GLU B 216 26.587 -1.670 7.605 1.00 0.00 O ATOM 0 H GLU B 216 22.946 -1.095 4.579 1.00 0.00 H new ATOM 0 HA GLU B 216 23.180 1.458 5.901 1.00 0.00 H new ATOM 0 HB2 GLU B 216 25.081 -0.547 4.639 1.00 0.00 H new ATOM 0 HB3 GLU B 216 25.683 1.002 5.192 1.00 0.00 H new ATOM 0 HG2 GLU B 216 25.371 0.482 7.429 1.00 0.00 H new ATOM 0 HG3 GLU B 216 23.874 -0.379 7.129 1.00 0.00 H new ATOM 798 N VAL B 217 23.628 3.154 4.086 1.00 0.00 N ATOM 799 CA VAL B 217 23.768 4.128 2.964 1.00 0.00 C ATOM 800 C VAL B 217 24.631 5.310 3.410 1.00 0.00 C ATOM 801 O VAL B 217 25.185 5.312 4.492 1.00 0.00 O ATOM 802 CB VAL B 217 22.384 4.638 2.547 1.00 0.00 C ATOM 803 CG1 VAL B 217 21.644 3.536 1.788 1.00 0.00 C ATOM 804 CG2 VAL B 217 21.578 5.031 3.787 1.00 0.00 C ATOM 0 H VAL B 217 23.504 3.569 5.010 1.00 0.00 H new ATOM 0 HA VAL B 217 24.243 3.631 2.118 1.00 0.00 H new ATOM 0 HB VAL B 217 22.502 5.511 1.905 1.00 0.00 H new ATOM 0 HG11 VAL B 217 20.659 3.897 1.491 1.00 0.00 H new ATOM 0 HG12 VAL B 217 22.213 3.261 0.900 1.00 0.00 H new ATOM 0 HG13 VAL B 217 21.531 2.664 2.432 1.00 0.00 H new ATOM 0 HG21 VAL B 217 20.596 5.392 3.483 1.00 0.00 H new ATOM 0 HG22 VAL B 217 21.460 4.162 4.435 1.00 0.00 H new ATOM 0 HG23 VAL B 217 22.103 5.819 4.328 1.00 0.00 H new ATOM 814 N GLU B 218 24.743 6.321 2.589 1.00 0.00 N ATOM 815 CA GLU B 218 25.564 7.505 2.969 1.00 0.00 C ATOM 816 C GLU B 218 24.809 8.784 2.592 1.00 0.00 C ATOM 817 O GLU B 218 24.004 8.785 1.681 1.00 0.00 O ATOM 818 CB GLU B 218 26.900 7.454 2.223 1.00 0.00 C ATOM 819 CG GLU B 218 27.848 6.499 2.951 1.00 0.00 C ATOM 820 CD GLU B 218 29.088 6.255 2.091 1.00 0.00 C ATOM 821 OE1 GLU B 218 29.048 6.590 0.919 1.00 0.00 O ATOM 822 OE2 GLU B 218 30.058 5.736 2.619 1.00 0.00 O ATOM 0 H GLU B 218 24.301 6.377 1.672 1.00 0.00 H new ATOM 0 HA GLU B 218 25.750 7.498 4.043 1.00 0.00 H new ATOM 0 HB2 GLU B 218 26.745 7.119 1.197 1.00 0.00 H new ATOM 0 HB3 GLU B 218 27.339 8.450 2.170 1.00 0.00 H new ATOM 0 HG2 GLU B 218 28.138 6.921 3.913 1.00 0.00 H new ATOM 0 HG3 GLU B 218 27.343 5.555 3.156 1.00 0.00 H new ATOM 829 N PRO B 219 25.059 9.865 3.286 1.00 0.00 N ATOM 830 CA PRO B 219 24.381 11.167 3.017 1.00 0.00 C ATOM 831 C PRO B 219 24.545 11.617 1.563 1.00 0.00 C ATOM 832 O PRO B 219 23.725 12.337 1.030 1.00 0.00 O ATOM 833 CB PRO B 219 25.067 12.163 3.965 1.00 0.00 C ATOM 834 CG PRO B 219 26.284 11.470 4.491 1.00 0.00 C ATOM 835 CD PRO B 219 26.010 9.972 4.401 1.00 0.00 C ATOM 0 HA PRO B 219 23.306 11.093 3.180 1.00 0.00 H new ATOM 0 HB2 PRO B 219 25.338 13.078 3.438 1.00 0.00 H new ATOM 0 HB3 PRO B 219 24.400 12.449 4.778 1.00 0.00 H new ATOM 0 HG2 PRO B 219 27.164 11.738 3.907 1.00 0.00 H new ATOM 0 HG3 PRO B 219 26.483 11.766 5.521 1.00 0.00 H new ATOM 0 HD2 PRO B 219 26.922 9.408 4.206 1.00 0.00 H new ATOM 0 HD3 PRO B 219 25.587 9.585 5.328 1.00 0.00 H new ATOM 843 N SER B 220 25.600 11.202 0.919 1.00 0.00 N ATOM 844 CA SER B 220 25.820 11.610 -0.497 1.00 0.00 C ATOM 845 C SER B 220 25.377 10.485 -1.435 1.00 0.00 C ATOM 846 O SER B 220 25.575 10.553 -2.631 1.00 0.00 O ATOM 847 CB SER B 220 27.308 11.885 -0.714 1.00 0.00 C ATOM 848 OG SER B 220 27.938 10.709 -1.204 1.00 0.00 O ATOM 0 H SER B 220 26.321 10.597 1.313 1.00 0.00 H new ATOM 0 HA SER B 220 25.239 12.508 -0.709 1.00 0.00 H new ATOM 0 HB2 SER B 220 27.439 12.703 -1.422 1.00 0.00 H new ATOM 0 HB3 SER B 220 27.772 12.197 0.222 1.00 0.00 H new ATOM 0 HG SER B 220 28.892 10.884 -1.345 1.00 0.00 H new ATOM 854 N ASP B 221 24.790 9.446 -0.907 1.00 0.00 N ATOM 855 CA ASP B 221 24.356 8.321 -1.782 1.00 0.00 C ATOM 856 C ASP B 221 23.158 8.758 -2.629 1.00 0.00 C ATOM 857 O ASP B 221 22.302 9.495 -2.180 1.00 0.00 O ATOM 858 CB ASP B 221 23.963 7.121 -0.917 1.00 0.00 C ATOM 859 CG ASP B 221 24.250 5.828 -1.681 1.00 0.00 C ATOM 860 OD1 ASP B 221 25.370 5.670 -2.138 1.00 0.00 O ATOM 861 OD2 ASP B 221 23.346 5.017 -1.794 1.00 0.00 O ATOM 0 H ASP B 221 24.593 9.328 0.087 1.00 0.00 H new ATOM 0 HA ASP B 221 25.178 8.039 -2.440 1.00 0.00 H new ATOM 0 HB2 ASP B 221 24.522 7.135 0.019 1.00 0.00 H new ATOM 0 HB3 ASP B 221 22.906 7.176 -0.658 1.00 0.00 H new ATOM 866 N THR B 222 23.090 8.308 -3.852 1.00 0.00 N ATOM 867 CA THR B 222 21.949 8.699 -4.726 1.00 0.00 C ATOM 868 C THR B 222 20.779 7.732 -4.513 1.00 0.00 C ATOM 869 O THR B 222 20.968 6.561 -4.249 1.00 0.00 O ATOM 870 CB THR B 222 22.392 8.658 -6.190 1.00 0.00 C ATOM 871 OG1 THR B 222 22.723 7.323 -6.544 1.00 0.00 O ATOM 872 CG2 THR B 222 23.617 9.555 -6.382 1.00 0.00 C ATOM 0 H THR B 222 23.775 7.687 -4.283 1.00 0.00 H new ATOM 0 HA THR B 222 21.628 9.709 -4.472 1.00 0.00 H new ATOM 0 HB THR B 222 21.581 9.015 -6.825 1.00 0.00 H new ATOM 0 HG1 THR B 222 23.292 7.328 -7.342 1.00 0.00 H new ATOM 0 HG21 THR B 222 23.931 9.524 -7.425 1.00 0.00 H new ATOM 0 HG22 THR B 222 23.364 10.580 -6.109 1.00 0.00 H new ATOM 0 HG23 THR B 222 24.430 9.201 -5.748 1.00 0.00 H new ATOM 880 N ILE B 223 19.570 8.215 -4.628 1.00 0.00 N ATOM 881 CA ILE B 223 18.384 7.329 -4.433 1.00 0.00 C ATOM 882 C ILE B 223 18.511 6.096 -5.330 1.00 0.00 C ATOM 883 O ILE B 223 18.225 4.988 -4.921 1.00 0.00 O ATOM 884 CB ILE B 223 17.110 8.086 -4.812 1.00 0.00 C ATOM 885 CG1 ILE B 223 16.937 9.329 -3.919 1.00 0.00 C ATOM 886 CG2 ILE B 223 15.902 7.160 -4.675 1.00 0.00 C ATOM 887 CD1 ILE B 223 16.648 8.938 -2.461 1.00 0.00 C ATOM 0 H ILE B 223 19.352 9.187 -4.849 1.00 0.00 H new ATOM 0 HA ILE B 223 18.336 7.023 -3.388 1.00 0.00 H new ATOM 0 HB ILE B 223 17.189 8.418 -5.847 1.00 0.00 H new ATOM 0 HG12 ILE B 223 17.840 9.938 -3.962 1.00 0.00 H new ATOM 0 HG13 ILE B 223 16.121 9.942 -4.301 1.00 0.00 H new ATOM 0 HG21 ILE B 223 14.996 7.702 -4.946 1.00 0.00 H new ATOM 0 HG22 ILE B 223 16.024 6.303 -5.337 1.00 0.00 H new ATOM 0 HG23 ILE B 223 15.824 6.814 -3.644 1.00 0.00 H new ATOM 0 HD11 ILE B 223 16.532 9.839 -1.859 1.00 0.00 H new ATOM 0 HD12 ILE B 223 15.731 8.351 -2.417 1.00 0.00 H new ATOM 0 HD13 ILE B 223 17.477 8.346 -2.072 1.00 0.00 H new ATOM 899 N GLU B 224 18.930 6.278 -6.552 1.00 0.00 N ATOM 900 CA GLU B 224 19.066 5.115 -7.475 1.00 0.00 C ATOM 901 C GLU B 224 19.903 4.024 -6.808 1.00 0.00 C ATOM 902 O GLU B 224 19.702 2.848 -7.040 1.00 0.00 O ATOM 903 CB GLU B 224 19.754 5.563 -8.766 1.00 0.00 C ATOM 904 CG GLU B 224 21.052 6.288 -8.424 1.00 0.00 C ATOM 905 CD GLU B 224 21.725 6.768 -9.710 1.00 0.00 C ATOM 906 OE1 GLU B 224 21.481 6.166 -10.742 1.00 0.00 O ATOM 907 OE2 GLU B 224 22.473 7.730 -9.641 1.00 0.00 O ATOM 0 H GLU B 224 19.184 7.181 -6.952 1.00 0.00 H new ATOM 0 HA GLU B 224 18.076 4.723 -7.706 1.00 0.00 H new ATOM 0 HB2 GLU B 224 19.962 4.700 -9.398 1.00 0.00 H new ATOM 0 HB3 GLU B 224 19.095 6.221 -9.332 1.00 0.00 H new ATOM 0 HG2 GLU B 224 20.846 7.136 -7.771 1.00 0.00 H new ATOM 0 HG3 GLU B 224 21.720 5.621 -7.879 1.00 0.00 H new ATOM 914 N ASN B 225 20.844 4.396 -5.980 1.00 0.00 N ATOM 915 CA ASN B 225 21.681 3.361 -5.311 1.00 0.00 C ATOM 916 C ASN B 225 20.852 2.663 -4.233 1.00 0.00 C ATOM 917 O ASN B 225 20.737 1.455 -4.220 1.00 0.00 O ATOM 918 CB ASN B 225 22.910 4.018 -4.677 1.00 0.00 C ATOM 919 CG ASN B 225 23.964 4.273 -5.756 1.00 0.00 C ATOM 920 OD1 ASN B 225 24.131 3.475 -6.658 1.00 0.00 O ATOM 921 ND2 ASN B 225 24.687 5.358 -5.703 1.00 0.00 N ATOM 0 H ASN B 225 21.067 5.362 -5.741 1.00 0.00 H new ATOM 0 HA ASN B 225 22.012 2.628 -6.047 1.00 0.00 H new ATOM 0 HB2 ASN B 225 22.628 4.956 -4.199 1.00 0.00 H new ATOM 0 HB3 ASN B 225 23.319 3.374 -3.898 1.00 0.00 H new ATOM 0 HD21 ASN B 225 25.392 5.536 -6.418 1.00 0.00 H new ATOM 0 HD22 ASN B 225 24.547 6.028 -4.946 1.00 0.00 H new ATOM 928 N VAL B 226 20.255 3.409 -3.341 1.00 0.00 N ATOM 929 CA VAL B 226 19.421 2.769 -2.282 1.00 0.00 C ATOM 930 C VAL B 226 18.409 1.841 -2.953 1.00 0.00 C ATOM 931 O VAL B 226 18.168 0.735 -2.511 1.00 0.00 O ATOM 932 CB VAL B 226 18.679 3.849 -1.494 1.00 0.00 C ATOM 933 CG1 VAL B 226 17.926 3.205 -0.327 1.00 0.00 C ATOM 934 CG2 VAL B 226 19.689 4.862 -0.951 1.00 0.00 C ATOM 0 H VAL B 226 20.308 4.427 -3.300 1.00 0.00 H new ATOM 0 HA VAL B 226 20.054 2.201 -1.601 1.00 0.00 H new ATOM 0 HB VAL B 226 17.969 4.354 -2.148 1.00 0.00 H new ATOM 0 HG11 VAL B 226 17.397 3.975 0.234 1.00 0.00 H new ATOM 0 HG12 VAL B 226 17.209 2.480 -0.712 1.00 0.00 H new ATOM 0 HG13 VAL B 226 18.635 2.700 0.329 1.00 0.00 H new ATOM 0 HG21 VAL B 226 19.164 5.634 -0.388 1.00 0.00 H new ATOM 0 HG22 VAL B 226 20.397 4.354 -0.296 1.00 0.00 H new ATOM 0 HG23 VAL B 226 20.227 5.320 -1.781 1.00 0.00 H new ATOM 944 N LYS B 227 17.827 2.289 -4.029 1.00 0.00 N ATOM 945 CA LYS B 227 16.836 1.450 -4.756 1.00 0.00 C ATOM 946 C LYS B 227 17.508 0.141 -5.180 1.00 0.00 C ATOM 947 O LYS B 227 16.942 -0.928 -5.071 1.00 0.00 O ATOM 948 CB LYS B 227 16.370 2.213 -6.003 1.00 0.00 C ATOM 949 CG LYS B 227 14.940 1.813 -6.379 1.00 0.00 C ATOM 950 CD LYS B 227 14.368 2.841 -7.357 1.00 0.00 C ATOM 951 CE LYS B 227 13.661 3.948 -6.574 1.00 0.00 C ATOM 952 NZ LYS B 227 13.669 5.205 -7.374 1.00 0.00 N ATOM 0 H LYS B 227 17.997 3.207 -4.439 1.00 0.00 H new ATOM 0 HA LYS B 227 15.982 1.230 -4.115 1.00 0.00 H new ATOM 0 HB2 LYS B 227 16.416 3.286 -5.817 1.00 0.00 H new ATOM 0 HB3 LYS B 227 17.042 2.005 -6.835 1.00 0.00 H new ATOM 0 HG2 LYS B 227 14.935 0.821 -6.831 1.00 0.00 H new ATOM 0 HG3 LYS B 227 14.318 1.759 -5.485 1.00 0.00 H new ATOM 0 HD2 LYS B 227 15.167 3.264 -7.966 1.00 0.00 H new ATOM 0 HD3 LYS B 227 13.668 2.359 -8.040 1.00 0.00 H new ATOM 0 HE2 LYS B 227 12.636 3.653 -6.351 1.00 0.00 H new ATOM 0 HE3 LYS B 227 14.161 4.109 -5.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 227 13.526 6.019 -6.743 1.00 0.00 H new ATOM 0 HZ2 LYS B 227 14.583 5.301 -7.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 227 12.903 5.174 -8.077 1.00 0.00 H new ATOM 966 N ALA B 228 18.720 0.227 -5.661 1.00 0.00 N ATOM 967 CA ALA B 228 19.445 -1.001 -6.095 1.00 0.00 C ATOM 968 C ALA B 228 19.613 -1.938 -4.897 1.00 0.00 C ATOM 969 O ALA B 228 19.598 -3.144 -5.031 1.00 0.00 O ATOM 970 CB ALA B 228 20.822 -0.615 -6.640 1.00 0.00 C ATOM 0 H ALA B 228 19.240 1.098 -5.772 1.00 0.00 H new ATOM 0 HA ALA B 228 18.876 -1.505 -6.876 1.00 0.00 H new ATOM 0 HB1 ALA B 228 21.352 -1.513 -6.957 1.00 0.00 H new ATOM 0 HB2 ALA B 228 20.702 0.055 -7.491 1.00 0.00 H new ATOM 0 HB3 ALA B 228 21.394 -0.112 -5.860 1.00 0.00 H new ATOM 976 N LYS B 229 19.775 -1.393 -3.726 1.00 0.00 N ATOM 977 CA LYS B 229 19.940 -2.258 -2.528 1.00 0.00 C ATOM 978 C LYS B 229 18.711 -3.159 -2.393 1.00 0.00 C ATOM 979 O LYS B 229 18.823 -4.366 -2.302 1.00 0.00 O ATOM 980 CB LYS B 229 20.088 -1.376 -1.289 1.00 0.00 C ATOM 981 CG LYS B 229 21.251 -0.409 -1.510 1.00 0.00 C ATOM 982 CD LYS B 229 21.508 0.400 -0.240 1.00 0.00 C ATOM 983 CE LYS B 229 22.530 -0.338 0.626 1.00 0.00 C ATOM 984 NZ LYS B 229 23.901 -0.066 0.112 1.00 0.00 N ATOM 0 H LYS B 229 19.800 -0.389 -3.547 1.00 0.00 H new ATOM 0 HA LYS B 229 20.830 -2.879 -2.630 1.00 0.00 H new ATOM 0 HB2 LYS B 229 19.167 -0.823 -1.107 1.00 0.00 H new ATOM 0 HB3 LYS B 229 20.270 -1.991 -0.408 1.00 0.00 H new ATOM 0 HG2 LYS B 229 22.148 -0.963 -1.785 1.00 0.00 H new ATOM 0 HG3 LYS B 229 21.024 0.262 -2.339 1.00 0.00 H new ATOM 0 HD2 LYS B 229 21.879 1.393 -0.495 1.00 0.00 H new ATOM 0 HD3 LYS B 229 20.578 0.539 0.312 1.00 0.00 H new ATOM 0 HE2 LYS B 229 22.447 -0.013 1.663 1.00 0.00 H new ATOM 0 HE3 LYS B 229 22.330 -1.409 0.611 1.00 0.00 H new ATOM 0 HZ1 LYS B 229 24.424 -0.961 0.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 229 23.838 0.387 -0.822 1.00 0.00 H new ATOM 0 HZ3 LYS B 229 24.400 0.566 0.770 1.00 0.00 H new ATOM 998 N ILE B 230 17.539 -2.587 -2.388 1.00 0.00 N ATOM 999 CA ILE B 230 16.309 -3.419 -2.269 1.00 0.00 C ATOM 1000 C ILE B 230 16.248 -4.397 -3.448 1.00 0.00 C ATOM 1001 O ILE B 230 15.759 -5.498 -3.328 1.00 0.00 O ATOM 1002 CB ILE B 230 15.072 -2.513 -2.288 1.00 0.00 C ATOM 1003 CG1 ILE B 230 15.005 -1.693 -0.990 1.00 0.00 C ATOM 1004 CG2 ILE B 230 13.811 -3.372 -2.405 1.00 0.00 C ATOM 1005 CD1 ILE B 230 15.767 -0.373 -1.157 1.00 0.00 C ATOM 0 H ILE B 230 17.380 -1.582 -2.461 1.00 0.00 H new ATOM 0 HA ILE B 230 16.332 -3.975 -1.332 1.00 0.00 H new ATOM 0 HB ILE B 230 15.139 -1.837 -3.141 1.00 0.00 H new ATOM 0 HG12 ILE B 230 13.965 -1.491 -0.732 1.00 0.00 H new ATOM 0 HG13 ILE B 230 15.432 -2.266 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE B 230 12.932 -2.728 -2.418 1.00 0.00 H new ATOM 0 HG22 ILE B 230 13.850 -3.952 -3.327 1.00 0.00 H new ATOM 0 HG23 ILE B 230 13.752 -4.049 -1.553 1.00 0.00 H new ATOM 0 HD11 ILE B 230 15.712 0.199 -0.231 1.00 0.00 H new ATOM 0 HD12 ILE B 230 16.810 -0.583 -1.393 1.00 0.00 H new ATOM 0 HD13 ILE B 230 15.321 0.205 -1.967 1.00 0.00 H new ATOM 1017 N GLN B 231 16.738 -3.999 -4.590 1.00 0.00 N ATOM 1018 CA GLN B 231 16.705 -4.907 -5.776 1.00 0.00 C ATOM 1019 C GLN B 231 17.537 -6.164 -5.498 1.00 0.00 C ATOM 1020 O GLN B 231 17.126 -7.267 -5.794 1.00 0.00 O ATOM 1021 CB GLN B 231 17.283 -4.174 -6.991 1.00 0.00 C ATOM 1022 CG GLN B 231 17.437 -5.149 -8.161 1.00 0.00 C ATOM 1023 CD GLN B 231 17.848 -4.375 -9.415 1.00 0.00 C ATOM 1024 OE1 GLN B 231 17.039 -4.336 -10.437 1.00 0.00 O flip ATOM 1025 NE2 GLN B 231 18.917 -3.801 -9.465 1.00 0.00 N flip ATOM 0 H GLN B 231 17.160 -3.085 -4.755 1.00 0.00 H new ATOM 0 HA GLN B 231 15.674 -5.198 -5.975 1.00 0.00 H new ATOM 0 HB2 GLN B 231 16.628 -3.351 -7.276 1.00 0.00 H new ATOM 0 HB3 GLN B 231 18.250 -3.739 -6.739 1.00 0.00 H new ATOM 0 HG2 GLN B 231 18.187 -5.904 -7.924 1.00 0.00 H new ATOM 0 HG3 GLN B 231 16.499 -5.676 -8.336 1.00 0.00 H new ATOM 0 HE21 GLN B 231 19.550 -3.831 -8.666 1.00 0.00 H new ATOM 0 HE22 GLN B 231 19.182 -3.289 -10.306 1.00 0.00 H new ATOM 1034 N ASP B 232 18.711 -6.007 -4.948 1.00 0.00 N ATOM 1035 CA ASP B 232 19.570 -7.196 -4.674 1.00 0.00 C ATOM 1036 C ASP B 232 19.020 -7.993 -3.485 1.00 0.00 C ATOM 1037 O ASP B 232 19.281 -9.171 -3.350 1.00 0.00 O ATOM 1038 CB ASP B 232 20.994 -6.732 -4.358 1.00 0.00 C ATOM 1039 CG ASP B 232 21.570 -5.990 -5.565 1.00 0.00 C ATOM 1040 OD1 ASP B 232 21.143 -6.277 -6.671 1.00 0.00 O ATOM 1041 OD2 ASP B 232 22.429 -5.147 -5.363 1.00 0.00 O ATOM 0 H ASP B 232 19.112 -5.109 -4.677 1.00 0.00 H new ATOM 0 HA ASP B 232 19.574 -7.837 -5.556 1.00 0.00 H new ATOM 0 HB2 ASP B 232 20.990 -6.079 -3.485 1.00 0.00 H new ATOM 0 HB3 ASP B 232 21.621 -7.589 -4.112 1.00 0.00 H new ATOM 1046 N LYS B 233 18.271 -7.368 -2.618 1.00 0.00 N ATOM 1047 CA LYS B 233 17.729 -8.109 -1.441 1.00 0.00 C ATOM 1048 C LYS B 233 16.311 -8.606 -1.741 1.00 0.00 C ATOM 1049 O LYS B 233 15.989 -9.759 -1.533 1.00 0.00 O ATOM 1050 CB LYS B 233 17.679 -7.174 -0.227 1.00 0.00 C ATOM 1051 CG LYS B 233 19.098 -6.843 0.243 1.00 0.00 C ATOM 1052 CD LYS B 233 19.180 -7.015 1.762 1.00 0.00 C ATOM 1053 CE LYS B 233 20.516 -6.469 2.268 1.00 0.00 C ATOM 1054 NZ LYS B 233 20.723 -6.894 3.682 1.00 0.00 N ATOM 0 H LYS B 233 18.012 -6.383 -2.672 1.00 0.00 H new ATOM 0 HA LYS B 233 18.377 -8.960 -1.231 1.00 0.00 H new ATOM 0 HB2 LYS B 233 17.151 -6.257 -0.487 1.00 0.00 H new ATOM 0 HB3 LYS B 233 17.121 -7.645 0.582 1.00 0.00 H new ATOM 0 HG2 LYS B 233 19.818 -7.497 -0.248 1.00 0.00 H new ATOM 0 HG3 LYS B 233 19.356 -5.821 -0.033 1.00 0.00 H new ATOM 0 HD2 LYS B 233 18.355 -6.489 2.243 1.00 0.00 H new ATOM 0 HD3 LYS B 233 19.083 -8.068 2.025 1.00 0.00 H new ATOM 0 HE2 LYS B 233 21.331 -6.836 1.644 1.00 0.00 H new ATOM 0 HE3 LYS B 233 20.526 -5.381 2.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 21.631 -6.523 4.027 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 19.951 -6.523 4.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 20.731 -7.933 3.735 1.00 0.00 H new ATOM 1068 N GLU B 234 15.458 -7.736 -2.202 1.00 0.00 N ATOM 1069 CA GLU B 234 14.052 -8.140 -2.489 1.00 0.00 C ATOM 1070 C GLU B 234 13.885 -8.591 -3.942 1.00 0.00 C ATOM 1071 O GLU B 234 12.833 -9.062 -4.326 1.00 0.00 O ATOM 1072 CB GLU B 234 13.128 -6.953 -2.232 1.00 0.00 C ATOM 1073 CG GLU B 234 13.098 -6.650 -0.735 1.00 0.00 C ATOM 1074 CD GLU B 234 12.436 -7.811 0.008 1.00 0.00 C ATOM 1075 OE1 GLU B 234 11.463 -8.340 -0.505 1.00 0.00 O ATOM 1076 OE2 GLU B 234 12.915 -8.155 1.077 1.00 0.00 O ATOM 0 H GLU B 234 15.674 -6.758 -2.394 1.00 0.00 H new ATOM 0 HA GLU B 234 13.799 -8.976 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU B 234 13.476 -6.080 -2.784 1.00 0.00 H new ATOM 0 HB3 GLU B 234 12.123 -7.176 -2.590 1.00 0.00 H new ATOM 0 HG2 GLU B 234 14.111 -6.498 -0.364 1.00 0.00 H new ATOM 0 HG3 GLU B 234 12.549 -5.727 -0.551 1.00 0.00 H new ATOM 1083 N GLY B 235 14.894 -8.470 -4.759 1.00 0.00 N ATOM 1084 CA GLY B 235 14.749 -8.914 -6.176 1.00 0.00 C ATOM 1085 C GLY B 235 13.734 -8.032 -6.910 1.00 0.00 C ATOM 1086 O GLY B 235 13.160 -8.434 -7.902 1.00 0.00 O ATOM 0 H GLY B 235 15.806 -8.086 -4.511 1.00 0.00 H new ATOM 0 HA2 GLY B 235 15.714 -8.865 -6.680 1.00 0.00 H new ATOM 0 HA3 GLY B 235 14.426 -9.954 -6.207 1.00 0.00 H new ATOM 1090 N ILE B 236 13.506 -6.836 -6.437 1.00 0.00 N ATOM 1091 CA ILE B 236 12.526 -5.942 -7.123 1.00 0.00 C ATOM 1092 C ILE B 236 13.285 -4.907 -7.971 1.00 0.00 C ATOM 1093 O ILE B 236 14.195 -4.265 -7.486 1.00 0.00 O ATOM 1094 CB ILE B 236 11.683 -5.216 -6.072 1.00 0.00 C ATOM 1095 CG1 ILE B 236 11.032 -6.245 -5.147 1.00 0.00 C ATOM 1096 CG2 ILE B 236 10.592 -4.394 -6.764 1.00 0.00 C ATOM 1097 CD1 ILE B 236 10.419 -5.530 -3.941 1.00 0.00 C ATOM 0 H ILE B 236 13.953 -6.440 -5.610 1.00 0.00 H new ATOM 0 HA ILE B 236 11.878 -6.536 -7.767 1.00 0.00 H new ATOM 0 HB ILE B 236 12.322 -4.551 -5.491 1.00 0.00 H new ATOM 0 HG12 ILE B 236 10.262 -6.798 -5.685 1.00 0.00 H new ATOM 0 HG13 ILE B 236 11.773 -6.972 -4.815 1.00 0.00 H new ATOM 0 HG21 ILE B 236 9.994 -3.878 -6.013 1.00 0.00 H new ATOM 0 HG22 ILE B 236 11.053 -3.661 -7.426 1.00 0.00 H new ATOM 0 HG23 ILE B 236 9.951 -5.056 -7.346 1.00 0.00 H new ATOM 0 HD11 ILE B 236 9.955 -6.263 -3.281 1.00 0.00 H new ATOM 0 HD12 ILE B 236 11.200 -4.997 -3.399 1.00 0.00 H new ATOM 0 HD13 ILE B 236 9.665 -4.821 -4.283 1.00 0.00 H new ATOM 1109 N PRO B 237 12.923 -4.734 -9.227 1.00 0.00 N ATOM 1110 CA PRO B 237 13.604 -3.751 -10.119 1.00 0.00 C ATOM 1111 C PRO B 237 13.218 -2.306 -9.780 1.00 0.00 C ATOM 1112 O PRO B 237 12.182 -2.057 -9.200 1.00 0.00 O ATOM 1113 CB PRO B 237 13.116 -4.123 -11.519 1.00 0.00 C ATOM 1114 CG PRO B 237 11.798 -4.792 -11.315 1.00 0.00 C ATOM 1115 CD PRO B 237 11.843 -5.446 -9.932 1.00 0.00 C ATOM 0 HA PRO B 237 14.688 -3.793 -10.017 1.00 0.00 H new ATOM 0 HB2 PRO B 237 13.014 -3.238 -12.147 1.00 0.00 H new ATOM 0 HB3 PRO B 237 13.821 -4.788 -12.017 1.00 0.00 H new ATOM 0 HG2 PRO B 237 10.984 -4.069 -11.374 1.00 0.00 H new ATOM 0 HG3 PRO B 237 11.619 -5.538 -12.090 1.00 0.00 H new ATOM 0 HD2 PRO B 237 10.891 -5.341 -9.411 1.00 0.00 H new ATOM 0 HD3 PRO B 237 12.051 -6.514 -10.003 1.00 0.00 H new ATOM 1123 N PRO B 238 14.050 -1.362 -10.134 1.00 0.00 N ATOM 1124 CA PRO B 238 13.799 0.082 -9.853 1.00 0.00 C ATOM 1125 C PRO B 238 12.661 0.662 -10.699 1.00 0.00 C ATOM 1126 O PRO B 238 11.953 1.553 -10.277 1.00 0.00 O ATOM 1127 CB PRO B 238 15.122 0.762 -10.213 1.00 0.00 C ATOM 1128 CG PRO B 238 15.790 -0.153 -11.185 1.00 0.00 C ATOM 1129 CD PRO B 238 15.322 -1.569 -10.847 1.00 0.00 C ATOM 0 HA PRO B 238 13.492 0.235 -8.819 1.00 0.00 H new ATOM 0 HB2 PRO B 238 14.951 1.745 -10.653 1.00 0.00 H new ATOM 0 HB3 PRO B 238 15.740 0.912 -9.327 1.00 0.00 H new ATOM 0 HG2 PRO B 238 15.524 0.109 -12.209 1.00 0.00 H new ATOM 0 HG3 PRO B 238 16.874 -0.075 -11.108 1.00 0.00 H new ATOM 0 HD2 PRO B 238 15.183 -2.169 -11.746 1.00 0.00 H new ATOM 0 HD3 PRO B 238 16.048 -2.092 -10.225 1.00 0.00 H new ATOM 1137 N ASP B 239 12.488 0.171 -11.894 1.00 0.00 N ATOM 1138 CA ASP B 239 11.406 0.704 -12.770 1.00 0.00 C ATOM 1139 C ASP B 239 10.035 0.355 -12.183 1.00 0.00 C ATOM 1140 O ASP B 239 9.012 0.805 -12.676 1.00 0.00 O ATOM 1141 CB ASP B 239 11.532 0.088 -14.164 1.00 0.00 C ATOM 1142 CG ASP B 239 11.462 -1.437 -14.057 1.00 0.00 C ATOM 1143 OD1 ASP B 239 11.257 -1.925 -12.957 1.00 0.00 O ATOM 1144 OD2 ASP B 239 11.614 -2.091 -15.075 1.00 0.00 O ATOM 0 H ASP B 239 13.049 -0.577 -12.303 1.00 0.00 H new ATOM 0 HA ASP B 239 11.501 1.788 -12.835 1.00 0.00 H new ATOM 0 HB2 ASP B 239 10.733 0.455 -14.809 1.00 0.00 H new ATOM 0 HB3 ASP B 239 12.475 0.388 -14.622 1.00 0.00 H new ATOM 1149 N GLN B 240 10.001 -0.443 -11.141 1.00 0.00 N ATOM 1150 CA GLN B 240 8.691 -0.822 -10.536 1.00 0.00 C ATOM 1151 C GLN B 240 8.708 -0.563 -9.024 1.00 0.00 C ATOM 1152 O GLN B 240 7.675 -0.410 -8.405 1.00 0.00 O ATOM 1153 CB GLN B 240 8.404 -2.304 -10.826 1.00 0.00 C ATOM 1154 CG GLN B 240 8.395 -3.125 -9.530 1.00 0.00 C ATOM 1155 CD GLN B 240 8.200 -4.603 -9.872 1.00 0.00 C ATOM 1156 OE1 GLN B 240 8.760 -5.092 -10.944 1.00 0.00 O flip ATOM 1157 NE2 GLN B 240 7.530 -5.320 -9.156 1.00 0.00 N flip ATOM 0 H GLN B 240 10.822 -0.845 -10.688 1.00 0.00 H new ATOM 0 HA GLN B 240 7.901 -0.213 -10.976 1.00 0.00 H new ATOM 0 HB2 GLN B 240 7.442 -2.400 -11.329 1.00 0.00 H new ATOM 0 HB3 GLN B 240 9.159 -2.698 -11.506 1.00 0.00 H new ATOM 0 HG2 GLN B 240 9.332 -2.985 -8.990 1.00 0.00 H new ATOM 0 HG3 GLN B 240 7.595 -2.783 -8.874 1.00 0.00 H new ATOM 0 HE21 GLN B 240 7.092 -4.938 -8.318 1.00 0.00 H new ATOM 0 HE22 GLN B 240 7.405 -6.304 -9.393 1.00 0.00 H new ATOM 1166 N GLN B 241 9.861 -0.509 -8.418 1.00 0.00 N ATOM 1167 CA GLN B 241 9.899 -0.254 -6.950 1.00 0.00 C ATOM 1168 C GLN B 241 9.921 1.257 -6.709 1.00 0.00 C ATOM 1169 O GLN B 241 10.601 1.991 -7.398 1.00 0.00 O ATOM 1170 CB GLN B 241 11.141 -0.921 -6.337 1.00 0.00 C ATOM 1171 CG GLN B 241 12.169 0.129 -5.907 1.00 0.00 C ATOM 1172 CD GLN B 241 13.427 -0.583 -5.407 1.00 0.00 C ATOM 1173 OE1 GLN B 241 13.977 -0.224 -4.385 1.00 0.00 O ATOM 1174 NE2 GLN B 241 13.908 -1.588 -6.088 1.00 0.00 N ATOM 0 H GLN B 241 10.768 -0.629 -8.868 1.00 0.00 H new ATOM 0 HA GLN B 241 9.015 -0.678 -6.474 1.00 0.00 H new ATOM 0 HB2 GLN B 241 10.848 -1.523 -5.477 1.00 0.00 H new ATOM 0 HB3 GLN B 241 11.590 -1.599 -7.063 1.00 0.00 H new ATOM 0 HG2 GLN B 241 12.414 0.782 -6.745 1.00 0.00 H new ATOM 0 HG3 GLN B 241 11.756 0.761 -5.121 1.00 0.00 H new ATOM 0 HE21 GLN B 241 13.447 -1.890 -6.946 1.00 0.00 H new ATOM 0 HE22 GLN B 241 14.745 -2.071 -5.762 1.00 0.00 H new ATOM 1183 N ARG B 242 9.177 1.728 -5.744 1.00 0.00 N ATOM 1184 CA ARG B 242 9.151 3.195 -5.469 1.00 0.00 C ATOM 1185 C ARG B 242 9.419 3.445 -3.983 1.00 0.00 C ATOM 1186 O ARG B 242 8.836 2.815 -3.124 1.00 0.00 O ATOM 1187 CB ARG B 242 7.776 3.755 -5.838 1.00 0.00 C ATOM 1188 CG ARG B 242 7.690 3.954 -7.353 1.00 0.00 C ATOM 1189 CD ARG B 242 6.326 4.548 -7.713 1.00 0.00 C ATOM 1190 NE ARG B 242 6.272 4.827 -9.176 1.00 0.00 N ATOM 1191 CZ ARG B 242 5.318 5.574 -9.663 1.00 0.00 C ATOM 1192 NH1 ARG B 242 4.409 6.073 -8.870 1.00 0.00 N ATOM 1193 NH2 ARG B 242 5.270 5.820 -10.943 1.00 0.00 N ATOM 0 H ARG B 242 8.587 1.162 -5.135 1.00 0.00 H new ATOM 0 HA ARG B 242 9.920 3.689 -6.063 1.00 0.00 H new ATOM 0 HB2 ARG B 242 6.994 3.072 -5.506 1.00 0.00 H new ATOM 0 HB3 ARG B 242 7.610 4.703 -5.327 1.00 0.00 H new ATOM 0 HG2 ARG B 242 8.487 4.617 -7.689 1.00 0.00 H new ATOM 0 HG3 ARG B 242 7.830 3.002 -7.864 1.00 0.00 H new ATOM 0 HD2 ARG B 242 5.532 3.855 -7.435 1.00 0.00 H new ATOM 0 HD3 ARG B 242 6.159 5.467 -7.151 1.00 0.00 H new ATOM 0 HE ARG B 242 6.980 4.435 -9.797 1.00 0.00 H new ATOM 0 HH11 ARG B 242 4.444 5.880 -7.869 1.00 0.00 H new ATOM 0 HH12 ARG B 242 3.664 6.656 -9.251 1.00 0.00 H new ATOM 0 HH21 ARG B 242 5.978 5.429 -11.564 1.00 0.00 H new ATOM 0 HH22 ARG B 242 4.524 6.404 -11.323 1.00 0.00 H new ATOM 1207 N LEU B 243 10.293 4.367 -3.677 1.00 0.00 N ATOM 1208 CA LEU B 243 10.595 4.667 -2.247 1.00 0.00 C ATOM 1209 C LEU B 243 9.937 5.994 -1.862 1.00 0.00 C ATOM 1210 O LEU B 243 10.133 7.009 -2.504 1.00 0.00 O ATOM 1211 CB LEU B 243 12.110 4.764 -2.045 1.00 0.00 C ATOM 1212 CG LEU B 243 12.720 3.359 -2.034 1.00 0.00 C ATOM 1213 CD1 LEU B 243 14.178 3.425 -2.499 1.00 0.00 C ATOM 1214 CD2 LEU B 243 12.667 2.790 -0.613 1.00 0.00 C ATOM 0 H LEU B 243 10.811 4.925 -4.356 1.00 0.00 H new ATOM 0 HA LEU B 243 10.204 3.868 -1.617 1.00 0.00 H new ATOM 0 HB2 LEU B 243 12.556 5.358 -2.843 1.00 0.00 H new ATOM 0 HB3 LEU B 243 12.330 5.274 -1.107 1.00 0.00 H new ATOM 0 HG LEU B 243 12.153 2.716 -2.708 1.00 0.00 H new ATOM 0 HD11 LEU B 243 14.609 2.424 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU B 243 14.219 3.828 -3.511 1.00 0.00 H new ATOM 0 HD13 LEU B 243 14.745 4.070 -1.828 1.00 0.00 H new ATOM 0 HD21 LEU B 243 13.101 1.790 -0.605 1.00 0.00 H new ATOM 0 HD22 LEU B 243 13.232 3.436 0.059 1.00 0.00 H new ATOM 0 HD23 LEU B 243 11.630 2.738 -0.280 1.00 0.00 H new ATOM 1226 N ILE B 244 9.149 5.985 -0.817 1.00 0.00 N ATOM 1227 CA ILE B 244 8.459 7.233 -0.378 1.00 0.00 C ATOM 1228 C ILE B 244 8.902 7.589 1.042 1.00 0.00 C ATOM 1229 O ILE B 244 8.953 6.746 1.916 1.00 0.00 O ATOM 1230 CB ILE B 244 6.948 7.002 -0.401 1.00 0.00 C ATOM 1231 CG1 ILE B 244 6.471 6.915 -1.854 1.00 0.00 C ATOM 1232 CG2 ILE B 244 6.235 8.159 0.303 1.00 0.00 C ATOM 1233 CD1 ILE B 244 5.022 6.424 -1.896 1.00 0.00 C ATOM 0 H ILE B 244 8.954 5.162 -0.247 1.00 0.00 H new ATOM 0 HA ILE B 244 8.715 8.052 -1.050 1.00 0.00 H new ATOM 0 HB ILE B 244 6.717 6.071 0.117 1.00 0.00 H new ATOM 0 HG12 ILE B 244 6.547 7.892 -2.330 1.00 0.00 H new ATOM 0 HG13 ILE B 244 7.111 6.235 -2.416 1.00 0.00 H new ATOM 0 HG21 ILE B 244 5.159 7.989 0.283 1.00 0.00 H new ATOM 0 HG22 ILE B 244 6.574 8.220 1.337 1.00 0.00 H new ATOM 0 HG23 ILE B 244 6.464 9.093 -0.210 1.00 0.00 H new ATOM 0 HD11 ILE B 244 4.688 6.364 -2.932 1.00 0.00 H new ATOM 0 HD12 ILE B 244 4.959 5.438 -1.437 1.00 0.00 H new ATOM 0 HD13 ILE B 244 4.386 7.120 -1.349 1.00 0.00 H new ATOM 1245 N PHE B 245 9.220 8.833 1.277 1.00 0.00 N ATOM 1246 CA PHE B 245 9.661 9.255 2.639 1.00 0.00 C ATOM 1247 C PHE B 245 8.823 10.453 3.089 1.00 0.00 C ATOM 1248 O PHE B 245 8.913 11.528 2.531 1.00 0.00 O ATOM 1249 CB PHE B 245 11.139 9.653 2.588 1.00 0.00 C ATOM 1250 CG PHE B 245 11.634 9.975 3.980 1.00 0.00 C ATOM 1251 CD1 PHE B 245 11.621 8.990 4.976 1.00 0.00 C ATOM 1252 CD2 PHE B 245 12.114 11.257 4.270 1.00 0.00 C ATOM 1253 CE1 PHE B 245 12.088 9.289 6.261 1.00 0.00 C ATOM 1254 CE2 PHE B 245 12.579 11.556 5.558 1.00 0.00 C ATOM 1255 CZ PHE B 245 12.567 10.572 6.552 1.00 0.00 C ATOM 0 H PHE B 245 9.193 9.579 0.582 1.00 0.00 H new ATOM 0 HA PHE B 245 9.529 8.433 3.343 1.00 0.00 H new ATOM 0 HB2 PHE B 245 11.729 8.841 2.162 1.00 0.00 H new ATOM 0 HB3 PHE B 245 11.269 10.518 1.937 1.00 0.00 H new ATOM 0 HD1 PHE B 245 11.251 8.000 4.752 1.00 0.00 H new ATOM 0 HD2 PHE B 245 12.126 12.016 3.502 1.00 0.00 H new ATOM 0 HE1 PHE B 245 12.079 8.529 7.029 1.00 0.00 H new ATOM 0 HE2 PHE B 245 12.947 12.546 5.783 1.00 0.00 H new ATOM 0 HZ PHE B 245 12.927 10.802 7.544 1.00 0.00 H new ATOM 1265 N ALA B 246 8.000 10.282 4.087 1.00 0.00 N ATOM 1266 CA ALA B 246 7.163 11.424 4.547 1.00 0.00 C ATOM 1267 C ALA B 246 6.196 11.816 3.429 1.00 0.00 C ATOM 1268 O ALA B 246 5.943 12.980 3.190 1.00 0.00 O ATOM 1269 CB ALA B 246 8.061 12.615 4.889 1.00 0.00 C ATOM 0 H ALA B 246 7.872 9.409 4.599 1.00 0.00 H new ATOM 0 HA ALA B 246 6.601 11.133 5.435 1.00 0.00 H new ATOM 0 HB1 ALA B 246 7.446 13.450 5.225 1.00 0.00 H new ATOM 0 HB2 ALA B 246 8.754 12.332 5.681 1.00 0.00 H new ATOM 0 HB3 ALA B 246 8.624 12.912 4.004 1.00 0.00 H new ATOM 1275 N GLY B 247 5.639 10.847 2.757 1.00 0.00 N ATOM 1276 CA GLY B 247 4.671 11.151 1.667 1.00 0.00 C ATOM 1277 C GLY B 247 5.380 11.848 0.504 1.00 0.00 C ATOM 1278 O GLY B 247 4.746 12.450 -0.338 1.00 0.00 O ATOM 0 H GLY B 247 5.813 9.855 2.917 1.00 0.00 H new ATOM 0 HA2 GLY B 247 4.205 10.229 1.318 1.00 0.00 H new ATOM 0 HA3 GLY B 247 3.872 11.787 2.048 1.00 0.00 H new ATOM 1282 N LYS B 248 6.686 11.773 0.446 1.00 0.00 N ATOM 1283 CA LYS B 248 7.419 12.436 -0.673 1.00 0.00 C ATOM 1284 C LYS B 248 8.047 11.367 -1.576 1.00 0.00 C ATOM 1285 O LYS B 248 8.613 10.397 -1.114 1.00 0.00 O ATOM 1286 CB LYS B 248 8.500 13.363 -0.099 1.00 0.00 C ATOM 1287 CG LYS B 248 9.843 12.632 -0.005 1.00 0.00 C ATOM 1288 CD LYS B 248 10.784 13.408 0.922 1.00 0.00 C ATOM 1289 CE LYS B 248 10.753 14.895 0.565 1.00 0.00 C ATOM 1290 NZ LYS B 248 10.918 15.057 -0.906 1.00 0.00 N ATOM 0 H LYS B 248 7.273 11.284 1.122 1.00 0.00 H new ATOM 0 HA LYS B 248 6.727 13.033 -1.267 1.00 0.00 H new ATOM 0 HB2 LYS B 248 8.603 14.245 -0.731 1.00 0.00 H new ATOM 0 HB3 LYS B 248 8.200 13.712 0.889 1.00 0.00 H new ATOM 0 HG2 LYS B 248 9.693 11.621 0.375 1.00 0.00 H new ATOM 0 HG3 LYS B 248 10.288 12.537 -0.996 1.00 0.00 H new ATOM 0 HD2 LYS B 248 10.484 13.268 1.960 1.00 0.00 H new ATOM 0 HD3 LYS B 248 11.800 13.023 0.829 1.00 0.00 H new ATOM 0 HE2 LYS B 248 9.810 15.337 0.887 1.00 0.00 H new ATOM 0 HE3 LYS B 248 11.549 15.423 1.091 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 11.314 15.997 -1.110 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 11.563 14.325 -1.266 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 9.993 14.963 -1.372 1.00 0.00 H new ATOM 1304 N GLN B 249 7.929 11.526 -2.865 1.00 0.00 N ATOM 1305 CA GLN B 249 8.505 10.511 -3.792 1.00 0.00 C ATOM 1306 C GLN B 249 9.981 10.826 -4.042 1.00 0.00 C ATOM 1307 O GLN B 249 10.333 11.921 -4.437 1.00 0.00 O ATOM 1308 CB GLN B 249 7.743 10.534 -5.119 1.00 0.00 C ATOM 1309 CG GLN B 249 8.030 9.245 -5.891 1.00 0.00 C ATOM 1310 CD GLN B 249 7.245 9.248 -7.203 1.00 0.00 C ATOM 1311 OE1 GLN B 249 6.099 9.648 -7.240 1.00 0.00 O ATOM 1312 NE2 GLN B 249 7.820 8.816 -8.293 1.00 0.00 N ATOM 0 H GLN B 249 7.460 12.312 -3.316 1.00 0.00 H new ATOM 0 HA GLN B 249 8.417 9.521 -3.344 1.00 0.00 H new ATOM 0 HB2 GLN B 249 6.673 10.630 -4.935 1.00 0.00 H new ATOM 0 HB3 GLN B 249 8.044 11.399 -5.709 1.00 0.00 H new ATOM 0 HG2 GLN B 249 9.098 9.161 -6.094 1.00 0.00 H new ATOM 0 HG3 GLN B 249 7.751 8.379 -5.290 1.00 0.00 H new ATOM 0 HE21 GLN B 249 8.783 8.480 -8.263 1.00 0.00 H new ATOM 0 HE22 GLN B 249 7.307 8.815 -9.174 1.00 0.00 H new ATOM 1321 N LEU B 250 10.849 9.878 -3.814 1.00 0.00 N ATOM 1322 CA LEU B 250 12.301 10.129 -4.040 1.00 0.00 C ATOM 1323 C LEU B 250 12.619 9.999 -5.531 1.00 0.00 C ATOM 1324 O LEU B 250 12.056 9.176 -6.225 1.00 0.00 O ATOM 1325 CB LEU B 250 13.127 9.111 -3.251 1.00 0.00 C ATOM 1326 CG LEU B 250 12.590 9.010 -1.823 1.00 0.00 C ATOM 1327 CD1 LEU B 250 13.379 7.949 -1.054 1.00 0.00 C ATOM 1328 CD2 LEU B 250 12.743 10.364 -1.125 1.00 0.00 C ATOM 0 H LEU B 250 10.616 8.942 -3.482 1.00 0.00 H new ATOM 0 HA LEU B 250 12.549 11.136 -3.703 1.00 0.00 H new ATOM 0 HB2 LEU B 250 13.082 8.136 -3.737 1.00 0.00 H new ATOM 0 HB3 LEU B 250 14.175 9.411 -3.236 1.00 0.00 H new ATOM 0 HG LEU B 250 11.537 8.730 -1.850 1.00 0.00 H new ATOM 0 HD11 LEU B 250 12.996 7.877 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU B 250 13.272 6.985 -1.551 1.00 0.00 H new ATOM 0 HD13 LEU B 250 14.432 8.228 -1.026 1.00 0.00 H new ATOM 0 HD21 LEU B 250 12.361 10.294 -0.107 1.00 0.00 H new ATOM 0 HD22 LEU B 250 13.796 10.643 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU B 250 12.181 11.121 -1.672 1.00 0.00 H new ATOM 1340 N GLU B 251 13.517 10.808 -6.030 1.00 0.00 N ATOM 1341 CA GLU B 251 13.870 10.734 -7.477 1.00 0.00 C ATOM 1342 C GLU B 251 15.238 10.066 -7.643 1.00 0.00 C ATOM 1343 O GLU B 251 16.112 10.201 -6.809 1.00 0.00 O ATOM 1344 CB GLU B 251 13.918 12.146 -8.064 1.00 0.00 C ATOM 1345 CG GLU B 251 14.197 12.069 -9.566 1.00 0.00 C ATOM 1346 CD GLU B 251 13.086 12.790 -10.330 1.00 0.00 C ATOM 1347 OE1 GLU B 251 11.930 12.489 -10.081 1.00 0.00 O ATOM 1348 OE2 GLU B 251 13.409 13.632 -11.153 1.00 0.00 O ATOM 0 H GLU B 251 14.021 11.517 -5.497 1.00 0.00 H new ATOM 0 HA GLU B 251 13.116 10.146 -8.001 1.00 0.00 H new ATOM 0 HB2 GLU B 251 12.972 12.657 -7.886 1.00 0.00 H new ATOM 0 HB3 GLU B 251 14.694 12.730 -7.569 1.00 0.00 H new ATOM 0 HG2 GLU B 251 15.162 12.524 -9.791 1.00 0.00 H new ATOM 0 HG3 GLU B 251 14.254 11.028 -9.883 1.00 0.00 H new ATOM 1355 N ASP B 252 15.426 9.345 -8.714 1.00 0.00 N ATOM 1356 CA ASP B 252 16.731 8.661 -8.940 1.00 0.00 C ATOM 1357 C ASP B 252 17.817 9.696 -9.242 1.00 0.00 C ATOM 1358 O ASP B 252 18.946 9.349 -9.531 1.00 0.00 O ATOM 1359 CB ASP B 252 16.603 7.704 -10.125 1.00 0.00 C ATOM 1360 CG ASP B 252 15.987 6.385 -9.653 1.00 0.00 C ATOM 1361 OD1 ASP B 252 15.430 6.369 -8.569 1.00 0.00 O ATOM 1362 OD2 ASP B 252 16.083 5.414 -10.385 1.00 0.00 O ATOM 0 H ASP B 252 14.730 9.200 -9.445 1.00 0.00 H new ATOM 0 HA ASP B 252 17.004 8.105 -8.043 1.00 0.00 H new ATOM 0 HB2 ASP B 252 15.981 8.151 -10.901 1.00 0.00 H new ATOM 0 HB3 ASP B 252 17.583 7.522 -10.567 1.00 0.00 H new ATOM 1367 N GLY B 253 17.488 10.962 -9.193 1.00 0.00 N ATOM 1368 CA GLY B 253 18.507 12.013 -9.494 1.00 0.00 C ATOM 1369 C GLY B 253 18.726 12.923 -8.282 1.00 0.00 C ATOM 1370 O GLY B 253 18.842 14.124 -8.420 1.00 0.00 O ATOM 0 H GLY B 253 16.560 11.313 -8.958 1.00 0.00 H new ATOM 0 HA2 GLY B 253 19.449 11.542 -9.776 1.00 0.00 H new ATOM 0 HA3 GLY B 253 18.181 12.608 -10.347 1.00 0.00 H new ATOM 1374 N ARG B 254 18.798 12.370 -7.101 1.00 0.00 N ATOM 1375 CA ARG B 254 19.027 13.224 -5.897 1.00 0.00 C ATOM 1376 C ARG B 254 19.777 12.417 -4.834 1.00 0.00 C ATOM 1377 O ARG B 254 19.999 11.232 -4.983 1.00 0.00 O ATOM 1378 CB ARG B 254 17.684 13.697 -5.331 1.00 0.00 C ATOM 1379 CG ARG B 254 17.385 15.128 -5.793 1.00 0.00 C ATOM 1380 CD ARG B 254 15.873 15.304 -5.936 1.00 0.00 C ATOM 1381 NE ARG B 254 15.508 16.727 -5.683 1.00 0.00 N ATOM 1382 CZ ARG B 254 15.502 17.588 -6.665 1.00 0.00 C ATOM 1383 NH1 ARG B 254 15.843 17.211 -7.867 1.00 0.00 N ATOM 1384 NH2 ARG B 254 15.161 18.828 -6.442 1.00 0.00 N ATOM 0 H ARG B 254 18.709 11.371 -6.917 1.00 0.00 H new ATOM 0 HA ARG B 254 19.621 14.093 -6.180 1.00 0.00 H new ATOM 0 HB2 ARG B 254 16.888 13.028 -5.659 1.00 0.00 H new ATOM 0 HB3 ARG B 254 17.706 13.657 -4.242 1.00 0.00 H new ATOM 0 HG2 ARG B 254 17.780 15.845 -5.074 1.00 0.00 H new ATOM 0 HG3 ARG B 254 17.878 15.326 -6.745 1.00 0.00 H new ATOM 0 HD2 ARG B 254 15.556 15.009 -6.936 1.00 0.00 H new ATOM 0 HD3 ARG B 254 15.353 14.654 -5.232 1.00 0.00 H new ATOM 0 HE ARG B 254 15.262 17.029 -4.740 1.00 0.00 H new ATOM 0 HH11 ARG B 254 16.114 16.243 -8.040 1.00 0.00 H new ATOM 0 HH12 ARG B 254 15.838 17.884 -8.633 1.00 0.00 H new ATOM 0 HH21 ARG B 254 14.900 19.124 -5.501 1.00 0.00 H new ATOM 0 HH22 ARG B 254 15.156 19.501 -7.208 1.00 0.00 H new ATOM 1398 N THR B 255 20.184 13.059 -3.770 1.00 0.00 N ATOM 1399 CA THR B 255 20.937 12.342 -2.700 1.00 0.00 C ATOM 1400 C THR B 255 20.106 12.284 -1.418 1.00 0.00 C ATOM 1401 O THR B 255 19.215 13.081 -1.204 1.00 0.00 O ATOM 1402 CB THR B 255 22.240 13.088 -2.419 1.00 0.00 C ATOM 1403 OG1 THR B 255 21.941 14.380 -1.914 1.00 0.00 O ATOM 1404 CG2 THR B 255 23.044 13.220 -3.711 1.00 0.00 C ATOM 0 H THR B 255 20.027 14.052 -3.596 1.00 0.00 H new ATOM 0 HA THR B 255 21.150 11.326 -3.033 1.00 0.00 H new ATOM 0 HB THR B 255 22.825 12.534 -1.685 1.00 0.00 H new ATOM 0 HG1 THR B 255 22.285 14.462 -1.000 1.00 0.00 H new ATOM 0 HG21 THR B 255 23.973 13.753 -3.508 1.00 0.00 H new ATOM 0 HG22 THR B 255 23.272 12.228 -4.101 1.00 0.00 H new ATOM 0 HG23 THR B 255 22.461 13.774 -4.447 1.00 0.00 H new ATOM 1412 N LEU B 256 20.393 11.341 -0.562 1.00 0.00 N ATOM 1413 CA LEU B 256 19.624 11.228 0.707 1.00 0.00 C ATOM 1414 C LEU B 256 19.702 12.552 1.463 1.00 0.00 C ATOM 1415 O LEU B 256 18.721 13.040 1.987 1.00 0.00 O ATOM 1416 CB LEU B 256 20.222 10.121 1.580 1.00 0.00 C ATOM 1417 CG LEU B 256 20.572 8.910 0.716 1.00 0.00 C ATOM 1418 CD1 LEU B 256 20.828 7.697 1.614 1.00 0.00 C ATOM 1419 CD2 LEU B 256 19.415 8.603 -0.234 1.00 0.00 C ATOM 0 H LEU B 256 21.127 10.644 -0.688 1.00 0.00 H new ATOM 0 HA LEU B 256 18.586 10.989 0.477 1.00 0.00 H new ATOM 0 HB2 LEU B 256 21.115 10.488 2.087 1.00 0.00 H new ATOM 0 HB3 LEU B 256 19.511 9.833 2.355 1.00 0.00 H new ATOM 0 HG LEU B 256 21.468 9.130 0.136 1.00 0.00 H new ATOM 0 HD11 LEU B 256 21.078 6.834 0.997 1.00 0.00 H new ATOM 0 HD12 LEU B 256 21.656 7.912 2.289 1.00 0.00 H new ATOM 0 HD13 LEU B 256 19.933 7.480 2.196 1.00 0.00 H new ATOM 0 HD21 LEU B 256 19.668 7.739 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU B 256 18.517 8.386 0.344 1.00 0.00 H new ATOM 0 HD23 LEU B 256 19.233 9.465 -0.877 1.00 0.00 H new ATOM 1431 N SER B 257 20.865 13.139 1.523 1.00 0.00 N ATOM 1432 CA SER B 257 21.009 14.432 2.243 1.00 0.00 C ATOM 1433 C SER B 257 20.106 15.476 1.584 1.00 0.00 C ATOM 1434 O SER B 257 19.626 16.389 2.227 1.00 0.00 O ATOM 1435 CB SER B 257 22.467 14.884 2.178 1.00 0.00 C ATOM 1436 OG SER B 257 22.777 15.293 0.852 1.00 0.00 O ATOM 0 H SER B 257 21.722 12.778 1.104 1.00 0.00 H new ATOM 0 HA SER B 257 20.718 14.313 3.287 1.00 0.00 H new ATOM 0 HB2 SER B 257 22.635 15.707 2.873 1.00 0.00 H new ATOM 0 HB3 SER B 257 23.125 14.070 2.482 1.00 0.00 H new ATOM 0 HG SER B 257 23.712 15.584 0.810 1.00 0.00 H new ATOM 1442 N ASP B 258 19.857 15.340 0.309 1.00 0.00 N ATOM 1443 CA ASP B 258 18.970 16.317 -0.381 1.00 0.00 C ATOM 1444 C ASP B 258 17.541 16.133 0.131 1.00 0.00 C ATOM 1445 O ASP B 258 16.696 16.988 -0.035 1.00 0.00 O ATOM 1446 CB ASP B 258 19.005 16.072 -1.891 1.00 0.00 C ATOM 1447 CG ASP B 258 19.695 17.250 -2.582 1.00 0.00 C ATOM 1448 OD1 ASP B 258 20.749 17.650 -2.117 1.00 0.00 O ATOM 1449 OD2 ASP B 258 19.156 17.731 -3.566 1.00 0.00 O ATOM 0 H ASP B 258 20.229 14.596 -0.282 1.00 0.00 H new ATOM 0 HA ASP B 258 19.312 17.331 -0.177 1.00 0.00 H new ATOM 0 HB2 ASP B 258 19.538 15.146 -2.108 1.00 0.00 H new ATOM 0 HB3 ASP B 258 17.992 15.954 -2.275 1.00 0.00 H new ATOM 1454 N TYR B 259 17.271 15.019 0.761 1.00 0.00 N ATOM 1455 CA TYR B 259 15.900 14.774 1.294 1.00 0.00 C ATOM 1456 C TYR B 259 15.925 14.918 2.816 1.00 0.00 C ATOM 1457 O TYR B 259 14.925 14.748 3.484 1.00 0.00 O ATOM 1458 CB TYR B 259 15.458 13.358 0.922 1.00 0.00 C ATOM 1459 CG TYR B 259 15.001 13.334 -0.516 1.00 0.00 C ATOM 1460 CD1 TYR B 259 13.845 14.024 -0.896 1.00 0.00 C ATOM 1461 CD2 TYR B 259 15.735 12.619 -1.469 1.00 0.00 C ATOM 1462 CE1 TYR B 259 13.421 14.000 -2.229 1.00 0.00 C ATOM 1463 CE2 TYR B 259 15.310 12.594 -2.803 1.00 0.00 C ATOM 1464 CZ TYR B 259 14.153 13.283 -3.182 1.00 0.00 C ATOM 1465 OH TYR B 259 13.733 13.256 -4.497 1.00 0.00 O ATOM 0 H TYR B 259 17.942 14.269 0.929 1.00 0.00 H new ATOM 0 HA TYR B 259 15.202 15.494 0.868 1.00 0.00 H new ATOM 0 HB2 TYR B 259 16.282 12.659 1.064 1.00 0.00 H new ATOM 0 HB3 TYR B 259 14.649 13.034 1.577 1.00 0.00 H new ATOM 0 HD1 TYR B 259 13.279 14.576 -0.160 1.00 0.00 H new ATOM 0 HD2 TYR B 259 16.628 12.087 -1.176 1.00 0.00 H new ATOM 0 HE1 TYR B 259 12.529 14.534 -2.522 1.00 0.00 H new ATOM 0 HE2 TYR B 259 15.876 12.043 -3.540 1.00 0.00 H new ATOM 0 HH TYR B 259 13.362 14.130 -4.740 1.00 0.00 H new ATOM 1475 N ASN B 260 17.066 15.233 3.366 1.00 0.00 N ATOM 1476 CA ASN B 260 17.170 15.395 4.844 1.00 0.00 C ATOM 1477 C ASN B 260 16.940 14.047 5.533 1.00 0.00 C ATOM 1478 O ASN B 260 16.304 13.969 6.567 1.00 0.00 O ATOM 1479 CB ASN B 260 16.123 16.402 5.320 1.00 0.00 C ATOM 1480 CG ASN B 260 15.951 17.490 4.260 1.00 0.00 C ATOM 1481 OD1 ASN B 260 16.841 17.728 3.468 1.00 0.00 O ATOM 1482 ND2 ASN B 260 14.835 18.164 4.208 1.00 0.00 N ATOM 0 H ASN B 260 17.934 15.386 2.853 1.00 0.00 H new ATOM 0 HA ASN B 260 18.166 15.758 5.097 1.00 0.00 H new ATOM 0 HB2 ASN B 260 15.173 15.899 5.499 1.00 0.00 H new ATOM 0 HB3 ASN B 260 16.432 16.846 6.266 1.00 0.00 H new ATOM 0 HD21 ASN B 260 14.710 18.890 3.503 1.00 0.00 H new ATOM 0 HD22 ASN B 260 14.087 17.965 4.873 1.00 0.00 H new ATOM 1489 N ILE B 261 17.454 12.985 4.974 1.00 0.00 N ATOM 1490 CA ILE B 261 17.268 11.647 5.604 1.00 0.00 C ATOM 1491 C ILE B 261 18.431 11.368 6.557 1.00 0.00 C ATOM 1492 O ILE B 261 19.573 11.650 6.253 1.00 0.00 O ATOM 1493 CB ILE B 261 17.230 10.570 4.520 1.00 0.00 C ATOM 1494 CG1 ILE B 261 15.912 10.671 3.750 1.00 0.00 C ATOM 1495 CG2 ILE B 261 17.336 9.188 5.170 1.00 0.00 C ATOM 1496 CD1 ILE B 261 16.079 10.026 2.373 1.00 0.00 C ATOM 0 H ILE B 261 17.994 12.986 4.109 1.00 0.00 H new ATOM 0 HA ILE B 261 16.330 11.635 6.159 1.00 0.00 H new ATOM 0 HB ILE B 261 18.065 10.714 3.834 1.00 0.00 H new ATOM 0 HG12 ILE B 261 15.116 10.173 4.303 1.00 0.00 H new ATOM 0 HG13 ILE B 261 15.620 11.716 3.642 1.00 0.00 H new ATOM 0 HG21 ILE B 261 17.309 8.420 4.397 1.00 0.00 H new ATOM 0 HG22 ILE B 261 18.274 9.116 5.721 1.00 0.00 H new ATOM 0 HG23 ILE B 261 16.501 9.043 5.855 1.00 0.00 H new ATOM 0 HD11 ILE B 261 15.141 10.097 1.822 1.00 0.00 H new ATOM 0 HD12 ILE B 261 16.864 10.544 1.821 1.00 0.00 H new ATOM 0 HD13 ILE B 261 16.351 8.977 2.493 1.00 0.00 H new ATOM 1508 N GLN B 262 18.151 10.815 7.709 1.00 0.00 N ATOM 1509 CA GLN B 262 19.242 10.515 8.682 1.00 0.00 C ATOM 1510 C GLN B 262 19.203 9.035 9.060 1.00 0.00 C ATOM 1511 O GLN B 262 18.336 8.293 8.643 1.00 0.00 O ATOM 1512 CB GLN B 262 19.068 11.360 9.945 1.00 0.00 C ATOM 1513 CG GLN B 262 19.173 12.844 9.590 1.00 0.00 C ATOM 1514 CD GLN B 262 18.601 13.686 10.733 1.00 0.00 C ATOM 1515 OE1 GLN B 262 17.515 13.425 11.211 1.00 0.00 O ATOM 1516 NE2 GLN B 262 19.292 14.692 11.194 1.00 0.00 N ATOM 0 H GLN B 262 17.213 10.558 8.017 1.00 0.00 H new ATOM 0 HA GLN B 262 20.200 10.752 8.219 1.00 0.00 H new ATOM 0 HB2 GLN B 262 18.100 11.153 10.402 1.00 0.00 H new ATOM 0 HB3 GLN B 262 19.830 11.097 10.678 1.00 0.00 H new ATOM 0 HG2 GLN B 262 20.214 13.113 9.412 1.00 0.00 H new ATOM 0 HG3 GLN B 262 18.629 13.047 8.667 1.00 0.00 H new ATOM 0 HE21 GLN B 262 20.204 14.911 10.793 1.00 0.00 H new ATOM 0 HE22 GLN B 262 18.920 15.259 11.956 1.00 0.00 H new ATOM 1525 N LYS B 263 20.156 8.604 9.833 1.00 0.00 N ATOM 1526 CA LYS B 263 20.218 7.178 10.240 1.00 0.00 C ATOM 1527 C LYS B 263 18.899 6.732 10.865 1.00 0.00 C ATOM 1528 O LYS B 263 18.110 7.527 11.331 1.00 0.00 O ATOM 1529 CB LYS B 263 21.364 6.978 11.256 1.00 0.00 C ATOM 1530 CG LYS B 263 20.993 7.532 12.649 1.00 0.00 C ATOM 1531 CD LYS B 263 21.171 9.051 12.694 1.00 0.00 C ATOM 1532 CE LYS B 263 22.313 9.392 13.642 1.00 0.00 C ATOM 1533 NZ LYS B 263 21.891 9.140 15.048 1.00 0.00 N ATOM 0 H LYS B 263 20.905 9.188 10.205 1.00 0.00 H new ATOM 0 HA LYS B 263 20.402 6.574 9.351 1.00 0.00 H new ATOM 0 HB2 LYS B 263 21.598 5.917 11.337 1.00 0.00 H new ATOM 0 HB3 LYS B 263 22.263 7.476 10.894 1.00 0.00 H new ATOM 0 HG2 LYS B 263 19.960 7.275 12.884 1.00 0.00 H new ATOM 0 HG3 LYS B 263 21.619 7.065 13.410 1.00 0.00 H new ATOM 0 HD2 LYS B 263 21.384 9.434 11.696 1.00 0.00 H new ATOM 0 HD3 LYS B 263 20.250 9.528 13.029 1.00 0.00 H new ATOM 0 HE2 LYS B 263 23.190 8.790 13.402 1.00 0.00 H new ATOM 0 HE3 LYS B 263 22.600 10.436 13.520 1.00 0.00 H new ATOM 0 HZ1 LYS B 263 22.507 9.671 15.696 1.00 0.00 H new ATOM 0 HZ2 LYS B 263 20.906 9.449 15.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 263 21.965 8.124 15.256 1.00 0.00 H new ATOM 1547 N GLU B 264 18.699 5.448 10.907 1.00 0.00 N ATOM 1548 CA GLU B 264 17.475 4.885 11.542 1.00 0.00 C ATOM 1549 C GLU B 264 16.203 5.426 10.878 1.00 0.00 C ATOM 1550 O GLU B 264 15.110 5.216 11.366 1.00 0.00 O ATOM 1551 CB GLU B 264 17.479 5.256 13.029 1.00 0.00 C ATOM 1552 CG GLU B 264 18.749 4.711 13.687 1.00 0.00 C ATOM 1553 CD GLU B 264 18.975 5.417 15.026 1.00 0.00 C ATOM 1554 OE1 GLU B 264 18.231 5.140 15.953 1.00 0.00 O ATOM 1555 OE2 GLU B 264 19.890 6.220 15.102 1.00 0.00 O ATOM 0 H GLU B 264 19.340 4.753 10.523 1.00 0.00 H new ATOM 0 HA GLU B 264 17.481 3.802 11.419 1.00 0.00 H new ATOM 0 HB2 GLU B 264 17.432 6.339 13.145 1.00 0.00 H new ATOM 0 HB3 GLU B 264 16.597 4.845 13.520 1.00 0.00 H new ATOM 0 HG2 GLU B 264 18.658 3.636 13.842 1.00 0.00 H new ATOM 0 HG3 GLU B 264 19.606 4.868 13.032 1.00 0.00 H new ATOM 1562 N SER B 265 16.322 6.097 9.768 1.00 0.00 N ATOM 1563 CA SER B 265 15.095 6.614 9.093 1.00 0.00 C ATOM 1564 C SER B 265 14.385 5.446 8.405 1.00 0.00 C ATOM 1565 O SER B 265 15.011 4.491 7.989 1.00 0.00 O ATOM 1566 CB SER B 265 15.470 7.679 8.062 1.00 0.00 C ATOM 1567 OG SER B 265 15.550 8.944 8.705 1.00 0.00 O ATOM 0 H SER B 265 17.204 6.309 9.301 1.00 0.00 H new ATOM 0 HA SER B 265 14.433 7.067 9.830 1.00 0.00 H new ATOM 0 HB2 SER B 265 16.425 7.433 7.598 1.00 0.00 H new ATOM 0 HB3 SER B 265 14.727 7.709 7.265 1.00 0.00 H new ATOM 0 HG SER B 265 16.463 9.089 9.029 1.00 0.00 H new ATOM 1573 N THR B 266 13.082 5.510 8.294 1.00 0.00 N ATOM 1574 CA THR B 266 12.330 4.395 7.645 1.00 0.00 C ATOM 1575 C THR B 266 11.685 4.883 6.345 1.00 0.00 C ATOM 1576 O THR B 266 11.135 5.964 6.281 1.00 0.00 O ATOM 1577 CB THR B 266 11.238 3.891 8.593 1.00 0.00 C ATOM 1578 OG1 THR B 266 11.784 3.709 9.892 1.00 0.00 O ATOM 1579 CG2 THR B 266 10.685 2.560 8.080 1.00 0.00 C ATOM 0 H THR B 266 12.508 6.285 8.625 1.00 0.00 H new ATOM 0 HA THR B 266 13.024 3.585 7.420 1.00 0.00 H new ATOM 0 HB THR B 266 10.432 4.624 8.637 1.00 0.00 H new ATOM 0 HG1 THR B 266 11.085 3.388 10.499 1.00 0.00 H new ATOM 0 HG21 THR B 266 9.908 2.204 8.757 1.00 0.00 H new ATOM 0 HG22 THR B 266 10.263 2.701 7.085 1.00 0.00 H new ATOM 0 HG23 THR B 266 11.489 1.826 8.033 1.00 0.00 H new ATOM 1587 N LEU B 267 11.752 4.089 5.306 1.00 0.00 N ATOM 1588 CA LEU B 267 11.146 4.494 4.003 1.00 0.00 C ATOM 1589 C LEU B 267 10.154 3.420 3.547 1.00 0.00 C ATOM 1590 O LEU B 267 10.398 2.237 3.687 1.00 0.00 O ATOM 1591 CB LEU B 267 12.249 4.646 2.952 1.00 0.00 C ATOM 1592 CG LEU B 267 12.913 6.016 3.100 1.00 0.00 C ATOM 1593 CD1 LEU B 267 13.656 6.091 4.437 1.00 0.00 C ATOM 1594 CD2 LEU B 267 13.904 6.234 1.956 1.00 0.00 C ATOM 0 H LEU B 267 12.203 3.174 5.305 1.00 0.00 H new ATOM 0 HA LEU B 267 10.625 5.444 4.124 1.00 0.00 H new ATOM 0 HB2 LEU B 267 12.991 3.856 3.072 1.00 0.00 H new ATOM 0 HB3 LEU B 267 11.829 4.540 1.952 1.00 0.00 H new ATOM 0 HG LEU B 267 12.145 6.789 3.069 1.00 0.00 H new ATOM 0 HD11 LEU B 267 14.127 7.069 4.537 1.00 0.00 H new ATOM 0 HD12 LEU B 267 12.950 5.943 5.254 1.00 0.00 H new ATOM 0 HD13 LEU B 267 14.420 5.315 4.473 1.00 0.00 H new ATOM 0 HD21 LEU B 267 14.375 7.211 2.064 1.00 0.00 H new ATOM 0 HD22 LEU B 267 14.668 5.457 1.984 1.00 0.00 H new ATOM 0 HD23 LEU B 267 13.376 6.190 1.004 1.00 0.00 H new ATOM 1606 N HIS B 268 9.032 3.820 3.009 1.00 0.00 N ATOM 1607 CA HIS B 268 8.027 2.818 2.554 1.00 0.00 C ATOM 1608 C HIS B 268 8.307 2.421 1.102 1.00 0.00 C ATOM 1609 O HIS B 268 8.688 3.236 0.287 1.00 0.00 O ATOM 1610 CB HIS B 268 6.624 3.419 2.656 1.00 0.00 C ATOM 1611 CG HIS B 268 6.417 3.977 4.037 1.00 0.00 C ATOM 1612 ND1 HIS B 268 6.817 5.261 4.384 1.00 0.00 N ATOM 1613 CD2 HIS B 268 5.852 3.441 5.167 1.00 0.00 C ATOM 1614 CE1 HIS B 268 6.489 5.451 5.676 1.00 0.00 C ATOM 1615 NE2 HIS B 268 5.900 4.374 6.196 1.00 0.00 N ATOM 0 H HIS B 268 8.770 4.795 2.866 1.00 0.00 H new ATOM 0 HA HIS B 268 8.093 1.933 3.187 1.00 0.00 H new ATOM 0 HB2 HIS B 268 6.499 4.206 1.912 1.00 0.00 H new ATOM 0 HB3 HIS B 268 5.874 2.657 2.444 1.00 0.00 H new ATOM 0 HD2 HIS B 268 5.435 2.448 5.245 1.00 0.00 H new ATOM 0 HE1 HIS B 268 6.679 6.363 6.223 1.00 0.00 H new ATOM 0 HE2 HIS B 268 5.556 4.259 7.149 1.00 0.00 H new ATOM 1624 N LEU B 269 8.112 1.169 0.776 1.00 0.00 N ATOM 1625 CA LEU B 269 8.357 0.708 -0.621 1.00 0.00 C ATOM 1626 C LEU B 269 7.016 0.392 -1.288 1.00 0.00 C ATOM 1627 O LEU B 269 6.218 -0.362 -0.769 1.00 0.00 O ATOM 1628 CB LEU B 269 9.225 -0.554 -0.597 1.00 0.00 C ATOM 1629 CG LEU B 269 9.763 -0.837 -2.004 1.00 0.00 C ATOM 1630 CD1 LEU B 269 10.974 0.054 -2.295 1.00 0.00 C ATOM 1631 CD2 LEU B 269 10.177 -2.306 -2.105 1.00 0.00 C ATOM 0 H LEU B 269 7.793 0.445 1.420 1.00 0.00 H new ATOM 0 HA LEU B 269 8.870 1.490 -1.181 1.00 0.00 H new ATOM 0 HB2 LEU B 269 10.053 -0.425 0.100 1.00 0.00 H new ATOM 0 HB3 LEU B 269 8.640 -1.403 -0.243 1.00 0.00 H new ATOM 0 HG LEU B 269 8.981 -0.624 -2.733 1.00 0.00 H new ATOM 0 HD11 LEU B 269 11.348 -0.156 -3.297 1.00 0.00 H new ATOM 0 HD12 LEU B 269 10.679 1.101 -2.230 1.00 0.00 H new ATOM 0 HD13 LEU B 269 11.758 -0.148 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU B 269 10.560 -2.508 -3.105 1.00 0.00 H new ATOM 0 HD22 LEU B 269 10.954 -2.516 -1.370 1.00 0.00 H new ATOM 0 HD23 LEU B 269 9.313 -2.942 -1.912 1.00 0.00 H new ATOM 1643 N VAL B 270 6.764 0.965 -2.436 1.00 0.00 N ATOM 1644 CA VAL B 270 5.473 0.705 -3.139 1.00 0.00 C ATOM 1645 C VAL B 270 5.739 -0.047 -4.444 1.00 0.00 C ATOM 1646 O VAL B 270 6.554 0.358 -5.250 1.00 0.00 O ATOM 1647 CB VAL B 270 4.787 2.036 -3.450 1.00 0.00 C ATOM 1648 CG1 VAL B 270 3.802 1.848 -4.605 1.00 0.00 C ATOM 1649 CG2 VAL B 270 4.030 2.518 -2.211 1.00 0.00 C ATOM 0 H VAL B 270 7.398 1.603 -2.918 1.00 0.00 H new ATOM 0 HA VAL B 270 4.829 0.102 -2.500 1.00 0.00 H new ATOM 0 HB VAL B 270 5.538 2.774 -3.731 1.00 0.00 H new ATOM 0 HG11 VAL B 270 3.314 2.797 -4.825 1.00 0.00 H new ATOM 0 HG12 VAL B 270 4.339 1.502 -5.488 1.00 0.00 H new ATOM 0 HG13 VAL B 270 3.050 1.110 -4.326 1.00 0.00 H new ATOM 0 HG21 VAL B 270 3.540 3.467 -2.430 1.00 0.00 H new ATOM 0 HG22 VAL B 270 3.280 1.778 -1.932 1.00 0.00 H new ATOM 0 HG23 VAL B 270 4.730 2.653 -1.387 1.00 0.00 H new ATOM 1659 N LEU B 271 5.055 -1.138 -4.661 1.00 0.00 N ATOM 1660 CA LEU B 271 5.267 -1.911 -5.916 1.00 0.00 C ATOM 1661 C LEU B 271 4.457 -1.273 -7.046 1.00 0.00 C ATOM 1662 O LEU B 271 3.368 -0.776 -6.838 1.00 0.00 O ATOM 1663 CB LEU B 271 4.815 -3.358 -5.714 1.00 0.00 C ATOM 1664 CG LEU B 271 5.865 -4.114 -4.898 1.00 0.00 C ATOM 1665 CD1 LEU B 271 5.331 -5.502 -4.539 1.00 0.00 C ATOM 1666 CD2 LEU B 271 7.149 -4.264 -5.720 1.00 0.00 C ATOM 0 H LEU B 271 4.360 -1.526 -4.024 1.00 0.00 H new ATOM 0 HA LEU B 271 6.326 -1.900 -6.174 1.00 0.00 H new ATOM 0 HB2 LEU B 271 3.854 -3.381 -5.200 1.00 0.00 H new ATOM 0 HB3 LEU B 271 4.672 -3.843 -6.680 1.00 0.00 H new ATOM 0 HG LEU B 271 6.080 -3.556 -3.986 1.00 0.00 H new ATOM 0 HD11 LEU B 271 6.079 -6.041 -3.958 1.00 0.00 H new ATOM 0 HD12 LEU B 271 4.419 -5.400 -3.951 1.00 0.00 H new ATOM 0 HD13 LEU B 271 5.114 -6.056 -5.452 1.00 0.00 H new ATOM 0 HD21 LEU B 271 7.894 -4.803 -5.135 1.00 0.00 H new ATOM 0 HD22 LEU B 271 6.934 -4.819 -6.633 1.00 0.00 H new ATOM 0 HD23 LEU B 271 7.534 -3.277 -5.977 1.00 0.00 H new ATOM 1678 N ARG B 272 4.985 -1.276 -8.236 1.00 0.00 N ATOM 1679 CA ARG B 272 4.256 -0.665 -9.383 1.00 0.00 C ATOM 1680 C ARG B 272 3.503 -1.772 -10.128 1.00 0.00 C ATOM 1681 O ARG B 272 2.877 -2.617 -9.521 1.00 0.00 O ATOM 1682 CB ARG B 272 5.282 -0.007 -10.306 1.00 0.00 C ATOM 1683 CG ARG B 272 4.639 1.039 -11.218 1.00 0.00 C ATOM 1684 CD ARG B 272 5.762 1.891 -11.812 1.00 0.00 C ATOM 1685 NE ARG B 272 5.272 2.636 -13.000 1.00 0.00 N ATOM 1686 CZ ARG B 272 6.122 2.998 -13.923 1.00 0.00 C ATOM 1687 NH1 ARG B 272 7.392 2.739 -13.779 1.00 0.00 N ATOM 1688 NH2 ARG B 272 5.705 3.617 -14.987 1.00 0.00 N ATOM 0 H ARG B 272 5.894 -1.677 -8.466 1.00 0.00 H new ATOM 0 HA ARG B 272 3.542 0.084 -9.041 1.00 0.00 H new ATOM 0 HB2 ARG B 272 6.061 0.464 -9.706 1.00 0.00 H new ATOM 0 HB3 ARG B 272 5.766 -0.771 -10.914 1.00 0.00 H new ATOM 0 HG2 ARG B 272 4.066 0.556 -12.009 1.00 0.00 H new ATOM 0 HG3 ARG B 272 3.943 1.661 -10.655 1.00 0.00 H new ATOM 0 HD2 ARG B 272 6.132 2.591 -11.063 1.00 0.00 H new ATOM 0 HD3 ARG B 272 6.600 1.254 -12.094 1.00 0.00 H new ATOM 0 HE ARG B 272 4.282 2.862 -13.094 1.00 0.00 H new ATOM 0 HH11 ARG B 272 7.722 2.253 -12.945 1.00 0.00 H new ATOM 0 HH12 ARG B 272 8.055 3.022 -14.500 1.00 0.00 H new ATOM 0 HH21 ARG B 272 4.712 3.821 -15.102 1.00 0.00 H new ATOM 0 HH22 ARG B 272 6.370 3.899 -15.707 1.00 0.00 H new ATOM 1702 N LEU B 273 3.554 -1.774 -11.433 1.00 0.00 N ATOM 1703 CA LEU B 273 2.836 -2.824 -12.209 1.00 0.00 C ATOM 1704 C LEU B 273 3.840 -3.560 -13.098 1.00 0.00 C ATOM 1705 O LEU B 273 3.654 -4.712 -13.437 1.00 0.00 O ATOM 1706 CB LEU B 273 1.766 -2.170 -13.087 1.00 0.00 C ATOM 1707 CG LEU B 273 0.875 -1.262 -12.233 1.00 0.00 C ATOM 1708 CD1 LEU B 273 -0.105 -0.516 -13.139 1.00 0.00 C ATOM 1709 CD2 LEU B 273 0.093 -2.101 -11.222 1.00 0.00 C ATOM 0 H LEU B 273 4.063 -1.092 -11.995 1.00 0.00 H new ATOM 0 HA LEU B 273 2.362 -3.527 -11.524 1.00 0.00 H new ATOM 0 HB2 LEU B 273 2.238 -1.590 -13.880 1.00 0.00 H new ATOM 0 HB3 LEU B 273 1.161 -2.937 -13.571 1.00 0.00 H new ATOM 0 HG LEU B 273 1.500 -0.547 -11.698 1.00 0.00 H new ATOM 0 HD11 LEU B 273 -0.740 0.131 -12.534 1.00 0.00 H new ATOM 0 HD12 LEU B 273 0.450 0.089 -13.856 1.00 0.00 H new ATOM 0 HD13 LEU B 273 -0.725 -1.235 -13.674 1.00 0.00 H new ATOM 0 HD21 LEU B 273 -0.538 -1.449 -10.619 1.00 0.00 H new ATOM 0 HD22 LEU B 273 -0.531 -2.821 -11.752 1.00 0.00 H new ATOM 0 HD23 LEU B 273 0.790 -2.633 -10.574 1.00 0.00 H new ATOM 1721 N ARG B 274 4.904 -2.907 -13.471 1.00 0.00 N ATOM 1722 CA ARG B 274 5.921 -3.571 -14.333 1.00 0.00 C ATOM 1723 C ARG B 274 6.363 -4.877 -13.670 1.00 0.00 C ATOM 1724 O ARG B 274 5.796 -5.926 -13.904 1.00 0.00 O ATOM 1725 CB ARG B 274 7.129 -2.641 -14.499 1.00 0.00 C ATOM 1726 CG ARG B 274 8.045 -3.146 -15.628 1.00 0.00 C ATOM 1727 CD ARG B 274 9.070 -4.161 -15.094 1.00 0.00 C ATOM 1728 NE ARG B 274 8.453 -5.517 -15.041 1.00 0.00 N ATOM 1729 CZ ARG B 274 9.093 -6.506 -14.478 1.00 0.00 C ATOM 1730 NH1 ARG B 274 10.283 -6.314 -13.977 1.00 0.00 N ATOM 1731 NH2 ARG B 274 8.545 -7.688 -14.419 1.00 0.00 N ATOM 0 H ARG B 274 5.114 -1.942 -13.216 1.00 0.00 H new ATOM 0 HA ARG B 274 5.494 -3.786 -15.313 1.00 0.00 H new ATOM 0 HB2 ARG B 274 6.789 -1.630 -14.723 1.00 0.00 H new ATOM 0 HB3 ARG B 274 7.688 -2.590 -13.564 1.00 0.00 H new ATOM 0 HG2 ARG B 274 7.443 -3.609 -16.410 1.00 0.00 H new ATOM 0 HG3 ARG B 274 8.565 -2.303 -16.083 1.00 0.00 H new ATOM 0 HD2 ARG B 274 9.950 -4.176 -15.737 1.00 0.00 H new ATOM 0 HD3 ARG B 274 9.406 -3.865 -14.100 1.00 0.00 H new ATOM 0 HE ARG B 274 7.529 -5.672 -15.445 1.00 0.00 H new ATOM 0 HH11 ARG B 274 10.714 -5.391 -14.025 1.00 0.00 H new ATOM 0 HH12 ARG B 274 10.782 -7.087 -13.537 1.00 0.00 H new ATOM 0 HH21 ARG B 274 7.616 -7.840 -14.813 1.00 0.00 H new ATOM 0 HH22 ARG B 274 9.045 -8.461 -13.979 1.00 0.00 H new TER 1745 ARG B 274