USER MOD reduce.3.24.130724 H: found=0, std=0, add=883, rem=0, adj=24 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 108:sc= 0.217 USER MOD Set 1.2: B 257 SER OG : rot -100:sc= 0.631 USER MOD Set 2.1: B 207 THR OG1 : rot 168:sc= -0.694 USER MOD Set 2.2: 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 -42:sc= 0.00233 USER MOD Single : A 71 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.015) USER MOD Single : A 74 TYR OH : rot 113:sc= -0.0601 USER MOD Single : A 81 GLN : amide:sc= 0.00149 X(o=0.0015,f=-0.33) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 201 MET CE :methyl 157:sc= -0.61 (180deg=-0.842) USER MOD Single : B 202 GLN :FLIP amide:sc=-0.00704 F(o=-0.99!,f=-0.007) USER MOD Single : B 206 LYS NZ :NH3+ 145:sc= 0.162 (180deg=0) USER MOD Single : B 211 LYS NZ :NH3+ -145:sc= -0.317 (180deg=-1.26!) 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 222 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 ASN : amide:sc= -0.0842 K(o=-0.084,f=-1.3!) USER MOD Single : B 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 229 LYS NZ :NH3+ -135:sc= 0.134 (180deg=-0.00981) USER MOD Single : B 231 GLN :FLIP amide:sc= -0.786 F(o=-3.4!,f=-0.79) USER MOD Single : B 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 GLN :FLIP amide:sc= -0.509 F(o=-2,f=-0.51) USER MOD Single : B 241 GLN : amide:sc= -4.19 K(o=-4.2,f=-7.4!) USER MOD Single : B 248 LYS NZ :NH3+ -136:sc= -1.03 (180deg=-1.69!) USER MOD Single : B 249 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 259 TYR OH : rot 30:sc= -0.148 USER MOD Single : B 260 ASN : amide:sc= -5.93! C(o=-5.9!,f=-5.7!) USER MOD Single : B 262 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.49) USER MOD Single : B 263 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0434) USER MOD Single : B 265 SER OG : rot -109:sc= -1.97! USER MOD Single : B 266 THR OG1 : rot 180:sc= 0 USER MOD Single : B 268 HIS : no HD1:sc= -1.95 K(o=-1.9,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 61 -16.120 -1.089 3.810 1.00 0.00 N ATOM 2 CA LYS A 61 -15.397 -2.382 3.956 1.00 0.00 C ATOM 3 C LYS A 61 -14.175 -2.396 3.036 1.00 0.00 C ATOM 4 O LYS A 61 -14.298 -2.301 1.831 1.00 0.00 O ATOM 5 CB LYS A 61 -16.331 -3.532 3.570 1.00 0.00 C ATOM 6 CG LYS A 61 -17.322 -3.800 4.708 1.00 0.00 C ATOM 7 CD LYS A 61 -16.679 -4.721 5.752 1.00 0.00 C ATOM 8 CE LYS A 61 -17.739 -5.159 6.764 1.00 0.00 C ATOM 9 NZ LYS A 61 -17.087 -5.429 8.077 1.00 0.00 N ATOM 0 HA LYS A 61 -15.074 -2.500 4.990 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -16.871 -3.283 2.656 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.750 -4.431 3.362 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -17.619 -2.860 5.173 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -18.228 -4.260 4.313 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -16.243 -5.593 5.265 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -15.867 -4.201 6.261 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -18.496 -4.382 6.874 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -18.250 -6.054 6.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -17.806 -5.727 8.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -16.381 -6.184 7.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -16.619 -4.565 8.416 1.00 0.00 H new ATOM 23 N ILE A 62 -12.998 -2.519 3.591 1.00 0.00 N ATOM 24 CA ILE A 62 -11.773 -2.545 2.739 1.00 0.00 C ATOM 25 C ILE A 62 -11.194 -3.960 2.701 1.00 0.00 C ATOM 26 O ILE A 62 -11.068 -4.621 3.712 1.00 0.00 O ATOM 27 CB ILE A 62 -10.721 -1.588 3.299 1.00 0.00 C ATOM 28 CG1 ILE A 62 -11.351 -0.207 3.514 1.00 0.00 C ATOM 29 CG2 ILE A 62 -9.571 -1.480 2.293 1.00 0.00 C ATOM 30 CD1 ILE A 62 -10.303 0.755 4.082 1.00 0.00 C ATOM 0 H ILE A 62 -12.832 -2.602 4.594 1.00 0.00 H new ATOM 0 HA ILE A 62 -12.045 -2.234 1.730 1.00 0.00 H new ATOM 0 HB ILE A 62 -10.345 -1.961 4.252 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.738 0.178 2.571 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -12.196 -0.285 4.198 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -8.812 -0.800 2.680 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -9.130 -2.465 2.137 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -9.951 -1.099 1.345 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -10.754 1.736 4.234 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -9.937 0.373 5.035 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -9.472 0.842 3.382 1.00 0.00 H new ATOM 42 N THR A 63 -10.834 -4.421 1.536 1.00 0.00 N ATOM 43 CA THR A 63 -10.250 -5.786 1.407 1.00 0.00 C ATOM 44 C THR A 63 -8.819 -5.665 0.883 1.00 0.00 C ATOM 45 O THR A 63 -8.572 -5.046 -0.132 1.00 0.00 O ATOM 46 CB THR A 63 -11.086 -6.605 0.420 1.00 0.00 C ATOM 47 OG1 THR A 63 -12.437 -6.639 0.859 1.00 0.00 O ATOM 48 CG2 THR A 63 -10.538 -8.030 0.341 1.00 0.00 C ATOM 0 H THR A 63 -10.920 -3.906 0.660 1.00 0.00 H new ATOM 0 HA THR A 63 -10.248 -6.282 2.378 1.00 0.00 H new ATOM 0 HB THR A 63 -11.035 -6.144 -0.567 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.973 -7.162 0.227 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.135 -8.611 -0.362 1.00 0.00 H new ATOM 0 HG22 THR A 63 -9.502 -8.003 0.002 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.586 -8.493 1.326 1.00 0.00 H new ATOM 56 N PHE A 64 -7.873 -6.249 1.572 1.00 0.00 N ATOM 57 CA PHE A 64 -6.455 -6.167 1.119 1.00 0.00 C ATOM 58 C PHE A 64 -5.967 -7.565 0.699 1.00 0.00 C ATOM 59 O PHE A 64 -6.186 -8.529 1.407 1.00 0.00 O ATOM 60 CB PHE A 64 -5.576 -5.680 2.275 1.00 0.00 C ATOM 61 CG PHE A 64 -5.965 -4.277 2.680 1.00 0.00 C ATOM 62 CD1 PHE A 64 -5.695 -3.199 1.828 1.00 0.00 C ATOM 63 CD2 PHE A 64 -6.584 -4.054 3.916 1.00 0.00 C ATOM 64 CE1 PHE A 64 -6.043 -1.898 2.215 1.00 0.00 C ATOM 65 CE2 PHE A 64 -6.933 -2.755 4.300 1.00 0.00 C ATOM 66 CZ PHE A 64 -6.661 -1.677 3.450 1.00 0.00 C ATOM 0 H PHE A 64 -8.023 -6.780 2.430 1.00 0.00 H new ATOM 0 HA PHE A 64 -6.391 -5.476 0.278 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -5.679 -6.353 3.127 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -4.528 -5.702 1.977 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.219 -3.370 0.874 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -6.792 -4.885 4.573 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -5.834 -1.066 1.559 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.412 -2.584 5.253 1.00 0.00 H new ATOM 0 HZ PHE A 64 -6.928 -0.674 3.748 1.00 0.00 H new ATOM 76 N PRO A 65 -5.285 -7.686 -0.420 1.00 0.00 N ATOM 77 CA PRO A 65 -4.741 -8.999 -0.883 1.00 0.00 C ATOM 78 C PRO A 65 -3.992 -9.753 0.222 1.00 0.00 C ATOM 79 O PRO A 65 -3.640 -9.203 1.246 1.00 0.00 O ATOM 80 CB PRO A 65 -3.762 -8.623 -1.992 1.00 0.00 C ATOM 81 CG PRO A 65 -4.222 -7.303 -2.512 1.00 0.00 C ATOM 82 CD PRO A 65 -4.968 -6.604 -1.374 1.00 0.00 C ATOM 0 HA PRO A 65 -5.545 -9.663 -1.202 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.744 -8.559 -1.609 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -3.759 -9.374 -2.782 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.374 -6.703 -2.842 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -4.874 -7.436 -3.375 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.352 -5.834 -0.910 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -5.873 -6.115 -1.734 1.00 0.00 H new ATOM 90 N SER A 66 -3.748 -11.015 0.002 1.00 0.00 N ATOM 91 CA SER A 66 -3.020 -11.844 1.008 1.00 0.00 C ATOM 92 C SER A 66 -1.575 -11.355 1.161 1.00 0.00 C ATOM 93 O SER A 66 -0.893 -11.719 2.098 1.00 0.00 O ATOM 94 CB SER A 66 -3.001 -13.299 0.537 1.00 0.00 C ATOM 95 OG SER A 66 -2.786 -14.150 1.656 1.00 0.00 O ATOM 0 H SER A 66 -4.025 -11.515 -0.843 1.00 0.00 H new ATOM 0 HA SER A 66 -3.529 -11.760 1.968 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.944 -13.549 0.051 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.213 -13.444 -0.202 1.00 0.00 H new ATOM 0 HG SER A 66 -2.103 -13.757 2.239 1.00 0.00 H new ATOM 101 N ASP A 67 -1.096 -10.548 0.251 1.00 0.00 N ATOM 102 CA ASP A 67 0.315 -10.060 0.357 1.00 0.00 C ATOM 103 C ASP A 67 0.341 -8.575 0.733 1.00 0.00 C ATOM 104 O ASP A 67 1.378 -7.945 0.708 1.00 0.00 O ATOM 105 CB ASP A 67 1.021 -10.251 -0.986 1.00 0.00 C ATOM 106 CG ASP A 67 0.773 -11.669 -1.502 1.00 0.00 C ATOM 107 OD1 ASP A 67 -0.377 -12.073 -1.536 1.00 0.00 O ATOM 108 OD2 ASP A 67 1.737 -12.327 -1.855 1.00 0.00 O ATOM 0 H ASP A 67 -1.616 -10.206 -0.557 1.00 0.00 H new ATOM 0 HA ASP A 67 0.826 -10.631 1.132 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.654 -9.522 -1.708 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.091 -10.077 -0.873 1.00 0.00 H new ATOM 113 N ILE A 68 -0.786 -8.010 1.065 1.00 0.00 N ATOM 114 CA ILE A 68 -0.820 -6.560 1.422 1.00 0.00 C ATOM 115 C ILE A 68 -1.143 -6.366 2.905 1.00 0.00 C ATOM 116 O ILE A 68 -2.103 -6.901 3.426 1.00 0.00 O ATOM 117 CB ILE A 68 -1.885 -5.860 0.576 1.00 0.00 C ATOM 118 CG1 ILE A 68 -1.446 -5.823 -0.898 1.00 0.00 C ATOM 119 CG2 ILE A 68 -2.108 -4.435 1.086 1.00 0.00 C ATOM 120 CD1 ILE A 68 -0.102 -5.099 -1.044 1.00 0.00 C ATOM 0 H ILE A 68 -1.686 -8.488 1.105 1.00 0.00 H new ATOM 0 HA ILE A 68 0.162 -6.131 1.225 1.00 0.00 H new ATOM 0 HB ILE A 68 -2.819 -6.416 0.656 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.361 -6.839 -1.283 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.204 -5.317 -1.496 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.868 -3.945 0.477 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.440 -4.468 2.124 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -1.175 -3.875 1.021 1.00 0.00 H new ATOM 0 HD11 ILE A 68 0.191 -5.084 -2.094 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.198 -4.076 -0.679 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.658 -5.622 -0.463 1.00 0.00 H new ATOM 132 N ASP A 69 -0.345 -5.582 3.579 1.00 0.00 N ATOM 133 CA ASP A 69 -0.587 -5.316 5.026 1.00 0.00 C ATOM 134 C ASP A 69 -1.287 -3.953 5.171 1.00 0.00 C ATOM 135 O ASP A 69 -0.939 -3.007 4.494 1.00 0.00 O ATOM 136 CB ASP A 69 0.751 -5.280 5.768 1.00 0.00 C ATOM 137 CG ASP A 69 0.517 -4.904 7.232 1.00 0.00 C ATOM 138 OD1 ASP A 69 0.081 -3.791 7.473 1.00 0.00 O ATOM 139 OD2 ASP A 69 0.776 -5.736 8.086 1.00 0.00 O ATOM 0 H ASP A 69 0.470 -5.111 3.186 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.213 -6.102 5.447 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.239 -6.253 5.706 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.419 -4.558 5.299 1.00 0.00 H new ATOM 144 N PRO A 70 -2.265 -3.845 6.042 1.00 0.00 N ATOM 145 CA PRO A 70 -3.007 -2.564 6.254 1.00 0.00 C ATOM 146 C PRO A 70 -2.149 -1.503 6.956 1.00 0.00 C ATOM 147 O PRO A 70 -2.105 -0.355 6.559 1.00 0.00 O ATOM 148 CB PRO A 70 -4.182 -2.965 7.150 1.00 0.00 C ATOM 149 CG PRO A 70 -3.748 -4.210 7.849 1.00 0.00 C ATOM 150 CD PRO A 70 -2.771 -4.918 6.913 1.00 0.00 C ATOM 0 HA PRO A 70 -3.309 -2.115 5.308 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -4.417 -2.176 7.865 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -5.082 -3.140 6.561 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.271 -3.974 8.800 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -4.603 -4.848 8.071 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -1.963 -5.395 7.467 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -3.267 -5.699 6.336 1.00 0.00 H new ATOM 158 N GLN A 71 -1.479 -1.891 8.003 1.00 0.00 N ATOM 159 CA GLN A 71 -0.623 -0.931 8.761 1.00 0.00 C ATOM 160 C GLN A 71 0.323 -0.185 7.813 1.00 0.00 C ATOM 161 O GLN A 71 0.491 1.012 7.920 1.00 0.00 O ATOM 162 CB GLN A 71 0.200 -1.696 9.800 1.00 0.00 C ATOM 163 CG GLN A 71 1.221 -0.753 10.439 1.00 0.00 C ATOM 164 CD GLN A 71 1.280 -1.007 11.947 1.00 0.00 C ATOM 165 OE1 GLN A 71 2.332 -1.287 12.485 1.00 0.00 O ATOM 166 NE2 GLN A 71 0.188 -0.921 12.654 1.00 0.00 N ATOM 0 H GLN A 71 -1.486 -2.842 8.372 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.267 -0.204 9.256 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.456 -2.111 10.565 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.710 -2.536 9.328 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.204 -0.910 9.995 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.945 0.284 10.245 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.695 -0.686 12.201 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.217 -1.089 13.660 1.00 0.00 H new ATOM 175 N VAL A 72 0.951 -0.868 6.898 1.00 0.00 N ATOM 176 CA VAL A 72 1.887 -0.163 5.972 1.00 0.00 C ATOM 177 C VAL A 72 1.102 0.551 4.870 1.00 0.00 C ATOM 178 O VAL A 72 1.576 1.497 4.273 1.00 0.00 O ATOM 179 CB VAL A 72 2.845 -1.171 5.334 1.00 0.00 C ATOM 180 CG1 VAL A 72 3.874 -0.421 4.486 1.00 0.00 C ATOM 181 CG2 VAL A 72 3.570 -1.951 6.432 1.00 0.00 C ATOM 0 H VAL A 72 0.860 -1.873 6.750 1.00 0.00 H new ATOM 0 HA VAL A 72 2.455 0.571 6.544 1.00 0.00 H new ATOM 0 HB VAL A 72 2.282 -1.862 4.706 1.00 0.00 H new ATOM 0 HG11 VAL A 72 4.559 -1.135 4.029 1.00 0.00 H new ATOM 0 HG12 VAL A 72 3.362 0.141 3.705 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.435 0.266 5.119 1.00 0.00 H new ATOM 0 HG21 VAL A 72 4.253 -2.669 5.978 1.00 0.00 H new ATOM 0 HG22 VAL A 72 4.134 -1.259 7.057 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.840 -2.481 7.044 1.00 0.00 H new ATOM 191 N PHE A 73 -0.086 0.100 4.582 1.00 0.00 N ATOM 192 CA PHE A 73 -0.892 0.744 3.505 1.00 0.00 C ATOM 193 C PHE A 73 -1.370 2.133 3.943 1.00 0.00 C ATOM 194 O PHE A 73 -1.207 3.106 3.234 1.00 0.00 O ATOM 195 CB PHE A 73 -2.107 -0.134 3.202 1.00 0.00 C ATOM 196 CG PHE A 73 -2.705 0.285 1.884 1.00 0.00 C ATOM 197 CD1 PHE A 73 -1.964 0.141 0.708 1.00 0.00 C ATOM 198 CD2 PHE A 73 -3.996 0.823 1.839 1.00 0.00 C ATOM 199 CE1 PHE A 73 -2.512 0.541 -0.515 1.00 0.00 C ATOM 200 CE2 PHE A 73 -4.544 1.218 0.613 1.00 0.00 C ATOM 201 CZ PHE A 73 -3.799 1.078 -0.563 1.00 0.00 C ATOM 0 H PHE A 73 -0.536 -0.689 5.046 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.271 0.854 2.616 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -1.812 -1.183 3.164 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -2.847 -0.039 3.997 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.969 -0.279 0.743 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.568 0.933 2.748 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.938 0.434 -1.424 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.541 1.631 0.575 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.220 1.386 -1.509 1.00 0.00 H new ATOM 211 N TYR A 74 -1.977 2.230 5.089 1.00 0.00 N ATOM 212 CA TYR A 74 -2.480 3.556 5.545 1.00 0.00 C ATOM 213 C TYR A 74 -1.309 4.525 5.735 1.00 0.00 C ATOM 214 O TYR A 74 -1.495 5.723 5.797 1.00 0.00 O ATOM 215 CB TYR A 74 -3.250 3.398 6.857 1.00 0.00 C ATOM 216 CG TYR A 74 -4.465 2.533 6.623 1.00 0.00 C ATOM 217 CD1 TYR A 74 -5.461 2.946 5.727 1.00 0.00 C ATOM 218 CD2 TYR A 74 -4.596 1.315 7.300 1.00 0.00 C ATOM 219 CE1 TYR A 74 -6.585 2.140 5.509 1.00 0.00 C ATOM 220 CE2 TYR A 74 -5.720 0.508 7.081 1.00 0.00 C ATOM 221 CZ TYR A 74 -6.715 0.922 6.186 1.00 0.00 C ATOM 222 OH TYR A 74 -7.821 0.127 5.968 1.00 0.00 O ATOM 0 H TYR A 74 -2.147 1.454 5.729 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.151 3.961 4.787 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.610 2.948 7.616 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.552 4.375 7.234 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.361 3.886 5.205 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.830 0.997 7.992 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -7.352 2.458 4.818 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -5.819 -0.433 7.602 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.546 -0.701 5.521 1.00 0.00 H new ATOM 232 N GLU A 75 -0.105 4.027 5.822 1.00 0.00 N ATOM 233 CA GLU A 75 1.062 4.938 6.004 1.00 0.00 C ATOM 234 C GLU A 75 1.505 5.495 4.646 1.00 0.00 C ATOM 235 O GLU A 75 2.364 6.352 4.569 1.00 0.00 O ATOM 236 CB GLU A 75 2.220 4.159 6.627 1.00 0.00 C ATOM 237 CG GLU A 75 1.825 3.687 8.027 1.00 0.00 C ATOM 238 CD GLU A 75 2.805 2.610 8.496 1.00 0.00 C ATOM 239 OE1 GLU A 75 3.859 2.493 7.892 1.00 0.00 O ATOM 240 OE2 GLU A 75 2.485 1.920 9.449 1.00 0.00 O ATOM 0 H GLU A 75 0.121 3.033 5.775 1.00 0.00 H new ATOM 0 HA GLU A 75 0.774 5.762 6.657 1.00 0.00 H new ATOM 0 HB2 GLU A 75 2.474 3.303 6.002 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.108 4.789 6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.832 4.527 8.721 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.810 3.290 8.016 1.00 0.00 H new ATOM 247 N LEU A 76 0.935 5.012 3.575 1.00 0.00 N ATOM 248 CA LEU A 76 1.335 5.513 2.225 1.00 0.00 C ATOM 249 C LEU A 76 0.476 6.725 1.844 1.00 0.00 C ATOM 250 O LEU A 76 -0.657 6.840 2.267 1.00 0.00 O ATOM 251 CB LEU A 76 1.124 4.402 1.194 1.00 0.00 C ATOM 252 CG LEU A 76 2.115 3.264 1.455 1.00 0.00 C ATOM 253 CD1 LEU A 76 1.820 2.105 0.505 1.00 0.00 C ATOM 254 CD2 LEU A 76 3.543 3.760 1.218 1.00 0.00 C ATOM 0 H LEU A 76 0.211 4.294 3.575 1.00 0.00 H new ATOM 0 HA LEU A 76 2.384 5.807 2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.102 4.028 1.252 1.00 0.00 H new ATOM 0 HB3 LEU A 76 1.263 4.795 0.187 1.00 0.00 H new ATOM 0 HG LEU A 76 2.014 2.928 2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.525 1.294 0.690 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.804 1.747 0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.920 2.445 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.246 2.948 1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.644 4.098 0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.757 4.588 1.894 1.00 0.00 H new ATOM 266 N PRO A 77 1.003 7.623 1.040 1.00 0.00 N ATOM 267 CA PRO A 77 0.255 8.836 0.598 1.00 0.00 C ATOM 268 C PRO A 77 -1.092 8.477 -0.038 1.00 0.00 C ATOM 269 O PRO A 77 -1.273 7.397 -0.562 1.00 0.00 O ATOM 270 CB PRO A 77 1.173 9.509 -0.431 1.00 0.00 C ATOM 271 CG PRO A 77 2.251 8.519 -0.738 1.00 0.00 C ATOM 272 CD PRO A 77 2.355 7.591 0.467 1.00 0.00 C ATOM 0 HA PRO A 77 0.020 9.486 1.441 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.620 9.774 -1.332 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.594 10.432 -0.032 1.00 0.00 H new ATOM 0 HG2 PRO A 77 2.013 7.956 -1.640 1.00 0.00 H new ATOM 0 HG3 PRO A 77 3.200 9.024 -0.919 1.00 0.00 H new ATOM 0 HD2 PRO A 77 2.643 6.582 0.173 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.102 7.941 1.180 1.00 0.00 H new ATOM 280 N GLU A 78 -2.037 9.375 0.009 1.00 0.00 N ATOM 281 CA GLU A 78 -3.375 9.092 -0.584 1.00 0.00 C ATOM 282 C GLU A 78 -3.261 8.873 -2.097 1.00 0.00 C ATOM 283 O GLU A 78 -3.761 7.902 -2.626 1.00 0.00 O ATOM 284 CB GLU A 78 -4.312 10.270 -0.312 1.00 0.00 C ATOM 285 CG GLU A 78 -5.703 9.955 -0.864 1.00 0.00 C ATOM 286 CD GLU A 78 -6.744 10.821 -0.150 1.00 0.00 C ATOM 287 OE1 GLU A 78 -6.627 12.033 -0.221 1.00 0.00 O ATOM 288 OE2 GLU A 78 -7.641 10.255 0.455 1.00 0.00 O ATOM 0 H GLU A 78 -1.940 10.297 0.435 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.774 8.186 -0.128 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.370 10.463 0.759 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.921 11.174 -0.778 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.731 10.144 -1.937 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.932 8.899 -0.720 1.00 0.00 H new ATOM 295 N ALA A 79 -2.632 9.774 -2.803 1.00 0.00 N ATOM 296 CA ALA A 79 -2.523 9.611 -4.283 1.00 0.00 C ATOM 297 C ALA A 79 -2.030 8.201 -4.622 1.00 0.00 C ATOM 298 O ALA A 79 -2.570 7.539 -5.487 1.00 0.00 O ATOM 299 CB ALA A 79 -1.548 10.648 -4.846 1.00 0.00 C ATOM 0 H ALA A 79 -2.191 10.611 -2.422 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.506 9.760 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.471 10.526 -5.926 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.912 11.650 -4.619 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -0.566 10.507 -4.394 1.00 0.00 H new ATOM 305 N VAL A 80 -1.034 7.721 -3.934 1.00 0.00 N ATOM 306 CA VAL A 80 -0.540 6.343 -4.213 1.00 0.00 C ATOM 307 C VAL A 80 -1.532 5.340 -3.631 1.00 0.00 C ATOM 308 O VAL A 80 -1.716 4.259 -4.148 1.00 0.00 O ATOM 309 CB VAL A 80 0.832 6.148 -3.563 1.00 0.00 C ATOM 310 CG1 VAL A 80 1.376 4.765 -3.927 1.00 0.00 C ATOM 311 CG2 VAL A 80 1.793 7.223 -4.076 1.00 0.00 C ATOM 0 H VAL A 80 -0.541 8.220 -3.193 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.448 6.191 -5.288 1.00 0.00 H new ATOM 0 HB VAL A 80 0.737 6.228 -2.480 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.353 4.625 -3.465 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.691 3.998 -3.566 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.472 4.685 -5.010 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.771 7.087 -3.615 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.888 7.140 -5.159 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.406 8.209 -3.820 1.00 0.00 H new ATOM 321 N GLN A 81 -2.188 5.705 -2.569 1.00 0.00 N ATOM 322 CA GLN A 81 -3.190 4.791 -1.957 1.00 0.00 C ATOM 323 C GLN A 81 -4.300 4.526 -2.976 1.00 0.00 C ATOM 324 O GLN A 81 -4.680 3.399 -3.225 1.00 0.00 O ATOM 325 CB GLN A 81 -3.783 5.464 -0.716 1.00 0.00 C ATOM 326 CG GLN A 81 -4.460 4.416 0.165 1.00 0.00 C ATOM 327 CD GLN A 81 -4.813 5.036 1.517 1.00 0.00 C ATOM 328 OE1 GLN A 81 -5.220 6.179 1.588 1.00 0.00 O ATOM 329 NE2 GLN A 81 -4.669 4.326 2.604 1.00 0.00 N ATOM 0 H GLN A 81 -2.074 6.601 -2.095 1.00 0.00 H new ATOM 0 HA GLN A 81 -2.720 3.850 -1.672 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.998 5.972 -0.156 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -4.505 6.225 -1.013 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -5.361 4.043 -0.322 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.798 3.562 0.307 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.327 3.367 2.545 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.898 4.731 3.512 1.00 0.00 H new ATOM 338 N LYS A 82 -4.823 5.568 -3.562 1.00 0.00 N ATOM 339 CA LYS A 82 -5.912 5.412 -4.567 1.00 0.00 C ATOM 340 C LYS A 82 -5.440 4.537 -5.733 1.00 0.00 C ATOM 341 O LYS A 82 -6.117 3.614 -6.134 1.00 0.00 O ATOM 342 CB LYS A 82 -6.300 6.792 -5.102 1.00 0.00 C ATOM 343 CG LYS A 82 -6.742 7.684 -3.939 1.00 0.00 C ATOM 344 CD LYS A 82 -8.051 7.154 -3.350 1.00 0.00 C ATOM 345 CE LYS A 82 -8.782 8.289 -2.632 1.00 0.00 C ATOM 346 NZ LYS A 82 -9.752 8.927 -3.569 1.00 0.00 N ATOM 0 H LYS A 82 -4.539 6.531 -3.385 1.00 0.00 H new ATOM 0 HA LYS A 82 -6.769 4.936 -4.091 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.454 7.244 -5.620 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.106 6.698 -5.829 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -5.969 7.706 -3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.876 8.709 -4.285 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -8.679 6.745 -4.141 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -7.846 6.341 -2.654 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -9.305 7.903 -1.757 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.066 9.028 -2.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -10.249 9.699 -3.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -9.241 9.309 -4.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -10.442 8.218 -3.889 1.00 0.00 H new ATOM 360 N GLU A 83 -4.298 4.828 -6.296 1.00 0.00 N ATOM 361 CA GLU A 83 -3.816 4.010 -7.451 1.00 0.00 C ATOM 362 C GLU A 83 -3.774 2.528 -7.066 1.00 0.00 C ATOM 363 O GLU A 83 -4.129 1.665 -7.848 1.00 0.00 O ATOM 364 CB GLU A 83 -2.413 4.463 -7.865 1.00 0.00 C ATOM 365 CG GLU A 83 -2.461 5.913 -8.347 1.00 0.00 C ATOM 366 CD GLU A 83 -1.096 6.311 -8.910 1.00 0.00 C ATOM 367 OE1 GLU A 83 -0.113 5.709 -8.512 1.00 0.00 O ATOM 368 OE2 GLU A 83 -1.057 7.214 -9.730 1.00 0.00 O ATOM 0 H GLU A 83 -3.682 5.589 -6.011 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.504 4.148 -8.285 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.728 4.372 -7.022 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.031 3.819 -8.657 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.229 6.027 -9.112 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.732 6.572 -7.522 1.00 0.00 H new ATOM 375 N LEU A 84 -3.342 2.219 -5.878 1.00 0.00 N ATOM 376 CA LEU A 84 -3.277 0.789 -5.471 1.00 0.00 C ATOM 377 C LEU A 84 -4.693 0.245 -5.255 1.00 0.00 C ATOM 378 O LEU A 84 -4.980 -0.892 -5.579 1.00 0.00 O ATOM 379 CB LEU A 84 -2.436 0.664 -4.198 1.00 0.00 C ATOM 380 CG LEU A 84 -1.026 1.189 -4.493 1.00 0.00 C ATOM 381 CD1 LEU A 84 -0.182 1.188 -3.217 1.00 0.00 C ATOM 382 CD2 LEU A 84 -0.361 0.295 -5.541 1.00 0.00 C ATOM 0 H LEU A 84 -3.033 2.889 -5.174 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.806 0.199 -6.258 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.890 1.233 -3.387 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.393 -0.376 -3.873 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.099 2.210 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.817 1.563 -3.441 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.651 1.828 -2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.109 0.172 -2.830 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.642 0.666 -5.752 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.298 -0.725 -5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.952 0.306 -6.457 1.00 0.00 H new ATOM 394 N LEU A 85 -5.591 1.040 -4.738 1.00 0.00 N ATOM 395 CA LEU A 85 -6.985 0.542 -4.542 1.00 0.00 C ATOM 396 C LEU A 85 -7.671 0.417 -5.906 1.00 0.00 C ATOM 397 O LEU A 85 -8.398 -0.524 -6.158 1.00 0.00 O ATOM 398 CB LEU A 85 -7.774 1.515 -3.658 1.00 0.00 C ATOM 399 CG LEU A 85 -7.399 1.312 -2.189 1.00 0.00 C ATOM 400 CD1 LEU A 85 -7.832 2.534 -1.377 1.00 0.00 C ATOM 401 CD2 LEU A 85 -8.116 0.074 -1.639 1.00 0.00 C ATOM 0 H LEU A 85 -5.424 2.003 -4.445 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.953 -0.432 -4.053 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -7.564 2.542 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.844 1.356 -3.794 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.320 1.178 -2.112 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -7.565 2.389 -0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.329 3.422 -1.760 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.911 2.663 -1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.847 -0.068 -0.592 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.194 0.212 -1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -7.818 -0.804 -2.212 1.00 0.00 H new ATOM 413 N ALA A 86 -7.449 1.354 -6.789 1.00 0.00 N ATOM 414 CA ALA A 86 -8.093 1.278 -8.131 1.00 0.00 C ATOM 415 C ALA A 86 -7.641 0.000 -8.839 1.00 0.00 C ATOM 416 O ALA A 86 -8.387 -0.609 -9.579 1.00 0.00 O ATOM 417 CB ALA A 86 -7.687 2.495 -8.965 1.00 0.00 C ATOM 0 H ALA A 86 -6.851 2.167 -6.639 1.00 0.00 H new ATOM 0 HA ALA A 86 -9.177 1.266 -8.014 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -8.159 2.438 -9.946 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -8.009 3.406 -8.460 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.604 2.510 -9.084 1.00 0.00 H new ATOM 423 N GLU A 87 -6.429 -0.425 -8.599 1.00 0.00 N ATOM 424 CA GLU A 87 -5.942 -1.680 -9.242 1.00 0.00 C ATOM 425 C GLU A 87 -6.571 -2.877 -8.524 1.00 0.00 C ATOM 426 O GLU A 87 -6.892 -3.885 -9.127 1.00 0.00 O ATOM 427 CB GLU A 87 -4.418 -1.756 -9.139 1.00 0.00 C ATOM 428 CG GLU A 87 -3.895 -2.833 -10.090 1.00 0.00 C ATOM 429 CD GLU A 87 -3.630 -2.216 -11.465 1.00 0.00 C ATOM 430 OE1 GLU A 87 -4.182 -1.162 -11.735 1.00 0.00 O ATOM 431 OE2 GLU A 87 -2.879 -2.808 -12.223 1.00 0.00 O ATOM 0 H GLU A 87 -5.758 0.040 -7.988 1.00 0.00 H new ATOM 0 HA GLU A 87 -6.224 -1.691 -10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.978 -0.791 -9.389 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.123 -1.986 -8.115 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.979 -3.270 -9.693 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.622 -3.641 -10.176 1.00 0.00 H new ATOM 438 N TRP A 88 -6.776 -2.769 -7.243 1.00 0.00 N ATOM 439 CA TRP A 88 -7.406 -3.896 -6.507 1.00 0.00 C ATOM 440 C TRP A 88 -8.905 -3.886 -6.797 1.00 0.00 C ATOM 441 O TRP A 88 -9.595 -4.861 -6.586 1.00 0.00 O ATOM 442 CB TRP A 88 -7.170 -3.734 -5.003 1.00 0.00 C ATOM 443 CG TRP A 88 -5.699 -3.730 -4.689 1.00 0.00 C ATOM 444 CD1 TRP A 88 -4.713 -4.266 -5.457 1.00 0.00 C ATOM 445 CD2 TRP A 88 -5.037 -3.169 -3.518 1.00 0.00 C ATOM 446 NE1 TRP A 88 -3.499 -4.070 -4.825 1.00 0.00 N ATOM 447 CE2 TRP A 88 -3.645 -3.399 -3.631 1.00 0.00 C ATOM 448 CE3 TRP A 88 -5.506 -2.490 -2.381 1.00 0.00 C ATOM 449 CZ2 TRP A 88 -2.752 -2.973 -2.649 1.00 0.00 C ATOM 450 CZ3 TRP A 88 -4.611 -2.058 -1.390 1.00 0.00 C ATOM 451 CH2 TRP A 88 -3.236 -2.300 -1.525 1.00 0.00 C ATOM 0 H TRP A 88 -6.536 -1.955 -6.677 1.00 0.00 H new ATOM 0 HA TRP A 88 -6.968 -4.841 -6.829 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -7.622 -2.804 -4.658 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.659 -4.546 -4.464 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.855 -4.763 -6.405 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -2.603 -4.384 -5.198 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -6.563 -2.299 -2.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -1.694 -3.162 -2.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -4.983 -1.537 -0.520 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -2.551 -1.966 -0.760 1.00 0.00 H new ATOM 462 N LYS A 89 -9.414 -2.784 -7.286 1.00 0.00 N ATOM 463 CA LYS A 89 -10.870 -2.709 -7.599 1.00 0.00 C ATOM 464 C LYS A 89 -11.102 -3.175 -9.037 1.00 0.00 C ATOM 465 O LYS A 89 -11.975 -3.979 -9.300 1.00 0.00 O ATOM 466 CB LYS A 89 -11.365 -1.265 -7.440 1.00 0.00 C ATOM 467 CG LYS A 89 -11.607 -0.949 -5.960 1.00 0.00 C ATOM 468 CD LYS A 89 -12.468 0.311 -5.847 1.00 0.00 C ATOM 469 CE LYS A 89 -12.015 1.137 -4.642 1.00 0.00 C ATOM 470 NZ LYS A 89 -12.977 2.253 -4.415 1.00 0.00 N ATOM 0 H LYS A 89 -8.884 -1.935 -7.481 1.00 0.00 H new ATOM 0 HA LYS A 89 -11.421 -3.351 -6.912 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -10.630 -0.573 -7.852 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -12.286 -1.124 -8.005 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -12.104 -1.788 -5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -10.656 -0.801 -5.448 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -12.385 0.903 -6.758 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -13.518 0.038 -5.739 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -11.958 0.506 -3.755 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -11.015 1.534 -4.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -12.670 2.815 -3.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -13.010 2.860 -5.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -13.924 1.863 -4.232 1.00 0.00 H new ATOM 484 N ARG A 90 -10.329 -2.695 -9.976 1.00 0.00 N ATOM 485 CA ARG A 90 -10.529 -3.141 -11.384 1.00 0.00 C ATOM 486 C ARG A 90 -10.466 -4.669 -11.429 1.00 0.00 C ATOM 487 O ARG A 90 -11.225 -5.310 -12.128 1.00 0.00 O ATOM 488 CB ARG A 90 -9.449 -2.536 -12.292 1.00 0.00 C ATOM 489 CG ARG A 90 -8.103 -3.218 -12.053 1.00 0.00 C ATOM 490 CD ARG A 90 -7.026 -2.515 -12.883 1.00 0.00 C ATOM 491 NE ARG A 90 -7.313 -2.712 -14.332 1.00 0.00 N ATOM 492 CZ ARG A 90 -6.776 -1.919 -15.218 1.00 0.00 C ATOM 493 NH1 ARG A 90 -5.981 -0.955 -14.837 1.00 0.00 N ATOM 494 NH2 ARG A 90 -7.033 -2.089 -16.486 1.00 0.00 N ATOM 0 H ARG A 90 -9.577 -2.022 -9.831 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.501 -2.803 -11.742 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.739 -2.648 -13.337 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -9.361 -1.467 -12.099 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.846 -3.180 -10.995 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -8.162 -4.271 -12.329 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.005 -1.451 -12.646 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.042 -2.916 -12.638 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.930 -3.467 -14.631 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.780 -0.822 -13.846 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.562 -0.336 -15.531 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.654 -2.842 -16.784 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.613 -1.469 -17.179 1.00 0.00 H new ATOM 508 N THR A 91 -9.575 -5.263 -10.674 1.00 0.00 N ATOM 509 CA THR A 91 -9.483 -6.752 -10.666 1.00 0.00 C ATOM 510 C THR A 91 -10.339 -7.303 -9.521 1.00 0.00 C ATOM 511 O THR A 91 -10.958 -8.342 -9.642 1.00 0.00 O ATOM 512 CB THR A 91 -8.025 -7.172 -10.462 1.00 0.00 C ATOM 513 OG1 THR A 91 -7.905 -8.573 -10.666 1.00 0.00 O ATOM 514 CG2 THR A 91 -7.585 -6.822 -9.040 1.00 0.00 C ATOM 0 H THR A 91 -8.911 -4.782 -10.066 1.00 0.00 H new ATOM 0 HA THR A 91 -9.843 -7.147 -11.616 1.00 0.00 H new ATOM 0 HB THR A 91 -7.391 -6.645 -11.175 1.00 0.00 H new ATOM 0 HG1 THR A 91 -6.972 -8.844 -10.537 1.00 0.00 H new ATOM 0 HG21 THR A 91 -6.547 -7.122 -8.896 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.677 -5.747 -8.885 1.00 0.00 H new ATOM 0 HG23 THR A 91 -8.217 -7.348 -8.324 1.00 0.00 H new ATOM 522 N GLY A 92 -10.373 -6.615 -8.411 1.00 0.00 N ATOM 523 CA GLY A 92 -11.185 -7.095 -7.252 1.00 0.00 C ATOM 524 C GLY A 92 -12.515 -7.667 -7.750 1.00 0.00 C ATOM 525 O GLY A 92 -13.144 -8.467 -7.087 1.00 0.00 O ATOM 0 H GLY A 92 -9.873 -5.740 -8.255 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.634 -7.858 -6.702 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.369 -6.273 -6.560 1.00 0.00 H new TER 529 GLY A 92 ATOM 530 N MET B 201 25.271 6.135 7.330 1.00 0.00 N ATOM 531 CA MET B 201 23.972 6.088 8.062 1.00 0.00 C ATOM 532 C MET B 201 23.080 5.011 7.443 1.00 0.00 C ATOM 533 O MET B 201 22.990 4.881 6.238 1.00 0.00 O ATOM 534 CB MET B 201 23.283 7.452 7.971 1.00 0.00 C ATOM 535 CG MET B 201 22.743 7.672 6.560 1.00 0.00 C ATOM 536 SD MET B 201 22.843 9.432 6.154 1.00 0.00 S ATOM 537 CE MET B 201 21.567 9.443 4.872 1.00 0.00 C ATOM 0 HA MET B 201 24.150 5.848 9.110 1.00 0.00 H new ATOM 0 HB2 MET B 201 22.468 7.506 8.693 1.00 0.00 H new ATOM 0 HB3 MET B 201 23.989 8.243 8.226 1.00 0.00 H new ATOM 0 HG2 MET B 201 23.318 7.087 5.842 1.00 0.00 H new ATOM 0 HG3 MET B 201 21.710 7.329 6.495 1.00 0.00 H new ATOM 0 HE1 MET B 201 21.169 10.452 4.763 1.00 0.00 H new ATOM 0 HE2 MET B 201 22.000 9.119 3.925 1.00 0.00 H new ATOM 0 HE3 MET B 201 20.762 8.764 5.154 1.00 0.00 H new ATOM 547 N GLN B 202 22.436 4.221 8.257 1.00 0.00 N ATOM 548 CA GLN B 202 21.568 3.139 7.713 1.00 0.00 C ATOM 549 C GLN B 202 20.115 3.600 7.645 1.00 0.00 C ATOM 550 O GLN B 202 19.727 4.575 8.260 1.00 0.00 O ATOM 551 CB GLN B 202 21.673 1.906 8.610 1.00 0.00 C ATOM 552 CG GLN B 202 20.645 1.994 9.741 1.00 0.00 C ATOM 553 CD GLN B 202 21.003 0.978 10.827 1.00 0.00 C ATOM 554 OE1 GLN B 202 21.842 0.016 10.549 1.00 0.00 O flip ATOM 555 NE2 GLN B 202 20.515 1.057 11.937 1.00 0.00 N flip ATOM 0 H GLN B 202 22.473 4.278 9.275 1.00 0.00 H new ATOM 0 HA GLN B 202 21.902 2.893 6.705 1.00 0.00 H new ATOM 0 HB2 GLN B 202 21.504 1.003 8.023 1.00 0.00 H new ATOM 0 HB3 GLN B 202 22.678 1.833 9.025 1.00 0.00 H new ATOM 0 HG2 GLN B 202 20.631 3.001 10.159 1.00 0.00 H new ATOM 0 HG3 GLN B 202 19.645 1.795 9.356 1.00 0.00 H new ATOM 0 HE21 GLN B 202 19.860 1.808 12.154 1.00 0.00 H new ATOM 0 HE22 GLN B 202 20.760 0.372 12.652 1.00 0.00 H new ATOM 564 N ILE B 203 19.305 2.890 6.902 1.00 0.00 N ATOM 565 CA ILE B 203 17.869 3.264 6.785 1.00 0.00 C ATOM 566 C ILE B 203 17.024 1.990 6.678 1.00 0.00 C ATOM 567 O ILE B 203 17.415 1.026 6.049 1.00 0.00 O ATOM 568 CB ILE B 203 17.668 4.122 5.533 1.00 0.00 C ATOM 569 CG1 ILE B 203 18.143 3.344 4.303 1.00 0.00 C ATOM 570 CG2 ILE B 203 18.482 5.411 5.663 1.00 0.00 C ATOM 571 CD1 ILE B 203 16.932 2.785 3.554 1.00 0.00 C ATOM 0 H ILE B 203 19.581 2.064 6.370 1.00 0.00 H new ATOM 0 HA ILE B 203 17.563 3.831 7.664 1.00 0.00 H new ATOM 0 HB ILE B 203 16.611 4.367 5.425 1.00 0.00 H new ATOM 0 HG12 ILE B 203 18.720 3.996 3.648 1.00 0.00 H new ATOM 0 HG13 ILE B 203 18.803 2.532 4.606 1.00 0.00 H new ATOM 0 HG21 ILE B 203 18.340 6.023 4.772 1.00 0.00 H new ATOM 0 HG22 ILE B 203 18.149 5.965 6.541 1.00 0.00 H new ATOM 0 HG23 ILE B 203 19.539 5.165 5.769 1.00 0.00 H new ATOM 0 HD11 ILE B 203 17.270 2.231 2.678 1.00 0.00 H new ATOM 0 HD12 ILE B 203 16.373 2.119 4.211 1.00 0.00 H new ATOM 0 HD13 ILE B 203 16.289 3.606 3.238 1.00 0.00 H new ATOM 583 N PHE B 204 15.874 1.977 7.292 1.00 0.00 N ATOM 584 CA PHE B 204 15.004 0.766 7.235 1.00 0.00 C ATOM 585 C PHE B 204 13.990 0.904 6.097 1.00 0.00 C ATOM 586 O PHE B 204 13.472 1.970 5.842 1.00 0.00 O ATOM 587 CB PHE B 204 14.253 0.624 8.561 1.00 0.00 C ATOM 588 CG PHE B 204 15.200 0.862 9.713 1.00 0.00 C ATOM 589 CD1 PHE B 204 16.398 0.142 9.801 1.00 0.00 C ATOM 590 CD2 PHE B 204 14.877 1.804 10.698 1.00 0.00 C ATOM 591 CE1 PHE B 204 17.273 0.362 10.872 1.00 0.00 C ATOM 592 CE2 PHE B 204 15.751 2.023 11.770 1.00 0.00 C ATOM 593 CZ PHE B 204 16.948 1.303 11.857 1.00 0.00 C ATOM 0 H PHE B 204 15.497 2.755 7.833 1.00 0.00 H new ATOM 0 HA PHE B 204 15.624 -0.113 7.060 1.00 0.00 H new ATOM 0 HB2 PHE B 204 13.430 1.337 8.602 1.00 0.00 H new ATOM 0 HB3 PHE B 204 13.816 -0.372 8.637 1.00 0.00 H new ATOM 0 HD1 PHE B 204 16.647 -0.584 9.042 1.00 0.00 H new ATOM 0 HD2 PHE B 204 13.954 2.361 10.631 1.00 0.00 H new ATOM 0 HE1 PHE B 204 18.197 -0.193 10.938 1.00 0.00 H new ATOM 0 HE2 PHE B 204 15.501 2.748 12.530 1.00 0.00 H new ATOM 0 HZ PHE B 204 17.621 1.473 12.684 1.00 0.00 H new ATOM 603 N VAL B 205 13.705 -0.171 5.409 1.00 0.00 N ATOM 604 CA VAL B 205 12.723 -0.109 4.287 1.00 0.00 C ATOM 605 C VAL B 205 11.574 -1.082 4.563 1.00 0.00 C ATOM 606 O VAL B 205 11.739 -2.283 4.507 1.00 0.00 O ATOM 607 CB VAL B 205 13.421 -0.493 2.980 1.00 0.00 C ATOM 608 CG1 VAL B 205 12.471 -0.270 1.801 1.00 0.00 C ATOM 609 CG2 VAL B 205 14.668 0.375 2.797 1.00 0.00 C ATOM 0 H VAL B 205 14.111 -1.091 5.577 1.00 0.00 H new ATOM 0 HA VAL B 205 12.327 0.903 4.202 1.00 0.00 H new ATOM 0 HB VAL B 205 13.707 -1.544 3.019 1.00 0.00 H new ATOM 0 HG11 VAL B 205 12.972 -0.545 0.873 1.00 0.00 H new ATOM 0 HG12 VAL B 205 11.581 -0.886 1.929 1.00 0.00 H new ATOM 0 HG13 VAL B 205 12.182 0.780 1.760 1.00 0.00 H new ATOM 0 HG21 VAL B 205 15.167 0.103 1.867 1.00 0.00 H new ATOM 0 HG22 VAL B 205 14.378 1.425 2.760 1.00 0.00 H new ATOM 0 HG23 VAL B 205 15.348 0.216 3.634 1.00 0.00 H new ATOM 619 N LYS B 206 10.406 -0.570 4.849 1.00 0.00 N ATOM 620 CA LYS B 206 9.245 -1.466 5.114 1.00 0.00 C ATOM 621 C LYS B 206 8.434 -1.613 3.826 1.00 0.00 C ATOM 622 O LYS B 206 8.199 -0.653 3.120 1.00 0.00 O ATOM 623 CB LYS B 206 8.374 -0.879 6.230 1.00 0.00 C ATOM 624 CG LYS B 206 8.054 0.586 5.925 1.00 0.00 C ATOM 625 CD LYS B 206 7.012 1.117 6.918 1.00 0.00 C ATOM 626 CE LYS B 206 7.349 0.654 8.339 1.00 0.00 C ATOM 627 NZ LYS B 206 6.544 1.437 9.320 1.00 0.00 N ATOM 0 H LYS B 206 10.207 0.429 4.910 1.00 0.00 H new ATOM 0 HA LYS B 206 9.598 -2.446 5.436 1.00 0.00 H new ATOM 0 HB2 LYS B 206 7.450 -1.451 6.321 1.00 0.00 H new ATOM 0 HB3 LYS B 206 8.892 -0.956 7.186 1.00 0.00 H new ATOM 0 HG2 LYS B 206 8.963 1.185 5.985 1.00 0.00 H new ATOM 0 HG3 LYS B 206 7.677 0.679 4.906 1.00 0.00 H new ATOM 0 HD2 LYS B 206 6.985 2.206 6.880 1.00 0.00 H new ATOM 0 HD3 LYS B 206 6.020 0.763 6.638 1.00 0.00 H new ATOM 0 HE2 LYS B 206 7.138 -0.410 8.446 1.00 0.00 H new ATOM 0 HE3 LYS B 206 8.413 0.789 8.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 206 6.288 0.828 10.123 1.00 0.00 H new ATOM 0 HZ2 LYS B 206 7.103 2.245 9.662 1.00 0.00 H new ATOM 0 HZ3 LYS B 206 5.679 1.785 8.860 1.00 0.00 H new ATOM 641 N THR B 207 8.027 -2.809 3.497 1.00 0.00 N ATOM 642 CA THR B 207 7.260 -3.007 2.235 1.00 0.00 C ATOM 643 C THR B 207 5.756 -3.014 2.510 1.00 0.00 C ATOM 644 O THR B 207 5.301 -2.751 3.606 1.00 0.00 O ATOM 645 CB THR B 207 7.661 -4.337 1.597 1.00 0.00 C ATOM 646 OG1 THR B 207 7.193 -5.407 2.406 1.00 0.00 O ATOM 647 CG2 THR B 207 9.183 -4.409 1.475 1.00 0.00 C ATOM 0 H THR B 207 8.192 -3.654 4.045 1.00 0.00 H new ATOM 0 HA THR B 207 7.489 -2.184 1.559 1.00 0.00 H new ATOM 0 HB THR B 207 7.219 -4.413 0.604 1.00 0.00 H new ATOM 0 HG1 THR B 207 7.274 -6.250 1.913 1.00 0.00 H new ATOM 0 HG21 THR B 207 9.467 -5.358 1.020 1.00 0.00 H new ATOM 0 HG22 THR B 207 9.537 -3.587 0.852 1.00 0.00 H new ATOM 0 HG23 THR B 207 9.631 -4.333 2.466 1.00 0.00 H new ATOM 655 N LEU B 208 4.987 -3.312 1.499 1.00 0.00 N ATOM 656 CA LEU B 208 3.508 -3.336 1.663 1.00 0.00 C ATOM 657 C LEU B 208 3.101 -4.561 2.480 1.00 0.00 C ATOM 658 O LEU B 208 1.982 -4.671 2.939 1.00 0.00 O ATOM 659 CB LEU B 208 2.836 -3.388 0.290 1.00 0.00 C ATOM 660 CG LEU B 208 3.498 -2.373 -0.640 1.00 0.00 C ATOM 661 CD1 LEU B 208 2.811 -2.408 -2.007 1.00 0.00 C ATOM 662 CD2 LEU B 208 3.359 -0.975 -0.038 1.00 0.00 C ATOM 0 H LEU B 208 5.322 -3.541 0.563 1.00 0.00 H new ATOM 0 HA LEU B 208 3.191 -2.433 2.184 1.00 0.00 H new ATOM 0 HB2 LEU B 208 2.920 -4.390 -0.130 1.00 0.00 H new ATOM 0 HB3 LEU B 208 1.772 -3.170 0.385 1.00 0.00 H new ATOM 0 HG LEU B 208 4.553 -2.619 -0.759 1.00 0.00 H new ATOM 0 HD11 LEU B 208 3.284 -1.684 -2.670 1.00 0.00 H new ATOM 0 HD12 LEU B 208 2.903 -3.406 -2.435 1.00 0.00 H new ATOM 0 HD13 LEU B 208 1.756 -2.159 -1.891 1.00 0.00 H new ATOM 0 HD21 LEU B 208 3.830 -0.246 -0.698 1.00 0.00 H new ATOM 0 HD22 LEU B 208 2.303 -0.732 0.077 1.00 0.00 H new ATOM 0 HD23 LEU B 208 3.845 -0.949 0.937 1.00 0.00 H new ATOM 674 N THR B 209 4.001 -5.488 2.661 1.00 0.00 N ATOM 675 CA THR B 209 3.661 -6.709 3.444 1.00 0.00 C ATOM 676 C THR B 209 4.220 -6.575 4.861 1.00 0.00 C ATOM 677 O THR B 209 4.009 -7.426 5.702 1.00 0.00 O ATOM 678 CB THR B 209 4.272 -7.946 2.774 1.00 0.00 C ATOM 679 OG1 THR B 209 5.659 -8.007 3.077 1.00 0.00 O ATOM 680 CG2 THR B 209 4.087 -7.865 1.257 1.00 0.00 C ATOM 0 H THR B 209 4.955 -5.453 2.301 1.00 0.00 H new ATOM 0 HA THR B 209 2.577 -6.819 3.483 1.00 0.00 H new ATOM 0 HB THR B 209 3.772 -8.840 3.147 1.00 0.00 H new ATOM 0 HG1 THR B 209 6.052 -8.797 2.652 1.00 0.00 H new ATOM 0 HG21 THR B 209 4.524 -8.747 0.790 1.00 0.00 H new ATOM 0 HG22 THR B 209 3.024 -7.819 1.022 1.00 0.00 H new ATOM 0 HG23 THR B 209 4.582 -6.971 0.877 1.00 0.00 H new ATOM 688 N GLY B 210 4.926 -5.512 5.139 1.00 0.00 N ATOM 689 CA GLY B 210 5.486 -5.334 6.508 1.00 0.00 C ATOM 690 C GLY B 210 6.929 -5.843 6.550 1.00 0.00 C ATOM 691 O GLY B 210 7.570 -5.830 7.583 1.00 0.00 O ATOM 0 H GLY B 210 5.138 -4.763 4.480 1.00 0.00 H new ATOM 0 HA2 GLY B 210 5.454 -4.281 6.790 1.00 0.00 H new ATOM 0 HA3 GLY B 210 4.878 -5.876 7.232 1.00 0.00 H new ATOM 695 N LYS B 211 7.451 -6.282 5.438 1.00 0.00 N ATOM 696 CA LYS B 211 8.855 -6.779 5.421 1.00 0.00 C ATOM 697 C LYS B 211 9.798 -5.602 5.676 1.00 0.00 C ATOM 698 O LYS B 211 9.840 -4.655 4.918 1.00 0.00 O ATOM 699 CB LYS B 211 9.156 -7.405 4.054 1.00 0.00 C ATOM 700 CG LYS B 211 10.659 -7.661 3.908 1.00 0.00 C ATOM 701 CD LYS B 211 11.163 -8.476 5.102 1.00 0.00 C ATOM 702 CE LYS B 211 12.386 -9.292 4.681 1.00 0.00 C ATOM 703 NZ LYS B 211 11.992 -10.263 3.621 1.00 0.00 N ATOM 0 H LYS B 211 6.966 -6.318 4.541 1.00 0.00 H new ATOM 0 HA LYS B 211 8.996 -7.533 6.195 1.00 0.00 H new ATOM 0 HB2 LYS B 211 8.608 -8.341 3.946 1.00 0.00 H new ATOM 0 HB3 LYS B 211 8.814 -6.742 3.259 1.00 0.00 H new ATOM 0 HG2 LYS B 211 10.858 -8.197 2.980 1.00 0.00 H new ATOM 0 HG3 LYS B 211 11.195 -6.714 3.850 1.00 0.00 H new ATOM 0 HD2 LYS B 211 11.422 -7.812 5.926 1.00 0.00 H new ATOM 0 HD3 LYS B 211 10.376 -9.139 5.462 1.00 0.00 H new ATOM 0 HE2 LYS B 211 13.169 -8.630 4.311 1.00 0.00 H new ATOM 0 HE3 LYS B 211 12.797 -9.822 5.540 1.00 0.00 H new ATOM 0 HZ1 LYS B 211 12.536 -11.142 3.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 211 10.976 -10.472 3.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 211 12.188 -9.854 2.685 1.00 0.00 H new ATOM 717 N THR B 212 10.557 -5.654 6.737 1.00 0.00 N ATOM 718 CA THR B 212 11.495 -4.535 7.037 1.00 0.00 C ATOM 719 C THR B 212 12.906 -4.925 6.603 1.00 0.00 C ATOM 720 O THR B 212 13.336 -6.046 6.788 1.00 0.00 O ATOM 721 CB THR B 212 11.483 -4.247 8.539 1.00 0.00 C ATOM 722 OG1 THR B 212 10.159 -4.388 9.035 1.00 0.00 O ATOM 723 CG2 THR B 212 11.975 -2.819 8.790 1.00 0.00 C ATOM 0 H THR B 212 10.568 -6.422 7.408 1.00 0.00 H new ATOM 0 HA THR B 212 11.182 -3.643 6.495 1.00 0.00 H new ATOM 0 HB THR B 212 12.140 -4.950 9.050 1.00 0.00 H new ATOM 0 HG1 THR B 212 10.149 -4.206 9.998 1.00 0.00 H new ATOM 0 HG21 THR B 212 11.966 -2.614 9.861 1.00 0.00 H new ATOM 0 HG22 THR B 212 12.990 -2.712 8.408 1.00 0.00 H new ATOM 0 HG23 THR B 212 11.319 -2.113 8.280 1.00 0.00 H new ATOM 731 N ILE B 213 13.627 -4.010 6.016 1.00 0.00 N ATOM 732 CA ILE B 213 15.007 -4.328 5.557 1.00 0.00 C ATOM 733 C ILE B 213 15.954 -3.192 5.951 1.00 0.00 C ATOM 734 O ILE B 213 15.639 -2.028 5.803 1.00 0.00 O ATOM 735 CB ILE B 213 14.990 -4.488 4.037 1.00 0.00 C ATOM 736 CG1 ILE B 213 13.890 -5.478 3.654 1.00 0.00 C ATOM 737 CG2 ILE B 213 16.338 -5.018 3.549 1.00 0.00 C ATOM 738 CD1 ILE B 213 13.907 -5.697 2.147 1.00 0.00 C ATOM 0 H ILE B 213 13.319 -3.055 5.834 1.00 0.00 H new ATOM 0 HA ILE B 213 15.353 -5.251 6.022 1.00 0.00 H new ATOM 0 HB ILE B 213 14.801 -3.519 3.575 1.00 0.00 H new ATOM 0 HG12 ILE B 213 14.042 -6.425 4.172 1.00 0.00 H new ATOM 0 HG13 ILE B 213 12.918 -5.097 3.966 1.00 0.00 H new ATOM 0 HG21 ILE B 213 16.315 -5.128 2.465 1.00 0.00 H new ATOM 0 HG22 ILE B 213 17.126 -4.318 3.826 1.00 0.00 H new ATOM 0 HG23 ILE B 213 16.536 -5.987 4.008 1.00 0.00 H new ATOM 0 HD11 ILE B 213 13.123 -6.403 1.873 1.00 0.00 H new ATOM 0 HD12 ILE B 213 13.734 -4.748 1.639 1.00 0.00 H new ATOM 0 HD13 ILE B 213 14.876 -6.097 1.848 1.00 0.00 H new ATOM 750 N THR B 214 17.117 -3.522 6.444 1.00 0.00 N ATOM 751 CA THR B 214 18.089 -2.464 6.840 1.00 0.00 C ATOM 752 C THR B 214 19.183 -2.377 5.777 1.00 0.00 C ATOM 753 O THR B 214 19.863 -3.344 5.500 1.00 0.00 O ATOM 754 CB THR B 214 18.719 -2.822 8.189 1.00 0.00 C ATOM 755 OG1 THR B 214 17.694 -3.102 9.131 1.00 0.00 O ATOM 756 CG2 THR B 214 19.565 -1.648 8.684 1.00 0.00 C ATOM 0 H THR B 214 17.436 -4.480 6.590 1.00 0.00 H new ATOM 0 HA THR B 214 17.576 -1.506 6.927 1.00 0.00 H new ATOM 0 HB THR B 214 19.353 -3.701 8.073 1.00 0.00 H new ATOM 0 HG1 THR B 214 18.097 -3.333 9.994 1.00 0.00 H new ATOM 0 HG21 THR B 214 20.014 -1.902 9.644 1.00 0.00 H new ATOM 0 HG22 THR B 214 20.352 -1.436 7.960 1.00 0.00 H new ATOM 0 HG23 THR B 214 18.933 -0.768 8.801 1.00 0.00 H new ATOM 764 N LEU B 215 19.354 -1.228 5.176 1.00 0.00 N ATOM 765 CA LEU B 215 20.401 -1.087 4.125 1.00 0.00 C ATOM 766 C LEU B 215 21.348 0.062 4.484 1.00 0.00 C ATOM 767 O LEU B 215 20.937 1.198 4.647 1.00 0.00 O ATOM 768 CB LEU B 215 19.738 -0.797 2.772 1.00 0.00 C ATOM 769 CG LEU B 215 18.531 -1.717 2.566 1.00 0.00 C ATOM 770 CD1 LEU B 215 17.753 -1.268 1.329 1.00 0.00 C ATOM 771 CD2 LEU B 215 19.009 -3.158 2.363 1.00 0.00 C ATOM 0 H LEU B 215 18.814 -0.384 5.368 1.00 0.00 H new ATOM 0 HA LEU B 215 20.969 -2.015 4.061 1.00 0.00 H new ATOM 0 HB2 LEU B 215 19.421 0.245 2.730 1.00 0.00 H new ATOM 0 HB3 LEU B 215 20.458 -0.944 1.967 1.00 0.00 H new ATOM 0 HG LEU B 215 17.888 -1.667 3.444 1.00 0.00 H new ATOM 0 HD11 LEU B 215 16.894 -1.923 1.182 1.00 0.00 H new ATOM 0 HD12 LEU B 215 17.409 -0.243 1.468 1.00 0.00 H new ATOM 0 HD13 LEU B 215 18.401 -1.318 0.454 1.00 0.00 H new ATOM 0 HD21 LEU B 215 18.148 -3.810 2.217 1.00 0.00 H new ATOM 0 HD22 LEU B 215 19.654 -3.207 1.486 1.00 0.00 H new ATOM 0 HD23 LEU B 215 19.566 -3.484 3.242 1.00 0.00 H new ATOM 783 N GLU B 216 22.615 -0.236 4.620 1.00 0.00 N ATOM 784 CA GLU B 216 23.608 0.821 4.972 1.00 0.00 C ATOM 785 C GLU B 216 23.750 1.797 3.798 1.00 0.00 C ATOM 786 O GLU B 216 23.882 1.395 2.661 1.00 0.00 O ATOM 787 CB GLU B 216 24.960 0.170 5.266 1.00 0.00 C ATOM 788 CG GLU B 216 25.053 -0.154 6.758 1.00 0.00 C ATOM 789 CD GLU B 216 26.362 -0.895 7.041 1.00 0.00 C ATOM 790 OE1 GLU B 216 27.364 -0.229 7.245 1.00 0.00 O ATOM 791 OE2 GLU B 216 26.339 -2.115 7.047 1.00 0.00 O ATOM 0 H GLU B 216 23.005 -1.171 4.502 1.00 0.00 H new ATOM 0 HA GLU B 216 23.268 1.363 5.854 1.00 0.00 H new ATOM 0 HB2 GLU B 216 25.074 -0.740 4.677 1.00 0.00 H new ATOM 0 HB3 GLU B 216 25.770 0.840 4.977 1.00 0.00 H new ATOM 0 HG2 GLU B 216 25.009 0.764 7.343 1.00 0.00 H new ATOM 0 HG3 GLU B 216 24.204 -0.766 7.061 1.00 0.00 H new ATOM 798 N VAL B 217 23.723 3.077 4.059 1.00 0.00 N ATOM 799 CA VAL B 217 23.854 4.063 2.947 1.00 0.00 C ATOM 800 C VAL B 217 24.719 5.244 3.390 1.00 0.00 C ATOM 801 O VAL B 217 25.284 5.247 4.467 1.00 0.00 O ATOM 802 CB VAL B 217 22.465 4.575 2.561 1.00 0.00 C ATOM 803 CG1 VAL B 217 21.681 3.454 1.878 1.00 0.00 C ATOM 804 CG2 VAL B 217 21.716 5.028 3.816 1.00 0.00 C ATOM 0 H VAL B 217 23.616 3.481 4.990 1.00 0.00 H new ATOM 0 HA VAL B 217 24.324 3.576 2.092 1.00 0.00 H new ATOM 0 HB VAL B 217 22.568 5.418 1.878 1.00 0.00 H new ATOM 0 HG11 VAL B 217 20.691 3.818 1.603 1.00 0.00 H new ATOM 0 HG12 VAL B 217 22.212 3.133 0.982 1.00 0.00 H new ATOM 0 HG13 VAL B 217 21.580 2.611 2.562 1.00 0.00 H new ATOM 0 HG21 VAL B 217 20.727 5.392 3.538 1.00 0.00 H new ATOM 0 HG22 VAL B 217 21.613 4.187 4.502 1.00 0.00 H new ATOM 0 HG23 VAL B 217 22.273 5.828 4.303 1.00 0.00 H new ATOM 814 N GLU B 218 24.817 6.255 2.569 1.00 0.00 N ATOM 815 CA GLU B 218 25.635 7.445 2.937 1.00 0.00 C ATOM 816 C GLU B 218 24.856 8.715 2.578 1.00 0.00 C ATOM 817 O GLU B 218 24.022 8.705 1.693 1.00 0.00 O ATOM 818 CB GLU B 218 26.955 7.411 2.162 1.00 0.00 C ATOM 819 CG GLU B 218 27.964 6.541 2.914 1.00 0.00 C ATOM 820 CD GLU B 218 29.277 6.487 2.132 1.00 0.00 C ATOM 821 OE1 GLU B 218 30.110 7.352 2.351 1.00 0.00 O ATOM 822 OE2 GLU B 218 29.428 5.582 1.329 1.00 0.00 O ATOM 0 H GLU B 218 24.364 6.307 1.657 1.00 0.00 H new ATOM 0 HA GLU B 218 25.846 7.436 4.006 1.00 0.00 H new ATOM 0 HB2 GLU B 218 26.791 7.014 1.160 1.00 0.00 H new ATOM 0 HB3 GLU B 218 27.346 8.421 2.044 1.00 0.00 H new ATOM 0 HG2 GLU B 218 28.139 6.947 3.910 1.00 0.00 H new ATOM 0 HG3 GLU B 218 27.565 5.535 3.045 1.00 0.00 H new ATOM 829 N PRO B 219 25.119 9.800 3.258 1.00 0.00 N ATOM 830 CA PRO B 219 24.422 11.095 3.004 1.00 0.00 C ATOM 831 C PRO B 219 24.579 11.561 1.554 1.00 0.00 C ATOM 832 O PRO B 219 23.760 12.296 1.037 1.00 0.00 O ATOM 833 CB PRO B 219 25.097 12.088 3.962 1.00 0.00 C ATOM 834 CG PRO B 219 26.350 11.422 4.429 1.00 0.00 C ATOM 835 CD PRO B 219 26.104 9.919 4.339 1.00 0.00 C ATOM 0 HA PRO B 219 23.348 11.007 3.167 1.00 0.00 H new ATOM 0 HB2 PRO B 219 25.320 13.028 3.457 1.00 0.00 H new ATOM 0 HB3 PRO B 219 24.444 12.325 4.802 1.00 0.00 H new ATOM 0 HG2 PRO B 219 27.198 11.714 3.809 1.00 0.00 H new ATOM 0 HG3 PRO B 219 26.587 11.715 5.452 1.00 0.00 H new ATOM 0 HD2 PRO B 219 27.020 9.375 4.110 1.00 0.00 H new ATOM 0 HD3 PRO B 219 25.721 9.518 5.277 1.00 0.00 H new ATOM 843 N SER B 220 25.625 11.143 0.895 1.00 0.00 N ATOM 844 CA SER B 220 25.838 11.567 -0.518 1.00 0.00 C ATOM 845 C SER B 220 25.396 10.452 -1.470 1.00 0.00 C ATOM 846 O SER B 220 25.589 10.540 -2.667 1.00 0.00 O ATOM 847 CB SER B 220 27.324 11.851 -0.739 1.00 0.00 C ATOM 848 OG SER B 220 27.847 12.531 0.394 1.00 0.00 O ATOM 0 H SER B 220 26.342 10.525 1.275 1.00 0.00 H new ATOM 0 HA SER B 220 25.252 12.464 -0.715 1.00 0.00 H new ATOM 0 HB2 SER B 220 27.864 10.918 -0.899 1.00 0.00 H new ATOM 0 HB3 SER B 220 27.461 12.456 -1.635 1.00 0.00 H new ATOM 0 HG SER B 220 28.800 12.713 0.255 1.00 0.00 H new ATOM 854 N ASP B 221 24.815 9.402 -0.958 1.00 0.00 N ATOM 855 CA ASP B 221 24.383 8.291 -1.854 1.00 0.00 C ATOM 856 C ASP B 221 23.168 8.737 -2.672 1.00 0.00 C ATOM 857 O ASP B 221 22.329 9.483 -2.201 1.00 0.00 O ATOM 858 CB ASP B 221 24.019 7.063 -1.016 1.00 0.00 C ATOM 859 CG ASP B 221 24.556 5.804 -1.699 1.00 0.00 C ATOM 860 OD1 ASP B 221 24.647 5.808 -2.916 1.00 0.00 O ATOM 861 OD2 ASP B 221 24.868 4.858 -0.994 1.00 0.00 O ATOM 0 H ASP B 221 24.622 9.265 0.034 1.00 0.00 H new ATOM 0 HA ASP B 221 25.199 8.034 -2.529 1.00 0.00 H new ATOM 0 HB2 ASP B 221 24.440 7.155 -0.015 1.00 0.00 H new ATOM 0 HB3 ASP B 221 22.937 6.995 -0.902 1.00 0.00 H new ATOM 866 N THR B 222 23.069 8.293 -3.896 1.00 0.00 N ATOM 867 CA THR B 222 21.912 8.697 -4.744 1.00 0.00 C ATOM 868 C THR B 222 20.736 7.747 -4.505 1.00 0.00 C ATOM 869 O THR B 222 20.914 6.567 -4.271 1.00 0.00 O ATOM 870 CB THR B 222 22.316 8.643 -6.219 1.00 0.00 C ATOM 871 OG1 THR B 222 22.509 7.290 -6.607 1.00 0.00 O ATOM 872 CG2 THR B 222 23.612 9.427 -6.425 1.00 0.00 C ATOM 0 H THR B 222 23.739 7.668 -4.345 1.00 0.00 H new ATOM 0 HA THR B 222 21.614 9.712 -4.483 1.00 0.00 H new ATOM 0 HB THR B 222 21.528 9.086 -6.828 1.00 0.00 H new ATOM 0 HG1 THR B 222 22.766 7.254 -7.552 1.00 0.00 H new ATOM 0 HG21 THR B 222 23.898 9.387 -7.476 1.00 0.00 H new ATOM 0 HG22 THR B 222 23.460 10.465 -6.129 1.00 0.00 H new ATOM 0 HG23 THR B 222 24.403 8.988 -5.817 1.00 0.00 H new ATOM 880 N ILE B 223 19.533 8.251 -4.575 1.00 0.00 N ATOM 881 CA ILE B 223 18.346 7.376 -4.367 1.00 0.00 C ATOM 882 C ILE B 223 18.470 6.161 -5.283 1.00 0.00 C ATOM 883 O ILE B 223 18.070 5.065 -4.941 1.00 0.00 O ATOM 884 CB ILE B 223 17.074 8.151 -4.721 1.00 0.00 C ATOM 885 CG1 ILE B 223 16.956 9.414 -3.846 1.00 0.00 C ATOM 886 CG2 ILE B 223 15.848 7.255 -4.531 1.00 0.00 C ATOM 887 CD1 ILE B 223 16.706 9.054 -2.373 1.00 0.00 C ATOM 0 H ILE B 223 19.322 9.230 -4.767 1.00 0.00 H new ATOM 0 HA ILE B 223 18.295 7.057 -3.326 1.00 0.00 H new ATOM 0 HB ILE B 223 17.127 8.459 -5.765 1.00 0.00 H new ATOM 0 HG12 ILE B 223 17.870 10.002 -3.928 1.00 0.00 H new ATOM 0 HG13 ILE B 223 16.141 10.038 -4.213 1.00 0.00 H new ATOM 0 HG21 ILE B 223 14.947 7.813 -4.785 1.00 0.00 H new ATOM 0 HG22 ILE B 223 15.930 6.384 -5.181 1.00 0.00 H new ATOM 0 HG23 ILE B 223 15.793 6.929 -3.492 1.00 0.00 H new ATOM 0 HD11 ILE B 223 16.628 9.967 -1.783 1.00 0.00 H new ATOM 0 HD12 ILE B 223 15.779 8.488 -2.289 1.00 0.00 H new ATOM 0 HD13 ILE B 223 17.534 8.451 -2.000 1.00 0.00 H new ATOM 899 N GLU B 224 19.031 6.347 -6.446 1.00 0.00 N ATOM 900 CA GLU B 224 19.193 5.207 -7.389 1.00 0.00 C ATOM 901 C GLU B 224 19.985 4.097 -6.698 1.00 0.00 C ATOM 902 O GLU B 224 19.712 2.926 -6.872 1.00 0.00 O ATOM 903 CB GLU B 224 19.925 5.704 -8.651 1.00 0.00 C ATOM 904 CG GLU B 224 21.107 4.791 -9.011 1.00 0.00 C ATOM 905 CD GLU B 224 20.605 3.371 -9.290 1.00 0.00 C ATOM 906 OE1 GLU B 224 19.433 3.229 -9.597 1.00 0.00 O ATOM 907 OE2 GLU B 224 21.401 2.452 -9.190 1.00 0.00 O ATOM 0 H GLU B 224 19.385 7.242 -6.784 1.00 0.00 H new ATOM 0 HA GLU B 224 18.222 4.809 -7.682 1.00 0.00 H new ATOM 0 HB2 GLU B 224 19.226 5.743 -9.487 1.00 0.00 H new ATOM 0 HB3 GLU B 224 20.285 6.720 -8.488 1.00 0.00 H new ATOM 0 HG2 GLU B 224 21.625 5.181 -9.887 1.00 0.00 H new ATOM 0 HG3 GLU B 224 21.828 4.777 -8.194 1.00 0.00 H new ATOM 914 N ASN B 225 20.970 4.451 -5.916 1.00 0.00 N ATOM 915 CA ASN B 225 21.773 3.406 -5.222 1.00 0.00 C ATOM 916 C ASN B 225 20.891 2.688 -4.202 1.00 0.00 C ATOM 917 O ASN B 225 20.790 1.477 -4.205 1.00 0.00 O ATOM 918 CB ASN B 225 22.967 4.050 -4.513 1.00 0.00 C ATOM 919 CG ASN B 225 24.194 3.996 -5.425 1.00 0.00 C ATOM 920 OD1 ASN B 225 24.418 3.013 -6.104 1.00 0.00 O ATOM 921 ND2 ASN B 225 25.003 5.018 -5.470 1.00 0.00 N ATOM 0 H ASN B 225 21.251 5.414 -5.729 1.00 0.00 H new ATOM 0 HA ASN B 225 22.143 2.688 -5.954 1.00 0.00 H new ATOM 0 HB2 ASN B 225 22.737 5.084 -4.257 1.00 0.00 H new ATOM 0 HB3 ASN B 225 23.173 3.528 -3.578 1.00 0.00 H new ATOM 0 HD21 ASN B 225 25.824 4.992 -6.075 1.00 0.00 H new ATOM 0 HD22 ASN B 225 24.815 5.843 -4.900 1.00 0.00 H new ATOM 928 N VAL B 226 20.238 3.417 -3.340 1.00 0.00 N ATOM 929 CA VAL B 226 19.355 2.757 -2.338 1.00 0.00 C ATOM 930 C VAL B 226 18.390 1.826 -3.071 1.00 0.00 C ATOM 931 O VAL B 226 18.216 0.679 -2.711 1.00 0.00 O ATOM 932 CB VAL B 226 18.560 3.816 -1.572 1.00 0.00 C ATOM 933 CG1 VAL B 226 17.855 3.163 -0.383 1.00 0.00 C ATOM 934 CG2 VAL B 226 19.514 4.901 -1.067 1.00 0.00 C ATOM 0 H VAL B 226 20.277 4.435 -3.286 1.00 0.00 H new ATOM 0 HA VAL B 226 19.960 2.187 -1.632 1.00 0.00 H new ATOM 0 HB VAL B 226 17.817 4.263 -2.233 1.00 0.00 H new ATOM 0 HG11 VAL B 226 17.288 3.917 0.163 1.00 0.00 H new ATOM 0 HG12 VAL B 226 17.177 2.389 -0.742 1.00 0.00 H new ATOM 0 HG13 VAL B 226 18.597 2.716 0.279 1.00 0.00 H new ATOM 0 HG21 VAL B 226 18.949 5.657 -0.521 1.00 0.00 H new ATOM 0 HG22 VAL B 226 20.256 4.454 -0.405 1.00 0.00 H new ATOM 0 HG23 VAL B 226 20.017 5.366 -1.915 1.00 0.00 H new ATOM 944 N LYS B 227 17.768 2.315 -4.108 1.00 0.00 N ATOM 945 CA LYS B 227 16.817 1.473 -4.885 1.00 0.00 C ATOM 946 C LYS B 227 17.520 0.176 -5.304 1.00 0.00 C ATOM 947 O LYS B 227 16.938 -0.892 -5.296 1.00 0.00 O ATOM 948 CB LYS B 227 16.384 2.252 -6.136 1.00 0.00 C ATOM 949 CG LYS B 227 14.938 1.916 -6.513 1.00 0.00 C ATOM 950 CD LYS B 227 14.418 2.968 -7.494 1.00 0.00 C ATOM 951 CE LYS B 227 13.621 4.027 -6.733 1.00 0.00 C ATOM 952 NZ LYS B 227 13.600 5.292 -7.520 1.00 0.00 N ATOM 0 H LYS B 227 17.879 3.269 -4.452 1.00 0.00 H new ATOM 0 HA LYS B 227 15.944 1.230 -4.279 1.00 0.00 H new ATOM 0 HB2 LYS B 227 16.478 3.323 -5.954 1.00 0.00 H new ATOM 0 HB3 LYS B 227 17.047 2.011 -6.967 1.00 0.00 H new ATOM 0 HG2 LYS B 227 14.888 0.925 -6.963 1.00 0.00 H new ATOM 0 HG3 LYS B 227 14.313 1.893 -5.621 1.00 0.00 H new ATOM 0 HD2 LYS B 227 15.252 3.434 -8.020 1.00 0.00 H new ATOM 0 HD3 LYS B 227 13.788 2.497 -8.249 1.00 0.00 H new ATOM 0 HE2 LYS B 227 12.603 3.677 -6.559 1.00 0.00 H new ATOM 0 HE3 LYS B 227 14.069 4.202 -5.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 227 13.058 6.013 -7.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 227 14.574 5.628 -7.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 227 13.154 5.119 -8.443 1.00 0.00 H new ATOM 966 N ALA B 228 18.772 0.266 -5.667 1.00 0.00 N ATOM 967 CA ALA B 228 19.522 -0.952 -6.087 1.00 0.00 C ATOM 968 C ALA B 228 19.677 -1.891 -4.888 1.00 0.00 C ATOM 969 O ALA B 228 19.623 -3.097 -5.018 1.00 0.00 O ATOM 970 CB ALA B 228 20.904 -0.548 -6.602 1.00 0.00 C ATOM 0 H ALA B 228 19.308 1.133 -5.691 1.00 0.00 H new ATOM 0 HA ALA B 228 18.975 -1.462 -6.880 1.00 0.00 H new ATOM 0 HB1 ALA B 228 21.452 -1.438 -6.909 1.00 0.00 H new ATOM 0 HB2 ALA B 228 20.793 0.122 -7.455 1.00 0.00 H new ATOM 0 HB3 ALA B 228 21.453 -0.039 -5.810 1.00 0.00 H new ATOM 976 N LYS B 229 19.868 -1.348 -3.721 1.00 0.00 N ATOM 977 CA LYS B 229 20.021 -2.211 -2.519 1.00 0.00 C ATOM 978 C LYS B 229 18.785 -3.103 -2.382 1.00 0.00 C ATOM 979 O LYS B 229 18.887 -4.311 -2.278 1.00 0.00 O ATOM 980 CB LYS B 229 20.176 -1.324 -1.282 1.00 0.00 C ATOM 981 CG LYS B 229 21.374 -0.392 -1.490 1.00 0.00 C ATOM 982 CD LYS B 229 21.679 0.363 -0.198 1.00 0.00 C ATOM 983 CE LYS B 229 22.616 -0.476 0.673 1.00 0.00 C ATOM 984 NZ LYS B 229 24.020 -0.306 0.201 1.00 0.00 N ATOM 0 H LYS B 229 19.925 -0.345 -3.547 1.00 0.00 H new ATOM 0 HA LYS B 229 20.905 -2.841 -2.617 1.00 0.00 H new ATOM 0 HB2 LYS B 229 19.269 -0.742 -1.119 1.00 0.00 H new ATOM 0 HB3 LYS B 229 20.325 -1.938 -0.394 1.00 0.00 H new ATOM 0 HG2 LYS B 229 22.246 -0.970 -1.798 1.00 0.00 H new ATOM 0 HG3 LYS B 229 21.161 0.315 -2.292 1.00 0.00 H new ATOM 0 HD2 LYS B 229 22.140 1.324 -0.426 1.00 0.00 H new ATOM 0 HD3 LYS B 229 20.755 0.572 0.340 1.00 0.00 H new ATOM 0 HE2 LYS B 229 22.532 -0.169 1.716 1.00 0.00 H new ATOM 0 HE3 LYS B 229 22.330 -1.527 0.626 1.00 0.00 H new ATOM 0 HZ1 LYS B 229 24.486 -1.235 0.156 1.00 0.00 H new ATOM 0 HZ2 LYS B 229 24.018 0.126 -0.745 1.00 0.00 H new ATOM 0 HZ3 LYS B 229 24.536 0.309 0.862 1.00 0.00 H new ATOM 998 N ILE B 230 17.616 -2.522 -2.388 1.00 0.00 N ATOM 999 CA ILE B 230 16.378 -3.342 -2.265 1.00 0.00 C ATOM 1000 C ILE B 230 16.324 -4.350 -3.421 1.00 0.00 C ATOM 1001 O ILE B 230 15.883 -5.467 -3.259 1.00 0.00 O ATOM 1002 CB ILE B 230 15.146 -2.427 -2.318 1.00 0.00 C ATOM 1003 CG1 ILE B 230 15.070 -1.575 -1.042 1.00 0.00 C ATOM 1004 CG2 ILE B 230 13.879 -3.278 -2.420 1.00 0.00 C ATOM 1005 CD1 ILE B 230 15.844 -0.266 -1.231 1.00 0.00 C ATOM 0 H ILE B 230 17.465 -1.517 -2.473 1.00 0.00 H new ATOM 0 HA ILE B 230 16.385 -3.876 -1.315 1.00 0.00 H new ATOM 0 HB ILE B 230 15.228 -1.776 -3.188 1.00 0.00 H new ATOM 0 HG12 ILE B 230 14.029 -1.359 -0.802 1.00 0.00 H new ATOM 0 HG13 ILE B 230 15.482 -2.131 -0.200 1.00 0.00 H new ATOM 0 HG21 ILE B 230 13.006 -2.627 -2.457 1.00 0.00 H new ATOM 0 HG22 ILE B 230 13.919 -3.884 -3.325 1.00 0.00 H new ATOM 0 HG23 ILE B 230 13.808 -3.931 -1.550 1.00 0.00 H new ATOM 0 HD11 ILE B 230 15.782 0.328 -0.319 1.00 0.00 H new ATOM 0 HD12 ILE B 230 16.889 -0.489 -1.448 1.00 0.00 H new ATOM 0 HD13 ILE B 230 15.413 0.295 -2.060 1.00 0.00 H new ATOM 1017 N GLN B 231 16.767 -3.966 -4.587 1.00 0.00 N ATOM 1018 CA GLN B 231 16.739 -4.912 -5.743 1.00 0.00 C ATOM 1019 C GLN B 231 17.558 -6.163 -5.408 1.00 0.00 C ATOM 1020 O GLN B 231 17.113 -7.277 -5.599 1.00 0.00 O ATOM 1021 CB GLN B 231 17.342 -4.229 -6.980 1.00 0.00 C ATOM 1022 CG GLN B 231 17.853 -5.288 -7.966 1.00 0.00 C ATOM 1023 CD GLN B 231 18.203 -4.626 -9.298 1.00 0.00 C ATOM 1024 OE1 GLN B 231 17.460 -3.654 -9.745 1.00 0.00 O flip ATOM 1025 NE2 GLN B 231 19.166 -4.997 -9.940 1.00 0.00 N flip ATOM 0 H GLN B 231 17.146 -3.041 -4.791 1.00 0.00 H new ATOM 0 HA GLN B 231 15.707 -5.197 -5.947 1.00 0.00 H new ATOM 0 HB2 GLN B 231 16.591 -3.603 -7.462 1.00 0.00 H new ATOM 0 HB3 GLN B 231 18.160 -3.573 -6.681 1.00 0.00 H new ATOM 0 HG2 GLN B 231 18.731 -5.787 -7.556 1.00 0.00 H new ATOM 0 HG3 GLN B 231 17.093 -6.054 -8.118 1.00 0.00 H new ATOM 0 HE21 GLN B 231 19.749 -5.758 -9.591 1.00 0.00 H new ATOM 0 HE22 GLN B 231 19.391 -4.547 -10.827 1.00 0.00 H new ATOM 1034 N ASP B 232 18.758 -5.983 -4.932 1.00 0.00 N ATOM 1035 CA ASP B 232 19.623 -7.155 -4.609 1.00 0.00 C ATOM 1036 C ASP B 232 19.026 -7.965 -3.454 1.00 0.00 C ATOM 1037 O ASP B 232 19.258 -9.152 -3.339 1.00 0.00 O ATOM 1038 CB ASP B 232 21.015 -6.662 -4.210 1.00 0.00 C ATOM 1039 CG ASP B 232 22.069 -7.345 -5.082 1.00 0.00 C ATOM 1040 OD1 ASP B 232 21.984 -7.213 -6.292 1.00 0.00 O ATOM 1041 OD2 ASP B 232 22.944 -7.989 -4.526 1.00 0.00 O ATOM 0 H ASP B 232 19.180 -5.072 -4.752 1.00 0.00 H new ATOM 0 HA ASP B 232 19.689 -7.794 -5.490 1.00 0.00 H new ATOM 0 HB2 ASP B 232 21.076 -5.580 -4.327 1.00 0.00 H new ATOM 0 HB3 ASP B 232 21.202 -6.880 -3.158 1.00 0.00 H new ATOM 1046 N LYS B 233 18.277 -7.342 -2.587 1.00 0.00 N ATOM 1047 CA LYS B 233 17.698 -8.098 -1.440 1.00 0.00 C ATOM 1048 C LYS B 233 16.274 -8.559 -1.764 1.00 0.00 C ATOM 1049 O LYS B 233 15.959 -9.730 -1.693 1.00 0.00 O ATOM 1050 CB LYS B 233 17.665 -7.198 -0.203 1.00 0.00 C ATOM 1051 CG LYS B 233 19.086 -6.743 0.138 1.00 0.00 C ATOM 1052 CD LYS B 233 19.355 -6.982 1.624 1.00 0.00 C ATOM 1053 CE LYS B 233 20.661 -6.290 2.024 1.00 0.00 C ATOM 1054 NZ LYS B 233 21.358 -7.105 3.059 1.00 0.00 N ATOM 0 H LYS B 233 18.042 -6.350 -2.621 1.00 0.00 H new ATOM 0 HA LYS B 233 18.319 -8.974 -1.250 1.00 0.00 H new ATOM 0 HB2 LYS B 233 17.029 -6.332 -0.388 1.00 0.00 H new ATOM 0 HB3 LYS B 233 17.233 -7.737 0.640 1.00 0.00 H new ATOM 0 HG2 LYS B 233 19.809 -7.291 -0.466 1.00 0.00 H new ATOM 0 HG3 LYS B 233 19.208 -5.686 -0.099 1.00 0.00 H new ATOM 0 HD2 LYS B 233 18.529 -6.596 2.221 1.00 0.00 H new ATOM 0 HD3 LYS B 233 19.421 -8.051 1.825 1.00 0.00 H new ATOM 0 HE2 LYS B 233 21.302 -6.166 1.151 1.00 0.00 H new ATOM 0 HE3 LYS B 233 20.453 -5.292 2.411 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 22.245 -6.636 3.331 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 20.747 -7.201 3.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 21.569 -8.048 2.674 1.00 0.00 H new ATOM 1068 N GLU B 234 15.406 -7.644 -2.091 1.00 0.00 N ATOM 1069 CA GLU B 234 13.996 -8.025 -2.388 1.00 0.00 C ATOM 1070 C GLU B 234 13.842 -8.504 -3.833 1.00 0.00 C ATOM 1071 O GLU B 234 12.788 -8.969 -4.219 1.00 0.00 O ATOM 1072 CB GLU B 234 13.087 -6.820 -2.164 1.00 0.00 C ATOM 1073 CG GLU B 234 13.003 -6.524 -0.668 1.00 0.00 C ATOM 1074 CD GLU B 234 12.251 -7.660 0.030 1.00 0.00 C ATOM 1075 OE1 GLU B 234 11.083 -7.841 -0.267 1.00 0.00 O ATOM 1076 OE2 GLU B 234 12.858 -8.329 0.851 1.00 0.00 O ATOM 0 H GLU B 234 15.611 -6.648 -2.166 1.00 0.00 H new ATOM 0 HA GLU B 234 13.718 -8.841 -1.721 1.00 0.00 H new ATOM 0 HB2 GLU B 234 13.476 -5.952 -2.697 1.00 0.00 H new ATOM 0 HB3 GLU B 234 12.093 -7.020 -2.563 1.00 0.00 H new ATOM 0 HG2 GLU B 234 14.004 -6.423 -0.249 1.00 0.00 H new ATOM 0 HG3 GLU B 234 12.491 -5.577 -0.501 1.00 0.00 H new ATOM 1083 N GLY B 235 14.862 -8.414 -4.641 1.00 0.00 N ATOM 1084 CA GLY B 235 14.726 -8.888 -6.049 1.00 0.00 C ATOM 1085 C GLY B 235 13.730 -8.009 -6.810 1.00 0.00 C ATOM 1086 O GLY B 235 13.132 -8.436 -7.778 1.00 0.00 O ATOM 0 H GLY B 235 15.776 -8.037 -4.392 1.00 0.00 H new ATOM 0 HA2 GLY B 235 15.697 -8.862 -6.544 1.00 0.00 H new ATOM 0 HA3 GLY B 235 14.390 -9.925 -6.060 1.00 0.00 H new ATOM 1090 N ILE B 236 13.543 -6.787 -6.385 1.00 0.00 N ATOM 1091 CA ILE B 236 12.580 -5.892 -7.094 1.00 0.00 C ATOM 1092 C ILE B 236 13.355 -4.843 -7.913 1.00 0.00 C ATOM 1093 O ILE B 236 14.219 -4.169 -7.387 1.00 0.00 O ATOM 1094 CB ILE B 236 11.706 -5.177 -6.063 1.00 0.00 C ATOM 1095 CG1 ILE B 236 11.032 -6.214 -5.162 1.00 0.00 C ATOM 1096 CG2 ILE B 236 10.634 -4.354 -6.781 1.00 0.00 C ATOM 1097 CD1 ILE B 236 10.366 -5.508 -3.979 1.00 0.00 C ATOM 0 H ILE B 236 14.013 -6.371 -5.581 1.00 0.00 H new ATOM 0 HA ILE B 236 11.956 -6.487 -7.762 1.00 0.00 H new ATOM 0 HB ILE B 236 12.326 -4.515 -5.459 1.00 0.00 H new ATOM 0 HG12 ILE B 236 10.289 -6.776 -5.729 1.00 0.00 H new ATOM 0 HG13 ILE B 236 11.769 -6.932 -4.802 1.00 0.00 H new ATOM 0 HG21 ILE B 236 10.012 -3.845 -6.045 1.00 0.00 H new ATOM 0 HG22 ILE B 236 11.112 -3.616 -7.424 1.00 0.00 H new ATOM 0 HG23 ILE B 236 10.013 -5.014 -7.386 1.00 0.00 H new ATOM 0 HD11 ILE B 236 9.886 -6.247 -3.338 1.00 0.00 H new ATOM 0 HD12 ILE B 236 11.120 -4.966 -3.407 1.00 0.00 H new ATOM 0 HD13 ILE B 236 9.617 -4.807 -4.348 1.00 0.00 H new ATOM 1109 N PRO B 237 13.055 -4.690 -9.188 1.00 0.00 N ATOM 1110 CA PRO B 237 13.750 -3.692 -10.052 1.00 0.00 C ATOM 1111 C PRO B 237 13.266 -2.262 -9.779 1.00 0.00 C ATOM 1112 O PRO B 237 12.193 -2.056 -9.248 1.00 0.00 O ATOM 1113 CB PRO B 237 13.382 -4.121 -11.473 1.00 0.00 C ATOM 1114 CG PRO B 237 12.072 -4.822 -11.344 1.00 0.00 C ATOM 1115 CD PRO B 237 12.036 -5.441 -9.944 1.00 0.00 C ATOM 0 HA PRO B 237 14.825 -3.674 -9.871 1.00 0.00 H new ATOM 0 HB2 PRO B 237 13.304 -3.260 -12.136 1.00 0.00 H new ATOM 0 HB3 PRO B 237 14.141 -4.780 -11.894 1.00 0.00 H new ATOM 0 HG2 PRO B 237 11.246 -4.124 -11.479 1.00 0.00 H new ATOM 0 HG3 PRO B 237 11.968 -5.591 -12.109 1.00 0.00 H new ATOM 0 HD2 PRO B 237 11.050 -5.341 -9.490 1.00 0.00 H new ATOM 0 HD3 PRO B 237 12.267 -6.506 -9.974 1.00 0.00 H new ATOM 1123 N PRO B 238 14.058 -1.285 -10.132 1.00 0.00 N ATOM 1124 CA PRO B 238 13.720 0.156 -9.913 1.00 0.00 C ATOM 1125 C PRO B 238 12.552 0.640 -10.778 1.00 0.00 C ATOM 1126 O PRO B 238 11.819 1.533 -10.402 1.00 0.00 O ATOM 1127 CB PRO B 238 15.002 0.896 -10.304 1.00 0.00 C ATOM 1128 CG PRO B 238 15.729 -0.028 -11.222 1.00 0.00 C ATOM 1129 CD PRO B 238 15.367 -1.444 -10.781 1.00 0.00 C ATOM 0 HA PRO B 238 13.400 0.330 -8.886 1.00 0.00 H new ATOM 0 HB2 PRO B 238 14.775 1.841 -10.797 1.00 0.00 H new ATOM 0 HB3 PRO B 238 15.603 1.131 -9.426 1.00 0.00 H new ATOM 0 HG2 PRO B 238 15.436 0.143 -12.258 1.00 0.00 H new ATOM 0 HG3 PRO B 238 16.805 0.134 -11.164 1.00 0.00 H new ATOM 0 HD2 PRO B 238 15.313 -2.126 -11.630 1.00 0.00 H new ATOM 0 HD3 PRO B 238 16.108 -1.850 -10.093 1.00 0.00 H new ATOM 1137 N ASP B 239 12.381 0.072 -11.940 1.00 0.00 N ATOM 1138 CA ASP B 239 11.270 0.517 -12.828 1.00 0.00 C ATOM 1139 C ASP B 239 9.923 0.111 -12.227 1.00 0.00 C ATOM 1140 O ASP B 239 8.874 0.474 -12.738 1.00 0.00 O ATOM 1141 CB ASP B 239 11.430 -0.124 -14.208 1.00 0.00 C ATOM 1142 CG ASP B 239 11.331 -1.646 -14.082 1.00 0.00 C ATOM 1143 OD1 ASP B 239 11.087 -2.114 -12.982 1.00 0.00 O ATOM 1144 OD2 ASP B 239 11.500 -2.316 -15.087 1.00 0.00 O ATOM 0 H ASP B 239 12.961 -0.680 -12.313 1.00 0.00 H new ATOM 0 HA ASP B 239 11.304 1.602 -12.924 1.00 0.00 H new ATOM 0 HB2 ASP B 239 10.659 0.246 -14.884 1.00 0.00 H new ATOM 0 HB3 ASP B 239 12.392 0.153 -14.640 1.00 0.00 H new ATOM 1149 N GLN B 240 9.937 -0.638 -11.150 1.00 0.00 N ATOM 1150 CA GLN B 240 8.653 -1.063 -10.521 1.00 0.00 C ATOM 1151 C GLN B 240 8.670 -0.745 -9.020 1.00 0.00 C ATOM 1152 O GLN B 240 7.637 -0.657 -8.387 1.00 0.00 O ATOM 1153 CB GLN B 240 8.447 -2.569 -10.754 1.00 0.00 C ATOM 1154 CG GLN B 240 8.308 -3.317 -9.422 1.00 0.00 C ATOM 1155 CD GLN B 240 8.095 -4.805 -9.700 1.00 0.00 C ATOM 1156 OE1 GLN B 240 8.876 -5.416 -10.549 1.00 0.00 O flip ATOM 1157 NE2 GLN B 240 7.207 -5.418 -9.141 1.00 0.00 N flip ATOM 0 H GLN B 240 10.781 -0.971 -10.683 1.00 0.00 H new ATOM 0 HA GLN B 240 7.826 -0.517 -10.975 1.00 0.00 H new ATOM 0 HB2 GLN B 240 7.555 -2.728 -11.360 1.00 0.00 H new ATOM 0 HB3 GLN B 240 9.290 -2.972 -11.316 1.00 0.00 H new ATOM 0 HG2 GLN B 240 9.202 -3.173 -8.815 1.00 0.00 H new ATOM 0 HG3 GLN B 240 7.469 -2.917 -8.853 1.00 0.00 H new ATOM 0 HE21 GLN B 240 6.597 -4.940 -8.478 1.00 0.00 H new ATOM 0 HE22 GLN B 240 7.072 -6.410 -9.335 1.00 0.00 H new ATOM 1166 N GLN B 241 9.828 -0.576 -8.442 1.00 0.00 N ATOM 1167 CA GLN B 241 9.885 -0.266 -6.984 1.00 0.00 C ATOM 1168 C GLN B 241 9.882 1.252 -6.788 1.00 0.00 C ATOM 1169 O GLN B 241 10.529 1.979 -7.515 1.00 0.00 O ATOM 1170 CB GLN B 241 11.154 -0.886 -6.377 1.00 0.00 C ATOM 1171 CG GLN B 241 12.158 0.201 -5.977 1.00 0.00 C ATOM 1172 CD GLN B 241 13.440 -0.466 -5.476 1.00 0.00 C ATOM 1173 OE1 GLN B 241 13.953 -0.118 -4.432 1.00 0.00 O ATOM 1174 NE2 GLN B 241 13.982 -1.421 -6.182 1.00 0.00 N ATOM 0 H GLN B 241 10.731 -0.638 -8.912 1.00 0.00 H new ATOM 0 HA GLN B 241 9.015 -0.688 -6.481 1.00 0.00 H new ATOM 0 HB2 GLN B 241 10.890 -1.482 -5.503 1.00 0.00 H new ATOM 0 HB3 GLN B 241 11.613 -1.563 -7.098 1.00 0.00 H new ATOM 0 HG2 GLN B 241 12.376 0.844 -6.830 1.00 0.00 H new ATOM 0 HG3 GLN B 241 11.735 0.836 -5.199 1.00 0.00 H new ATOM 0 HE21 GLN B 241 13.552 -1.714 -7.059 1.00 0.00 H new ATOM 0 HE22 GLN B 241 14.836 -1.874 -5.856 1.00 0.00 H new ATOM 1183 N ARG B 242 9.158 1.736 -5.813 1.00 0.00 N ATOM 1184 CA ARG B 242 9.114 3.209 -5.572 1.00 0.00 C ATOM 1185 C ARG B 242 9.411 3.492 -4.098 1.00 0.00 C ATOM 1186 O ARG B 242 8.850 2.875 -3.214 1.00 0.00 O ATOM 1187 CB ARG B 242 7.722 3.743 -5.919 1.00 0.00 C ATOM 1188 CG ARG B 242 7.592 3.895 -7.435 1.00 0.00 C ATOM 1189 CD ARG B 242 6.298 4.642 -7.762 1.00 0.00 C ATOM 1190 NE ARG B 242 6.306 5.041 -9.198 1.00 0.00 N ATOM 1191 CZ ARG B 242 5.517 5.992 -9.616 1.00 0.00 C ATOM 1192 NH1 ARG B 242 4.720 6.593 -8.775 1.00 0.00 N ATOM 1193 NH2 ARG B 242 5.526 6.344 -10.872 1.00 0.00 N ATOM 0 H ARG B 242 8.595 1.175 -5.173 1.00 0.00 H new ATOM 0 HA ARG B 242 9.859 3.701 -6.197 1.00 0.00 H new ATOM 0 HB2 ARG B 242 6.957 3.062 -5.545 1.00 0.00 H new ATOM 0 HB3 ARG B 242 7.559 4.704 -5.432 1.00 0.00 H new ATOM 0 HG2 ARG B 242 8.449 4.439 -7.832 1.00 0.00 H new ATOM 0 HG3 ARG B 242 7.589 2.914 -7.911 1.00 0.00 H new ATOM 0 HD2 ARG B 242 5.436 4.007 -7.554 1.00 0.00 H new ATOM 0 HD3 ARG B 242 6.204 5.524 -7.129 1.00 0.00 H new ATOM 0 HE ARG B 242 6.929 4.570 -9.854 1.00 0.00 H new ATOM 0 HH11 ARG B 242 4.715 6.319 -7.793 1.00 0.00 H new ATOM 0 HH12 ARG B 242 4.102 7.337 -9.100 1.00 0.00 H new ATOM 0 HH21 ARG B 242 6.150 5.875 -11.528 1.00 0.00 H new ATOM 0 HH22 ARG B 242 4.909 7.088 -11.198 1.00 0.00 H new ATOM 1207 N LEU B 243 10.287 4.423 -3.826 1.00 0.00 N ATOM 1208 CA LEU B 243 10.615 4.749 -2.408 1.00 0.00 C ATOM 1209 C LEU B 243 9.951 6.074 -2.023 1.00 0.00 C ATOM 1210 O LEU B 243 10.158 7.095 -2.652 1.00 0.00 O ATOM 1211 CB LEU B 243 12.131 4.860 -2.239 1.00 0.00 C ATOM 1212 CG LEU B 243 12.734 3.464 -2.090 1.00 0.00 C ATOM 1213 CD1 LEU B 243 14.186 3.479 -2.573 1.00 0.00 C ATOM 1214 CD2 LEU B 243 12.691 3.047 -0.617 1.00 0.00 C ATOM 0 H LEU B 243 10.789 4.971 -4.524 1.00 0.00 H new ATOM 0 HA LEU B 243 10.243 3.956 -1.759 1.00 0.00 H new ATOM 0 HB2 LEU B 243 12.567 5.365 -3.101 1.00 0.00 H new ATOM 0 HB3 LEU B 243 12.366 5.464 -1.363 1.00 0.00 H new ATOM 0 HG LEU B 243 12.161 2.755 -2.687 1.00 0.00 H new ATOM 0 HD11 LEU B 243 14.615 2.483 -2.466 1.00 0.00 H new ATOM 0 HD12 LEU B 243 14.218 3.778 -3.621 1.00 0.00 H new ATOM 0 HD13 LEU B 243 14.761 4.187 -1.976 1.00 0.00 H new ATOM 0 HD21 LEU B 243 13.121 2.051 -0.508 1.00 0.00 H new ATOM 0 HD22 LEU B 243 13.265 3.757 -0.021 1.00 0.00 H new ATOM 0 HD23 LEU B 243 11.657 3.036 -0.272 1.00 0.00 H new ATOM 1226 N ILE B 244 9.150 6.055 -0.989 1.00 0.00 N ATOM 1227 CA ILE B 244 8.456 7.297 -0.543 1.00 0.00 C ATOM 1228 C ILE B 244 8.878 7.627 0.892 1.00 0.00 C ATOM 1229 O ILE B 244 8.947 6.762 1.742 1.00 0.00 O ATOM 1230 CB ILE B 244 6.941 7.073 -0.598 1.00 0.00 C ATOM 1231 CG1 ILE B 244 6.489 7.017 -2.060 1.00 0.00 C ATOM 1232 CG2 ILE B 244 6.220 8.221 0.111 1.00 0.00 C ATOM 1233 CD1 ILE B 244 5.124 6.334 -2.147 1.00 0.00 C ATOM 0 H ILE B 244 8.946 5.225 -0.431 1.00 0.00 H new ATOM 0 HA ILE B 244 8.725 8.127 -1.197 1.00 0.00 H new ATOM 0 HB ILE B 244 6.698 6.134 -0.101 1.00 0.00 H new ATOM 0 HG12 ILE B 244 6.430 8.024 -2.472 1.00 0.00 H new ATOM 0 HG13 ILE B 244 7.219 6.471 -2.657 1.00 0.00 H new ATOM 0 HG21 ILE B 244 5.143 8.056 0.068 1.00 0.00 H new ATOM 0 HG22 ILE B 244 6.540 8.264 1.152 1.00 0.00 H new ATOM 0 HG23 ILE B 244 6.462 9.163 -0.382 1.00 0.00 H new ATOM 0 HD11 ILE B 244 4.803 6.294 -3.188 1.00 0.00 H new ATOM 0 HD12 ILE B 244 5.198 5.321 -1.751 1.00 0.00 H new ATOM 0 HD13 ILE B 244 4.397 6.899 -1.564 1.00 0.00 H new ATOM 1245 N PHE B 245 9.166 8.872 1.161 1.00 0.00 N ATOM 1246 CA PHE B 245 9.591 9.268 2.536 1.00 0.00 C ATOM 1247 C PHE B 245 8.758 10.466 2.995 1.00 0.00 C ATOM 1248 O PHE B 245 8.855 11.545 2.445 1.00 0.00 O ATOM 1249 CB PHE B 245 11.075 9.649 2.507 1.00 0.00 C ATOM 1250 CG PHE B 245 11.570 9.926 3.908 1.00 0.00 C ATOM 1251 CD1 PHE B 245 11.533 8.919 4.882 1.00 0.00 C ATOM 1252 CD2 PHE B 245 12.077 11.191 4.231 1.00 0.00 C ATOM 1253 CE1 PHE B 245 12.000 9.179 6.176 1.00 0.00 C ATOM 1254 CE2 PHE B 245 12.545 11.450 5.525 1.00 0.00 C ATOM 1255 CZ PHE B 245 12.505 10.444 6.498 1.00 0.00 C ATOM 0 H PHE B 245 9.125 9.635 0.485 1.00 0.00 H new ATOM 0 HA PHE B 245 9.441 8.439 3.228 1.00 0.00 H new ATOM 0 HB2 PHE B 245 11.656 8.842 2.061 1.00 0.00 H new ATOM 0 HB3 PHE B 245 11.220 10.530 1.881 1.00 0.00 H new ATOM 0 HD1 PHE B 245 11.144 7.942 4.634 1.00 0.00 H new ATOM 0 HD2 PHE B 245 12.107 11.968 3.481 1.00 0.00 H new ATOM 0 HE1 PHE B 245 11.971 8.403 6.926 1.00 0.00 H new ATOM 0 HE2 PHE B 245 12.937 12.426 5.773 1.00 0.00 H new ATOM 0 HZ PHE B 245 12.864 10.644 7.497 1.00 0.00 H new ATOM 1265 N ALA B 246 7.934 10.293 3.992 1.00 0.00 N ATOM 1266 CA ALA B 246 7.099 11.434 4.462 1.00 0.00 C ATOM 1267 C ALA B 246 6.133 11.844 3.347 1.00 0.00 C ATOM 1268 O ALA B 246 5.907 13.013 3.102 1.00 0.00 O ATOM 1269 CB ALA B 246 7.997 12.618 4.828 1.00 0.00 C ATOM 0 H ALA B 246 7.803 9.417 4.498 1.00 0.00 H new ATOM 0 HA ALA B 246 6.533 11.132 5.343 1.00 0.00 H new ATOM 0 HB1 ALA B 246 7.381 13.449 5.171 1.00 0.00 H new ATOM 0 HB2 ALA B 246 8.683 12.323 5.622 1.00 0.00 H new ATOM 0 HB3 ALA B 246 8.568 12.926 3.952 1.00 0.00 H new ATOM 1275 N GLY B 247 5.548 10.883 2.684 1.00 0.00 N ATOM 1276 CA GLY B 247 4.576 11.198 1.599 1.00 0.00 C ATOM 1277 C GLY B 247 5.280 11.888 0.430 1.00 0.00 C ATOM 1278 O GLY B 247 4.639 12.354 -0.491 1.00 0.00 O ATOM 0 H GLY B 247 5.703 9.888 2.849 1.00 0.00 H new ATOM 0 HA2 GLY B 247 4.099 10.281 1.253 1.00 0.00 H new ATOM 0 HA3 GLY B 247 3.786 11.842 1.986 1.00 0.00 H new ATOM 1282 N LYS B 248 6.585 11.960 0.451 1.00 0.00 N ATOM 1283 CA LYS B 248 7.306 12.625 -0.673 1.00 0.00 C ATOM 1284 C LYS B 248 7.977 11.562 -1.549 1.00 0.00 C ATOM 1285 O LYS B 248 8.533 10.596 -1.066 1.00 0.00 O ATOM 1286 CB LYS B 248 8.352 13.599 -0.114 1.00 0.00 C ATOM 1287 CG LYS B 248 9.730 12.933 -0.056 1.00 0.00 C ATOM 1288 CD LYS B 248 10.659 13.748 0.848 1.00 0.00 C ATOM 1289 CE LYS B 248 10.562 15.237 0.500 1.00 0.00 C ATOM 1290 NZ LYS B 248 10.728 15.422 -0.970 1.00 0.00 N ATOM 0 H LYS B 248 7.179 11.590 1.193 1.00 0.00 H new ATOM 0 HA LYS B 248 6.597 13.187 -1.281 1.00 0.00 H new ATOM 0 HB2 LYS B 248 8.399 14.490 -0.740 1.00 0.00 H new ATOM 0 HB3 LYS B 248 8.057 13.925 0.883 1.00 0.00 H new ATOM 0 HG2 LYS B 248 9.637 11.916 0.324 1.00 0.00 H new ATOM 0 HG3 LYS B 248 10.153 12.861 -1.058 1.00 0.00 H new ATOM 0 HD2 LYS B 248 10.390 13.593 1.893 1.00 0.00 H new ATOM 0 HD3 LYS B 248 11.687 13.405 0.729 1.00 0.00 H new ATOM 0 HE2 LYS B 248 9.598 15.633 0.819 1.00 0.00 H new ATOM 0 HE3 LYS B 248 11.329 15.796 1.035 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 11.364 16.225 -1.149 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 11.134 14.559 -1.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 9.801 15.611 -1.403 1.00 0.00 H new ATOM 1304 N GLN B 249 7.906 11.720 -2.840 1.00 0.00 N ATOM 1305 CA GLN B 249 8.523 10.713 -3.747 1.00 0.00 C ATOM 1306 C GLN B 249 10.006 11.040 -3.947 1.00 0.00 C ATOM 1307 O GLN B 249 10.361 12.137 -4.327 1.00 0.00 O ATOM 1308 CB GLN B 249 7.809 10.740 -5.099 1.00 0.00 C ATOM 1309 CG GLN B 249 8.141 9.463 -5.872 1.00 0.00 C ATOM 1310 CD GLN B 249 7.457 9.498 -7.238 1.00 0.00 C ATOM 1311 OE1 GLN B 249 6.956 10.523 -7.655 1.00 0.00 O ATOM 1312 NE2 GLN B 249 7.416 8.411 -7.960 1.00 0.00 N ATOM 0 H GLN B 249 7.448 12.503 -3.307 1.00 0.00 H new ATOM 0 HA GLN B 249 8.428 9.722 -3.304 1.00 0.00 H new ATOM 0 HB2 GLN B 249 6.732 10.820 -4.953 1.00 0.00 H new ATOM 0 HB3 GLN B 249 8.119 11.615 -5.670 1.00 0.00 H new ATOM 0 HG2 GLN B 249 9.220 9.371 -5.997 1.00 0.00 H new ATOM 0 HG3 GLN B 249 7.810 8.589 -5.310 1.00 0.00 H new ATOM 0 HE21 GLN B 249 7.837 7.550 -7.610 1.00 0.00 H new ATOM 0 HE22 GLN B 249 6.963 8.423 -8.874 1.00 0.00 H new ATOM 1321 N LEU B 250 10.875 10.096 -3.697 1.00 0.00 N ATOM 1322 CA LEU B 250 12.331 10.363 -3.881 1.00 0.00 C ATOM 1323 C LEU B 250 12.667 10.319 -5.375 1.00 0.00 C ATOM 1324 O LEU B 250 12.093 9.553 -6.125 1.00 0.00 O ATOM 1325 CB LEU B 250 13.145 9.302 -3.139 1.00 0.00 C ATOM 1326 CG LEU B 250 12.574 9.104 -1.733 1.00 0.00 C ATOM 1327 CD1 LEU B 250 13.424 8.080 -0.980 1.00 0.00 C ATOM 1328 CD2 LEU B 250 12.596 10.434 -0.978 1.00 0.00 C ATOM 0 H LEU B 250 10.641 9.157 -3.375 1.00 0.00 H new ATOM 0 HA LEU B 250 12.576 11.347 -3.481 1.00 0.00 H new ATOM 0 HB2 LEU B 250 13.120 8.361 -3.688 1.00 0.00 H new ATOM 0 HB3 LEU B 250 14.189 9.608 -3.078 1.00 0.00 H new ATOM 0 HG LEU B 250 11.547 8.746 -1.806 1.00 0.00 H new ATOM 0 HD11 LEU B 250 13.019 7.937 0.022 1.00 0.00 H new ATOM 0 HD12 LEU B 250 13.410 7.131 -1.516 1.00 0.00 H new ATOM 0 HD13 LEU B 250 14.450 8.441 -0.909 1.00 0.00 H new ATOM 0 HD21 LEU B 250 12.189 10.291 0.023 1.00 0.00 H new ATOM 0 HD22 LEU B 250 13.622 10.794 -0.904 1.00 0.00 H new ATOM 0 HD23 LEU B 250 11.992 11.167 -1.514 1.00 0.00 H new ATOM 1340 N GLU B 251 13.587 11.135 -5.816 1.00 0.00 N ATOM 1341 CA GLU B 251 13.948 11.139 -7.265 1.00 0.00 C ATOM 1342 C GLU B 251 15.265 10.386 -7.477 1.00 0.00 C ATOM 1343 O GLU B 251 16.162 10.439 -6.660 1.00 0.00 O ATOM 1344 CB GLU B 251 14.108 12.584 -7.746 1.00 0.00 C ATOM 1345 CG GLU B 251 13.475 12.737 -9.131 1.00 0.00 C ATOM 1346 CD GLU B 251 14.190 11.817 -10.123 1.00 0.00 C ATOM 1347 OE1 GLU B 251 15.195 12.237 -10.672 1.00 0.00 O ATOM 1348 OE2 GLU B 251 13.718 10.709 -10.319 1.00 0.00 O ATOM 0 H GLU B 251 14.103 11.798 -5.238 1.00 0.00 H new ATOM 0 HA GLU B 251 13.157 10.647 -7.832 1.00 0.00 H new ATOM 0 HB2 GLU B 251 13.634 13.267 -7.041 1.00 0.00 H new ATOM 0 HB3 GLU B 251 15.164 12.850 -7.786 1.00 0.00 H new ATOM 0 HG2 GLU B 251 12.415 12.489 -9.087 1.00 0.00 H new ATOM 0 HG3 GLU B 251 13.546 13.773 -9.463 1.00 0.00 H new ATOM 1355 N ASP B 252 15.384 9.685 -8.573 1.00 0.00 N ATOM 1356 CA ASP B 252 16.638 8.926 -8.848 1.00 0.00 C ATOM 1357 C ASP B 252 17.773 9.900 -9.178 1.00 0.00 C ATOM 1358 O ASP B 252 18.871 9.493 -9.502 1.00 0.00 O ATOM 1359 CB ASP B 252 16.416 7.985 -10.033 1.00 0.00 C ATOM 1360 CG ASP B 252 15.422 8.618 -11.009 1.00 0.00 C ATOM 1361 OD1 ASP B 252 14.233 8.429 -10.818 1.00 0.00 O ATOM 1362 OD2 ASP B 252 15.868 9.280 -11.933 1.00 0.00 O ATOM 0 H ASP B 252 14.664 9.605 -9.292 1.00 0.00 H new ATOM 0 HA ASP B 252 16.906 8.346 -7.965 1.00 0.00 H new ATOM 0 HB2 ASP B 252 17.362 7.789 -10.537 1.00 0.00 H new ATOM 0 HB3 ASP B 252 16.037 7.025 -9.683 1.00 0.00 H new ATOM 1367 N GLY B 253 17.513 11.181 -9.106 1.00 0.00 N ATOM 1368 CA GLY B 253 18.577 12.181 -9.426 1.00 0.00 C ATOM 1369 C GLY B 253 18.860 13.066 -8.209 1.00 0.00 C ATOM 1370 O GLY B 253 19.119 14.246 -8.340 1.00 0.00 O ATOM 0 H GLY B 253 16.612 11.577 -8.840 1.00 0.00 H new ATOM 0 HA2 GLY B 253 19.489 11.667 -9.730 1.00 0.00 H new ATOM 0 HA3 GLY B 253 18.264 12.798 -10.268 1.00 0.00 H new ATOM 1374 N ARG B 254 18.823 12.512 -7.026 1.00 0.00 N ATOM 1375 CA ARG B 254 19.101 13.335 -5.811 1.00 0.00 C ATOM 1376 C ARG B 254 19.833 12.482 -4.771 1.00 0.00 C ATOM 1377 O ARG B 254 20.008 11.292 -4.944 1.00 0.00 O ATOM 1378 CB ARG B 254 17.783 13.842 -5.217 1.00 0.00 C ATOM 1379 CG ARG B 254 17.466 15.238 -5.759 1.00 0.00 C ATOM 1380 CD ARG B 254 15.948 15.405 -5.871 1.00 0.00 C ATOM 1381 NE ARG B 254 15.592 16.840 -5.704 1.00 0.00 N ATOM 1382 CZ ARG B 254 15.962 17.713 -6.600 1.00 0.00 C ATOM 1383 NH1 ARG B 254 16.633 17.324 -7.649 1.00 0.00 N ATOM 1384 NH2 ARG B 254 15.658 18.972 -6.450 1.00 0.00 N ATOM 0 H ARG B 254 18.613 11.530 -6.848 1.00 0.00 H new ATOM 0 HA ARG B 254 19.723 14.186 -6.088 1.00 0.00 H new ATOM 0 HB2 ARG B 254 16.975 13.154 -5.465 1.00 0.00 H new ATOM 0 HB3 ARG B 254 17.853 13.872 -4.130 1.00 0.00 H new ATOM 0 HG2 ARG B 254 17.879 16.000 -5.098 1.00 0.00 H new ATOM 0 HG3 ARG B 254 17.932 15.376 -6.735 1.00 0.00 H new ATOM 0 HD2 ARG B 254 15.602 15.044 -6.840 1.00 0.00 H new ATOM 0 HD3 ARG B 254 15.448 14.805 -5.111 1.00 0.00 H new ATOM 0 HE ARG B 254 15.058 17.141 -4.889 1.00 0.00 H new ATOM 0 HH11 ARG B 254 16.868 16.338 -7.768 1.00 0.00 H new ATOM 0 HH12 ARG B 254 16.923 18.005 -8.350 1.00 0.00 H new ATOM 0 HH21 ARG B 254 15.130 19.275 -5.631 1.00 0.00 H new ATOM 0 HH22 ARG B 254 15.948 19.654 -7.151 1.00 0.00 H new ATOM 1398 N THR B 255 20.271 13.089 -3.696 1.00 0.00 N ATOM 1399 CA THR B 255 21.003 12.322 -2.644 1.00 0.00 C ATOM 1400 C THR B 255 20.172 12.272 -1.362 1.00 0.00 C ATOM 1401 O THR B 255 19.265 13.057 -1.166 1.00 0.00 O ATOM 1402 CB THR B 255 22.336 13.009 -2.350 1.00 0.00 C ATOM 1403 OG1 THR B 255 22.095 14.324 -1.870 1.00 0.00 O ATOM 1404 CG2 THR B 255 23.171 13.077 -3.630 1.00 0.00 C ATOM 0 H THR B 255 20.153 14.083 -3.502 1.00 0.00 H new ATOM 0 HA THR B 255 21.179 11.307 -3.000 1.00 0.00 H new ATOM 0 HB THR B 255 22.878 12.440 -1.595 1.00 0.00 H new ATOM 0 HG1 THR B 255 22.299 14.365 -0.912 1.00 0.00 H new ATOM 0 HG21 THR B 255 24.121 13.567 -3.419 1.00 0.00 H new ATOM 0 HG22 THR B 255 23.357 12.068 -3.997 1.00 0.00 H new ATOM 0 HG23 THR B 255 22.630 13.645 -4.387 1.00 0.00 H new ATOM 1412 N LEU B 256 20.473 11.350 -0.487 1.00 0.00 N ATOM 1413 CA LEU B 256 19.700 11.245 0.784 1.00 0.00 C ATOM 1414 C LEU B 256 19.829 12.544 1.581 1.00 0.00 C ATOM 1415 O LEU B 256 18.869 13.035 2.141 1.00 0.00 O ATOM 1416 CB LEU B 256 20.239 10.085 1.626 1.00 0.00 C ATOM 1417 CG LEU B 256 20.648 8.927 0.712 1.00 0.00 C ATOM 1418 CD1 LEU B 256 20.931 7.681 1.551 1.00 0.00 C ATOM 1419 CD2 LEU B 256 19.521 8.629 -0.277 1.00 0.00 C ATOM 0 H LEU B 256 21.221 10.665 -0.598 1.00 0.00 H new ATOM 0 HA LEU B 256 18.652 11.067 0.544 1.00 0.00 H new ATOM 0 HB2 LEU B 256 21.095 10.417 2.213 1.00 0.00 H new ATOM 0 HB3 LEU B 256 19.478 9.752 2.332 1.00 0.00 H new ATOM 0 HG LEU B 256 21.548 9.206 0.164 1.00 0.00 H new ATOM 0 HD11 LEU B 256 21.222 6.860 0.896 1.00 0.00 H new ATOM 0 HD12 LEU B 256 21.739 7.890 2.252 1.00 0.00 H new ATOM 0 HD13 LEU B 256 20.034 7.404 2.105 1.00 0.00 H new ATOM 0 HD21 LEU B 256 19.815 7.804 -0.926 1.00 0.00 H new ATOM 0 HD22 LEU B 256 18.619 8.356 0.271 1.00 0.00 H new ATOM 0 HD23 LEU B 256 19.324 9.514 -0.882 1.00 0.00 H new ATOM 1431 N SER B 257 21.004 13.105 1.643 1.00 0.00 N ATOM 1432 CA SER B 257 21.178 14.369 2.409 1.00 0.00 C ATOM 1433 C SER B 257 20.287 15.452 1.801 1.00 0.00 C ATOM 1434 O SER B 257 19.851 16.363 2.476 1.00 0.00 O ATOM 1435 CB SER B 257 22.641 14.808 2.341 1.00 0.00 C ATOM 1436 OG SER B 257 22.994 15.053 0.986 1.00 0.00 O ATOM 0 H SER B 257 21.848 12.744 1.198 1.00 0.00 H new ATOM 0 HA SER B 257 20.898 14.210 3.450 1.00 0.00 H new ATOM 0 HB2 SER B 257 22.791 15.708 2.937 1.00 0.00 H new ATOM 0 HB3 SER B 257 23.285 14.036 2.763 1.00 0.00 H new ATOM 0 HG SER B 257 23.482 14.281 0.630 1.00 0.00 H new ATOM 1442 N ASP B 258 20.013 15.357 0.530 1.00 0.00 N ATOM 1443 CA ASP B 258 19.146 16.378 -0.122 1.00 0.00 C ATOM 1444 C ASP B 258 17.705 16.174 0.341 1.00 0.00 C ATOM 1445 O ASP B 258 16.854 17.020 0.151 1.00 0.00 O ATOM 1446 CB ASP B 258 19.222 16.219 -1.642 1.00 0.00 C ATOM 1447 CG ASP B 258 20.151 17.287 -2.223 1.00 0.00 C ATOM 1448 OD1 ASP B 258 21.094 17.656 -1.543 1.00 0.00 O ATOM 1449 OD2 ASP B 258 19.905 17.715 -3.337 1.00 0.00 O ATOM 0 H ASP B 258 20.351 14.617 -0.085 1.00 0.00 H new ATOM 0 HA ASP B 258 19.484 17.378 0.152 1.00 0.00 H new ATOM 0 HB2 ASP B 258 19.590 15.225 -1.896 1.00 0.00 H new ATOM 0 HB3 ASP B 258 18.227 16.312 -2.078 1.00 0.00 H new ATOM 1454 N TYR B 259 17.427 15.052 0.948 1.00 0.00 N ATOM 1455 CA TYR B 259 16.044 14.780 1.426 1.00 0.00 C ATOM 1456 C TYR B 259 15.998 14.890 2.951 1.00 0.00 C ATOM 1457 O TYR B 259 14.967 14.710 3.560 1.00 0.00 O ATOM 1458 CB TYR B 259 15.634 13.370 1.004 1.00 0.00 C ATOM 1459 CG TYR B 259 15.146 13.393 -0.425 1.00 0.00 C ATOM 1460 CD1 TYR B 259 13.991 14.109 -0.761 1.00 0.00 C ATOM 1461 CD2 TYR B 259 15.848 12.695 -1.415 1.00 0.00 C ATOM 1462 CE1 TYR B 259 13.537 14.126 -2.085 1.00 0.00 C ATOM 1463 CE2 TYR B 259 15.395 12.712 -2.740 1.00 0.00 C ATOM 1464 CZ TYR B 259 14.238 13.427 -3.073 1.00 0.00 C ATOM 1465 OH TYR B 259 13.789 13.441 -4.378 1.00 0.00 O ATOM 0 H TYR B 259 18.102 14.310 1.133 1.00 0.00 H new ATOM 0 HA TYR B 259 15.358 15.507 0.991 1.00 0.00 H new ATOM 0 HB2 TYR B 259 16.480 12.690 1.099 1.00 0.00 H new ATOM 0 HB3 TYR B 259 14.849 12.996 1.661 1.00 0.00 H new ATOM 0 HD1 TYR B 259 13.450 14.649 0.002 1.00 0.00 H new ATOM 0 HD2 TYR B 259 16.740 12.143 -1.157 1.00 0.00 H new ATOM 0 HE1 TYR B 259 12.646 14.679 -2.343 1.00 0.00 H new ATOM 0 HE2 TYR B 259 15.937 12.174 -3.504 1.00 0.00 H new ATOM 0 HH TYR B 259 13.324 14.285 -4.555 1.00 0.00 H new ATOM 1475 N ASN B 260 17.110 15.195 3.566 1.00 0.00 N ATOM 1476 CA ASN B 260 17.144 15.329 5.055 1.00 0.00 C ATOM 1477 C ASN B 260 16.930 13.952 5.705 1.00 0.00 C ATOM 1478 O ASN B 260 16.384 13.824 6.783 1.00 0.00 O ATOM 1479 CB ASN B 260 16.074 16.354 5.489 1.00 0.00 C ATOM 1480 CG ASN B 260 14.908 15.695 6.243 1.00 0.00 C ATOM 1481 OD1 ASN B 260 14.449 16.220 7.238 1.00 0.00 O ATOM 1482 ND2 ASN B 260 14.408 14.566 5.820 1.00 0.00 N ATOM 0 H ASN B 260 18.002 15.358 3.099 1.00 0.00 H new ATOM 0 HA ASN B 260 18.116 15.694 5.387 1.00 0.00 H new ATOM 0 HB2 ASN B 260 16.535 17.110 6.125 1.00 0.00 H new ATOM 0 HB3 ASN B 260 15.690 16.870 4.609 1.00 0.00 H new ATOM 0 HD21 ASN B 260 13.636 14.129 6.324 1.00 0.00 H new ATOM 0 HD22 ASN B 260 14.789 14.120 4.985 1.00 0.00 H new ATOM 1489 N ILE B 261 17.406 12.913 5.075 1.00 0.00 N ATOM 1490 CA ILE B 261 17.257 11.553 5.667 1.00 0.00 C ATOM 1491 C ILE B 261 18.408 11.290 6.640 1.00 0.00 C ATOM 1492 O ILE B 261 19.556 11.543 6.338 1.00 0.00 O ATOM 1493 CB ILE B 261 17.276 10.507 4.552 1.00 0.00 C ATOM 1494 CG1 ILE B 261 15.998 10.636 3.721 1.00 0.00 C ATOM 1495 CG2 ILE B 261 17.343 9.108 5.168 1.00 0.00 C ATOM 1496 CD1 ILE B 261 16.172 9.893 2.397 1.00 0.00 C ATOM 0 H ILE B 261 17.891 12.947 4.178 1.00 0.00 H new ATOM 0 HA ILE B 261 16.310 11.491 6.204 1.00 0.00 H new ATOM 0 HB ILE B 261 18.146 10.665 3.915 1.00 0.00 H new ATOM 0 HG12 ILE B 261 15.151 10.226 4.271 1.00 0.00 H new ATOM 0 HG13 ILE B 261 15.778 11.687 3.534 1.00 0.00 H new ATOM 0 HG21 ILE B 261 17.357 8.361 4.374 1.00 0.00 H new ATOM 0 HG22 ILE B 261 18.249 9.017 5.767 1.00 0.00 H new ATOM 0 HG23 ILE B 261 16.471 8.948 5.802 1.00 0.00 H new ATOM 0 HD11 ILE B 261 15.261 9.985 1.806 1.00 0.00 H new ATOM 0 HD12 ILE B 261 17.008 10.323 1.845 1.00 0.00 H new ATOM 0 HD13 ILE B 261 16.371 8.840 2.594 1.00 0.00 H new ATOM 1508 N GLN B 262 18.104 10.780 7.807 1.00 0.00 N ATOM 1509 CA GLN B 262 19.179 10.498 8.805 1.00 0.00 C ATOM 1510 C GLN B 262 19.179 9.010 9.158 1.00 0.00 C ATOM 1511 O GLN B 262 18.296 8.264 8.781 1.00 0.00 O ATOM 1512 CB GLN B 262 18.940 11.319 10.077 1.00 0.00 C ATOM 1513 CG GLN B 262 19.161 12.807 9.788 1.00 0.00 C ATOM 1514 CD GLN B 262 19.734 13.486 11.034 1.00 0.00 C ATOM 1515 OE1 GLN B 262 20.672 12.998 11.628 1.00 0.00 O ATOM 1516 NE2 GLN B 262 19.204 14.601 11.454 1.00 0.00 N ATOM 0 H GLN B 262 17.159 10.547 8.111 1.00 0.00 H new ATOM 0 HA GLN B 262 20.142 10.771 8.373 1.00 0.00 H new ATOM 0 HB2 GLN B 262 17.925 11.157 10.439 1.00 0.00 H new ATOM 0 HB3 GLN B 262 19.616 10.989 10.866 1.00 0.00 H new ATOM 0 HG2 GLN B 262 19.844 12.928 8.947 1.00 0.00 H new ATOM 0 HG3 GLN B 262 18.220 13.278 9.504 1.00 0.00 H new ATOM 0 HE21 GLN B 262 18.415 15.011 10.954 1.00 0.00 H new ATOM 0 HE22 GLN B 262 19.578 15.063 12.283 1.00 0.00 H new ATOM 1525 N LYS B 263 20.182 8.578 9.871 1.00 0.00 N ATOM 1526 CA LYS B 263 20.283 7.146 10.255 1.00 0.00 C ATOM 1527 C LYS B 263 18.970 6.656 10.862 1.00 0.00 C ATOM 1528 O LYS B 263 18.160 7.425 11.341 1.00 0.00 O ATOM 1529 CB LYS B 263 21.420 6.963 11.281 1.00 0.00 C ATOM 1530 CG LYS B 263 21.037 7.571 12.642 1.00 0.00 C ATOM 1531 CD LYS B 263 21.142 9.097 12.595 1.00 0.00 C ATOM 1532 CE LYS B 263 22.022 9.568 13.739 1.00 0.00 C ATOM 1533 NZ LYS B 263 21.329 9.325 15.036 1.00 0.00 N ATOM 0 H LYS B 263 20.945 9.166 10.207 1.00 0.00 H new ATOM 0 HA LYS B 263 20.495 6.562 9.359 1.00 0.00 H new ATOM 0 HB2 LYS B 263 21.639 5.902 11.401 1.00 0.00 H new ATOM 0 HB3 LYS B 263 22.329 7.436 10.910 1.00 0.00 H new ATOM 0 HG2 LYS B 263 20.020 7.278 12.905 1.00 0.00 H new ATOM 0 HG3 LYS B 263 21.693 7.179 13.420 1.00 0.00 H new ATOM 0 HD2 LYS B 263 21.562 9.416 11.641 1.00 0.00 H new ATOM 0 HD3 LYS B 263 20.151 9.545 12.673 1.00 0.00 H new ATOM 0 HE2 LYS B 263 22.975 9.039 13.720 1.00 0.00 H new ATOM 0 HE3 LYS B 263 22.244 10.629 13.627 1.00 0.00 H new ATOM 0 HZ1 LYS B 263 21.878 9.754 15.808 1.00 0.00 H new ATOM 0 HZ2 LYS B 263 20.380 9.750 15.008 1.00 0.00 H new ATOM 0 HZ3 LYS B 263 21.245 8.301 15.198 1.00 0.00 H new ATOM 1547 N GLU B 264 18.789 5.370 10.873 1.00 0.00 N ATOM 1548 CA GLU B 264 17.567 4.776 11.482 1.00 0.00 C ATOM 1549 C GLU B 264 16.299 5.345 10.841 1.00 0.00 C ATOM 1550 O GLU B 264 15.209 5.163 11.346 1.00 0.00 O ATOM 1551 CB GLU B 264 17.561 5.075 12.984 1.00 0.00 C ATOM 1552 CG GLU B 264 18.789 4.436 13.636 1.00 0.00 C ATOM 1553 CD GLU B 264 18.567 4.312 15.146 1.00 0.00 C ATOM 1554 OE1 GLU B 264 17.447 4.523 15.581 1.00 0.00 O ATOM 1555 OE2 GLU B 264 19.522 4.007 15.842 1.00 0.00 O ATOM 0 H GLU B 264 19.444 4.693 10.481 1.00 0.00 H new ATOM 0 HA GLU B 264 17.580 3.699 11.312 1.00 0.00 H new ATOM 0 HB2 GLU B 264 17.566 6.152 13.151 1.00 0.00 H new ATOM 0 HB3 GLU B 264 16.650 4.686 13.439 1.00 0.00 H new ATOM 0 HG2 GLU B 264 18.971 3.452 13.204 1.00 0.00 H new ATOM 0 HG3 GLU B 264 19.674 5.041 13.437 1.00 0.00 H new ATOM 1562 N SER B 265 16.418 6.014 9.730 1.00 0.00 N ATOM 1563 CA SER B 265 15.197 6.560 9.072 1.00 0.00 C ATOM 1564 C SER B 265 14.472 5.414 8.366 1.00 0.00 C ATOM 1565 O SER B 265 15.084 4.456 7.939 1.00 0.00 O ATOM 1566 CB SER B 265 15.589 7.634 8.060 1.00 0.00 C ATOM 1567 OG SER B 265 16.770 7.229 7.383 1.00 0.00 O ATOM 0 H SER B 265 17.298 6.206 9.252 1.00 0.00 H new ATOM 0 HA SER B 265 14.541 7.010 9.817 1.00 0.00 H new ATOM 0 HB2 SER B 265 14.781 7.789 7.345 1.00 0.00 H new ATOM 0 HB3 SER B 265 15.754 8.585 8.566 1.00 0.00 H new ATOM 0 HG SER B 265 17.520 7.791 7.669 1.00 0.00 H new ATOM 1573 N THR B 266 13.171 5.498 8.256 1.00 0.00 N ATOM 1574 CA THR B 266 12.406 4.402 7.595 1.00 0.00 C ATOM 1575 C THR B 266 11.760 4.907 6.303 1.00 0.00 C ATOM 1576 O THR B 266 11.208 5.989 6.252 1.00 0.00 O ATOM 1577 CB THR B 266 11.317 3.896 8.544 1.00 0.00 C ATOM 1578 OG1 THR B 266 11.875 3.681 9.833 1.00 0.00 O ATOM 1579 CG2 THR B 266 10.745 2.583 8.009 1.00 0.00 C ATOM 0 H THR B 266 12.607 6.277 8.595 1.00 0.00 H new ATOM 0 HA THR B 266 13.092 3.590 7.353 1.00 0.00 H new ATOM 0 HB THR B 266 10.521 4.637 8.613 1.00 0.00 H new ATOM 0 HG1 THR B 266 11.178 3.358 10.442 1.00 0.00 H new ATOM 0 HG21 THR B 266 9.969 2.222 8.684 1.00 0.00 H new ATOM 0 HG22 THR B 266 10.317 2.749 7.020 1.00 0.00 H new ATOM 0 HG23 THR B 266 11.540 1.841 7.940 1.00 0.00 H new ATOM 1587 N LEU B 267 11.826 4.122 5.258 1.00 0.00 N ATOM 1588 CA LEU B 267 11.218 4.537 3.961 1.00 0.00 C ATOM 1589 C LEU B 267 10.205 3.478 3.516 1.00 0.00 C ATOM 1590 O LEU B 267 10.428 2.291 3.665 1.00 0.00 O ATOM 1591 CB LEU B 267 12.316 4.662 2.901 1.00 0.00 C ATOM 1592 CG LEU B 267 12.982 6.034 3.009 1.00 0.00 C ATOM 1593 CD1 LEU B 267 13.701 6.153 4.354 1.00 0.00 C ATOM 1594 CD2 LEU B 267 13.996 6.197 1.875 1.00 0.00 C ATOM 0 H LEU B 267 12.277 3.207 5.249 1.00 0.00 H new ATOM 0 HA LEU B 267 10.717 5.497 4.083 1.00 0.00 H new ATOM 0 HB2 LEU B 267 13.058 3.875 3.037 1.00 0.00 H new ATOM 0 HB3 LEU B 267 11.891 4.531 1.906 1.00 0.00 H new ATOM 0 HG LEU B 267 12.222 6.812 2.936 1.00 0.00 H new ATOM 0 HD11 LEU B 267 14.175 7.132 4.428 1.00 0.00 H new ATOM 0 HD12 LEU B 267 12.980 6.037 5.163 1.00 0.00 H new ATOM 0 HD13 LEU B 267 14.461 5.375 4.430 1.00 0.00 H new ATOM 0 HD21 LEU B 267 14.472 7.175 1.950 1.00 0.00 H new ATOM 0 HD22 LEU B 267 14.754 5.418 1.950 1.00 0.00 H new ATOM 0 HD23 LEU B 267 13.485 6.115 0.916 1.00 0.00 H new ATOM 1606 N HIS B 268 9.090 3.892 2.977 1.00 0.00 N ATOM 1607 CA HIS B 268 8.069 2.901 2.531 1.00 0.00 C ATOM 1608 C HIS B 268 8.335 2.501 1.077 1.00 0.00 C ATOM 1609 O HIS B 268 8.714 3.316 0.258 1.00 0.00 O ATOM 1610 CB HIS B 268 6.673 3.518 2.641 1.00 0.00 C ATOM 1611 CG HIS B 268 6.422 3.946 4.061 1.00 0.00 C ATOM 1612 ND1 HIS B 268 6.977 5.101 4.595 1.00 0.00 N ATOM 1613 CD2 HIS B 268 5.679 3.385 5.070 1.00 0.00 C ATOM 1614 CE1 HIS B 268 6.563 5.197 5.873 1.00 0.00 C ATOM 1615 NE2 HIS B 268 5.772 4.176 6.209 1.00 0.00 N ATOM 0 H HIS B 268 8.843 4.870 2.827 1.00 0.00 H new ATOM 0 HA HIS B 268 8.128 2.017 3.165 1.00 0.00 H new ATOM 0 HB2 HIS B 268 6.589 4.374 1.972 1.00 0.00 H new ATOM 0 HB3 HIS B 268 5.919 2.795 2.330 1.00 0.00 H new ATOM 0 HD2 HIS B 268 5.110 2.470 4.991 1.00 0.00 H new ATOM 0 HE1 HIS B 268 6.837 5.999 6.542 1.00 0.00 H new ATOM 0 HE2 HIS B 268 5.329 4.011 7.113 1.00 0.00 H new ATOM 1624 N LEU B 269 8.139 1.249 0.754 1.00 0.00 N ATOM 1625 CA LEU B 269 8.377 0.784 -0.644 1.00 0.00 C ATOM 1626 C LEU B 269 7.040 0.437 -1.301 1.00 0.00 C ATOM 1627 O LEU B 269 6.252 -0.313 -0.759 1.00 0.00 O ATOM 1628 CB LEU B 269 9.264 -0.464 -0.622 1.00 0.00 C ATOM 1629 CG LEU B 269 9.676 -0.824 -2.053 1.00 0.00 C ATOM 1630 CD1 LEU B 269 10.775 0.124 -2.543 1.00 0.00 C ATOM 1631 CD2 LEU B 269 10.197 -2.261 -2.086 1.00 0.00 C ATOM 0 H LEU B 269 7.823 0.526 1.401 1.00 0.00 H new ATOM 0 HA LEU B 269 8.869 1.575 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU B 269 10.149 -0.283 -0.012 1.00 0.00 H new ATOM 0 HB3 LEU B 269 8.728 -1.296 -0.166 1.00 0.00 H new ATOM 0 HG LEU B 269 8.808 -0.729 -2.705 1.00 0.00 H new ATOM 0 HD11 LEU B 269 11.058 -0.143 -3.561 1.00 0.00 H new ATOM 0 HD12 LEU B 269 10.405 1.149 -2.526 1.00 0.00 H new ATOM 0 HD13 LEU B 269 11.644 0.041 -1.891 1.00 0.00 H new ATOM 0 HD21 LEU B 269 10.490 -2.518 -3.104 1.00 0.00 H new ATOM 0 HD22 LEU B 269 11.060 -2.350 -1.426 1.00 0.00 H new ATOM 0 HD23 LEU B 269 9.413 -2.940 -1.752 1.00 0.00 H new ATOM 1643 N VAL B 270 6.779 0.973 -2.464 1.00 0.00 N ATOM 1644 CA VAL B 270 5.492 0.672 -3.156 1.00 0.00 C ATOM 1645 C VAL B 270 5.764 -0.108 -4.442 1.00 0.00 C ATOM 1646 O VAL B 270 6.568 0.290 -5.262 1.00 0.00 O ATOM 1647 CB VAL B 270 4.778 1.980 -3.502 1.00 0.00 C ATOM 1648 CG1 VAL B 270 3.749 1.720 -4.602 1.00 0.00 C ATOM 1649 CG2 VAL B 270 4.066 2.517 -2.259 1.00 0.00 C ATOM 0 H VAL B 270 7.402 1.607 -2.965 1.00 0.00 H new ATOM 0 HA VAL B 270 4.864 0.074 -2.495 1.00 0.00 H new ATOM 0 HB VAL B 270 5.508 2.712 -3.848 1.00 0.00 H new ATOM 0 HG11 VAL B 270 3.239 2.651 -4.850 1.00 0.00 H new ATOM 0 HG12 VAL B 270 4.253 1.335 -5.488 1.00 0.00 H new ATOM 0 HG13 VAL B 270 3.020 0.989 -4.253 1.00 0.00 H new ATOM 0 HG21 VAL B 270 3.557 3.449 -2.505 1.00 0.00 H new ATOM 0 HG22 VAL B 270 3.336 1.785 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL B 270 4.797 2.700 -1.471 1.00 0.00 H new ATOM 1659 N LEU B 271 5.094 -1.213 -4.627 1.00 0.00 N ATOM 1660 CA LEU B 271 5.308 -2.012 -5.866 1.00 0.00 C ATOM 1661 C LEU B 271 4.470 -1.412 -6.998 1.00 0.00 C ATOM 1662 O LEU B 271 3.390 -0.898 -6.782 1.00 0.00 O ATOM 1663 CB LEU B 271 4.889 -3.465 -5.622 1.00 0.00 C ATOM 1664 CG LEU B 271 5.972 -4.183 -4.806 1.00 0.00 C ATOM 1665 CD1 LEU B 271 5.421 -5.509 -4.278 1.00 0.00 C ATOM 1666 CD2 LEU B 271 7.199 -4.462 -5.687 1.00 0.00 C ATOM 0 H LEU B 271 4.409 -1.596 -3.975 1.00 0.00 H new ATOM 0 HA LEU B 271 6.363 -1.990 -6.141 1.00 0.00 H new ATOM 0 HB2 LEU B 271 3.938 -3.495 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU B 271 4.738 -3.975 -6.573 1.00 0.00 H new ATOM 0 HG LEU B 271 6.265 -3.546 -3.972 1.00 0.00 H new ATOM 0 HD11 LEU B 271 6.191 -6.018 -3.699 1.00 0.00 H new ATOM 0 HD12 LEU B 271 4.557 -5.317 -3.643 1.00 0.00 H new ATOM 0 HD13 LEU B 271 5.122 -6.138 -5.116 1.00 0.00 H new ATOM 0 HD21 LEU B 271 7.961 -4.972 -5.098 1.00 0.00 H new ATOM 0 HD22 LEU B 271 6.908 -5.092 -6.527 1.00 0.00 H new ATOM 0 HD23 LEU B 271 7.600 -3.520 -6.062 1.00 0.00 H new ATOM 1678 N ARG B 272 4.969 -1.457 -8.200 1.00 0.00 N ATOM 1679 CA ARG B 272 4.219 -0.875 -9.349 1.00 0.00 C ATOM 1680 C ARG B 272 3.442 -1.996 -10.049 1.00 0.00 C ATOM 1681 O ARG B 272 2.841 -2.831 -9.403 1.00 0.00 O ATOM 1682 CB ARG B 272 5.240 -0.253 -10.303 1.00 0.00 C ATOM 1683 CG ARG B 272 4.600 0.776 -11.238 1.00 0.00 C ATOM 1684 CD ARG B 272 5.726 1.620 -11.836 1.00 0.00 C ATOM 1685 NE ARG B 272 5.257 2.336 -13.053 1.00 0.00 N ATOM 1686 CZ ARG B 272 5.522 1.847 -14.238 1.00 0.00 C ATOM 1687 NH1 ARG B 272 6.075 0.669 -14.359 1.00 0.00 N ATOM 1688 NH2 ARG B 272 5.216 2.526 -15.303 1.00 0.00 N ATOM 0 H ARG B 272 5.869 -1.874 -8.439 1.00 0.00 H new ATOM 0 HA ARG B 272 3.512 -0.114 -9.020 1.00 0.00 H new ATOM 0 HB2 ARG B 272 6.031 0.225 -9.725 1.00 0.00 H new ATOM 0 HB3 ARG B 272 5.708 -1.039 -10.895 1.00 0.00 H new ATOM 0 HG2 ARG B 272 4.035 0.278 -12.026 1.00 0.00 H new ATOM 0 HG3 ARG B 272 3.898 1.406 -10.691 1.00 0.00 H new ATOM 0 HD2 ARG B 272 6.079 2.340 -11.098 1.00 0.00 H new ATOM 0 HD3 ARG B 272 6.572 0.981 -12.088 1.00 0.00 H new ATOM 0 HE ARG B 272 4.731 3.205 -12.964 1.00 0.00 H new ATOM 0 HH11 ARG B 272 6.303 0.125 -13.527 1.00 0.00 H new ATOM 0 HH12 ARG B 272 6.279 0.294 -15.285 1.00 0.00 H new ATOM 0 HH21 ARG B 272 4.770 3.439 -15.215 1.00 0.00 H new ATOM 0 HH22 ARG B 272 5.422 2.146 -16.227 1.00 0.00 H new ATOM 1702 N LEU B 273 3.442 -2.020 -11.354 1.00 0.00 N ATOM 1703 CA LEU B 273 2.695 -3.084 -12.081 1.00 0.00 C ATOM 1704 C LEU B 273 3.657 -3.835 -13.002 1.00 0.00 C ATOM 1705 O LEU B 273 3.338 -4.885 -13.524 1.00 0.00 O ATOM 1706 CB LEU B 273 1.584 -2.449 -12.919 1.00 0.00 C ATOM 1707 CG LEU B 273 0.723 -1.542 -12.035 1.00 0.00 C ATOM 1708 CD1 LEU B 273 -0.362 -0.881 -12.888 1.00 0.00 C ATOM 1709 CD2 LEU B 273 0.064 -2.372 -10.931 1.00 0.00 C ATOM 0 H LEU B 273 3.928 -1.348 -11.948 1.00 0.00 H new ATOM 0 HA LEU B 273 2.256 -3.776 -11.363 1.00 0.00 H new ATOM 0 HB2 LEU B 273 2.017 -1.872 -13.736 1.00 0.00 H new ATOM 0 HB3 LEU B 273 0.966 -3.226 -13.370 1.00 0.00 H new ATOM 0 HG LEU B 273 1.353 -0.775 -11.584 1.00 0.00 H new ATOM 0 HD11 LEU B 273 -0.976 -0.235 -12.260 1.00 0.00 H new ATOM 0 HD12 LEU B 273 0.105 -0.286 -13.673 1.00 0.00 H new ATOM 0 HD13 LEU B 273 -0.989 -1.650 -13.339 1.00 0.00 H new ATOM 0 HD21 LEU B 273 -0.548 -1.723 -10.304 1.00 0.00 H new ATOM 0 HD22 LEU B 273 -0.565 -3.141 -11.380 1.00 0.00 H new ATOM 0 HD23 LEU B 273 0.835 -2.844 -10.321 1.00 0.00 H new ATOM 1721 N ARG B 274 4.833 -3.306 -13.207 1.00 0.00 N ATOM 1722 CA ARG B 274 5.816 -3.989 -14.093 1.00 0.00 C ATOM 1723 C ARG B 274 6.923 -4.612 -13.241 1.00 0.00 C ATOM 1724 O ARG B 274 7.229 -5.781 -13.361 1.00 0.00 O ATOM 1725 CB ARG B 274 6.427 -2.967 -15.054 1.00 0.00 C ATOM 1726 CG ARG B 274 5.376 -2.545 -16.084 1.00 0.00 C ATOM 1727 CD ARG B 274 6.055 -1.776 -17.221 1.00 0.00 C ATOM 1728 NE ARG B 274 5.022 -1.300 -18.184 1.00 0.00 N ATOM 1729 CZ ARG B 274 5.334 -0.421 -19.096 1.00 0.00 C ATOM 1730 NH1 ARG B 274 6.551 0.042 -19.168 1.00 0.00 N ATOM 1731 NH2 ARG B 274 4.427 -0.004 -19.937 1.00 0.00 N ATOM 0 H ARG B 274 5.155 -2.429 -12.798 1.00 0.00 H new ATOM 0 HA ARG B 274 5.313 -4.771 -14.662 1.00 0.00 H new ATOM 0 HB2 ARG B 274 6.780 -2.097 -14.501 1.00 0.00 H new ATOM 0 HB3 ARG B 274 7.293 -3.397 -15.557 1.00 0.00 H new ATOM 0 HG2 ARG B 274 4.865 -3.423 -16.479 1.00 0.00 H new ATOM 0 HG3 ARG B 274 4.618 -1.921 -15.611 1.00 0.00 H new ATOM 0 HD2 ARG B 274 6.612 -0.929 -16.820 1.00 0.00 H new ATOM 0 HD3 ARG B 274 6.774 -2.418 -17.730 1.00 0.00 H new ATOM 0 HE ARG B 274 4.070 -1.662 -18.130 1.00 0.00 H new ATOM 0 HH11 ARG B 274 7.260 -0.283 -18.511 1.00 0.00 H new ATOM 0 HH12 ARG B 274 6.794 0.729 -19.882 1.00 0.00 H new ATOM 0 HH21 ARG B 274 3.475 -0.365 -19.881 1.00 0.00 H new ATOM 0 HH22 ARG B 274 4.670 0.683 -20.650 1.00 0.00 H new TER 1745 ARG B 274