USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1226 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 81 ASN : amide:sc= 0.93 K(o=0.87,f=-1!) USER MOD Set 1.2: B 84 THR OG1 : rot -170:sc= -0.0626 USER MOD Set 2.1: B 78 HIS : no HE2:sc= -1.04 K(o=-2.2,f=-3.4!) USER MOD Set 2.2: B 80 SER OG : rot -60:sc= -1.2 USER MOD Set 3.1: B 62 LYS NZ :NH3+ -166:sc= 1.76 (180deg=1.1!) USER MOD Set 3.2: B 64 GLN : amide:sc= -7.36! C(o=-5.6!,f=-9.2!) USER MOD Set 4.1: B 54 LYS NZ :NH3+ -174:sc= 1.83 (180deg=0.601) USER MOD Set 4.2: B 66 GLN : amide:sc= -1.16! C(o=-1.6!,f=-18!) USER MOD Set 4.3: B 76 ASN : amide:sc= -2.27 K(o=-1.6,f=-15!) USER MOD Set 5.1: B 45 HIS : no HE2:sc= 0.047 K(o=0.64,f=-0.75) USER MOD Set 5.2: B 75 THR OG1 : rot -129:sc= 0.593 USER MOD Set 6.1: A 405 TYR OH : rot 107:sc= -0.12 USER MOD Set 6.2: A 426 TYR OH : rot 180:sc= -0.593 USER MOD Set 7.1: A 409 SER OG : rot -65:sc= 1.8 USER MOD Set 7.2: A 410 GLN : amide:sc= 0.413 K(o=2.2,f=1) USER MOD Single : A 397 MET CE :methyl -161:sc= -0.0458 (180deg=-0.408) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 406 SER OG : rot 39:sc= 1.24 USER MOD Single : A 417 GLN : amide:sc= -0.222 X(o=-0.22,f=-0.22) USER MOD Single : A 418 MET CE :methyl -154:sc= -5.61! (180deg=-7.03!) USER MOD Single : A 419 THR OG1 : rot 159:sc= 0.993 USER MOD Single : A 423 LYS NZ :NH3+ 165:sc= -1.71! (180deg=-2.84!) USER MOD Single : A 429 MET CE :methyl 175:sc= -5.63! (180deg=-5.66!) USER MOD Single : A 431 GLN : amide:sc= 0.16 K(o=0.16,f=-7!) USER MOD Single : A 433 MET CE :methyl -132:sc= -4.02 (180deg=-6.99!) USER MOD Single : B 13 LYS NZ :NH3+ -150:sc= 0.63 (180deg=-1.33!) USER MOD Single : B 14 LYS NZ :NH3+ -172:sc= 1.13 (180deg=1.05) USER MOD Single : B 17 GLN :FLIP amide:sc= -0.241 F(o=-1.7!,f=-0.24) USER MOD Single : B 18 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0794) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 GLN : amide:sc= 1.14 K(o=1.1,f=-0.018) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -132:sc= -3.23! (180deg=-8.03!) USER MOD Single : B 38 LYS NZ :NH3+ -103:sc= -1.3! (180deg=-5.21!) USER MOD Single : B 42 THR OG1 : rot -150:sc= -0.696 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl -127:sc= -1.53 (180deg=-1.93) USER MOD Single : B 47 TYR OH : rot 180:sc= -0.66 USER MOD Single : B 51 LYS NZ :NH3+ -159:sc= 1.24 (180deg=1.17) USER MOD Single : B 52 CYS SG : rot -34:sc= -0.319 USER MOD Single : B 53 GLN : amide:sc= -3.03 K(o=-3,f=-3.8) USER MOD Single : B 56 SER OG : rot 156:sc= 2.07 USER MOD Single : B 60 LYS NZ :NH3+ 142:sc= 1.64 (180deg=-2.68!) USER MOD Single : B 70 HIS : no HE2:sc= -3.92 K(o=-3.9,f=-5.7!) USER MOD Single : B 74 THR OG1 : rot 30:sc= 0.164 USER MOD Single : B 83 SER OG : rot 54:sc= 1.14 USER MOD Single : B 87 LYS NZ :NH3+ 133:sc= 1.31 (180deg=0.713) USER MOD Single : B 93 LYS NZ :NH3+ -170:sc= 2.96 (180deg=2.55) USER MOD Single : B 97 GLN :FLIP amide:sc= -0.617 F(o=-3.3!,f=-0.62) USER MOD Single : B 98 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : B 102 LYS NZ :NH3+ 160:sc= 0.692 (180deg=0.547) USER MOD Single : B 104 LYS NZ :NH3+ -155:sc= 2.24 (180deg=-1.15!) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 10.667 11.102 10.073 1.00 0.00 N ATOM 59 CA GLU A 382 9.304 10.593 10.097 1.00 0.00 C ATOM 60 C GLU A 382 8.891 10.140 11.493 1.00 0.00 C ATOM 61 O GLU A 382 9.730 9.836 12.341 1.00 0.00 O ATOM 62 CB GLU A 382 9.156 9.440 9.105 1.00 0.00 C ATOM 63 CG GLU A 382 8.596 9.877 7.763 1.00 0.00 C ATOM 64 CD GLU A 382 7.290 10.627 7.913 1.00 0.00 C ATOM 65 OE1 GLU A 382 6.298 10.009 8.352 1.00 0.00 O ATOM 66 OE2 GLU A 382 7.261 11.840 7.613 1.00 0.00 O ATOM 0 HA GLU A 382 8.642 11.409 9.806 1.00 0.00 H new ATOM 0 HB2 GLU A 382 10.129 8.974 8.951 1.00 0.00 H new ATOM 0 HB3 GLU A 382 8.503 8.681 9.535 1.00 0.00 H new ATOM 0 HG2 GLU A 382 9.323 10.512 7.256 1.00 0.00 H new ATOM 0 HG3 GLU A 382 8.442 9.002 7.132 1.00 0.00 H new ATOM 73 N GLU A 383 7.583 10.106 11.715 1.00 0.00 N ATOM 74 CA GLU A 383 7.011 9.696 12.989 1.00 0.00 C ATOM 75 C GLU A 383 5.588 9.182 12.758 1.00 0.00 C ATOM 76 O GLU A 383 5.275 8.715 11.672 1.00 0.00 O ATOM 77 CB GLU A 383 7.034 10.865 13.998 1.00 0.00 C ATOM 78 CG GLU A 383 6.059 12.006 13.699 1.00 0.00 C ATOM 79 CD GLU A 383 6.321 12.689 12.374 1.00 0.00 C ATOM 80 OE1 GLU A 383 7.130 13.635 12.330 1.00 0.00 O ATOM 81 OE2 GLU A 383 5.721 12.273 11.364 1.00 0.00 O ATOM 0 H GLU A 383 6.888 10.363 11.014 1.00 0.00 H new ATOM 0 HA GLU A 383 7.609 8.891 13.416 1.00 0.00 H new ATOM 0 HB2 GLU A 383 6.814 10.471 14.990 1.00 0.00 H new ATOM 0 HB3 GLU A 383 8.044 11.272 14.034 1.00 0.00 H new ATOM 0 HG2 GLU A 383 5.042 11.615 13.703 1.00 0.00 H new ATOM 0 HG3 GLU A 383 6.120 12.745 14.498 1.00 0.00 H new ATOM 88 N ASP A 384 4.739 9.259 13.767 1.00 0.00 N ATOM 89 CA ASP A 384 3.353 8.807 13.649 1.00 0.00 C ATOM 90 C ASP A 384 2.457 9.819 14.340 1.00 0.00 C ATOM 91 O ASP A 384 2.058 9.629 15.489 1.00 0.00 O ATOM 92 CB ASP A 384 3.165 7.418 14.277 1.00 0.00 C ATOM 93 CG ASP A 384 2.259 6.507 13.460 1.00 0.00 C ATOM 94 OD1 ASP A 384 1.076 6.850 13.243 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.726 5.428 13.040 1.00 0.00 O ATOM 0 H ASP A 384 4.981 9.632 14.685 1.00 0.00 H new ATOM 0 HA ASP A 384 3.091 8.727 12.594 1.00 0.00 H new ATOM 0 HB2 ASP A 384 4.139 6.943 14.391 1.00 0.00 H new ATOM 0 HB3 ASP A 384 2.747 7.532 15.277 1.00 0.00 H new ATOM 100 N ASP A 385 2.175 10.916 13.651 1.00 0.00 N ATOM 101 CA ASP A 385 1.368 11.978 14.231 1.00 0.00 C ATOM 102 C ASP A 385 0.019 12.164 13.531 1.00 0.00 C ATOM 103 O ASP A 385 -0.922 12.663 14.148 1.00 0.00 O ATOM 104 CB ASP A 385 2.168 13.291 14.233 1.00 0.00 C ATOM 105 CG ASP A 385 1.936 14.137 13.002 1.00 0.00 C ATOM 106 OD1 ASP A 385 2.206 13.655 11.882 1.00 0.00 O ATOM 107 OD2 ASP A 385 1.485 15.294 13.153 1.00 0.00 O ATOM 0 H ASP A 385 2.491 11.092 12.697 1.00 0.00 H new ATOM 0 HA ASP A 385 1.136 11.684 15.255 1.00 0.00 H new ATOM 0 HB2 ASP A 385 1.901 13.869 15.118 1.00 0.00 H new ATOM 0 HB3 ASP A 385 3.230 13.060 14.311 1.00 0.00 H new ATOM 112 N GLU A 386 -0.105 11.754 12.268 1.00 0.00 N ATOM 113 CA GLU A 386 -1.349 11.917 11.557 1.00 0.00 C ATOM 114 C GLU A 386 -1.345 11.039 10.336 1.00 0.00 C ATOM 115 O GLU A 386 -1.047 11.480 9.226 1.00 0.00 O ATOM 116 CB GLU A 386 -1.548 13.364 11.154 1.00 0.00 C ATOM 117 CG GLU A 386 -2.958 13.874 11.379 1.00 0.00 C ATOM 118 CD GLU A 386 -3.209 15.194 10.683 1.00 0.00 C ATOM 119 OE1 GLU A 386 -2.633 16.211 11.123 1.00 0.00 O ATOM 120 OE2 GLU A 386 -3.958 15.211 9.686 1.00 0.00 O ATOM 0 H GLU A 386 0.640 11.312 11.730 1.00 0.00 H new ATOM 0 HA GLU A 386 -2.171 11.628 12.212 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -0.852 13.987 11.716 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -1.295 13.476 10.100 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -3.672 13.134 11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -3.134 13.990 12.448 1.00 0.00 H new ATOM 127 N PHE A 387 -1.630 9.784 10.558 1.00 0.00 N ATOM 128 CA PHE A 387 -1.660 8.823 9.487 1.00 0.00 C ATOM 129 C PHE A 387 -2.974 8.078 9.493 1.00 0.00 C ATOM 130 O PHE A 387 -3.463 7.662 10.543 1.00 0.00 O ATOM 131 CB PHE A 387 -0.531 7.792 9.619 1.00 0.00 C ATOM 132 CG PHE A 387 0.872 8.315 9.502 1.00 0.00 C ATOM 133 CD1 PHE A 387 1.408 9.127 10.485 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.668 7.968 8.418 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.695 9.586 10.390 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.959 8.427 8.322 1.00 0.00 C ATOM 137 CZ PHE A 387 3.470 9.237 9.311 1.00 0.00 C ATOM 0 H PHE A 387 -1.846 9.401 11.478 1.00 0.00 H new ATOM 0 HA PHE A 387 -1.534 9.377 8.557 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.631 7.298 10.586 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -0.675 7.029 8.855 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.805 9.402 11.337 1.00 0.00 H new ATOM 0 HD2 PHE A 387 1.268 7.331 7.643 1.00 0.00 H new ATOM 0 HE1 PHE A 387 3.100 10.222 11.163 1.00 0.00 H new ATOM 0 HE2 PHE A 387 3.570 8.154 7.475 1.00 0.00 H new ATOM 0 HZ PHE A 387 4.485 9.600 9.238 1.00 0.00 H new ATOM 147 N GLU A 388 -3.515 7.897 8.316 1.00 0.00 N ATOM 148 CA GLU A 388 -4.750 7.174 8.141 1.00 0.00 C ATOM 149 C GLU A 388 -4.395 5.744 7.827 1.00 0.00 C ATOM 150 O GLU A 388 -3.689 5.501 6.845 1.00 0.00 O ATOM 151 CB GLU A 388 -5.565 7.754 6.980 1.00 0.00 C ATOM 152 CG GLU A 388 -6.280 9.050 7.310 1.00 0.00 C ATOM 153 CD GLU A 388 -7.256 8.896 8.460 1.00 0.00 C ATOM 154 OE1 GLU A 388 -8.144 8.022 8.371 1.00 0.00 O ATOM 155 OE2 GLU A 388 -7.128 9.641 9.453 1.00 0.00 O ATOM 0 H GLU A 388 -3.110 8.248 7.448 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.351 7.248 9.047 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -4.900 7.924 6.133 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.302 7.016 6.663 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.544 9.814 7.562 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.815 9.401 6.428 1.00 0.00 H new ATOM 162 N GLU A 389 -4.807 4.808 8.669 1.00 0.00 N ATOM 163 CA GLU A 389 -4.512 3.417 8.398 1.00 0.00 C ATOM 164 C GLU A 389 -5.196 3.058 7.091 1.00 0.00 C ATOM 165 O GLU A 389 -6.418 2.923 7.028 1.00 0.00 O ATOM 166 CB GLU A 389 -4.983 2.503 9.538 1.00 0.00 C ATOM 167 CG GLU A 389 -4.598 1.039 9.344 1.00 0.00 C ATOM 168 CD GLU A 389 -3.664 0.510 10.420 1.00 0.00 C ATOM 169 OE1 GLU A 389 -2.853 1.300 10.950 1.00 0.00 O ATOM 170 OE2 GLU A 389 -3.736 -0.705 10.734 1.00 0.00 O ATOM 0 H GLU A 389 -5.334 4.983 9.525 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.434 3.272 8.321 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -4.561 2.860 10.477 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -6.067 2.577 9.628 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -5.503 0.432 9.330 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -4.121 0.923 8.371 1.00 0.00 H new ATOM 177 N VAL A 390 -4.402 2.927 6.042 1.00 0.00 N ATOM 178 CA VAL A 390 -4.940 2.626 4.747 1.00 0.00 C ATOM 179 C VAL A 390 -5.309 1.160 4.689 1.00 0.00 C ATOM 180 O VAL A 390 -4.496 0.291 5.013 1.00 0.00 O ATOM 181 CB VAL A 390 -3.972 2.924 3.587 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.709 2.860 2.259 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.306 4.270 3.747 1.00 0.00 C ATOM 0 H VAL A 390 -3.387 3.026 6.072 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.808 3.272 4.620 1.00 0.00 H new ATOM 0 HB VAL A 390 -3.192 2.163 3.604 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -4.014 3.072 1.447 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -5.131 1.864 2.125 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.511 3.598 2.252 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.631 4.444 2.909 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -4.066 5.051 3.769 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.740 4.288 4.679 1.00 0.00 H new ATOM 193 N ALA A 391 -6.515 0.890 4.258 1.00 0.00 N ATOM 194 CA ALA A 391 -7.002 -0.463 4.170 1.00 0.00 C ATOM 195 C ALA A 391 -6.684 -1.047 2.811 1.00 0.00 C ATOM 196 O ALA A 391 -6.831 -0.377 1.793 1.00 0.00 O ATOM 197 CB ALA A 391 -8.500 -0.507 4.432 1.00 0.00 C ATOM 0 H ALA A 391 -7.185 1.599 3.959 1.00 0.00 H new ATOM 0 HA ALA A 391 -6.503 -1.063 4.931 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.852 -1.536 4.362 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.706 -0.120 5.430 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -9.017 0.104 3.692 1.00 0.00 H new ATOM 203 N ASP A 392 -6.181 -2.263 2.821 1.00 0.00 N ATOM 204 CA ASP A 392 -5.853 -2.995 1.612 1.00 0.00 C ATOM 205 C ASP A 392 -7.118 -3.300 0.825 1.00 0.00 C ATOM 206 O ASP A 392 -7.724 -4.357 0.986 1.00 0.00 O ATOM 207 CB ASP A 392 -5.123 -4.301 1.955 1.00 0.00 C ATOM 208 CG ASP A 392 -5.533 -4.893 3.296 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.303 -4.239 4.343 1.00 0.00 O ATOM 210 OD2 ASP A 392 -6.058 -6.026 3.316 1.00 0.00 O ATOM 0 H ASP A 392 -5.985 -2.779 3.679 1.00 0.00 H new ATOM 0 HA ASP A 392 -5.194 -2.377 1.002 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -5.316 -5.032 1.170 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -4.049 -4.116 1.962 1.00 0.00 H new ATOM 215 N ASP A 393 -7.515 -2.362 -0.014 1.00 0.00 N ATOM 216 CA ASP A 393 -8.714 -2.518 -0.813 1.00 0.00 C ATOM 217 C ASP A 393 -8.369 -2.619 -2.289 1.00 0.00 C ATOM 218 O ASP A 393 -7.798 -1.695 -2.868 1.00 0.00 O ATOM 219 CB ASP A 393 -9.652 -1.347 -0.567 1.00 0.00 C ATOM 220 CG ASP A 393 -11.099 -1.670 -0.924 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.823 -2.218 -0.068 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.524 -1.376 -2.064 1.00 0.00 O ATOM 0 H ASP A 393 -7.022 -1.481 -0.160 1.00 0.00 H new ATOM 0 HA ASP A 393 -9.212 -3.442 -0.519 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.597 -1.056 0.482 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -9.319 -0.490 -1.153 1.00 0.00 H new ATOM 227 N PRO A 394 -8.712 -3.747 -2.918 1.00 0.00 N ATOM 228 CA PRO A 394 -8.428 -3.992 -4.324 1.00 0.00 C ATOM 229 C PRO A 394 -9.497 -3.430 -5.252 1.00 0.00 C ATOM 230 O PRO A 394 -10.604 -3.089 -4.828 1.00 0.00 O ATOM 231 CB PRO A 394 -8.422 -5.513 -4.390 1.00 0.00 C ATOM 232 CG PRO A 394 -9.455 -5.918 -3.400 1.00 0.00 C ATOM 233 CD PRO A 394 -9.416 -4.883 -2.301 1.00 0.00 C ATOM 0 HA PRO A 394 -7.504 -3.514 -4.649 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -8.666 -5.870 -5.390 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.443 -5.920 -4.136 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.442 -5.958 -3.862 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.247 -6.913 -3.005 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.419 -4.605 -1.977 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.888 -5.252 -1.422 1.00 0.00 H new ATOM 241 N ILE A 395 -9.164 -3.362 -6.526 1.00 0.00 N ATOM 242 CA ILE A 395 -10.084 -2.859 -7.528 1.00 0.00 C ATOM 243 C ILE A 395 -10.726 -4.023 -8.265 1.00 0.00 C ATOM 244 O ILE A 395 -10.052 -4.788 -8.957 1.00 0.00 O ATOM 245 CB ILE A 395 -9.381 -1.920 -8.539 1.00 0.00 C ATOM 246 CG1 ILE A 395 -9.097 -0.568 -7.888 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.221 -1.735 -9.802 1.00 0.00 C ATOM 248 CD1 ILE A 395 -10.332 0.092 -7.316 1.00 0.00 C ATOM 0 H ILE A 395 -8.257 -3.651 -6.894 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.849 -2.277 -7.014 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.438 -2.381 -8.830 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.364 -0.702 -7.093 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.648 0.096 -8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -9.700 -1.071 -10.491 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.378 -2.702 -10.279 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.185 -1.300 -9.537 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -10.060 1.048 -6.869 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -11.058 0.257 -8.112 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.770 -0.553 -6.554 1.00 0.00 H new ATOM 260 N VAL A 396 -12.021 -4.165 -8.088 1.00 0.00 N ATOM 261 CA VAL A 396 -12.768 -5.222 -8.730 1.00 0.00 C ATOM 262 C VAL A 396 -13.717 -4.625 -9.767 1.00 0.00 C ATOM 263 O VAL A 396 -14.575 -3.800 -9.446 1.00 0.00 O ATOM 264 CB VAL A 396 -13.513 -6.104 -7.687 1.00 0.00 C ATOM 265 CG1 VAL A 396 -13.888 -5.309 -6.445 1.00 0.00 C ATOM 266 CG2 VAL A 396 -14.735 -6.782 -8.289 1.00 0.00 C ATOM 0 H VAL A 396 -12.584 -3.553 -7.497 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.074 -5.883 -9.249 1.00 0.00 H new ATOM 0 HB VAL A 396 -12.819 -6.887 -7.383 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.406 -5.959 -5.740 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -12.985 -4.915 -5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.542 -4.483 -6.725 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.227 -7.388 -7.528 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.429 -6.024 -8.654 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.426 -7.420 -9.117 1.00 0.00 H new ATOM 276 N MET A 397 -13.532 -5.027 -11.019 1.00 0.00 N ATOM 277 CA MET A 397 -14.333 -4.521 -12.110 1.00 0.00 C ATOM 278 C MET A 397 -15.702 -5.158 -12.094 1.00 0.00 C ATOM 279 O MET A 397 -15.836 -6.355 -11.849 1.00 0.00 O ATOM 280 CB MET A 397 -13.651 -4.805 -13.454 1.00 0.00 C ATOM 281 CG MET A 397 -12.159 -4.511 -13.467 1.00 0.00 C ATOM 282 SD MET A 397 -11.787 -2.747 -13.473 1.00 0.00 S ATOM 283 CE MET A 397 -12.298 -2.298 -15.129 1.00 0.00 C ATOM 0 H MET A 397 -12.826 -5.708 -11.298 1.00 0.00 H new ATOM 0 HA MET A 397 -14.437 -3.443 -11.985 1.00 0.00 H new ATOM 0 HB2 MET A 397 -13.806 -5.852 -13.714 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.135 -4.209 -14.228 1.00 0.00 H new ATOM 0 HG2 MET A 397 -11.696 -4.971 -12.594 1.00 0.00 H new ATOM 0 HG3 MET A 397 -11.711 -4.974 -14.346 1.00 0.00 H new ATOM 0 HE1 MET A 397 -11.836 -1.351 -15.408 1.00 0.00 H new ATOM 0 HE2 MET A 397 -11.987 -3.074 -15.829 1.00 0.00 H new ATOM 0 HE3 MET A 397 -13.383 -2.195 -15.160 1.00 0.00 H new ATOM 293 N VAL A 398 -16.709 -4.340 -12.307 1.00 0.00 N ATOM 294 CA VAL A 398 -18.078 -4.803 -12.361 1.00 0.00 C ATOM 295 C VAL A 398 -18.736 -4.211 -13.589 1.00 0.00 C ATOM 296 O VAL A 398 -18.824 -2.989 -13.716 1.00 0.00 O ATOM 297 CB VAL A 398 -18.877 -4.413 -11.112 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.320 -4.844 -11.276 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.272 -5.038 -9.866 1.00 0.00 C ATOM 0 H VAL A 398 -16.602 -3.335 -12.448 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.068 -5.892 -12.407 1.00 0.00 H new ATOM 0 HB VAL A 398 -18.839 -3.330 -10.995 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -20.886 -4.566 -10.387 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -20.750 -4.352 -12.149 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.364 -5.925 -11.411 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -18.856 -4.747 -8.993 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.280 -6.124 -9.963 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.245 -4.692 -9.747 1.00 0.00 H new ATOM 309 N ALA A 399 -19.157 -5.075 -14.501 1.00 0.00 N ATOM 310 CA ALA A 399 -19.769 -4.659 -15.751 1.00 0.00 C ATOM 311 C ALA A 399 -18.758 -3.860 -16.565 1.00 0.00 C ATOM 312 O ALA A 399 -19.123 -3.046 -17.424 1.00 0.00 O ATOM 313 CB ALA A 399 -21.042 -3.854 -15.505 1.00 0.00 C ATOM 0 H ALA A 399 -19.083 -6.087 -14.393 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.059 -5.545 -16.316 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.475 -3.558 -16.460 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -21.758 -4.465 -14.955 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.803 -2.964 -14.924 1.00 0.00 H new ATOM 319 N GLY A 400 -17.473 -4.087 -16.281 1.00 0.00 N ATOM 320 CA GLY A 400 -16.425 -3.382 -16.983 1.00 0.00 C ATOM 321 C GLY A 400 -16.086 -2.059 -16.328 1.00 0.00 C ATOM 322 O GLY A 400 -15.233 -1.319 -16.816 1.00 0.00 O ATOM 0 H GLY A 400 -17.147 -4.748 -15.576 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -15.532 -4.006 -17.021 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -16.735 -3.206 -18.013 1.00 0.00 H new ATOM 326 N ARG A 401 -16.765 -1.746 -15.231 1.00 0.00 N ATOM 327 CA ARG A 401 -16.513 -0.506 -14.511 1.00 0.00 C ATOM 328 C ARG A 401 -15.584 -0.788 -13.340 1.00 0.00 C ATOM 329 O ARG A 401 -15.800 -1.738 -12.591 1.00 0.00 O ATOM 330 CB ARG A 401 -17.809 0.123 -13.984 1.00 0.00 C ATOM 331 CG ARG A 401 -19.058 -0.194 -14.790 1.00 0.00 C ATOM 332 CD ARG A 401 -19.110 0.589 -16.084 1.00 0.00 C ATOM 333 NE ARG A 401 -18.893 -0.274 -17.245 1.00 0.00 N ATOM 334 CZ ARG A 401 -18.388 0.135 -18.406 1.00 0.00 C ATOM 335 NH1 ARG A 401 -18.042 1.408 -18.578 1.00 0.00 N ATOM 336 NH2 ARG A 401 -18.228 -0.737 -19.396 1.00 0.00 N ATOM 0 H ARG A 401 -17.492 -2.333 -14.822 1.00 0.00 H new ATOM 0 HA ARG A 401 -16.056 0.198 -15.206 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -17.964 -0.210 -12.958 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -17.682 1.205 -13.952 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -19.086 -1.261 -15.010 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -19.942 0.032 -14.193 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -20.078 1.082 -16.173 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -18.353 1.373 -16.066 1.00 0.00 H new ATOM 0 HE ARG A 401 -19.147 -1.258 -17.158 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -18.163 2.077 -17.817 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -17.655 1.715 -19.470 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -18.492 -1.713 -19.263 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -17.841 -0.430 -20.289 1.00 0.00 H new ATOM 350 N PRO A 402 -14.535 0.021 -13.171 1.00 0.00 N ATOM 351 CA PRO A 402 -13.577 -0.164 -12.083 1.00 0.00 C ATOM 352 C PRO A 402 -14.120 0.290 -10.731 1.00 0.00 C ATOM 353 O PRO A 402 -14.200 1.486 -10.447 1.00 0.00 O ATOM 354 CB PRO A 402 -12.391 0.701 -12.511 1.00 0.00 C ATOM 355 CG PRO A 402 -12.984 1.774 -13.359 1.00 0.00 C ATOM 356 CD PRO A 402 -14.190 1.168 -14.030 1.00 0.00 C ATOM 0 HA PRO A 402 -13.327 -1.215 -11.936 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -11.876 1.120 -11.647 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.657 0.118 -13.068 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -13.268 2.635 -12.754 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -12.265 2.127 -14.098 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -15.012 1.881 -14.094 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -13.964 0.851 -15.048 1.00 0.00 H new ATOM 364 N PHE A 403 -14.511 -0.671 -9.911 1.00 0.00 N ATOM 365 CA PHE A 403 -15.026 -0.380 -8.585 1.00 0.00 C ATOM 366 C PHE A 403 -14.085 -0.954 -7.546 1.00 0.00 C ATOM 367 O PHE A 403 -13.299 -1.848 -7.841 1.00 0.00 O ATOM 368 CB PHE A 403 -16.427 -0.972 -8.400 1.00 0.00 C ATOM 369 CG PHE A 403 -17.450 -0.385 -9.332 1.00 0.00 C ATOM 370 CD1 PHE A 403 -17.674 0.982 -9.369 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.175 -1.202 -10.181 1.00 0.00 C ATOM 372 CE1 PHE A 403 -18.604 1.522 -10.239 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.109 -0.671 -11.049 1.00 0.00 C ATOM 374 CZ PHE A 403 -19.323 0.693 -11.080 1.00 0.00 C ATOM 0 H PHE A 403 -14.481 -1.664 -10.142 1.00 0.00 H new ATOM 0 HA PHE A 403 -15.095 0.701 -8.466 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.381 -2.050 -8.555 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.749 -0.811 -7.371 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -17.117 1.633 -8.712 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -18.008 -2.269 -10.165 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -18.768 2.589 -10.261 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -19.671 -1.322 -11.703 1.00 0.00 H new ATOM 0 HZ PHE A 403 -20.051 1.111 -11.760 1.00 0.00 H new ATOM 384 N SER A 404 -14.143 -0.441 -6.342 1.00 0.00 N ATOM 385 CA SER A 404 -13.296 -0.942 -5.286 1.00 0.00 C ATOM 386 C SER A 404 -14.039 -2.037 -4.538 1.00 0.00 C ATOM 387 O SER A 404 -15.251 -2.173 -4.680 1.00 0.00 O ATOM 388 CB SER A 404 -12.901 0.188 -4.342 1.00 0.00 C ATOM 389 OG SER A 404 -12.583 1.367 -5.064 1.00 0.00 O ATOM 0 H SER A 404 -14.765 0.320 -6.069 1.00 0.00 H new ATOM 0 HA SER A 404 -12.381 -1.354 -5.712 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.718 0.391 -3.650 1.00 0.00 H new ATOM 0 HB3 SER A 404 -12.044 -0.118 -3.742 1.00 0.00 H new ATOM 0 HG SER A 404 -12.335 2.078 -4.437 1.00 0.00 H new ATOM 395 N TYR A 405 -13.329 -2.817 -3.756 1.00 0.00 N ATOM 396 CA TYR A 405 -13.943 -3.887 -3.002 1.00 0.00 C ATOM 397 C TYR A 405 -14.882 -3.295 -1.964 1.00 0.00 C ATOM 398 O TYR A 405 -15.973 -3.810 -1.753 1.00 0.00 O ATOM 399 CB TYR A 405 -12.890 -4.773 -2.346 1.00 0.00 C ATOM 400 CG TYR A 405 -13.446 -6.069 -1.801 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.962 -6.147 -0.512 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.468 -7.214 -2.585 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.483 -7.329 -0.022 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.984 -8.400 -2.102 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.492 -8.452 -0.821 1.00 0.00 C ATOM 406 OH TYR A 405 -15.017 -9.630 -0.340 1.00 0.00 O ATOM 0 H TYR A 405 -12.321 -2.730 -3.625 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.515 -4.518 -3.683 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -12.112 -4.999 -3.075 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.416 -4.221 -1.535 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.955 -5.269 0.117 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -13.075 -7.177 -3.590 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.881 -7.373 0.981 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.990 -9.283 -2.724 1.00 0.00 H new ATOM 0 HH TYR A 405 -15.880 -9.803 -0.771 1.00 0.00 H new ATOM 416 N SER A 406 -14.466 -2.194 -1.340 1.00 0.00 N ATOM 417 CA SER A 406 -15.303 -1.505 -0.359 1.00 0.00 C ATOM 418 C SER A 406 -16.584 -1.003 -1.031 1.00 0.00 C ATOM 419 O SER A 406 -17.564 -0.674 -0.372 1.00 0.00 O ATOM 420 CB SER A 406 -14.542 -0.337 0.276 1.00 0.00 C ATOM 421 OG SER A 406 -13.582 -0.800 1.208 1.00 0.00 O ATOM 0 H SER A 406 -13.556 -1.761 -1.496 1.00 0.00 H new ATOM 0 HA SER A 406 -15.567 -2.208 0.431 1.00 0.00 H new ATOM 0 HB2 SER A 406 -14.047 0.244 -0.502 1.00 0.00 H new ATOM 0 HB3 SER A 406 -15.245 0.331 0.775 1.00 0.00 H new ATOM 0 HG SER A 406 -13.154 -1.611 0.862 1.00 0.00 H new ATOM 427 N GLU A 407 -16.553 -0.975 -2.354 1.00 0.00 N ATOM 428 CA GLU A 407 -17.683 -0.556 -3.157 1.00 0.00 C ATOM 429 C GLU A 407 -18.529 -1.756 -3.531 1.00 0.00 C ATOM 430 O GLU A 407 -19.693 -1.856 -3.162 1.00 0.00 O ATOM 431 CB GLU A 407 -17.191 0.145 -4.424 1.00 0.00 C ATOM 432 CG GLU A 407 -17.074 1.651 -4.299 1.00 0.00 C ATOM 433 CD GLU A 407 -18.415 2.338 -4.505 1.00 0.00 C ATOM 434 OE1 GLU A 407 -19.068 2.082 -5.545 1.00 0.00 O ATOM 435 OE2 GLU A 407 -18.821 3.120 -3.629 1.00 0.00 O ATOM 0 H GLU A 407 -15.736 -1.245 -2.901 1.00 0.00 H new ATOM 0 HA GLU A 407 -18.289 0.139 -2.576 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -16.217 -0.262 -4.695 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.873 -0.088 -5.242 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -16.682 1.905 -3.314 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -16.358 2.023 -5.032 1.00 0.00 H new ATOM 442 N VAL A 408 -17.908 -2.686 -4.234 1.00 0.00 N ATOM 443 CA VAL A 408 -18.577 -3.887 -4.702 1.00 0.00 C ATOM 444 C VAL A 408 -19.179 -4.706 -3.555 1.00 0.00 C ATOM 445 O VAL A 408 -20.241 -5.300 -3.704 1.00 0.00 O ATOM 446 CB VAL A 408 -17.602 -4.778 -5.497 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.334 -5.938 -6.128 1.00 0.00 C ATOM 448 CG2 VAL A 408 -16.874 -3.981 -6.564 1.00 0.00 C ATOM 0 H VAL A 408 -16.924 -2.630 -4.497 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.391 -3.555 -5.347 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.863 -5.166 -4.796 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.628 -6.554 -6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.805 -6.538 -5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.099 -5.560 -6.807 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.194 -4.637 -7.107 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.599 -3.555 -7.258 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.306 -3.178 -6.094 1.00 0.00 H new ATOM 458 N SER A 409 -18.516 -4.706 -2.408 1.00 0.00 N ATOM 459 CA SER A 409 -18.981 -5.490 -1.262 1.00 0.00 C ATOM 460 C SER A 409 -20.170 -4.842 -0.570 1.00 0.00 C ATOM 461 O SER A 409 -21.076 -5.527 -0.097 1.00 0.00 O ATOM 462 CB SER A 409 -17.851 -5.683 -0.246 1.00 0.00 C ATOM 463 OG SER A 409 -17.433 -4.445 0.306 1.00 0.00 O ATOM 0 H SER A 409 -17.660 -4.177 -2.242 1.00 0.00 H new ATOM 0 HA SER A 409 -19.298 -6.458 -1.651 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.187 -6.344 0.553 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.005 -6.172 -0.729 1.00 0.00 H new ATOM 0 HG SER A 409 -17.041 -3.888 -0.399 1.00 0.00 H new ATOM 469 N GLN A 410 -20.166 -3.522 -0.518 1.00 0.00 N ATOM 470 CA GLN A 410 -21.229 -2.792 0.148 1.00 0.00 C ATOM 471 C GLN A 410 -22.371 -2.479 -0.807 1.00 0.00 C ATOM 472 O GLN A 410 -23.398 -1.935 -0.402 1.00 0.00 O ATOM 473 CB GLN A 410 -20.683 -1.494 0.746 1.00 0.00 C ATOM 474 CG GLN A 410 -19.585 -1.695 1.784 1.00 0.00 C ATOM 475 CD GLN A 410 -19.896 -2.801 2.777 1.00 0.00 C ATOM 476 OE1 GLN A 410 -20.596 -2.587 3.765 1.00 0.00 O ATOM 477 NE2 GLN A 410 -19.353 -3.984 2.535 1.00 0.00 N ATOM 0 H GLN A 410 -19.440 -2.935 -0.928 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.617 -3.424 0.946 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -20.295 -0.871 -0.060 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -21.505 -0.945 1.205 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -18.650 -1.926 1.274 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -19.431 -0.762 2.326 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -18.778 -4.121 1.704 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -19.510 -4.759 3.180 1.00 0.00 H new ATOM 486 N ARG A 411 -22.196 -2.827 -2.072 1.00 0.00 N ATOM 487 CA ARG A 411 -23.215 -2.556 -3.069 1.00 0.00 C ATOM 488 C ARG A 411 -23.725 -3.829 -3.730 1.00 0.00 C ATOM 489 O ARG A 411 -23.086 -4.396 -4.634 1.00 0.00 O ATOM 490 CB ARG A 411 -22.677 -1.598 -4.116 1.00 0.00 C ATOM 491 CG ARG A 411 -22.290 -0.252 -3.543 1.00 0.00 C ATOM 492 CD ARG A 411 -21.783 0.663 -4.627 1.00 0.00 C ATOM 493 NE ARG A 411 -22.842 1.008 -5.566 1.00 0.00 N ATOM 494 CZ ARG A 411 -22.687 1.841 -6.582 1.00 0.00 C ATOM 495 NH1 ARG A 411 -21.509 2.426 -6.797 1.00 0.00 N ATOM 496 NH2 ARG A 411 -23.718 2.085 -7.383 1.00 0.00 N ATOM 0 H ARG A 411 -21.363 -3.295 -2.429 1.00 0.00 H new ATOM 0 HA ARG A 411 -24.061 -2.097 -2.557 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.807 -2.045 -4.597 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.431 -1.454 -4.890 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -23.151 0.201 -3.052 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -21.521 -0.383 -2.782 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.380 1.572 -4.180 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -20.964 0.180 -5.160 1.00 0.00 H new ATOM 0 HE ARG A 411 -23.759 0.581 -5.432 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -20.723 2.232 -6.177 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -21.394 3.068 -7.582 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -24.616 1.632 -7.211 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -23.612 2.725 -8.170 1.00 0.00 H new ATOM 510 N PRO A 412 -24.904 -4.283 -3.294 1.00 0.00 N ATOM 511 CA PRO A 412 -25.537 -5.478 -3.832 1.00 0.00 C ATOM 512 C PRO A 412 -25.844 -5.334 -5.318 1.00 0.00 C ATOM 513 O PRO A 412 -25.927 -6.326 -6.027 1.00 0.00 O ATOM 514 CB PRO A 412 -26.834 -5.611 -3.023 1.00 0.00 C ATOM 515 CG PRO A 412 -27.072 -4.258 -2.446 1.00 0.00 C ATOM 516 CD PRO A 412 -25.713 -3.660 -2.234 1.00 0.00 C ATOM 0 HA PRO A 412 -24.892 -6.352 -3.750 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.664 -5.921 -3.658 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.735 -6.362 -2.239 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -27.668 -3.644 -3.121 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -27.621 -4.324 -1.507 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -25.732 -2.574 -2.327 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -25.323 -3.888 -1.242 1.00 0.00 H new ATOM 524 N GLU A 413 -25.979 -4.090 -5.789 1.00 0.00 N ATOM 525 CA GLU A 413 -26.280 -3.834 -7.193 1.00 0.00 C ATOM 526 C GLU A 413 -25.077 -4.188 -8.035 1.00 0.00 C ATOM 527 O GLU A 413 -25.208 -4.705 -9.136 1.00 0.00 O ATOM 528 CB GLU A 413 -26.608 -2.363 -7.450 1.00 0.00 C ATOM 529 CG GLU A 413 -27.219 -1.643 -6.273 1.00 0.00 C ATOM 530 CD GLU A 413 -26.166 -0.878 -5.494 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.632 0.126 -6.024 1.00 0.00 O ATOM 532 OE2 GLU A 413 -25.845 -1.303 -4.371 1.00 0.00 O ATOM 0 H GLU A 413 -25.884 -3.250 -5.218 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.147 -4.441 -7.454 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -25.694 -1.846 -7.742 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.294 -2.299 -8.295 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -27.988 -0.955 -6.623 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -27.710 -2.362 -5.617 1.00 0.00 H new ATOM 539 N LEU A 414 -23.899 -3.900 -7.502 1.00 0.00 N ATOM 540 CA LEU A 414 -22.666 -4.183 -8.206 1.00 0.00 C ATOM 541 C LEU A 414 -22.507 -5.676 -8.386 1.00 0.00 C ATOM 542 O LEU A 414 -22.291 -6.147 -9.491 1.00 0.00 O ATOM 543 CB LEU A 414 -21.466 -3.591 -7.468 1.00 0.00 C ATOM 544 CG LEU A 414 -21.420 -2.064 -7.444 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.047 -1.581 -7.008 1.00 0.00 C ATOM 546 CD2 LEU A 414 -21.780 -1.497 -8.810 1.00 0.00 C ATOM 0 H LEU A 414 -23.775 -3.471 -6.585 1.00 0.00 H new ATOM 0 HA LEU A 414 -22.711 -3.715 -9.189 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.472 -3.957 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.552 -3.961 -7.933 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.155 -1.708 -6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -20.031 -0.491 -6.996 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -19.829 -1.958 -6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.294 -1.947 -7.706 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.742 -0.408 -8.774 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.070 -1.860 -9.553 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -22.786 -1.816 -9.083 1.00 0.00 H new ATOM 558 N VAL A 415 -22.675 -6.428 -7.313 1.00 0.00 N ATOM 559 CA VAL A 415 -22.550 -7.882 -7.398 1.00 0.00 C ATOM 560 C VAL A 415 -23.752 -8.464 -8.155 1.00 0.00 C ATOM 561 O VAL A 415 -23.741 -9.612 -8.597 1.00 0.00 O ATOM 562 CB VAL A 415 -22.416 -8.511 -5.989 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.222 -10.020 -6.058 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.255 -7.870 -5.242 1.00 0.00 C ATOM 0 H VAL A 415 -22.895 -6.069 -6.384 1.00 0.00 H new ATOM 0 HA VAL A 415 -21.642 -8.125 -7.949 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.345 -8.322 -5.452 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.132 -10.422 -5.049 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.079 -10.475 -6.555 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.316 -10.245 -6.620 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.168 -8.318 -4.252 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.331 -8.033 -5.797 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.434 -6.799 -5.141 1.00 0.00 H new ATOM 574 N ALA A 416 -24.774 -7.633 -8.328 1.00 0.00 N ATOM 575 CA ALA A 416 -25.981 -8.019 -9.045 1.00 0.00 C ATOM 576 C ALA A 416 -25.866 -7.670 -10.521 1.00 0.00 C ATOM 577 O ALA A 416 -26.670 -8.112 -11.341 1.00 0.00 O ATOM 578 CB ALA A 416 -27.182 -7.310 -8.454 1.00 0.00 C ATOM 0 H ALA A 416 -24.788 -6.676 -7.976 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.106 -9.097 -8.947 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.081 -7.604 -8.996 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.285 -7.583 -7.404 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.045 -6.232 -8.536 1.00 0.00 H new ATOM 584 N GLN A 417 -24.880 -6.850 -10.850 1.00 0.00 N ATOM 585 CA GLN A 417 -24.662 -6.436 -12.222 1.00 0.00 C ATOM 586 C GLN A 417 -23.303 -6.914 -12.666 1.00 0.00 C ATOM 587 O GLN A 417 -22.859 -6.638 -13.780 1.00 0.00 O ATOM 588 CB GLN A 417 -24.772 -4.916 -12.360 1.00 0.00 C ATOM 589 CG GLN A 417 -26.189 -4.398 -12.179 1.00 0.00 C ATOM 590 CD GLN A 417 -27.121 -4.837 -13.293 1.00 0.00 C ATOM 591 OE1 GLN A 417 -27.318 -4.120 -14.270 1.00 0.00 O ATOM 592 NE2 GLN A 417 -27.692 -6.025 -13.160 1.00 0.00 N ATOM 0 H GLN A 417 -24.217 -6.458 -10.181 1.00 0.00 H new ATOM 0 HA GLN A 417 -25.430 -6.878 -12.857 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.123 -4.443 -11.623 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -24.407 -4.620 -13.343 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -26.580 -4.749 -11.224 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.170 -3.309 -12.135 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -27.503 -6.592 -12.333 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -28.320 -6.373 -13.884 1.00 0.00 H new ATOM 601 N MET A 418 -22.647 -7.635 -11.774 1.00 0.00 N ATOM 602 CA MET A 418 -21.344 -8.166 -12.056 1.00 0.00 C ATOM 603 C MET A 418 -21.506 -9.527 -12.691 1.00 0.00 C ATOM 604 O MET A 418 -22.403 -10.298 -12.340 1.00 0.00 O ATOM 605 CB MET A 418 -20.481 -8.212 -10.787 1.00 0.00 C ATOM 606 CG MET A 418 -20.330 -9.579 -10.149 1.00 0.00 C ATOM 607 SD MET A 418 -19.740 -9.470 -8.448 1.00 0.00 S ATOM 608 CE MET A 418 -18.332 -8.381 -8.650 1.00 0.00 C ATOM 0 H MET A 418 -23.006 -7.862 -10.846 1.00 0.00 H new ATOM 0 HA MET A 418 -20.818 -7.515 -12.755 1.00 0.00 H new ATOM 0 HB2 MET A 418 -19.489 -7.832 -11.030 1.00 0.00 H new ATOM 0 HB3 MET A 418 -20.911 -7.533 -10.051 1.00 0.00 H new ATOM 0 HG2 MET A 418 -21.290 -10.096 -10.167 1.00 0.00 H new ATOM 0 HG3 MET A 418 -19.634 -10.178 -10.736 1.00 0.00 H new ATOM 0 HE1 MET A 418 -17.611 -8.567 -7.854 1.00 0.00 H new ATOM 0 HE2 MET A 418 -17.863 -8.568 -9.616 1.00 0.00 H new ATOM 0 HE3 MET A 418 -18.664 -7.344 -8.603 1.00 0.00 H new ATOM 618 N THR A 419 -20.651 -9.798 -13.634 1.00 0.00 N ATOM 619 CA THR A 419 -20.699 -11.050 -14.372 1.00 0.00 C ATOM 620 C THR A 419 -20.138 -12.186 -13.527 1.00 0.00 C ATOM 621 O THR A 419 -19.529 -11.935 -12.489 1.00 0.00 O ATOM 622 CB THR A 419 -19.913 -10.951 -15.698 1.00 0.00 C ATOM 623 OG1 THR A 419 -18.508 -10.864 -15.440 1.00 0.00 O ATOM 624 CG2 THR A 419 -20.359 -9.740 -16.505 1.00 0.00 C ATOM 0 H THR A 419 -19.901 -9.169 -13.920 1.00 0.00 H new ATOM 0 HA THR A 419 -21.744 -11.256 -14.606 1.00 0.00 H new ATOM 0 HB THR A 419 -20.118 -11.852 -16.276 1.00 0.00 H new ATOM 0 HG1 THR A 419 -18.011 -11.140 -16.238 1.00 0.00 H new ATOM 0 HG21 THR A 419 -19.791 -9.692 -17.434 1.00 0.00 H new ATOM 0 HG22 THR A 419 -21.421 -9.826 -16.733 1.00 0.00 H new ATOM 0 HG23 THR A 419 -20.185 -8.833 -15.926 1.00 0.00 H new ATOM 632 N PRO A 420 -20.368 -13.453 -13.924 1.00 0.00 N ATOM 633 CA PRO A 420 -19.833 -14.604 -13.196 1.00 0.00 C ATOM 634 C PRO A 420 -18.335 -14.444 -12.972 1.00 0.00 C ATOM 635 O PRO A 420 -17.829 -14.672 -11.876 1.00 0.00 O ATOM 636 CB PRO A 420 -20.126 -15.784 -14.123 1.00 0.00 C ATOM 637 CG PRO A 420 -21.308 -15.352 -14.920 1.00 0.00 C ATOM 638 CD PRO A 420 -21.174 -13.862 -15.091 1.00 0.00 C ATOM 0 HA PRO A 420 -20.274 -14.728 -12.207 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -19.274 -16.004 -14.766 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -20.340 -16.690 -13.556 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -21.331 -15.855 -15.887 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -22.237 -15.604 -14.408 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -20.680 -13.608 -16.029 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -22.146 -13.370 -15.100 1.00 0.00 H new ATOM 646 N GLU A 421 -17.646 -14.008 -14.020 1.00 0.00 N ATOM 647 CA GLU A 421 -16.211 -13.778 -13.963 1.00 0.00 C ATOM 648 C GLU A 421 -15.883 -12.739 -12.897 1.00 0.00 C ATOM 649 O GLU A 421 -15.003 -12.952 -12.063 1.00 0.00 O ATOM 650 CB GLU A 421 -15.678 -13.289 -15.314 1.00 0.00 C ATOM 651 CG GLU A 421 -16.229 -14.038 -16.516 1.00 0.00 C ATOM 652 CD GLU A 421 -17.580 -13.513 -16.945 1.00 0.00 C ATOM 653 OE1 GLU A 421 -17.638 -12.391 -17.485 1.00 0.00 O ATOM 654 OE2 GLU A 421 -18.587 -14.206 -16.708 1.00 0.00 O ATOM 0 H GLU A 421 -18.065 -13.805 -14.928 1.00 0.00 H new ATOM 0 HA GLU A 421 -15.734 -14.726 -13.714 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -15.914 -12.230 -15.422 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -14.591 -13.375 -15.315 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -15.528 -13.955 -17.347 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -16.313 -15.098 -16.275 1.00 0.00 H new ATOM 661 N GLU A 422 -16.607 -11.622 -12.917 1.00 0.00 N ATOM 662 CA GLU A 422 -16.392 -10.550 -11.967 1.00 0.00 C ATOM 663 C GLU A 422 -16.767 -10.998 -10.557 1.00 0.00 C ATOM 664 O GLU A 422 -16.074 -10.678 -9.596 1.00 0.00 O ATOM 665 CB GLU A 422 -17.192 -9.330 -12.409 1.00 0.00 C ATOM 666 CG GLU A 422 -16.712 -8.780 -13.743 1.00 0.00 C ATOM 667 CD GLU A 422 -17.571 -7.653 -14.259 1.00 0.00 C ATOM 668 OE1 GLU A 422 -18.800 -7.685 -14.026 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.023 -6.724 -14.895 1.00 0.00 O ATOM 0 H GLU A 422 -17.352 -11.442 -13.590 1.00 0.00 H new ATOM 0 HA GLU A 422 -15.336 -10.282 -11.942 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -18.246 -9.597 -12.486 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.115 -8.553 -11.649 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -15.686 -8.428 -13.637 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -16.698 -9.585 -14.478 1.00 0.00 H new ATOM 676 N LYS A 423 -17.865 -11.732 -10.441 1.00 0.00 N ATOM 677 CA LYS A 423 -18.317 -12.259 -9.156 1.00 0.00 C ATOM 678 C LYS A 423 -17.266 -13.190 -8.564 1.00 0.00 C ATOM 679 O LYS A 423 -16.940 -13.090 -7.383 1.00 0.00 O ATOM 680 CB LYS A 423 -19.646 -13.001 -9.340 1.00 0.00 C ATOM 681 CG LYS A 423 -20.558 -12.950 -8.121 1.00 0.00 C ATOM 682 CD LYS A 423 -20.243 -14.050 -7.121 1.00 0.00 C ATOM 683 CE LYS A 423 -20.979 -15.339 -7.449 1.00 0.00 C ATOM 684 NZ LYS A 423 -20.365 -16.065 -8.592 1.00 0.00 N ATOM 0 H LYS A 423 -18.466 -11.979 -11.228 1.00 0.00 H new ATOM 0 HA LYS A 423 -18.467 -11.429 -8.465 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -20.173 -12.575 -10.193 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -19.438 -14.043 -9.582 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.457 -11.980 -7.635 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -21.596 -13.040 -8.442 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -19.169 -14.237 -7.112 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -20.517 -13.720 -6.119 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -20.984 -15.985 -6.571 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -22.019 -15.111 -7.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -20.728 -17.039 -8.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -20.605 -15.580 -9.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -19.332 -16.084 -8.476 1.00 0.00 H new ATOM 698 N GLU A 424 -16.722 -14.074 -9.392 1.00 0.00 N ATOM 699 CA GLU A 424 -15.702 -15.009 -8.934 1.00 0.00 C ATOM 700 C GLU A 424 -14.435 -14.243 -8.604 1.00 0.00 C ATOM 701 O GLU A 424 -13.733 -14.560 -7.643 1.00 0.00 O ATOM 702 CB GLU A 424 -15.421 -16.077 -9.993 1.00 0.00 C ATOM 703 CG GLU A 424 -16.216 -17.362 -9.792 1.00 0.00 C ATOM 704 CD GLU A 424 -17.665 -17.116 -9.417 1.00 0.00 C ATOM 705 OE1 GLU A 424 -17.958 -16.974 -8.209 1.00 0.00 O ATOM 706 OE2 GLU A 424 -18.526 -17.055 -10.318 1.00 0.00 O ATOM 0 H GLU A 424 -16.968 -14.163 -10.378 1.00 0.00 H new ATOM 0 HA GLU A 424 -16.064 -15.517 -8.040 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -15.649 -15.669 -10.978 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -14.357 -16.313 -9.985 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -16.180 -17.951 -10.708 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -15.741 -17.957 -9.012 1.00 0.00 H new ATOM 713 N ALA A 425 -14.160 -13.223 -9.405 1.00 0.00 N ATOM 714 CA ALA A 425 -13.003 -12.374 -9.195 1.00 0.00 C ATOM 715 C ALA A 425 -13.146 -11.638 -7.871 1.00 0.00 C ATOM 716 O ALA A 425 -12.199 -11.547 -7.093 1.00 0.00 O ATOM 717 CB ALA A 425 -12.859 -11.391 -10.344 1.00 0.00 C ATOM 0 H ALA A 425 -14.729 -12.965 -10.211 1.00 0.00 H new ATOM 0 HA ALA A 425 -12.104 -12.989 -9.160 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -11.987 -10.759 -10.175 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -12.735 -11.939 -11.278 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -13.752 -10.769 -10.404 1.00 0.00 H new ATOM 723 N TYR A 426 -14.349 -11.129 -7.619 1.00 0.00 N ATOM 724 CA TYR A 426 -14.647 -10.428 -6.388 1.00 0.00 C ATOM 725 C TYR A 426 -14.469 -11.374 -5.210 1.00 0.00 C ATOM 726 O TYR A 426 -13.856 -11.024 -4.202 1.00 0.00 O ATOM 727 CB TYR A 426 -16.084 -9.889 -6.433 1.00 0.00 C ATOM 728 CG TYR A 426 -16.635 -9.496 -5.084 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.409 -8.232 -4.564 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.371 -10.399 -4.326 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.898 -7.874 -3.324 1.00 0.00 C ATOM 732 CE2 TYR A 426 -17.864 -10.049 -3.088 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.625 -8.790 -2.591 1.00 0.00 C ATOM 734 OH TYR A 426 -18.104 -8.452 -1.349 1.00 0.00 O ATOM 0 H TYR A 426 -15.137 -11.194 -8.264 1.00 0.00 H new ATOM 0 HA TYR A 426 -13.964 -9.587 -6.271 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.115 -9.022 -7.093 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -16.732 -10.648 -6.872 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.841 -7.515 -5.138 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -17.559 -11.390 -4.713 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.713 -6.885 -2.931 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.436 -10.761 -2.511 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.595 -9.211 -0.970 1.00 0.00 H new ATOM 744 N ILE A 427 -15.014 -12.577 -5.355 1.00 0.00 N ATOM 745 CA ILE A 427 -14.918 -13.590 -4.318 1.00 0.00 C ATOM 746 C ILE A 427 -13.457 -13.947 -4.037 1.00 0.00 C ATOM 747 O ILE A 427 -13.006 -13.907 -2.890 1.00 0.00 O ATOM 748 CB ILE A 427 -15.694 -14.870 -4.703 1.00 0.00 C ATOM 749 CG1 ILE A 427 -17.199 -14.598 -4.680 1.00 0.00 C ATOM 750 CG2 ILE A 427 -15.348 -16.022 -3.765 1.00 0.00 C ATOM 751 CD1 ILE A 427 -18.033 -15.786 -5.100 1.00 0.00 C ATOM 0 H ILE A 427 -15.528 -12.872 -6.185 1.00 0.00 H new ATOM 0 HA ILE A 427 -15.365 -13.169 -3.417 1.00 0.00 H new ATOM 0 HB ILE A 427 -15.401 -15.158 -5.713 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -17.490 -14.297 -3.674 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -17.419 -13.759 -5.340 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -15.908 -16.910 -4.058 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -14.280 -16.230 -3.823 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -15.609 -15.750 -2.742 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -19.090 -15.521 -5.060 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -17.769 -16.074 -6.118 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -17.842 -16.621 -4.426 1.00 0.00 H new ATOM 763 N ALA A 428 -12.724 -14.281 -5.097 1.00 0.00 N ATOM 764 CA ALA A 428 -11.316 -14.649 -4.989 1.00 0.00 C ATOM 765 C ALA A 428 -10.499 -13.530 -4.348 1.00 0.00 C ATOM 766 O ALA A 428 -9.659 -13.778 -3.481 1.00 0.00 O ATOM 767 CB ALA A 428 -10.761 -14.995 -6.363 1.00 0.00 C ATOM 0 H ALA A 428 -13.088 -14.304 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 428 -11.241 -15.525 -4.345 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -9.710 -15.268 -6.272 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -11.319 -15.833 -6.780 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -10.856 -14.132 -7.022 1.00 0.00 H new ATOM 773 N MET A 429 -10.757 -12.299 -4.773 1.00 0.00 N ATOM 774 CA MET A 429 -10.055 -11.141 -4.236 1.00 0.00 C ATOM 775 C MET A 429 -10.415 -10.934 -2.773 1.00 0.00 C ATOM 776 O MET A 429 -9.571 -10.560 -1.958 1.00 0.00 O ATOM 777 CB MET A 429 -10.402 -9.888 -5.043 1.00 0.00 C ATOM 778 CG MET A 429 -9.676 -9.808 -6.373 1.00 0.00 C ATOM 779 SD MET A 429 -9.083 -8.148 -6.737 1.00 0.00 S ATOM 780 CE MET A 429 -10.589 -7.212 -6.516 1.00 0.00 C ATOM 0 H MET A 429 -11.449 -12.077 -5.489 1.00 0.00 H new ATOM 0 HA MET A 429 -8.983 -11.322 -4.311 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.477 -9.866 -5.222 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.160 -9.005 -4.451 1.00 0.00 H new ATOM 0 HG2 MET A 429 -8.832 -10.498 -6.364 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.346 -10.134 -7.169 1.00 0.00 H new ATOM 0 HE1 MET A 429 -10.375 -6.148 -6.618 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.317 -7.510 -7.271 1.00 0.00 H new ATOM 0 HE3 MET A 429 -10.996 -7.406 -5.524 1.00 0.00 H new ATOM 790 N GLY A 430 -11.670 -11.204 -2.447 1.00 0.00 N ATOM 791 CA GLY A 430 -12.144 -11.047 -1.095 1.00 0.00 C ATOM 792 C GLY A 430 -11.537 -12.057 -0.160 1.00 0.00 C ATOM 793 O GLY A 430 -11.247 -11.738 0.985 1.00 0.00 O ATOM 0 H GLY A 430 -12.374 -11.533 -3.107 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.909 -10.042 -0.744 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.229 -11.145 -1.078 1.00 0.00 H new ATOM 797 N GLN A 431 -11.328 -13.272 -0.657 1.00 0.00 N ATOM 798 CA GLN A 431 -10.744 -14.345 0.141 1.00 0.00 C ATOM 799 C GLN A 431 -9.391 -13.921 0.702 1.00 0.00 C ATOM 800 O GLN A 431 -9.030 -14.292 1.816 1.00 0.00 O ATOM 801 CB GLN A 431 -10.596 -15.620 -0.702 1.00 0.00 C ATOM 802 CG GLN A 431 -10.201 -16.852 0.106 1.00 0.00 C ATOM 803 CD GLN A 431 -8.698 -17.062 0.169 1.00 0.00 C ATOM 804 OE1 GLN A 431 -7.978 -16.797 -0.795 1.00 0.00 O ATOM 805 NE2 GLN A 431 -8.213 -17.525 1.312 1.00 0.00 N ATOM 0 H GLN A 431 -11.556 -13.539 -1.615 1.00 0.00 H new ATOM 0 HA GLN A 431 -11.413 -14.555 0.976 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -11.539 -15.819 -1.211 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -9.846 -15.448 -1.474 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -10.592 -16.756 1.119 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -10.668 -17.733 -0.334 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -8.843 -17.732 2.087 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -7.209 -17.674 1.417 1.00 0.00 H new ATOM 814 N ARG A 432 -8.662 -13.120 -0.066 1.00 0.00 N ATOM 815 CA ARG A 432 -7.352 -12.645 0.353 1.00 0.00 C ATOM 816 C ARG A 432 -7.467 -11.752 1.588 1.00 0.00 C ATOM 817 O ARG A 432 -6.688 -11.881 2.528 1.00 0.00 O ATOM 818 CB ARG A 432 -6.675 -11.885 -0.784 1.00 0.00 C ATOM 819 CG ARG A 432 -5.158 -11.902 -0.701 1.00 0.00 C ATOM 820 CD ARG A 432 -4.553 -12.984 -1.587 1.00 0.00 C ATOM 821 NE ARG A 432 -5.094 -14.318 -1.281 1.00 0.00 N ATOM 822 CZ ARG A 432 -4.837 -15.012 -0.160 1.00 0.00 C ATOM 823 NH1 ARG A 432 -4.038 -14.526 0.779 1.00 0.00 N ATOM 824 NH2 ARG A 432 -5.402 -16.191 0.035 1.00 0.00 N ATOM 0 H ARG A 432 -8.958 -12.786 -0.983 1.00 0.00 H new ATOM 0 HA ARG A 432 -6.743 -13.511 0.611 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -6.984 -12.318 -1.735 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -7.020 -10.851 -0.777 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -4.767 -10.929 -0.998 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -4.853 -12.066 0.332 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.747 -12.746 -2.633 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -3.471 -12.994 -1.458 1.00 0.00 H new ATOM 0 HE ARG A 432 -5.710 -14.747 -1.971 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -3.606 -13.610 0.657 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -3.855 -15.068 1.623 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -6.035 -16.576 -0.667 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -5.205 -16.716 0.887 1.00 0.00 H new ATOM 838 N MET A 433 -8.443 -10.850 1.580 1.00 0.00 N ATOM 839 CA MET A 433 -8.663 -9.952 2.713 1.00 0.00 C ATOM 840 C MET A 433 -9.361 -10.706 3.833 1.00 0.00 C ATOM 841 O MET A 433 -9.144 -10.449 5.010 1.00 0.00 O ATOM 842 CB MET A 433 -9.516 -8.754 2.299 1.00 0.00 C ATOM 843 CG MET A 433 -8.778 -7.729 1.458 1.00 0.00 C ATOM 844 SD MET A 433 -9.905 -6.714 0.485 1.00 0.00 S ATOM 845 CE MET A 433 -10.600 -7.939 -0.616 1.00 0.00 C ATOM 0 H MET A 433 -9.093 -10.720 0.805 1.00 0.00 H new ATOM 0 HA MET A 433 -7.695 -9.588 3.058 1.00 0.00 H new ATOM 0 HB2 MET A 433 -10.380 -9.113 1.740 1.00 0.00 H new ATOM 0 HB3 MET A 433 -9.897 -8.266 3.196 1.00 0.00 H new ATOM 0 HG2 MET A 433 -8.183 -7.088 2.108 1.00 0.00 H new ATOM 0 HG3 MET A 433 -8.083 -8.240 0.791 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.570 -7.567 -1.640 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.021 -8.860 -0.548 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.633 -8.138 -0.333 1.00 0.00 H new ATOM 855 N PHE A 434 -10.203 -11.649 3.436 1.00 0.00 N ATOM 856 CA PHE A 434 -10.950 -12.479 4.369 1.00 0.00 C ATOM 857 C PHE A 434 -10.005 -13.349 5.186 1.00 0.00 C ATOM 858 O PHE A 434 -10.345 -13.820 6.271 1.00 0.00 O ATOM 859 CB PHE A 434 -11.933 -13.353 3.592 1.00 0.00 C ATOM 860 CG PHE A 434 -13.273 -12.707 3.374 1.00 0.00 C ATOM 861 CD1 PHE A 434 -13.803 -11.836 4.312 1.00 0.00 C ATOM 862 CD2 PHE A 434 -13.998 -12.967 2.222 1.00 0.00 C ATOM 863 CE1 PHE A 434 -15.029 -11.235 4.104 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.225 -12.371 2.009 1.00 0.00 C ATOM 865 CZ PHE A 434 -15.742 -11.504 2.949 1.00 0.00 C ATOM 0 H PHE A 434 -10.388 -11.860 2.455 1.00 0.00 H new ATOM 0 HA PHE A 434 -11.500 -11.836 5.056 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -11.498 -13.602 2.624 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.075 -14.291 4.129 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -13.251 -11.625 5.216 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -13.598 -13.644 1.482 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -15.431 -10.556 4.842 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -15.780 -12.583 1.107 1.00 0.00 H new ATOM 0 HZ PHE A 434 -16.701 -11.036 2.784 1.00 0.00 H new ATOM 875 N GLU A 435 -8.817 -13.550 4.644 1.00 0.00 N ATOM 876 CA GLU A 435 -7.782 -14.346 5.288 1.00 0.00 C ATOM 877 C GLU A 435 -7.056 -13.532 6.358 1.00 0.00 C ATOM 878 O GLU A 435 -6.125 -14.013 7.006 1.00 0.00 O ATOM 879 CB GLU A 435 -6.790 -14.842 4.229 1.00 0.00 C ATOM 880 CG GLU A 435 -5.994 -16.072 4.631 1.00 0.00 C ATOM 881 CD GLU A 435 -4.840 -16.340 3.684 1.00 0.00 C ATOM 882 OE1 GLU A 435 -5.083 -16.867 2.575 1.00 0.00 O ATOM 883 OE2 GLU A 435 -3.689 -16.007 4.039 1.00 0.00 O ATOM 0 H GLU A 435 -8.540 -13.165 3.741 1.00 0.00 H new ATOM 0 HA GLU A 435 -8.247 -15.202 5.778 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -7.338 -15.064 3.313 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -6.094 -14.036 3.997 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -5.609 -15.940 5.642 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -6.654 -16.939 4.652 1.00 0.00 H new ATOM 890 N ASP A 436 -7.512 -12.310 6.553 1.00 0.00 N ATOM 891 CA ASP A 436 -6.911 -11.412 7.533 1.00 0.00 C ATOM 892 C ASP A 436 -7.900 -10.354 8.012 1.00 0.00 C ATOM 893 O ASP A 436 -8.041 -9.295 7.405 1.00 0.00 O ATOM 894 CB ASP A 436 -5.675 -10.727 6.956 1.00 0.00 C ATOM 895 CG ASP A 436 -5.014 -9.814 7.966 1.00 0.00 C ATOM 896 OD1 ASP A 436 -4.738 -10.281 9.094 1.00 0.00 O ATOM 897 OD2 ASP A 436 -4.770 -8.637 7.638 1.00 0.00 O ATOM 0 H ASP A 436 -8.301 -11.910 6.045 1.00 0.00 H new ATOM 0 HA ASP A 436 -6.620 -12.023 8.387 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -4.961 -11.482 6.627 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -5.957 -10.150 6.075 1.00 0.00 H new ATOM 1036 N GLU B 7 5.911 -6.173 -12.689 1.00 0.00 N ATOM 1037 CA GLU B 7 4.913 -5.124 -12.740 1.00 0.00 C ATOM 1038 C GLU B 7 5.382 -3.881 -11.996 1.00 0.00 C ATOM 1039 O GLU B 7 4.916 -3.620 -10.894 1.00 0.00 O ATOM 1040 CB GLU B 7 3.589 -5.592 -12.112 1.00 0.00 C ATOM 1041 CG GLU B 7 3.040 -6.890 -12.678 1.00 0.00 C ATOM 1042 CD GLU B 7 2.067 -7.582 -11.729 1.00 0.00 C ATOM 1043 OE1 GLU B 7 1.211 -6.892 -11.124 1.00 0.00 O ATOM 1044 OE2 GLU B 7 2.157 -8.820 -11.574 1.00 0.00 O ATOM 0 HA GLU B 7 4.759 -4.885 -13.792 1.00 0.00 H new ATOM 0 HB2 GLU B 7 3.735 -5.713 -11.039 1.00 0.00 H new ATOM 0 HB3 GLU B 7 2.843 -4.809 -12.246 1.00 0.00 H new ATOM 0 HG2 GLU B 7 2.536 -6.685 -13.622 1.00 0.00 H new ATOM 0 HG3 GLU B 7 3.868 -7.564 -12.898 1.00 0.00 H new ATOM 1051 N VAL B 8 6.334 -3.136 -12.547 1.00 0.00 N ATOM 1052 CA VAL B 8 6.740 -1.907 -11.885 1.00 0.00 C ATOM 1053 C VAL B 8 5.584 -0.944 -11.990 1.00 0.00 C ATOM 1054 O VAL B 8 5.251 -0.442 -13.063 1.00 0.00 O ATOM 1055 CB VAL B 8 8.022 -1.284 -12.432 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.132 0.162 -11.965 1.00 0.00 C ATOM 1057 CG2 VAL B 8 9.198 -2.086 -11.930 1.00 0.00 C ATOM 0 H VAL B 8 6.822 -3.351 -13.417 1.00 0.00 H new ATOM 0 HA VAL B 8 6.982 -2.143 -10.849 1.00 0.00 H new ATOM 0 HB VAL B 8 8.009 -1.295 -13.522 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.048 0.602 -12.358 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.273 0.728 -12.327 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.153 0.192 -10.876 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.123 -1.654 -12.312 1.00 0.00 H new ATOM 0 HG22 VAL B 8 9.212 -2.068 -10.840 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.110 -3.116 -12.275 1.00 0.00 H new ATOM 1067 N LEU B 9 4.973 -0.728 -10.861 1.00 0.00 N ATOM 1068 CA LEU B 9 3.793 0.087 -10.763 1.00 0.00 C ATOM 1069 C LEU B 9 4.103 1.564 -10.718 1.00 0.00 C ATOM 1070 O LEU B 9 3.641 2.330 -11.561 1.00 0.00 O ATOM 1071 CB LEU B 9 3.024 -0.336 -9.514 1.00 0.00 C ATOM 1072 CG LEU B 9 3.192 -1.815 -9.162 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.095 -2.054 -7.673 1.00 0.00 C ATOM 1074 CD2 LEU B 9 2.168 -2.651 -9.892 1.00 0.00 C ATOM 0 H LEU B 9 5.283 -1.117 -9.970 1.00 0.00 H new ATOM 0 HA LEU B 9 3.192 -0.067 -11.659 1.00 0.00 H new ATOM 0 HB2 LEU B 9 3.356 0.269 -8.671 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.965 -0.124 -9.661 1.00 0.00 H new ATOM 0 HG LEU B 9 4.191 -2.114 -9.481 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.220 -3.117 -7.466 1.00 0.00 H new ATOM 0 HD12 LEU B 9 3.876 -1.491 -7.162 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.119 -1.727 -7.315 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.302 -3.701 -9.630 1.00 0.00 H new ATOM 0 HD22 LEU B 9 1.166 -2.331 -9.606 1.00 0.00 H new ATOM 0 HD23 LEU B 9 2.296 -2.526 -10.967 1.00 0.00 H new ATOM 1086 N LEU B 10 4.881 1.971 -9.741 1.00 0.00 N ATOM 1087 CA LEU B 10 5.180 3.377 -9.602 1.00 0.00 C ATOM 1088 C LEU B 10 6.596 3.652 -9.121 1.00 0.00 C ATOM 1089 O LEU B 10 7.052 3.101 -8.118 1.00 0.00 O ATOM 1090 CB LEU B 10 4.184 3.985 -8.633 1.00 0.00 C ATOM 1091 CG LEU B 10 3.988 5.491 -8.742 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.227 5.846 -10.011 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.258 6.003 -7.513 1.00 0.00 C ATOM 0 H LEU B 10 5.310 1.363 -9.044 1.00 0.00 H new ATOM 0 HA LEU B 10 5.102 3.828 -10.591 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.219 3.500 -8.782 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.505 3.752 -7.618 1.00 0.00 H new ATOM 0 HG LEU B 10 4.965 5.971 -8.796 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.099 6.927 -10.068 1.00 0.00 H new ATOM 0 HD12 LEU B 10 3.787 5.501 -10.880 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.249 5.365 -9.995 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.120 7.081 -7.595 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.285 5.517 -7.439 1.00 0.00 H new ATOM 0 HD23 LEU B 10 3.844 5.779 -6.622 1.00 0.00 H new ATOM 1105 N ILE B 11 7.281 4.493 -9.874 1.00 0.00 N ATOM 1106 CA ILE B 11 8.621 4.937 -9.542 1.00 0.00 C ATOM 1107 C ILE B 11 8.544 6.375 -9.052 1.00 0.00 C ATOM 1108 O ILE B 11 8.384 7.297 -9.855 1.00 0.00 O ATOM 1109 CB ILE B 11 9.557 4.888 -10.765 1.00 0.00 C ATOM 1110 CG1 ILE B 11 9.721 3.450 -11.255 1.00 0.00 C ATOM 1111 CG2 ILE B 11 10.907 5.507 -10.428 1.00 0.00 C ATOM 1112 CD1 ILE B 11 10.414 3.345 -12.595 1.00 0.00 C ATOM 0 H ILE B 11 6.919 4.890 -10.741 1.00 0.00 H new ATOM 0 HA ILE B 11 9.022 4.273 -8.776 1.00 0.00 H new ATOM 0 HB ILE B 11 9.109 5.471 -11.570 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.289 2.885 -10.516 1.00 0.00 H new ATOM 0 HG13 ILE B 11 8.738 2.984 -11.326 1.00 0.00 H new ATOM 0 HG21 ILE B 11 11.556 5.464 -11.303 1.00 0.00 H new ATOM 0 HG22 ILE B 11 10.767 6.546 -10.131 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.366 4.954 -9.608 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.496 2.296 -12.881 1.00 0.00 H new ATOM 0 HD12 ILE B 11 9.835 3.882 -13.347 1.00 0.00 H new ATOM 0 HD13 ILE B 11 11.410 3.781 -12.524 1.00 0.00 H new ATOM 1124 N VAL B 12 8.629 6.582 -7.752 1.00 0.00 N ATOM 1125 CA VAL B 12 8.540 7.923 -7.221 1.00 0.00 C ATOM 1126 C VAL B 12 9.903 8.429 -6.802 1.00 0.00 C ATOM 1127 O VAL B 12 10.657 7.717 -6.156 1.00 0.00 O ATOM 1128 CB VAL B 12 7.595 7.988 -6.011 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.145 9.416 -5.764 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.403 7.071 -6.210 1.00 0.00 C ATOM 0 H VAL B 12 8.758 5.849 -7.055 1.00 0.00 H new ATOM 0 HA VAL B 12 8.143 8.553 -8.017 1.00 0.00 H new ATOM 0 HB VAL B 12 8.139 7.645 -5.131 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.476 9.443 -4.904 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.015 10.043 -5.568 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.620 9.789 -6.643 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.747 7.133 -5.341 1.00 0.00 H new ATOM 0 HG22 VAL B 12 5.854 7.376 -7.101 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.750 6.045 -6.330 1.00 0.00 H new ATOM 1140 N LYS B 13 10.221 9.649 -7.189 1.00 0.00 N ATOM 1141 CA LYS B 13 11.486 10.255 -6.817 1.00 0.00 C ATOM 1142 C LYS B 13 11.248 11.294 -5.739 1.00 0.00 C ATOM 1143 O LYS B 13 10.102 11.619 -5.430 1.00 0.00 O ATOM 1144 CB LYS B 13 12.209 10.883 -8.006 1.00 0.00 C ATOM 1145 CG LYS B 13 12.175 10.049 -9.269 1.00 0.00 C ATOM 1146 CD LYS B 13 12.778 8.661 -9.079 1.00 0.00 C ATOM 1147 CE LYS B 13 14.175 8.709 -8.473 1.00 0.00 C ATOM 1148 NZ LYS B 13 15.168 9.355 -9.372 1.00 0.00 N ATOM 0 H LYS B 13 9.620 10.241 -7.762 1.00 0.00 H new ATOM 0 HA LYS B 13 12.133 9.463 -6.439 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.763 11.855 -8.215 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.248 11.062 -7.731 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.143 9.949 -9.605 1.00 0.00 H new ATOM 0 HG3 LYS B 13 12.717 10.571 -10.058 1.00 0.00 H new ATOM 0 HD2 LYS B 13 12.126 8.071 -8.435 1.00 0.00 H new ATOM 0 HD3 LYS B 13 12.821 8.152 -10.042 1.00 0.00 H new ATOM 0 HE2 LYS B 13 14.139 9.252 -7.529 1.00 0.00 H new ATOM 0 HE3 LYS B 13 14.503 7.695 -8.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.109 8.945 -9.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 14.895 9.195 -10.363 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 15.196 10.377 -9.181 1.00 0.00 H new ATOM 1162 N LYS B 14 12.336 11.794 -5.168 1.00 0.00 N ATOM 1163 CA LYS B 14 12.287 12.767 -4.085 1.00 0.00 C ATOM 1164 C LYS B 14 11.642 12.161 -2.845 1.00 0.00 C ATOM 1165 O LYS B 14 11.229 12.874 -1.927 1.00 0.00 O ATOM 1166 CB LYS B 14 11.545 14.014 -4.534 1.00 0.00 C ATOM 1167 CG LYS B 14 12.443 15.081 -5.137 1.00 0.00 C ATOM 1168 CD LYS B 14 11.794 16.453 -5.056 1.00 0.00 C ATOM 1169 CE LYS B 14 12.717 17.469 -4.400 1.00 0.00 C ATOM 1170 NZ LYS B 14 11.958 18.572 -3.758 1.00 0.00 N ATOM 0 H LYS B 14 13.283 11.534 -5.445 1.00 0.00 H new ATOM 0 HA LYS B 14 13.306 13.051 -3.824 1.00 0.00 H new ATOM 0 HB2 LYS B 14 10.790 13.731 -5.268 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.017 14.438 -3.680 1.00 0.00 H new ATOM 0 HG2 LYS B 14 13.398 15.096 -4.612 1.00 0.00 H new ATOM 0 HG3 LYS B 14 12.655 14.837 -6.178 1.00 0.00 H new ATOM 0 HD2 LYS B 14 11.532 16.792 -6.058 1.00 0.00 H new ATOM 0 HD3 LYS B 14 10.865 16.384 -4.489 1.00 0.00 H new ATOM 0 HE2 LYS B 14 13.334 16.970 -3.653 1.00 0.00 H new ATOM 0 HE3 LYS B 14 13.394 17.881 -5.148 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 12.619 19.310 -3.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 11.288 18.977 -4.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 11.434 18.202 -2.939 1.00 0.00 H new ATOM 1184 N VAL B 15 11.556 10.838 -2.835 1.00 0.00 N ATOM 1185 CA VAL B 15 10.988 10.113 -1.710 1.00 0.00 C ATOM 1186 C VAL B 15 12.037 9.983 -0.614 1.00 0.00 C ATOM 1187 O VAL B 15 12.992 9.226 -0.748 1.00 0.00 O ATOM 1188 CB VAL B 15 10.489 8.713 -2.134 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.707 8.046 -1.021 1.00 0.00 C ATOM 1190 CG2 VAL B 15 9.629 8.814 -3.373 1.00 0.00 C ATOM 0 H VAL B 15 11.875 10.243 -3.599 1.00 0.00 H new ATOM 0 HA VAL B 15 10.129 10.672 -1.338 1.00 0.00 H new ATOM 0 HB VAL B 15 11.365 8.101 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.370 7.063 -1.351 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.345 7.935 -0.144 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.843 8.659 -0.766 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.285 7.820 -3.659 1.00 0.00 H new ATOM 0 HG22 VAL B 15 8.768 9.451 -3.168 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.213 9.244 -4.187 1.00 0.00 H new ATOM 1200 N ARG B 16 11.864 10.733 0.459 1.00 0.00 N ATOM 1201 CA ARG B 16 12.808 10.728 1.558 1.00 0.00 C ATOM 1202 C ARG B 16 12.412 9.727 2.631 1.00 0.00 C ATOM 1203 O ARG B 16 11.239 9.568 2.950 1.00 0.00 O ATOM 1204 CB ARG B 16 12.907 12.130 2.166 1.00 0.00 C ATOM 1205 CG ARG B 16 13.293 13.199 1.157 1.00 0.00 C ATOM 1206 CD ARG B 16 13.221 14.597 1.750 1.00 0.00 C ATOM 1207 NE ARG B 16 14.023 14.729 2.967 1.00 0.00 N ATOM 1208 CZ ARG B 16 15.308 15.087 2.989 1.00 0.00 C ATOM 1209 NH1 ARG B 16 15.968 15.289 1.856 1.00 0.00 N ATOM 1210 NH2 ARG B 16 15.934 15.225 4.149 1.00 0.00 N ATOM 0 H ARG B 16 11.070 11.359 0.592 1.00 0.00 H new ATOM 0 HA ARG B 16 13.779 10.430 1.163 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.948 12.392 2.614 1.00 0.00 H new ATOM 0 HB3 ARG B 16 13.642 12.118 2.971 1.00 0.00 H new ATOM 0 HG2 ARG B 16 14.305 13.010 0.798 1.00 0.00 H new ATOM 0 HG3 ARG B 16 12.631 13.137 0.293 1.00 0.00 H new ATOM 0 HD2 ARG B 16 13.565 15.320 1.011 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.182 14.840 1.974 1.00 0.00 H new ATOM 0 HE ARG B 16 13.569 14.534 3.859 1.00 0.00 H new ATOM 0 HH11 ARG B 16 15.493 15.171 0.961 1.00 0.00 H new ATOM 0 HH12 ARG B 16 16.950 15.563 1.880 1.00 0.00 H new ATOM 0 HH21 ARG B 16 15.433 15.058 5.022 1.00 0.00 H new ATOM 0 HH22 ARG B 16 16.916 15.499 4.169 1.00 0.00 H new ATOM 1224 N GLN B 17 13.402 9.036 3.157 1.00 0.00 N ATOM 1225 CA GLN B 17 13.196 8.071 4.222 1.00 0.00 C ATOM 1226 C GLN B 17 14.299 8.260 5.245 1.00 0.00 C ATOM 1227 O GLN B 17 15.456 7.954 4.966 1.00 0.00 O ATOM 1228 CB GLN B 17 13.207 6.638 3.680 1.00 0.00 C ATOM 1229 CG GLN B 17 12.496 5.634 4.580 1.00 0.00 C ATOM 1230 CD GLN B 17 13.336 5.175 5.760 1.00 0.00 C ATOM 1231 OE1 GLN B 17 14.645 5.095 5.567 1.00 0.00 O flip ATOM 1232 NE2 GLN B 17 12.815 4.888 6.833 1.00 0.00 N flip ATOM 0 H GLN B 17 14.373 9.126 2.859 1.00 0.00 H new ATOM 0 HA GLN B 17 12.221 8.233 4.681 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.736 6.628 2.697 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.240 6.320 3.542 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.574 6.081 4.953 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.211 4.765 3.987 1.00 0.00 H new ATOM 0 HE21 GLN B 17 11.804 4.962 6.945 1.00 0.00 H new ATOM 0 HE22 GLN B 17 13.393 4.576 7.613 1.00 0.00 H new ATOM 1241 N LYS B 18 13.938 8.792 6.409 1.00 0.00 N ATOM 1242 CA LYS B 18 14.902 9.054 7.473 1.00 0.00 C ATOM 1243 C LYS B 18 15.993 9.993 6.966 1.00 0.00 C ATOM 1244 O LYS B 18 17.157 9.606 6.872 1.00 0.00 O ATOM 1245 CB LYS B 18 15.525 7.751 7.985 1.00 0.00 C ATOM 1246 CG LYS B 18 15.789 7.749 9.480 1.00 0.00 C ATOM 1247 CD LYS B 18 16.560 6.510 9.905 1.00 0.00 C ATOM 1248 CE LYS B 18 16.141 6.033 11.289 1.00 0.00 C ATOM 1249 NZ LYS B 18 16.257 7.096 12.314 1.00 0.00 N ATOM 0 H LYS B 18 12.979 9.051 6.640 1.00 0.00 H new ATOM 0 HA LYS B 18 14.376 9.527 8.302 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.862 6.921 7.741 1.00 0.00 H new ATOM 0 HB3 LYS B 18 16.463 7.575 7.459 1.00 0.00 H new ATOM 0 HG2 LYS B 18 16.352 8.641 9.753 1.00 0.00 H new ATOM 0 HG3 LYS B 18 14.842 7.793 10.018 1.00 0.00 H new ATOM 0 HD2 LYS B 18 16.396 5.713 9.180 1.00 0.00 H new ATOM 0 HD3 LYS B 18 17.628 6.728 9.903 1.00 0.00 H new ATOM 0 HE2 LYS B 18 15.111 5.680 11.252 1.00 0.00 H new ATOM 0 HE3 LYS B 18 16.759 5.183 11.580 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 16.142 6.680 13.260 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 17.192 7.545 12.244 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 15.518 7.811 12.158 1.00 0.00 H new ATOM 1263 N LYS B 19 15.581 11.217 6.625 1.00 0.00 N ATOM 1264 CA LYS B 19 16.470 12.270 6.107 1.00 0.00 C ATOM 1265 C LYS B 19 17.345 11.782 4.946 1.00 0.00 C ATOM 1266 O LYS B 19 18.495 12.199 4.800 1.00 0.00 O ATOM 1267 CB LYS B 19 17.323 12.912 7.227 1.00 0.00 C ATOM 1268 CG LYS B 19 18.366 12.002 7.865 1.00 0.00 C ATOM 1269 CD LYS B 19 18.022 11.697 9.314 1.00 0.00 C ATOM 1270 CE LYS B 19 18.743 10.454 9.815 1.00 0.00 C ATOM 1271 NZ LYS B 19 20.219 10.636 9.853 1.00 0.00 N ATOM 0 H LYS B 19 14.608 11.512 6.701 1.00 0.00 H new ATOM 0 HA LYS B 19 15.819 13.047 5.707 1.00 0.00 H new ATOM 0 HB2 LYS B 19 17.831 13.785 6.817 1.00 0.00 H new ATOM 0 HB3 LYS B 19 16.653 13.271 8.009 1.00 0.00 H new ATOM 0 HG2 LYS B 19 18.433 11.071 7.301 1.00 0.00 H new ATOM 0 HG3 LYS B 19 19.346 12.477 7.814 1.00 0.00 H new ATOM 0 HD2 LYS B 19 18.290 12.549 9.939 1.00 0.00 H new ATOM 0 HD3 LYS B 19 16.945 11.557 9.411 1.00 0.00 H new ATOM 0 HE2 LYS B 19 18.384 10.206 10.814 1.00 0.00 H new ATOM 0 HE3 LYS B 19 18.499 9.610 9.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 20.667 9.764 10.200 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 20.567 10.847 8.896 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 20.455 11.424 10.489 1.00 0.00 H new ATOM 1285 N GLN B 20 16.782 10.914 4.107 1.00 0.00 N ATOM 1286 CA GLN B 20 17.486 10.386 2.947 1.00 0.00 C ATOM 1287 C GLN B 20 16.568 10.472 1.742 1.00 0.00 C ATOM 1288 O GLN B 20 15.587 9.737 1.661 1.00 0.00 O ATOM 1289 CB GLN B 20 17.903 8.926 3.169 1.00 0.00 C ATOM 1290 CG GLN B 20 18.910 8.725 4.289 1.00 0.00 C ATOM 1291 CD GLN B 20 20.298 9.213 3.929 1.00 0.00 C ATOM 1292 OE1 GLN B 20 21.124 8.457 3.423 1.00 0.00 O ATOM 1293 NE2 GLN B 20 20.562 10.482 4.181 1.00 0.00 N ATOM 0 H GLN B 20 15.831 10.561 4.214 1.00 0.00 H new ATOM 0 HA GLN B 20 18.389 10.974 2.784 1.00 0.00 H new ATOM 0 HB2 GLN B 20 17.013 8.336 3.387 1.00 0.00 H new ATOM 0 HB3 GLN B 20 18.325 8.536 2.243 1.00 0.00 H new ATOM 0 HG2 GLN B 20 18.565 9.251 5.179 1.00 0.00 H new ATOM 0 HG3 GLN B 20 18.957 7.666 4.542 1.00 0.00 H new ATOM 0 HE21 GLN B 20 19.849 11.077 4.602 1.00 0.00 H new ATOM 0 HE22 GLN B 20 21.479 10.867 3.954 1.00 0.00 H new ATOM 1302 N ASP B 21 16.858 11.376 0.825 1.00 0.00 N ATOM 1303 CA ASP B 21 16.029 11.543 -0.358 1.00 0.00 C ATOM 1304 C ASP B 21 16.405 10.555 -1.447 1.00 0.00 C ATOM 1305 O ASP B 21 17.538 10.517 -1.925 1.00 0.00 O ATOM 1306 CB ASP B 21 16.069 12.985 -0.894 1.00 0.00 C ATOM 1307 CG ASP B 21 17.368 13.725 -0.614 1.00 0.00 C ATOM 1308 OD1 ASP B 21 18.423 13.077 -0.478 1.00 0.00 O ATOM 1309 OD2 ASP B 21 17.313 14.968 -0.494 1.00 0.00 O ATOM 0 H ASP B 21 17.659 12.005 0.875 1.00 0.00 H new ATOM 0 HA ASP B 21 15.004 11.335 -0.051 1.00 0.00 H new ATOM 0 HB2 ASP B 21 15.902 12.964 -1.971 1.00 0.00 H new ATOM 0 HB3 ASP B 21 15.244 13.546 -0.455 1.00 0.00 H new ATOM 1314 N GLY B 22 15.445 9.726 -1.812 1.00 0.00 N ATOM 1315 CA GLY B 22 15.672 8.750 -2.835 1.00 0.00 C ATOM 1316 C GLY B 22 14.471 8.519 -3.720 1.00 0.00 C ATOM 1317 O GLY B 22 13.917 9.454 -4.304 1.00 0.00 O ATOM 0 H GLY B 22 14.507 9.717 -1.411 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.512 9.069 -3.451 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.958 7.807 -2.370 1.00 0.00 H new ATOM 1321 N ALA B 23 14.051 7.272 -3.789 1.00 0.00 N ATOM 1322 CA ALA B 23 12.951 6.879 -4.630 1.00 0.00 C ATOM 1323 C ALA B 23 12.153 5.751 -4.013 1.00 0.00 C ATOM 1324 O ALA B 23 12.711 4.856 -3.380 1.00 0.00 O ATOM 1325 CB ALA B 23 13.488 6.435 -5.972 1.00 0.00 C ATOM 0 H ALA B 23 14.467 6.505 -3.261 1.00 0.00 H new ATOM 0 HA ALA B 23 12.288 7.736 -4.747 1.00 0.00 H new ATOM 0 HB1 ALA B 23 12.660 6.136 -6.614 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.029 7.258 -6.438 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.163 5.590 -5.833 1.00 0.00 H new ATOM 1331 N LEU B 24 10.851 5.791 -4.218 1.00 0.00 N ATOM 1332 CA LEU B 24 9.970 4.769 -3.704 1.00 0.00 C ATOM 1333 C LEU B 24 9.454 3.970 -4.897 1.00 0.00 C ATOM 1334 O LEU B 24 8.668 4.472 -5.701 1.00 0.00 O ATOM 1335 CB LEU B 24 8.816 5.404 -2.934 1.00 0.00 C ATOM 1336 CG LEU B 24 8.286 4.583 -1.757 1.00 0.00 C ATOM 1337 CD1 LEU B 24 6.838 4.928 -1.472 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.449 3.096 -1.993 1.00 0.00 C ATOM 0 H LEU B 24 10.380 6.528 -4.742 1.00 0.00 H new ATOM 0 HA LEU B 24 10.499 4.113 -3.012 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.141 6.376 -2.561 1.00 0.00 H new ATOM 0 HB3 LEU B 24 7.995 5.587 -3.627 1.00 0.00 H new ATOM 0 HG LEU B 24 8.881 4.841 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.481 4.333 -0.632 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.758 5.987 -1.227 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.233 4.712 -2.352 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.061 2.547 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU B 24 7.898 2.807 -2.888 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.505 2.862 -2.126 1.00 0.00 H new ATOM 1350 N TYR B 25 9.926 2.747 -5.023 1.00 0.00 N ATOM 1351 CA TYR B 25 9.551 1.886 -6.136 1.00 0.00 C ATOM 1352 C TYR B 25 8.501 0.852 -5.759 1.00 0.00 C ATOM 1353 O TYR B 25 8.773 -0.063 -4.981 1.00 0.00 O ATOM 1354 CB TYR B 25 10.775 1.129 -6.644 1.00 0.00 C ATOM 1355 CG TYR B 25 11.608 1.860 -7.658 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.273 3.028 -7.328 1.00 0.00 C ATOM 1357 CD2 TYR B 25 11.748 1.360 -8.944 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.056 3.682 -8.252 1.00 0.00 C ATOM 1359 CE2 TYR B 25 12.525 2.009 -9.877 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.181 3.171 -9.527 1.00 0.00 C ATOM 1361 OH TYR B 25 13.966 3.823 -10.451 1.00 0.00 O ATOM 0 H TYR B 25 10.577 2.320 -4.364 1.00 0.00 H new ATOM 0 HA TYR B 25 9.136 2.543 -6.900 1.00 0.00 H new ATOM 0 HB2 TYR B 25 11.407 0.879 -5.792 1.00 0.00 H new ATOM 0 HB3 TYR B 25 10.443 0.187 -7.082 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.176 3.432 -6.331 1.00 0.00 H new ATOM 0 HD2 TYR B 25 11.240 0.447 -9.218 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.570 4.592 -7.980 1.00 0.00 H new ATOM 0 HE2 TYR B 25 12.620 1.611 -10.876 1.00 0.00 H new ATOM 0 HH TYR B 25 13.948 3.333 -11.299 1.00 0.00 H new ATOM 1371 N LEU B 26 7.308 0.987 -6.310 1.00 0.00 N ATOM 1372 CA LEU B 26 6.276 -0.005 -6.073 1.00 0.00 C ATOM 1373 C LEU B 26 6.384 -1.028 -7.176 1.00 0.00 C ATOM 1374 O LEU B 26 6.073 -0.724 -8.329 1.00 0.00 O ATOM 1375 CB LEU B 26 4.858 0.571 -6.109 1.00 0.00 C ATOM 1376 CG LEU B 26 4.677 1.951 -5.515 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.307 2.496 -5.873 1.00 0.00 C ATOM 1378 CD2 LEU B 26 4.824 1.919 -4.012 1.00 0.00 C ATOM 0 H LEU B 26 7.033 1.761 -6.915 1.00 0.00 H new ATOM 0 HA LEU B 26 6.432 -0.419 -5.077 1.00 0.00 H new ATOM 0 HB2 LEU B 26 4.527 0.600 -7.147 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.196 -0.117 -5.583 1.00 0.00 H new ATOM 0 HG LEU B 26 5.451 2.598 -5.928 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.186 3.489 -5.441 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.212 2.558 -6.957 1.00 0.00 H new ATOM 0 HD13 LEU B 26 2.537 1.833 -5.478 1.00 0.00 H new ATOM 0 HD21 LEU B 26 4.689 2.924 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.071 1.255 -3.587 1.00 0.00 H new ATOM 0 HD23 LEU B 26 5.818 1.555 -3.751 1.00 0.00 H new ATOM 1390 N MET B 27 6.861 -2.210 -6.863 1.00 0.00 N ATOM 1391 CA MET B 27 6.974 -3.228 -7.879 1.00 0.00 C ATOM 1392 C MET B 27 5.875 -4.246 -7.742 1.00 0.00 C ATOM 1393 O MET B 27 5.148 -4.260 -6.747 1.00 0.00 O ATOM 1394 CB MET B 27 8.342 -3.913 -7.869 1.00 0.00 C ATOM 1395 CG MET B 27 9.363 -3.250 -8.774 1.00 0.00 C ATOM 1396 SD MET B 27 11.032 -3.319 -8.105 1.00 0.00 S ATOM 1397 CE MET B 27 10.875 -2.143 -6.774 1.00 0.00 C ATOM 0 H MET B 27 7.171 -2.487 -5.932 1.00 0.00 H new ATOM 0 HA MET B 27 6.872 -2.726 -8.841 1.00 0.00 H new ATOM 0 HB2 MET B 27 8.726 -3.923 -6.849 1.00 0.00 H new ATOM 0 HB3 MET B 27 8.220 -4.952 -8.174 1.00 0.00 H new ATOM 0 HG2 MET B 27 9.347 -3.735 -9.750 1.00 0.00 H new ATOM 0 HG3 MET B 27 9.082 -2.209 -8.931 1.00 0.00 H new ATOM 0 HE1 MET B 27 11.713 -1.446 -6.803 1.00 0.00 H new ATOM 0 HE2 MET B 27 9.941 -1.592 -6.884 1.00 0.00 H new ATOM 0 HE3 MET B 27 10.875 -2.671 -5.820 1.00 0.00 H new ATOM 1407 N ALA B 28 5.845 -5.137 -8.715 1.00 0.00 N ATOM 1408 CA ALA B 28 4.818 -6.150 -8.851 1.00 0.00 C ATOM 1409 C ALA B 28 4.342 -6.750 -7.540 1.00 0.00 C ATOM 1410 O ALA B 28 3.153 -6.722 -7.224 1.00 0.00 O ATOM 1411 CB ALA B 28 5.345 -7.273 -9.706 1.00 0.00 C ATOM 0 H ALA B 28 6.551 -5.177 -9.450 1.00 0.00 H new ATOM 0 HA ALA B 28 3.963 -5.643 -9.298 1.00 0.00 H new ATOM 0 HB1 ALA B 28 4.578 -8.040 -9.813 1.00 0.00 H new ATOM 0 HB2 ALA B 28 5.612 -6.887 -10.690 1.00 0.00 H new ATOM 0 HB3 ALA B 28 6.227 -7.706 -9.235 1.00 0.00 H new ATOM 1417 N GLU B 29 5.279 -7.279 -6.784 1.00 0.00 N ATOM 1418 CA GLU B 29 4.977 -7.928 -5.529 1.00 0.00 C ATOM 1419 C GLU B 29 5.877 -7.420 -4.420 1.00 0.00 C ATOM 1420 O GLU B 29 5.843 -7.931 -3.295 1.00 0.00 O ATOM 1421 CB GLU B 29 5.165 -9.443 -5.690 1.00 0.00 C ATOM 1422 CG GLU B 29 6.611 -9.882 -5.922 1.00 0.00 C ATOM 1423 CD GLU B 29 7.211 -9.357 -7.212 1.00 0.00 C ATOM 1424 OE1 GLU B 29 7.717 -8.209 -7.208 1.00 0.00 O ATOM 1425 OE2 GLU B 29 7.180 -10.081 -8.220 1.00 0.00 O ATOM 0 H GLU B 29 6.271 -7.271 -7.023 1.00 0.00 H new ATOM 0 HA GLU B 29 3.945 -7.702 -5.259 1.00 0.00 H new ATOM 0 HB2 GLU B 29 4.787 -9.940 -4.797 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.556 -9.785 -6.527 1.00 0.00 H new ATOM 0 HG2 GLU B 29 7.222 -9.545 -5.085 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.653 -10.971 -5.929 1.00 0.00 H new ATOM 1432 N ARG B 30 6.644 -6.384 -4.705 1.00 0.00 N ATOM 1433 CA ARG B 30 7.568 -5.876 -3.716 1.00 0.00 C ATOM 1434 C ARG B 30 7.708 -4.364 -3.796 1.00 0.00 C ATOM 1435 O ARG B 30 7.847 -3.792 -4.870 1.00 0.00 O ATOM 1436 CB ARG B 30 8.942 -6.546 -3.886 1.00 0.00 C ATOM 1437 CG ARG B 30 9.689 -6.126 -5.147 1.00 0.00 C ATOM 1438 CD ARG B 30 10.263 -7.320 -5.893 1.00 0.00 C ATOM 1439 NE ARG B 30 11.189 -6.906 -6.947 1.00 0.00 N ATOM 1440 CZ ARG B 30 10.878 -6.850 -8.247 1.00 0.00 C ATOM 1441 NH1 ARG B 30 9.683 -7.232 -8.680 1.00 0.00 N ATOM 1442 NH2 ARG B 30 11.778 -6.420 -9.120 1.00 0.00 N ATOM 0 H ARG B 30 6.645 -5.888 -5.596 1.00 0.00 H new ATOM 0 HA ARG B 30 7.166 -6.117 -2.732 1.00 0.00 H new ATOM 0 HB2 ARG B 30 9.558 -6.313 -3.017 1.00 0.00 H new ATOM 0 HB3 ARG B 30 8.807 -7.628 -3.900 1.00 0.00 H new ATOM 0 HG2 ARG B 30 9.013 -5.579 -5.804 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.496 -5.443 -4.880 1.00 0.00 H new ATOM 0 HD2 ARG B 30 10.780 -7.974 -5.190 1.00 0.00 H new ATOM 0 HD3 ARG B 30 9.451 -7.901 -6.330 1.00 0.00 H new ATOM 0 HE ARG B 30 12.135 -6.642 -6.672 1.00 0.00 H new ATOM 0 HH11 ARG B 30 8.986 -7.574 -8.018 1.00 0.00 H new ATOM 0 HH12 ARG B 30 9.461 -7.183 -9.674 1.00 0.00 H new ATOM 0 HH21 ARG B 30 12.703 -6.134 -8.800 1.00 0.00 H new ATOM 0 HH22 ARG B 30 11.546 -6.376 -10.112 1.00 0.00 H new ATOM 1456 N ILE B 31 7.647 -3.724 -2.651 1.00 0.00 N ATOM 1457 CA ILE B 31 7.811 -2.291 -2.574 1.00 0.00 C ATOM 1458 C ILE B 31 9.218 -2.015 -2.068 1.00 0.00 C ATOM 1459 O ILE B 31 9.575 -2.390 -0.949 1.00 0.00 O ATOM 1460 CB ILE B 31 6.750 -1.628 -1.663 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.143 -0.183 -1.346 1.00 0.00 C ATOM 1462 CG2 ILE B 31 6.550 -2.432 -0.385 1.00 0.00 C ATOM 1463 CD1 ILE B 31 5.993 0.664 -0.854 1.00 0.00 C ATOM 0 H ILE B 31 7.483 -4.178 -1.753 1.00 0.00 H new ATOM 0 HA ILE B 31 7.667 -1.856 -3.563 1.00 0.00 H new ATOM 0 HB ILE B 31 5.801 -1.614 -2.199 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.929 -0.187 -0.591 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.563 0.275 -2.241 1.00 0.00 H new ATOM 0 HG21 ILE B 31 5.800 -1.945 0.238 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.215 -3.438 -0.637 1.00 0.00 H new ATOM 0 HG23 ILE B 31 7.492 -2.489 0.160 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.347 1.675 -0.650 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.215 0.699 -1.616 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.587 0.230 0.060 1.00 0.00 H new ATOM 1475 N ALA B 32 10.033 -1.404 -2.905 1.00 0.00 N ATOM 1476 CA ALA B 32 11.409 -1.141 -2.537 1.00 0.00 C ATOM 1477 C ALA B 32 11.791 0.320 -2.712 1.00 0.00 C ATOM 1478 O ALA B 32 11.506 0.937 -3.730 1.00 0.00 O ATOM 1479 CB ALA B 32 12.340 -2.035 -3.336 1.00 0.00 C ATOM 0 H ALA B 32 9.769 -1.083 -3.836 1.00 0.00 H new ATOM 0 HA ALA B 32 11.510 -1.367 -1.475 1.00 0.00 H new ATOM 0 HB1 ALA B 32 13.373 -1.831 -3.053 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.107 -3.080 -3.130 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.210 -1.838 -4.400 1.00 0.00 H new ATOM 1485 N TRP B 33 12.437 0.854 -1.699 1.00 0.00 N ATOM 1486 CA TRP B 33 12.890 2.227 -1.699 1.00 0.00 C ATOM 1487 C TRP B 33 14.413 2.259 -1.720 1.00 0.00 C ATOM 1488 O TRP B 33 15.067 1.390 -1.135 1.00 0.00 O ATOM 1489 CB TRP B 33 12.350 2.931 -0.441 1.00 0.00 C ATOM 1490 CG TRP B 33 12.810 4.357 -0.248 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.063 5.488 -0.401 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.113 4.801 0.152 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.828 6.599 -0.126 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.086 6.200 0.213 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.300 4.144 0.454 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.200 6.953 0.572 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.406 4.880 0.801 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.353 6.281 0.860 1.00 0.00 C ATOM 0 H TRP B 33 12.664 0.343 -0.846 1.00 0.00 H new ATOM 0 HA TRP B 33 12.521 2.746 -2.584 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.261 2.921 -0.479 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.644 2.351 0.434 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.024 5.509 -0.695 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.505 7.566 -0.169 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.352 3.066 0.416 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 15.154 8.031 0.621 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.331 4.373 1.032 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.237 6.836 1.137 1.00 0.00 H new ATOM 1509 N ALA B 34 14.967 3.251 -2.397 1.00 0.00 N ATOM 1510 CA ALA B 34 16.409 3.441 -2.467 1.00 0.00 C ATOM 1511 C ALA B 34 16.705 4.919 -2.641 1.00 0.00 C ATOM 1512 O ALA B 34 15.910 5.624 -3.239 1.00 0.00 O ATOM 1513 CB ALA B 34 17.007 2.647 -3.599 1.00 0.00 C ATOM 0 H ALA B 34 14.431 3.948 -2.914 1.00 0.00 H new ATOM 0 HA ALA B 34 16.860 3.083 -1.541 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.085 2.808 -3.627 1.00 0.00 H new ATOM 0 HB2 ALA B 34 16.802 1.587 -3.448 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.567 2.970 -4.542 1.00 0.00 H new ATOM 1519 N PRO B 35 17.830 5.418 -2.113 1.00 0.00 N ATOM 1520 CA PRO B 35 18.174 6.835 -2.227 1.00 0.00 C ATOM 1521 C PRO B 35 18.504 7.229 -3.668 1.00 0.00 C ATOM 1522 O PRO B 35 18.733 6.367 -4.522 1.00 0.00 O ATOM 1523 CB PRO B 35 19.397 6.994 -1.319 1.00 0.00 C ATOM 1524 CG PRO B 35 19.971 5.623 -1.172 1.00 0.00 C ATOM 1525 CD PRO B 35 18.849 4.647 -1.386 1.00 0.00 C ATOM 0 HA PRO B 35 17.345 7.481 -1.939 1.00 0.00 H new ATOM 0 HB2 PRO B 35 20.124 7.678 -1.757 1.00 0.00 H new ATOM 0 HB3 PRO B 35 19.115 7.406 -0.350 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.767 5.459 -1.898 1.00 0.00 H new ATOM 0 HG3 PRO B 35 20.410 5.494 -0.183 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.179 3.782 -1.961 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.463 4.271 -0.439 1.00 0.00 H new ATOM 1533 N GLU B 36 18.519 8.531 -3.934 1.00 0.00 N ATOM 1534 CA GLU B 36 18.798 9.031 -5.272 1.00 0.00 C ATOM 1535 C GLU B 36 20.209 8.653 -5.711 1.00 0.00 C ATOM 1536 O GLU B 36 21.171 8.790 -4.951 1.00 0.00 O ATOM 1537 CB GLU B 36 18.608 10.548 -5.326 1.00 0.00 C ATOM 1538 CG GLU B 36 18.474 11.096 -6.741 1.00 0.00 C ATOM 1539 CD GLU B 36 17.337 10.455 -7.515 1.00 0.00 C ATOM 1540 OE1 GLU B 36 17.553 9.391 -8.140 1.00 0.00 O ATOM 1541 OE2 GLU B 36 16.219 11.011 -7.518 1.00 0.00 O ATOM 0 H GLU B 36 18.341 9.257 -3.240 1.00 0.00 H new ATOM 0 HA GLU B 36 18.093 8.568 -5.962 1.00 0.00 H new ATOM 0 HB2 GLU B 36 17.718 10.815 -4.756 1.00 0.00 H new ATOM 0 HB3 GLU B 36 19.455 11.029 -4.838 1.00 0.00 H new ATOM 0 HG2 GLU B 36 18.314 12.173 -6.695 1.00 0.00 H new ATOM 0 HG3 GLU B 36 19.409 10.935 -7.278 1.00 0.00 H new ATOM 1548 N GLY B 37 20.314 8.158 -6.935 1.00 0.00 N ATOM 1549 CA GLY B 37 21.600 7.760 -7.468 1.00 0.00 C ATOM 1550 C GLY B 37 22.053 6.410 -6.945 1.00 0.00 C ATOM 1551 O GLY B 37 23.247 6.092 -6.960 1.00 0.00 O ATOM 0 H GLY B 37 19.528 8.024 -7.571 1.00 0.00 H new ATOM 0 HA2 GLY B 37 21.543 7.724 -8.556 1.00 0.00 H new ATOM 0 HA3 GLY B 37 22.345 8.514 -7.212 1.00 0.00 H new ATOM 1555 N LYS B 38 21.115 5.605 -6.475 1.00 0.00 N ATOM 1556 CA LYS B 38 21.458 4.297 -5.956 1.00 0.00 C ATOM 1557 C LYS B 38 20.839 3.186 -6.792 1.00 0.00 C ATOM 1558 O LYS B 38 19.638 3.165 -7.044 1.00 0.00 O ATOM 1559 CB LYS B 38 21.049 4.159 -4.493 1.00 0.00 C ATOM 1560 CG LYS B 38 22.082 3.423 -3.653 1.00 0.00 C ATOM 1561 CD LYS B 38 23.445 4.105 -3.710 1.00 0.00 C ATOM 1562 CE LYS B 38 24.472 3.258 -4.453 1.00 0.00 C ATOM 1563 NZ LYS B 38 24.663 3.699 -5.865 1.00 0.00 N ATOM 0 H LYS B 38 20.121 5.833 -6.443 1.00 0.00 H new ATOM 0 HA LYS B 38 22.542 4.199 -6.017 1.00 0.00 H new ATOM 0 HB2 LYS B 38 20.887 5.151 -4.072 1.00 0.00 H new ATOM 0 HB3 LYS B 38 20.098 3.629 -4.436 1.00 0.00 H new ATOM 0 HG2 LYS B 38 21.742 3.375 -2.618 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.174 2.396 -4.007 1.00 0.00 H new ATOM 0 HD2 LYS B 38 23.347 5.072 -4.203 1.00 0.00 H new ATOM 0 HD3 LYS B 38 23.798 4.298 -2.697 1.00 0.00 H new ATOM 0 HE2 LYS B 38 25.426 3.307 -3.928 1.00 0.00 H new ATOM 0 HE3 LYS B 38 24.155 2.215 -4.441 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 24.164 3.047 -6.503 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 24.282 4.659 -5.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 25.677 3.699 -6.095 1.00 0.00 H new ATOM 1577 N ASP B 39 21.700 2.279 -7.221 1.00 0.00 N ATOM 1578 CA ASP B 39 21.321 1.133 -8.031 1.00 0.00 C ATOM 1579 C ASP B 39 20.758 0.018 -7.158 1.00 0.00 C ATOM 1580 O ASP B 39 19.947 -0.791 -7.604 1.00 0.00 O ATOM 1581 CB ASP B 39 22.556 0.628 -8.785 1.00 0.00 C ATOM 1582 CG ASP B 39 23.774 0.513 -7.880 1.00 0.00 C ATOM 1583 OD1 ASP B 39 24.225 1.556 -7.339 1.00 0.00 O ATOM 1584 OD2 ASP B 39 24.272 -0.613 -7.689 1.00 0.00 O ATOM 0 H ASP B 39 22.698 2.318 -7.013 1.00 0.00 H new ATOM 0 HA ASP B 39 20.549 1.435 -8.738 1.00 0.00 H new ATOM 0 HB2 ASP B 39 22.339 -0.346 -9.224 1.00 0.00 H new ATOM 0 HB3 ASP B 39 22.780 1.306 -9.608 1.00 0.00 H new ATOM 1589 N ARG B 40 21.201 -0.023 -5.910 1.00 0.00 N ATOM 1590 CA ARG B 40 20.744 -1.035 -4.973 1.00 0.00 C ATOM 1591 C ARG B 40 19.716 -0.448 -4.020 1.00 0.00 C ATOM 1592 O ARG B 40 19.907 0.645 -3.485 1.00 0.00 O ATOM 1593 CB ARG B 40 21.923 -1.611 -4.184 1.00 0.00 C ATOM 1594 CG ARG B 40 22.419 -2.954 -4.707 1.00 0.00 C ATOM 1595 CD ARG B 40 22.957 -2.842 -6.124 1.00 0.00 C ATOM 1596 NE ARG B 40 23.525 -4.105 -6.599 1.00 0.00 N ATOM 1597 CZ ARG B 40 24.445 -4.193 -7.561 1.00 0.00 C ATOM 1598 NH1 ARG B 40 24.912 -3.096 -8.145 1.00 0.00 N ATOM 1599 NH2 ARG B 40 24.902 -5.385 -7.937 1.00 0.00 N ATOM 0 H ARG B 40 21.878 0.635 -5.524 1.00 0.00 H new ATOM 0 HA ARG B 40 20.279 -1.841 -5.540 1.00 0.00 H new ATOM 0 HB2 ARG B 40 22.746 -0.897 -4.207 1.00 0.00 H new ATOM 0 HB3 ARG B 40 21.628 -1.725 -3.141 1.00 0.00 H new ATOM 0 HG2 ARG B 40 23.201 -3.334 -4.050 1.00 0.00 H new ATOM 0 HG3 ARG B 40 21.604 -3.677 -4.683 1.00 0.00 H new ATOM 0 HD2 ARG B 40 22.154 -2.532 -6.793 1.00 0.00 H new ATOM 0 HD3 ARG B 40 23.721 -2.065 -6.161 1.00 0.00 H new ATOM 0 HE ARG B 40 23.198 -4.970 -6.168 1.00 0.00 H new ATOM 0 HH11 ARG B 40 24.567 -2.180 -7.859 1.00 0.00 H new ATOM 0 HH12 ARG B 40 25.615 -3.170 -8.880 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.549 -6.231 -7.490 1.00 0.00 H new ATOM 0 HH22 ARG B 40 25.605 -5.453 -8.673 1.00 0.00 H new ATOM 1613 N PHE B 41 18.627 -1.176 -3.821 1.00 0.00 N ATOM 1614 CA PHE B 41 17.563 -0.736 -2.934 1.00 0.00 C ATOM 1615 C PHE B 41 18.008 -0.804 -1.480 1.00 0.00 C ATOM 1616 O PHE B 41 18.849 -1.621 -1.111 1.00 0.00 O ATOM 1617 CB PHE B 41 16.307 -1.582 -3.146 1.00 0.00 C ATOM 1618 CG PHE B 41 15.692 -1.401 -4.505 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.065 -0.212 -4.842 1.00 0.00 C ATOM 1620 CD2 PHE B 41 15.741 -2.418 -5.446 1.00 0.00 C ATOM 1621 CE1 PHE B 41 14.499 -0.040 -6.090 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.176 -2.251 -6.696 1.00 0.00 C ATOM 1623 CZ PHE B 41 14.555 -1.060 -7.018 1.00 0.00 C ATOM 0 H PHE B 41 18.458 -2.079 -4.265 1.00 0.00 H new ATOM 0 HA PHE B 41 17.329 0.302 -3.172 1.00 0.00 H new ATOM 0 HB2 PHE B 41 16.557 -2.633 -3.005 1.00 0.00 H new ATOM 0 HB3 PHE B 41 15.571 -1.325 -2.384 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.018 0.590 -4.120 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.226 -3.351 -5.199 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.013 0.892 -6.339 1.00 0.00 H new ATOM 0 HE2 PHE B 41 15.220 -3.051 -7.420 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.114 -0.927 -7.995 1.00 0.00 H new ATOM 1633 N THR B 42 17.435 0.063 -0.668 1.00 0.00 N ATOM 1634 CA THR B 42 17.767 0.136 0.744 1.00 0.00 C ATOM 1635 C THR B 42 16.683 -0.517 1.599 1.00 0.00 C ATOM 1636 O THR B 42 16.971 -1.164 2.605 1.00 0.00 O ATOM 1637 CB THR B 42 17.949 1.609 1.152 1.00 0.00 C ATOM 1638 OG1 THR B 42 18.998 2.189 0.369 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.276 1.752 2.627 1.00 0.00 C ATOM 0 H THR B 42 16.728 0.735 -0.966 1.00 0.00 H new ATOM 0 HA THR B 42 18.697 -0.407 0.911 1.00 0.00 H new ATOM 0 HB THR B 42 17.008 2.128 0.971 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.441 2.894 0.886 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.396 2.807 2.872 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.465 1.331 3.222 1.00 0.00 H new ATOM 0 HG23 THR B 42 19.202 1.220 2.848 1.00 0.00 H new ATOM 1647 N ILE B 43 15.437 -0.358 1.186 1.00 0.00 N ATOM 1648 CA ILE B 43 14.314 -0.921 1.913 1.00 0.00 C ATOM 1649 C ILE B 43 13.430 -1.729 0.970 1.00 0.00 C ATOM 1650 O ILE B 43 12.945 -1.208 -0.028 1.00 0.00 O ATOM 1651 CB ILE B 43 13.502 0.202 2.603 1.00 0.00 C ATOM 1652 CG1 ILE B 43 14.076 0.481 3.994 1.00 0.00 C ATOM 1653 CG2 ILE B 43 12.018 -0.144 2.695 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.598 1.784 4.594 1.00 0.00 C ATOM 0 H ILE B 43 15.178 0.160 0.346 1.00 0.00 H new ATOM 0 HA ILE B 43 14.693 -1.590 2.686 1.00 0.00 H new ATOM 0 HB ILE B 43 13.587 1.101 1.992 1.00 0.00 H new ATOM 0 HG12 ILE B 43 13.805 -0.338 4.661 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.164 0.496 3.933 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.484 0.670 3.186 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.616 -0.290 1.693 1.00 0.00 H new ATOM 0 HG23 ILE B 43 11.893 -1.060 3.273 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.045 1.916 5.579 1.00 0.00 H new ATOM 0 HD12 ILE B 43 13.892 2.611 3.948 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.512 1.765 4.687 1.00 0.00 H new ATOM 1666 N SER B 44 13.270 -3.011 1.261 1.00 0.00 N ATOM 1667 CA SER B 44 12.450 -3.888 0.438 1.00 0.00 C ATOM 1668 C SER B 44 11.425 -4.631 1.280 1.00 0.00 C ATOM 1669 O SER B 44 11.778 -5.342 2.221 1.00 0.00 O ATOM 1670 CB SER B 44 13.338 -4.875 -0.320 1.00 0.00 C ATOM 1671 OG SER B 44 14.350 -4.190 -1.039 1.00 0.00 O ATOM 0 H SER B 44 13.699 -3.469 2.065 1.00 0.00 H new ATOM 0 HA SER B 44 11.908 -3.274 -0.281 1.00 0.00 H new ATOM 0 HB2 SER B 44 13.793 -5.574 0.381 1.00 0.00 H new ATOM 0 HB3 SER B 44 12.731 -5.463 -1.008 1.00 0.00 H new ATOM 0 HG SER B 44 14.909 -4.839 -1.516 1.00 0.00 H new ATOM 1677 N HIS B 45 10.162 -4.451 0.939 1.00 0.00 N ATOM 1678 CA HIS B 45 9.073 -5.107 1.634 1.00 0.00 C ATOM 1679 C HIS B 45 8.167 -5.744 0.612 1.00 0.00 C ATOM 1680 O HIS B 45 8.013 -5.242 -0.499 1.00 0.00 O ATOM 1681 CB HIS B 45 8.283 -4.121 2.503 1.00 0.00 C ATOM 1682 CG HIS B 45 9.076 -3.550 3.639 1.00 0.00 C ATOM 1683 ND1 HIS B 45 9.534 -4.288 4.706 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.509 -2.285 3.845 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.222 -3.466 5.509 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.239 -2.236 5.030 1.00 0.00 N ATOM 0 H HIS B 45 9.864 -3.847 0.173 1.00 0.00 H new ATOM 0 HA HIS B 45 9.484 -5.866 2.300 1.00 0.00 H new ATOM 0 HB2 HIS B 45 7.924 -3.305 1.876 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.404 -4.626 2.903 1.00 0.00 H new ATOM 0 HD1 HIS B 45 9.377 -5.284 4.858 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.319 -1.445 3.193 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.700 -3.770 6.428 1.00 0.00 H new ATOM 1694 N MET B 46 7.589 -6.853 0.973 1.00 0.00 N ATOM 1695 CA MET B 46 6.707 -7.559 0.079 1.00 0.00 C ATOM 1696 C MET B 46 5.269 -7.318 0.482 1.00 0.00 C ATOM 1697 O MET B 46 4.945 -7.312 1.662 1.00 0.00 O ATOM 1698 CB MET B 46 7.027 -9.049 0.100 1.00 0.00 C ATOM 1699 CG MET B 46 8.161 -9.442 -0.831 1.00 0.00 C ATOM 1700 SD MET B 46 8.002 -11.130 -1.441 1.00 0.00 S ATOM 1701 CE MET B 46 6.560 -10.963 -2.488 1.00 0.00 C ATOM 0 H MET B 46 7.711 -7.293 1.885 1.00 0.00 H new ATOM 0 HA MET B 46 6.852 -7.189 -0.936 1.00 0.00 H new ATOM 0 HB2 MET B 46 7.286 -9.342 1.118 1.00 0.00 H new ATOM 0 HB3 MET B 46 6.132 -9.608 -0.175 1.00 0.00 H new ATOM 0 HG2 MET B 46 8.187 -8.755 -1.677 1.00 0.00 H new ATOM 0 HG3 MET B 46 9.110 -9.337 -0.306 1.00 0.00 H new ATOM 0 HE1 MET B 46 5.820 -11.713 -2.210 1.00 0.00 H new ATOM 0 HE2 MET B 46 6.133 -9.968 -2.363 1.00 0.00 H new ATOM 0 HE3 MET B 46 6.848 -11.106 -3.529 1.00 0.00 H new ATOM 1711 N TYR B 47 4.403 -7.132 -0.503 1.00 0.00 N ATOM 1712 CA TYR B 47 2.980 -6.886 -0.239 1.00 0.00 C ATOM 1713 C TYR B 47 2.355 -8.055 0.535 1.00 0.00 C ATOM 1714 O TYR B 47 1.213 -7.981 0.978 1.00 0.00 O ATOM 1715 CB TYR B 47 2.200 -6.684 -1.544 1.00 0.00 C ATOM 1716 CG TYR B 47 2.557 -5.432 -2.318 1.00 0.00 C ATOM 1717 CD1 TYR B 47 3.827 -5.253 -2.847 1.00 0.00 C ATOM 1718 CD2 TYR B 47 1.614 -4.433 -2.533 1.00 0.00 C ATOM 1719 CE1 TYR B 47 4.151 -4.120 -3.562 1.00 0.00 C ATOM 1720 CE2 TYR B 47 1.930 -3.297 -3.252 1.00 0.00 C ATOM 1721 CZ TYR B 47 3.202 -3.146 -3.763 1.00 0.00 C ATOM 1722 OH TYR B 47 3.524 -2.020 -4.483 1.00 0.00 O ATOM 0 H TYR B 47 4.653 -7.145 -1.492 1.00 0.00 H new ATOM 0 HA TYR B 47 2.919 -5.978 0.361 1.00 0.00 H new ATOM 0 HB2 TYR B 47 2.366 -7.549 -2.186 1.00 0.00 H new ATOM 0 HB3 TYR B 47 1.135 -6.658 -1.313 1.00 0.00 H new ATOM 0 HD1 TYR B 47 4.576 -6.016 -2.696 1.00 0.00 H new ATOM 0 HD2 TYR B 47 0.618 -4.547 -2.131 1.00 0.00 H new ATOM 0 HE1 TYR B 47 5.146 -3.998 -3.963 1.00 0.00 H new ATOM 0 HE2 TYR B 47 1.185 -2.531 -3.413 1.00 0.00 H new ATOM 0 HH TYR B 47 2.743 -1.430 -4.535 1.00 0.00 H new ATOM 1732 N ALA B 48 3.115 -9.137 0.666 1.00 0.00 N ATOM 1733 CA ALA B 48 2.669 -10.324 1.372 1.00 0.00 C ATOM 1734 C ALA B 48 2.898 -10.205 2.878 1.00 0.00 C ATOM 1735 O ALA B 48 2.230 -10.877 3.668 1.00 0.00 O ATOM 1736 CB ALA B 48 3.387 -11.550 0.822 1.00 0.00 C ATOM 0 H ALA B 48 4.058 -9.212 0.284 1.00 0.00 H new ATOM 0 HA ALA B 48 1.596 -10.429 1.212 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.049 -12.439 1.355 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.164 -11.657 -0.240 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.462 -11.433 0.957 1.00 0.00 H new ATOM 1742 N ASP B 49 3.844 -9.362 3.280 1.00 0.00 N ATOM 1743 CA ASP B 49 4.135 -9.178 4.698 1.00 0.00 C ATOM 1744 C ASP B 49 3.555 -7.864 5.194 1.00 0.00 C ATOM 1745 O ASP B 49 3.427 -7.652 6.400 1.00 0.00 O ATOM 1746 CB ASP B 49 5.648 -9.247 4.977 1.00 0.00 C ATOM 1747 CG ASP B 49 6.419 -8.023 4.501 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.440 -7.010 5.229 1.00 0.00 O ATOM 1749 OD2 ASP B 49 7.022 -8.086 3.406 1.00 0.00 O ATOM 0 H ASP B 49 4.418 -8.800 2.651 1.00 0.00 H new ATOM 0 HA ASP B 49 3.663 -9.994 5.244 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.805 -9.369 6.049 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.057 -10.133 4.492 1.00 0.00 H new ATOM 1754 N ILE B 50 3.196 -6.990 4.267 1.00 0.00 N ATOM 1755 CA ILE B 50 2.609 -5.715 4.633 1.00 0.00 C ATOM 1756 C ILE B 50 1.143 -5.909 4.981 1.00 0.00 C ATOM 1757 O ILE B 50 0.377 -6.470 4.199 1.00 0.00 O ATOM 1758 CB ILE B 50 2.725 -4.657 3.521 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.096 -4.721 2.856 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.494 -3.269 4.102 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.211 -3.834 1.641 1.00 0.00 C ATOM 0 H ILE B 50 3.300 -7.140 3.264 1.00 0.00 H new ATOM 0 HA ILE B 50 3.168 -5.347 5.493 1.00 0.00 H new ATOM 0 HB ILE B 50 1.966 -4.863 2.766 1.00 0.00 H new ATOM 0 HG12 ILE B 50 4.858 -4.433 3.581 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.304 -5.751 2.567 1.00 0.00 H new ATOM 0 HG21 ILE B 50 2.577 -2.525 3.310 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.498 -3.220 4.543 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.241 -3.067 4.870 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.210 -3.927 1.216 1.00 0.00 H new ATOM 0 HD12 ILE B 50 3.472 -4.136 0.899 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.034 -2.798 1.929 1.00 0.00 H new ATOM 1773 N LYS B 51 0.764 -5.446 6.154 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.599 -5.571 6.624 1.00 0.00 C ATOM 1775 C LYS B 51 -1.474 -4.477 6.040 1.00 0.00 C ATOM 1776 O LYS B 51 -2.396 -4.736 5.274 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.629 -5.480 8.147 1.00 0.00 C ATOM 1778 CG LYS B 51 -2.034 -5.455 8.713 1.00 0.00 C ATOM 1779 CD LYS B 51 -2.150 -4.495 9.876 1.00 0.00 C ATOM 1780 CE LYS B 51 -3.599 -4.344 10.286 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.781 -3.360 11.387 1.00 0.00 N ATOM 0 H LYS B 51 1.390 -4.974 6.806 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.985 -6.538 6.302 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -0.090 -6.329 8.566 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -0.101 -4.580 8.462 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.737 -5.166 7.931 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.313 -6.457 9.039 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.562 -4.860 10.718 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.740 -3.524 9.598 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.187 -4.031 9.423 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -3.987 -5.313 10.601 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.686 -3.540 11.867 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -3.002 -3.454 12.069 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.783 -2.397 10.995 1.00 0.00 H new ATOM 1795 N CYS B 52 -1.158 -3.253 6.399 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.918 -2.104 5.948 1.00 0.00 C ATOM 1797 C CYS B 52 -0.971 -0.950 5.714 1.00 0.00 C ATOM 1798 O CYS B 52 0.247 -1.122 5.738 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.986 -1.732 6.982 1.00 0.00 C ATOM 1800 SG CYS B 52 -4.370 -2.897 7.058 1.00 0.00 S ATOM 0 H CYS B 52 -0.372 -3.024 7.008 1.00 0.00 H new ATOM 0 HA CYS B 52 -2.428 -2.344 5.015 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.520 -1.672 7.966 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.372 -0.739 6.751 1.00 0.00 H new ATOM 0 HG CYS B 52 -4.609 -3.366 5.869 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.514 0.217 5.483 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.693 1.378 5.240 1.00 0.00 C ATOM 1808 C GLN B 53 -1.135 2.516 6.134 1.00 0.00 C ATOM 1809 O GLN B 53 -2.053 2.367 6.925 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.777 1.799 3.773 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.815 0.636 2.797 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.998 0.721 1.859 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -1.954 1.440 0.867 1.00 0.00 O ATOM 1814 NE2 GLN B 53 -3.067 -0.008 2.162 1.00 0.00 N ATOM 0 H GLN B 53 -2.519 0.390 5.458 1.00 0.00 H new ATOM 0 HA GLN B 53 0.343 1.126 5.467 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.670 2.408 3.631 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.080 2.430 3.537 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.107 0.620 2.216 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.859 -0.301 3.352 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -3.065 -0.594 2.997 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.890 0.019 1.560 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.446 3.626 6.031 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.760 4.818 6.786 1.00 0.00 C ATOM 1825 C LYS B 54 -0.369 6.012 5.937 1.00 0.00 C ATOM 1826 O LYS B 54 0.632 5.961 5.232 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.015 4.833 8.119 1.00 0.00 C ATOM 1828 CG LYS B 54 -0.613 3.922 9.179 1.00 0.00 C ATOM 1829 CD LYS B 54 -1.168 4.723 10.339 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.049 3.976 11.656 1.00 0.00 C ATOM 1831 NZ LYS B 54 0.242 4.267 12.344 1.00 0.00 N ATOM 0 H LYS B 54 0.359 3.730 5.413 1.00 0.00 H new ATOM 0 HA LYS B 54 -1.825 4.848 7.017 1.00 0.00 H new ATOM 0 HB2 LYS B 54 1.021 4.540 7.947 1.00 0.00 H new ATOM 0 HB3 LYS B 54 0.002 5.854 8.501 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -1.406 3.318 8.738 1.00 0.00 H new ATOM 0 HG3 LYS B 54 0.149 3.232 9.541 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -0.637 5.672 10.411 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -2.215 4.958 10.149 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.878 4.253 12.307 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -1.131 2.904 11.475 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 0.331 3.663 13.186 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 1.032 4.075 11.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.265 5.266 12.631 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.161 7.064 5.964 1.00 0.00 N ATOM 1846 CA ILE B 55 -0.867 8.238 5.150 1.00 0.00 C ATOM 1847 C ILE B 55 -1.218 9.525 5.864 1.00 0.00 C ATOM 1848 O ILE B 55 -2.136 9.548 6.673 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.672 8.211 3.834 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.169 8.123 4.130 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.239 7.057 2.955 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.020 7.979 2.894 1.00 0.00 C ATOM 0 H ILE B 55 -2.005 7.136 6.532 1.00 0.00 H new ATOM 0 HA ILE B 55 0.204 8.206 4.951 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.474 9.138 3.296 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.352 7.273 4.788 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.477 9.017 4.671 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.823 7.062 2.034 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.181 7.160 2.714 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.401 6.117 3.482 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.070 7.922 3.180 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.867 8.841 2.244 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.739 7.070 2.363 1.00 0.00 H new ATOM 1864 N SER B 56 -0.475 10.581 5.579 1.00 0.00 N ATOM 1865 CA SER B 56 -0.773 11.879 6.148 1.00 0.00 C ATOM 1866 C SER B 56 -1.862 12.509 5.294 1.00 0.00 C ATOM 1867 O SER B 56 -1.628 12.886 4.145 1.00 0.00 O ATOM 1868 CB SER B 56 0.474 12.756 6.199 1.00 0.00 C ATOM 1869 OG SER B 56 1.047 12.957 4.917 1.00 0.00 O ATOM 0 H SER B 56 0.335 10.563 4.959 1.00 0.00 H new ATOM 0 HA SER B 56 -1.116 11.775 7.177 1.00 0.00 H new ATOM 0 HB2 SER B 56 0.218 13.722 6.635 1.00 0.00 H new ATOM 0 HB3 SER B 56 1.212 12.295 6.856 1.00 0.00 H new ATOM 0 HG SER B 56 1.571 13.785 4.919 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.070 12.610 5.835 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.229 13.113 5.103 1.00 0.00 C ATOM 1877 C PRO B 57 -4.185 14.621 4.805 1.00 0.00 C ATOM 1878 O PRO B 57 -3.147 15.269 4.952 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.407 12.729 6.008 1.00 0.00 C ATOM 1880 CG PRO B 57 -4.830 11.810 7.025 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.425 12.259 7.207 1.00 0.00 C ATOM 0 HA PRO B 57 -4.290 12.683 4.103 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.847 13.609 6.477 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.198 12.241 5.439 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.384 11.863 7.962 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -4.871 10.774 6.688 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -3.347 13.109 7.884 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -2.788 11.471 7.610 1.00 0.00 H new ATOM 1889 N GLU B 58 -5.327 15.159 4.380 1.00 0.00 N ATOM 1890 CA GLU B 58 -5.470 16.572 3.996 1.00 0.00 C ATOM 1891 C GLU B 58 -4.994 17.560 5.066 1.00 0.00 C ATOM 1892 O GLU B 58 -4.610 18.683 4.741 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.930 16.880 3.647 1.00 0.00 C ATOM 1894 CG GLU B 58 -7.535 15.931 2.622 1.00 0.00 C ATOM 1895 CD GLU B 58 -8.212 14.737 3.266 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -7.494 13.824 3.725 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -9.455 14.720 3.324 1.00 0.00 O ATOM 0 H GLU B 58 -6.191 14.625 4.290 1.00 0.00 H new ATOM 0 HA GLU B 58 -4.824 16.708 3.129 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -7.526 16.842 4.559 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -6.995 17.899 3.266 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -8.260 16.472 2.014 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.752 15.582 1.949 1.00 0.00 H new ATOM 1904 N GLY B 59 -5.015 17.157 6.327 1.00 0.00 N ATOM 1905 CA GLY B 59 -4.591 18.054 7.391 1.00 0.00 C ATOM 1906 C GLY B 59 -3.091 18.038 7.613 1.00 0.00 C ATOM 1907 O GLY B 59 -2.598 18.541 8.624 1.00 0.00 O ATOM 0 H GLY B 59 -5.315 16.232 6.635 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -4.907 19.069 7.151 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -5.093 17.774 8.317 1.00 0.00 H new ATOM 1911 N LYS B 60 -2.354 17.494 6.658 1.00 0.00 N ATOM 1912 CA LYS B 60 -0.913 17.401 6.783 1.00 0.00 C ATOM 1913 C LYS B 60 -0.181 18.216 5.729 1.00 0.00 C ATOM 1914 O LYS B 60 -0.569 18.246 4.562 1.00 0.00 O ATOM 1915 CB LYS B 60 -0.481 15.945 6.683 1.00 0.00 C ATOM 1916 CG LYS B 60 0.527 15.556 7.732 1.00 0.00 C ATOM 1917 CD LYS B 60 -0.151 15.294 9.055 1.00 0.00 C ATOM 1918 CE LYS B 60 0.735 15.683 10.213 1.00 0.00 C ATOM 1919 NZ LYS B 60 -0.039 16.289 11.328 1.00 0.00 N ATOM 0 H LYS B 60 -2.731 17.112 5.791 1.00 0.00 H new ATOM 0 HA LYS B 60 -0.649 17.812 7.758 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -1.358 15.305 6.775 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -0.057 15.765 5.695 1.00 0.00 H new ATOM 0 HG2 LYS B 60 1.066 14.665 7.412 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.264 16.351 7.847 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -1.085 15.854 9.105 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -0.409 14.238 9.131 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.264 14.802 10.576 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.490 16.390 9.870 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.354 15.971 12.237 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 0.020 17.326 11.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -1.034 15.995 11.260 1.00 0.00 H new ATOM 1933 N ALA B 61 0.892 18.872 6.159 1.00 0.00 N ATOM 1934 CA ALA B 61 1.712 19.670 5.263 1.00 0.00 C ATOM 1935 C ALA B 61 2.800 18.808 4.650 1.00 0.00 C ATOM 1936 O ALA B 61 3.112 18.936 3.469 1.00 0.00 O ATOM 1937 CB ALA B 61 2.320 20.848 5.999 1.00 0.00 C ATOM 0 H ALA B 61 1.213 18.865 7.127 1.00 0.00 H new ATOM 0 HA ALA B 61 1.079 20.059 4.465 1.00 0.00 H new ATOM 0 HB1 ALA B 61 2.930 21.432 5.310 1.00 0.00 H new ATOM 0 HB2 ALA B 61 1.525 21.476 6.401 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.943 20.484 6.816 1.00 0.00 H new ATOM 1943 N LYS B 62 3.394 17.936 5.460 1.00 0.00 N ATOM 1944 CA LYS B 62 4.413 17.040 4.956 1.00 0.00 C ATOM 1945 C LYS B 62 3.719 15.797 4.427 1.00 0.00 C ATOM 1946 O LYS B 62 2.846 15.226 5.086 1.00 0.00 O ATOM 1947 CB LYS B 62 5.482 16.712 6.016 1.00 0.00 C ATOM 1948 CG LYS B 62 4.982 15.984 7.256 1.00 0.00 C ATOM 1949 CD LYS B 62 6.135 15.682 8.208 1.00 0.00 C ATOM 1950 CE LYS B 62 5.776 14.610 9.222 1.00 0.00 C ATOM 1951 NZ LYS B 62 6.900 13.669 9.469 1.00 0.00 N ATOM 0 H LYS B 62 3.187 17.836 6.454 1.00 0.00 H new ATOM 0 HA LYS B 62 4.962 17.524 4.148 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.256 16.104 5.548 1.00 0.00 H new ATOM 0 HB3 LYS B 62 5.954 17.643 6.330 1.00 0.00 H new ATOM 0 HG2 LYS B 62 4.235 16.593 7.764 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.492 15.055 6.965 1.00 0.00 H new ATOM 0 HD2 LYS B 62 7.003 15.360 7.633 1.00 0.00 H new ATOM 0 HD3 LYS B 62 6.420 16.594 8.732 1.00 0.00 H new ATOM 0 HE2 LYS B 62 5.488 15.083 10.161 1.00 0.00 H new ATOM 0 HE3 LYS B 62 4.909 14.052 8.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.547 12.831 9.973 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.315 13.378 8.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 7.626 14.139 10.046 1.00 0.00 H new ATOM 1965 N ILE B 63 4.075 15.405 3.225 1.00 0.00 N ATOM 1966 CA ILE B 63 3.448 14.274 2.579 1.00 0.00 C ATOM 1967 C ILE B 63 4.146 12.989 2.991 1.00 0.00 C ATOM 1968 O ILE B 63 5.184 12.637 2.448 1.00 0.00 O ATOM 1969 CB ILE B 63 3.471 14.459 1.052 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.583 15.644 0.654 1.00 0.00 C ATOM 1971 CG2 ILE B 63 2.995 13.198 0.353 1.00 0.00 C ATOM 1972 CD1 ILE B 63 3.135 17.018 0.983 1.00 0.00 C ATOM 0 H ILE B 63 4.802 15.857 2.671 1.00 0.00 H new ATOM 0 HA ILE B 63 2.407 14.209 2.894 1.00 0.00 H new ATOM 0 HB ILE B 63 4.497 14.660 0.744 1.00 0.00 H new ATOM 0 HG12 ILE B 63 2.400 15.593 -0.419 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.617 15.533 1.147 1.00 0.00 H new ATOM 0 HG21 ILE B 63 3.019 13.349 -0.726 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.649 12.367 0.617 1.00 0.00 H new ATOM 0 HG23 ILE B 63 1.976 12.972 0.665 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.428 17.781 0.659 1.00 0.00 H new ATOM 0 HD12 ILE B 63 3.290 17.100 2.059 1.00 0.00 H new ATOM 0 HD13 ILE B 63 4.085 17.161 0.468 1.00 0.00 H new ATOM 1984 N GLN B 64 3.577 12.291 3.956 1.00 0.00 N ATOM 1985 CA GLN B 64 4.189 11.076 4.455 1.00 0.00 C ATOM 1986 C GLN B 64 3.291 9.850 4.278 1.00 0.00 C ATOM 1987 O GLN B 64 2.063 9.952 4.201 1.00 0.00 O ATOM 1988 CB GLN B 64 4.556 11.264 5.925 1.00 0.00 C ATOM 1989 CG GLN B 64 3.350 11.376 6.839 1.00 0.00 C ATOM 1990 CD GLN B 64 3.501 12.435 7.913 1.00 0.00 C ATOM 1991 OE1 GLN B 64 3.070 13.575 7.744 1.00 0.00 O ATOM 1992 NE2 GLN B 64 4.122 12.071 9.019 1.00 0.00 N ATOM 0 H GLN B 64 2.698 12.543 4.407 1.00 0.00 H new ATOM 0 HA GLN B 64 5.088 10.889 3.867 1.00 0.00 H new ATOM 0 HB2 GLN B 64 5.171 10.424 6.248 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.165 12.162 6.028 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.469 11.602 6.239 1.00 0.00 H new ATOM 0 HG3 GLN B 64 3.173 10.411 7.314 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.465 11.116 9.121 1.00 0.00 H new ATOM 0 HE22 GLN B 64 4.259 12.745 9.772 1.00 0.00 H new ATOM 2001 N LEU B 65 3.938 8.703 4.188 1.00 0.00 N ATOM 2002 CA LEU B 65 3.287 7.414 4.030 1.00 0.00 C ATOM 2003 C LEU B 65 3.876 6.442 5.043 1.00 0.00 C ATOM 2004 O LEU B 65 4.959 6.681 5.547 1.00 0.00 O ATOM 2005 CB LEU B 65 3.551 6.879 2.624 1.00 0.00 C ATOM 2006 CG LEU B 65 2.809 5.592 2.257 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.467 5.898 1.604 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.678 4.723 1.363 1.00 0.00 C ATOM 0 H LEU B 65 4.955 8.639 4.223 1.00 0.00 H new ATOM 0 HA LEU B 65 2.214 7.522 4.186 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.280 7.651 1.904 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.621 6.704 2.516 1.00 0.00 H new ATOM 0 HG LEU B 65 2.602 5.038 3.173 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.963 4.965 1.354 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.849 6.471 2.295 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.628 6.478 0.695 1.00 0.00 H new ATOM 0 HD21 LEU B 65 3.140 3.810 1.108 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.920 5.268 0.451 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.598 4.467 1.888 1.00 0.00 H new ATOM 2020 N GLN B 66 3.168 5.371 5.353 1.00 0.00 N ATOM 2021 CA GLN B 66 3.672 4.375 6.283 1.00 0.00 C ATOM 2022 C GLN B 66 3.220 2.980 5.877 1.00 0.00 C ATOM 2023 O GLN B 66 2.054 2.763 5.558 1.00 0.00 O ATOM 2024 CB GLN B 66 3.235 4.672 7.711 1.00 0.00 C ATOM 2025 CG GLN B 66 3.614 3.577 8.699 1.00 0.00 C ATOM 2026 CD GLN B 66 3.168 3.879 10.113 1.00 0.00 C ATOM 2027 OE1 GLN B 66 2.054 3.549 10.504 1.00 0.00 O ATOM 2028 NE2 GLN B 66 4.040 4.480 10.898 1.00 0.00 N ATOM 0 H GLN B 66 2.243 5.168 4.975 1.00 0.00 H new ATOM 0 HA GLN B 66 4.761 4.417 6.247 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.683 5.612 8.032 1.00 0.00 H new ATOM 0 HB3 GLN B 66 2.154 4.811 7.731 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.170 2.635 8.377 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.695 3.441 8.686 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.958 4.739 10.536 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.797 4.686 11.867 1.00 0.00 H new ATOM 2037 N LEU B 67 4.158 2.052 5.855 1.00 0.00 N ATOM 2038 CA LEU B 67 3.872 0.672 5.515 1.00 0.00 C ATOM 2039 C LEU B 67 3.751 -0.146 6.784 1.00 0.00 C ATOM 2040 O LEU B 67 4.755 -0.539 7.366 1.00 0.00 O ATOM 2041 CB LEU B 67 4.985 0.079 4.655 1.00 0.00 C ATOM 2042 CG LEU B 67 5.093 0.626 3.238 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.235 -0.061 2.512 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.784 0.432 2.489 1.00 0.00 C ATOM 0 H LEU B 67 5.138 2.234 6.072 1.00 0.00 H new ATOM 0 HA LEU B 67 2.938 0.646 4.954 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.936 0.244 5.161 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.838 -0.999 4.597 1.00 0.00 H new ATOM 0 HG LEU B 67 5.297 1.696 3.284 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.310 0.332 1.498 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.168 0.125 3.044 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.048 -1.134 2.472 1.00 0.00 H new ATOM 0 HD21 LEU B 67 3.881 0.829 1.479 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.547 -0.631 2.440 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.985 0.958 3.011 1.00 0.00 H new ATOM 2056 N VAL B 68 2.534 -0.389 7.221 1.00 0.00 N ATOM 2057 CA VAL B 68 2.320 -1.169 8.423 1.00 0.00 C ATOM 2058 C VAL B 68 2.373 -2.644 8.085 1.00 0.00 C ATOM 2059 O VAL B 68 1.423 -3.197 7.541 1.00 0.00 O ATOM 2060 CB VAL B 68 0.975 -0.848 9.087 1.00 0.00 C ATOM 2061 CG1 VAL B 68 0.908 -1.490 10.459 1.00 0.00 C ATOM 2062 CG2 VAL B 68 0.775 0.654 9.183 1.00 0.00 C ATOM 0 H VAL B 68 1.682 -0.061 6.766 1.00 0.00 H new ATOM 0 HA VAL B 68 3.110 -0.911 9.129 1.00 0.00 H new ATOM 0 HB VAL B 68 0.172 -1.257 8.474 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.050 -1.257 10.923 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.010 -2.571 10.360 1.00 0.00 H new ATOM 0 HG13 VAL B 68 1.716 -1.104 11.081 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -0.184 0.864 9.656 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.577 1.091 9.778 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.788 1.087 8.183 1.00 0.00 H new ATOM 2072 N LEU B 69 3.486 -3.276 8.395 1.00 0.00 N ATOM 2073 CA LEU B 69 3.662 -4.681 8.090 1.00 0.00 C ATOM 2074 C LEU B 69 3.120 -5.557 9.210 1.00 0.00 C ATOM 2075 O LEU B 69 3.032 -5.122 10.359 1.00 0.00 O ATOM 2076 CB LEU B 69 5.133 -4.997 7.863 1.00 0.00 C ATOM 2077 CG LEU B 69 5.980 -3.849 7.310 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.449 -4.161 7.466 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.666 -3.581 5.854 1.00 0.00 C ATOM 0 H LEU B 69 4.283 -2.839 8.858 1.00 0.00 H new ATOM 0 HA LEU B 69 3.103 -4.894 7.179 1.00 0.00 H new ATOM 0 HB2 LEU B 69 5.566 -5.321 8.809 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.203 -5.840 7.175 1.00 0.00 H new ATOM 0 HG LEU B 69 5.737 -2.953 7.881 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.040 -3.336 7.069 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.682 -4.298 8.522 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.687 -5.074 6.920 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.285 -2.760 5.493 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.872 -4.476 5.267 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.614 -3.314 5.752 1.00 0.00 H new ATOM 2091 N HIS B 70 2.789 -6.798 8.869 1.00 0.00 N ATOM 2092 CA HIS B 70 2.259 -7.764 9.835 1.00 0.00 C ATOM 2093 C HIS B 70 3.313 -8.123 10.873 1.00 0.00 C ATOM 2094 O HIS B 70 2.998 -8.615 11.954 1.00 0.00 O ATOM 2095 CB HIS B 70 1.828 -9.055 9.131 1.00 0.00 C ATOM 2096 CG HIS B 70 0.558 -8.949 8.352 1.00 0.00 C ATOM 2097 ND1 HIS B 70 -0.658 -8.636 8.908 1.00 0.00 N ATOM 2098 CD2 HIS B 70 0.330 -9.141 7.028 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -1.575 -8.646 7.934 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -1.026 -8.948 6.769 1.00 0.00 N ATOM 0 H HIS B 70 2.878 -7.165 7.921 1.00 0.00 H new ATOM 0 HA HIS B 70 1.401 -7.299 10.320 1.00 0.00 H new ATOM 0 HB2 HIS B 70 2.626 -9.369 8.458 1.00 0.00 H new ATOM 0 HB3 HIS B 70 1.715 -9.840 9.879 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -0.832 -8.432 9.892 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.078 -9.401 6.294 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.624 -8.435 8.080 1.00 0.00 H new ATOM 2108 N ALA B 71 4.570 -7.888 10.523 1.00 0.00 N ATOM 2109 CA ALA B 71 5.685 -8.203 11.402 1.00 0.00 C ATOM 2110 C ALA B 71 5.715 -7.306 12.633 1.00 0.00 C ATOM 2111 O ALA B 71 6.280 -7.678 13.659 1.00 0.00 O ATOM 2112 CB ALA B 71 6.996 -8.095 10.641 1.00 0.00 C ATOM 0 H ALA B 71 4.843 -7.477 9.630 1.00 0.00 H new ATOM 0 HA ALA B 71 5.550 -9.227 11.749 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.825 -8.333 11.308 1.00 0.00 H new ATOM 0 HB2 ALA B 71 6.990 -8.795 9.805 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.115 -7.080 10.263 1.00 0.00 H new ATOM 2118 N GLY B 72 5.114 -6.126 12.534 1.00 0.00 N ATOM 2119 CA GLY B 72 5.122 -5.216 13.653 1.00 0.00 C ATOM 2120 C GLY B 72 6.123 -4.133 13.394 1.00 0.00 C ATOM 2121 O GLY B 72 6.768 -3.613 14.302 1.00 0.00 O ATOM 0 H GLY B 72 4.626 -5.789 11.704 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.131 -4.786 13.796 1.00 0.00 H new ATOM 0 HA3 GLY B 72 5.373 -5.749 14.570 1.00 0.00 H new ATOM 2125 N ASP B 73 6.227 -3.800 12.121 1.00 0.00 N ATOM 2126 CA ASP B 73 7.141 -2.806 11.640 1.00 0.00 C ATOM 2127 C ASP B 73 6.367 -1.917 10.719 1.00 0.00 C ATOM 2128 O ASP B 73 5.443 -2.374 10.043 1.00 0.00 O ATOM 2129 CB ASP B 73 8.304 -3.444 10.876 1.00 0.00 C ATOM 2130 CG ASP B 73 9.352 -2.425 10.471 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.485 -1.399 11.171 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.032 -2.647 9.448 1.00 0.00 O ATOM 0 H ASP B 73 5.663 -4.227 11.386 1.00 0.00 H new ATOM 0 HA ASP B 73 7.566 -2.252 12.477 1.00 0.00 H new ATOM 0 HB2 ASP B 73 8.767 -4.211 11.497 1.00 0.00 H new ATOM 0 HB3 ASP B 73 7.921 -3.943 9.985 1.00 0.00 H new ATOM 2137 N THR B 74 6.702 -0.668 10.705 1.00 0.00 N ATOM 2138 CA THR B 74 6.011 0.260 9.861 1.00 0.00 C ATOM 2139 C THR B 74 7.019 1.168 9.148 1.00 0.00 C ATOM 2140 O THR B 74 7.764 1.905 9.794 1.00 0.00 O ATOM 2141 CB THR B 74 5.028 1.096 10.691 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.696 1.658 11.827 1.00 0.00 O ATOM 2143 CG2 THR B 74 3.847 0.255 11.154 1.00 0.00 C ATOM 0 H THR B 74 7.450 -0.263 11.268 1.00 0.00 H new ATOM 0 HA THR B 74 5.447 -0.293 9.110 1.00 0.00 H new ATOM 0 HB THR B 74 4.651 1.899 10.058 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.638 1.817 11.607 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.167 0.874 11.740 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.320 -0.141 10.286 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.207 -0.570 11.768 1.00 0.00 H new ATOM 2151 N THR B 75 7.033 1.118 7.823 1.00 0.00 N ATOM 2152 CA THR B 75 7.964 1.915 7.027 1.00 0.00 C ATOM 2153 C THR B 75 7.352 3.243 6.592 1.00 0.00 C ATOM 2154 O THR B 75 6.477 3.269 5.732 1.00 0.00 O ATOM 2155 CB THR B 75 8.374 1.136 5.769 1.00 0.00 C ATOM 2156 OG1 THR B 75 8.219 -0.269 6.000 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.808 1.446 5.378 1.00 0.00 C ATOM 0 H THR B 75 6.407 0.531 7.272 1.00 0.00 H new ATOM 0 HA THR B 75 8.830 2.120 7.656 1.00 0.00 H new ATOM 0 HB THR B 75 7.727 1.442 4.947 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.046 -0.734 5.753 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.072 0.881 4.484 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.907 2.512 5.176 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.476 1.168 6.193 1.00 0.00 H new ATOM 2165 N ASN B 76 7.815 4.347 7.162 1.00 0.00 N ATOM 2166 CA ASN B 76 7.274 5.651 6.793 1.00 0.00 C ATOM 2167 C ASN B 76 8.137 6.311 5.720 1.00 0.00 C ATOM 2168 O ASN B 76 9.366 6.303 5.796 1.00 0.00 O ATOM 2169 CB ASN B 76 7.123 6.591 8.002 1.00 0.00 C ATOM 2170 CG ASN B 76 6.329 5.996 9.148 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.409 4.805 9.443 1.00 0.00 O ATOM 2172 ND2 ASN B 76 5.553 6.834 9.806 1.00 0.00 N ATOM 0 H ASN B 76 8.550 4.369 7.869 1.00 0.00 H new ATOM 0 HA ASN B 76 6.276 5.473 6.393 1.00 0.00 H new ATOM 0 HB2 ASN B 76 8.114 6.864 8.363 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.638 7.511 7.676 1.00 0.00 H new ATOM 0 HD21 ASN B 76 4.992 6.501 10.590 1.00 0.00 H new ATOM 0 HD22 ASN B 76 5.514 7.815 9.531 1.00 0.00 H new ATOM 2179 N PHE B 77 7.474 6.865 4.716 1.00 0.00 N ATOM 2180 CA PHE B 77 8.138 7.534 3.605 1.00 0.00 C ATOM 2181 C PHE B 77 7.685 8.987 3.521 1.00 0.00 C ATOM 2182 O PHE B 77 6.496 9.274 3.618 1.00 0.00 O ATOM 2183 CB PHE B 77 7.825 6.819 2.290 1.00 0.00 C ATOM 2184 CG PHE B 77 8.422 5.445 2.192 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.789 5.264 2.289 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.615 4.336 2.000 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.345 4.004 2.197 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.164 3.072 1.907 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.531 2.906 2.005 1.00 0.00 C ATOM 0 H PHE B 77 6.456 6.864 4.648 1.00 0.00 H new ATOM 0 HA PHE B 77 9.214 7.504 3.776 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.744 6.744 2.176 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.192 7.425 1.461 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.430 6.120 2.439 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.545 4.461 1.922 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.415 3.878 2.275 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.525 2.215 1.758 1.00 0.00 H new ATOM 0 HZ PHE B 77 9.963 1.919 1.932 1.00 0.00 H new ATOM 2199 N HIS B 78 8.629 9.890 3.324 1.00 0.00 N ATOM 2200 CA HIS B 78 8.332 11.314 3.242 1.00 0.00 C ATOM 2201 C HIS B 78 8.504 11.819 1.810 1.00 0.00 C ATOM 2202 O HIS B 78 9.610 11.863 1.278 1.00 0.00 O ATOM 2203 CB HIS B 78 9.249 12.079 4.205 1.00 0.00 C ATOM 2204 CG HIS B 78 9.016 13.562 4.250 1.00 0.00 C ATOM 2205 ND1 HIS B 78 10.015 14.480 4.482 1.00 0.00 N ATOM 2206 CD2 HIS B 78 7.875 14.284 4.087 1.00 0.00 C ATOM 2207 CE1 HIS B 78 9.470 15.701 4.454 1.00 0.00 C ATOM 2208 NE2 HIS B 78 8.173 15.639 4.217 1.00 0.00 N ATOM 0 H HIS B 78 9.617 9.662 3.217 1.00 0.00 H new ATOM 0 HA HIS B 78 7.294 11.482 3.529 1.00 0.00 H new ATOM 0 HB2 HIS B 78 9.118 11.674 5.208 1.00 0.00 H new ATOM 0 HB3 HIS B 78 10.285 11.896 3.920 1.00 0.00 H new ATOM 0 HD1 HIS B 78 10.999 14.266 4.646 1.00 0.00 H new ATOM 0 HD2 HIS B 78 6.896 13.873 3.889 1.00 0.00 H new ATOM 0 HE1 HIS B 78 10.020 16.618 4.606 1.00 0.00 H new ATOM 2216 N PHE B 79 7.399 12.188 1.192 1.00 0.00 N ATOM 2217 CA PHE B 79 7.407 12.699 -0.167 1.00 0.00 C ATOM 2218 C PHE B 79 7.532 14.211 -0.123 1.00 0.00 C ATOM 2219 O PHE B 79 6.688 14.899 0.449 1.00 0.00 O ATOM 2220 CB PHE B 79 6.133 12.292 -0.908 1.00 0.00 C ATOM 2221 CG PHE B 79 5.960 10.805 -1.053 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.681 10.012 0.050 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.065 10.202 -2.294 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.514 8.648 -0.083 1.00 0.00 C ATOM 2225 CE2 PHE B 79 5.899 8.839 -2.432 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.622 8.061 -1.327 1.00 0.00 C ATOM 0 H PHE B 79 6.472 12.143 1.615 1.00 0.00 H new ATOM 0 HA PHE B 79 8.255 12.275 -0.705 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.271 12.698 -0.378 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.141 12.745 -1.899 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.593 10.467 1.025 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.279 10.805 -3.164 1.00 0.00 H new ATOM 0 HE1 PHE B 79 5.299 8.042 0.785 1.00 0.00 H new ATOM 0 HE2 PHE B 79 5.986 8.381 -3.406 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.490 6.995 -1.435 1.00 0.00 H new ATOM 2236 N SER B 80 8.575 14.727 -0.736 1.00 0.00 N ATOM 2237 CA SER B 80 8.827 16.155 -0.718 1.00 0.00 C ATOM 2238 C SER B 80 8.912 16.758 -2.120 1.00 0.00 C ATOM 2239 O SER B 80 9.795 17.571 -2.392 1.00 0.00 O ATOM 2240 CB SER B 80 10.120 16.432 0.048 1.00 0.00 C ATOM 2241 OG SER B 80 10.274 15.525 1.125 1.00 0.00 O ATOM 0 H SER B 80 9.263 14.181 -1.254 1.00 0.00 H new ATOM 0 HA SER B 80 7.981 16.630 -0.220 1.00 0.00 H new ATOM 0 HB2 SER B 80 10.972 16.349 -0.627 1.00 0.00 H new ATOM 0 HB3 SER B 80 10.111 17.454 0.427 1.00 0.00 H new ATOM 0 HG SER B 80 9.518 15.618 1.742 1.00 0.00 H new ATOM 2247 N ASN B 81 8.014 16.361 -3.013 1.00 0.00 N ATOM 2248 CA ASN B 81 7.992 16.920 -4.344 1.00 0.00 C ATOM 2249 C ASN B 81 7.032 18.102 -4.282 1.00 0.00 C ATOM 2250 O ASN B 81 5.824 17.940 -4.427 1.00 0.00 O ATOM 2251 CB ASN B 81 7.551 15.844 -5.341 1.00 0.00 C ATOM 2252 CG ASN B 81 8.082 16.073 -6.738 1.00 0.00 C ATOM 2253 OD1 ASN B 81 8.935 16.929 -6.963 1.00 0.00 O ATOM 2254 ND2 ASN B 81 7.601 15.279 -7.679 1.00 0.00 N ATOM 0 H ASN B 81 7.298 15.657 -2.834 1.00 0.00 H new ATOM 0 HA ASN B 81 8.971 17.261 -4.682 1.00 0.00 H new ATOM 0 HB2 ASN B 81 7.887 14.870 -4.987 1.00 0.00 H new ATOM 0 HB3 ASN B 81 6.462 15.813 -5.374 1.00 0.00 H new ATOM 0 HD21 ASN B 81 7.938 15.363 -8.638 1.00 0.00 H new ATOM 0 HD22 ASN B 81 6.893 14.582 -7.446 1.00 0.00 H new ATOM 2261 N GLU B 82 7.584 19.277 -3.999 1.00 0.00 N ATOM 2262 CA GLU B 82 6.811 20.506 -3.799 1.00 0.00 C ATOM 2263 C GLU B 82 5.976 20.923 -5.013 1.00 0.00 C ATOM 2264 O GLU B 82 6.319 21.869 -5.722 1.00 0.00 O ATOM 2265 CB GLU B 82 7.731 21.660 -3.351 1.00 0.00 C ATOM 2266 CG GLU B 82 8.937 21.915 -4.256 1.00 0.00 C ATOM 2267 CD GLU B 82 10.039 20.889 -4.087 1.00 0.00 C ATOM 2268 OE1 GLU B 82 10.888 21.052 -3.188 1.00 0.00 O ATOM 2269 OE2 GLU B 82 10.055 19.898 -4.846 1.00 0.00 O ATOM 0 H GLU B 82 8.591 19.408 -3.900 1.00 0.00 H new ATOM 0 HA GLU B 82 6.095 20.281 -3.009 1.00 0.00 H new ATOM 0 HB2 GLU B 82 7.140 22.574 -3.293 1.00 0.00 H new ATOM 0 HB3 GLU B 82 8.090 21.448 -2.344 1.00 0.00 H new ATOM 0 HG2 GLU B 82 8.609 21.918 -5.295 1.00 0.00 H new ATOM 0 HG3 GLU B 82 9.338 22.907 -4.046 1.00 0.00 H new ATOM 2276 N SER B 83 4.860 20.215 -5.193 1.00 0.00 N ATOM 2277 CA SER B 83 3.893 20.435 -6.271 1.00 0.00 C ATOM 2278 C SER B 83 3.047 19.184 -6.456 1.00 0.00 C ATOM 2279 O SER B 83 1.855 19.254 -6.772 1.00 0.00 O ATOM 2280 CB SER B 83 4.571 20.767 -7.610 1.00 0.00 C ATOM 2281 OG SER B 83 4.762 22.162 -7.757 1.00 0.00 O ATOM 0 H SER B 83 4.595 19.449 -4.574 1.00 0.00 H new ATOM 0 HA SER B 83 3.279 21.288 -5.982 1.00 0.00 H new ATOM 0 HB2 SER B 83 5.533 20.258 -7.669 1.00 0.00 H new ATOM 0 HB3 SER B 83 3.961 20.393 -8.432 1.00 0.00 H new ATOM 0 HG SER B 83 5.248 22.509 -6.980 1.00 0.00 H new ATOM 2287 N THR B 84 3.668 18.035 -6.248 1.00 0.00 N ATOM 2288 CA THR B 84 2.998 16.764 -6.442 1.00 0.00 C ATOM 2289 C THR B 84 3.085 15.815 -5.254 1.00 0.00 C ATOM 2290 O THR B 84 2.347 14.843 -5.214 1.00 0.00 O ATOM 2291 CB THR B 84 3.641 16.046 -7.605 1.00 0.00 C ATOM 2292 OG1 THR B 84 4.989 16.494 -7.756 1.00 0.00 O ATOM 2293 CG2 THR B 84 2.894 16.266 -8.884 1.00 0.00 C ATOM 0 H THR B 84 4.639 17.958 -5.944 1.00 0.00 H new ATOM 0 HA THR B 84 1.948 17.010 -6.602 1.00 0.00 H new ATOM 0 HB THR B 84 3.619 14.978 -7.388 1.00 0.00 H new ATOM 0 HG1 THR B 84 5.355 16.151 -8.598 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.392 15.731 -9.693 1.00 0.00 H new ATOM 0 HG22 THR B 84 1.874 15.896 -8.778 1.00 0.00 H new ATOM 0 HG23 THR B 84 2.871 17.331 -9.113 1.00 0.00 H new ATOM 2301 N ALA B 85 3.973 16.117 -4.311 1.00 0.00 N ATOM 2302 CA ALA B 85 4.234 15.281 -3.131 1.00 0.00 C ATOM 2303 C ALA B 85 3.021 14.456 -2.693 1.00 0.00 C ATOM 2304 O ALA B 85 3.073 13.225 -2.673 1.00 0.00 O ATOM 2305 CB ALA B 85 4.727 16.168 -1.998 1.00 0.00 C ATOM 0 H ALA B 85 4.543 16.962 -4.341 1.00 0.00 H new ATOM 0 HA ALA B 85 5.000 14.554 -3.401 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.924 15.557 -1.117 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.644 16.671 -2.303 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.966 16.912 -1.761 1.00 0.00 H new ATOM 2311 N VAL B 86 1.941 15.145 -2.358 1.00 0.00 N ATOM 2312 CA VAL B 86 0.691 14.514 -1.935 1.00 0.00 C ATOM 2313 C VAL B 86 0.184 13.445 -2.910 1.00 0.00 C ATOM 2314 O VAL B 86 -0.149 12.339 -2.494 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.388 15.602 -1.730 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.772 15.091 -2.093 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.401 16.087 -0.290 1.00 0.00 C ATOM 0 H VAL B 86 1.902 16.164 -2.371 1.00 0.00 H new ATOM 0 HA VAL B 86 0.897 13.996 -0.998 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.134 16.430 -2.392 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.505 15.883 -1.936 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.785 14.787 -3.140 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -2.021 14.237 -1.464 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.168 16.852 -0.171 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.617 15.250 0.374 1.00 0.00 H new ATOM 0 HG23 VAL B 86 0.573 16.508 -0.039 1.00 0.00 H new ATOM 2327 N LYS B 87 0.188 13.753 -4.198 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.331 12.836 -5.202 1.00 0.00 C ATOM 2329 C LYS B 87 0.564 11.624 -5.326 1.00 0.00 C ATOM 2330 O LYS B 87 0.075 10.517 -5.453 1.00 0.00 O ATOM 2331 CB LYS B 87 -0.444 13.534 -6.560 1.00 0.00 C ATOM 2332 CG LYS B 87 -1.062 14.921 -6.495 1.00 0.00 C ATOM 2333 CD LYS B 87 -0.477 15.833 -7.562 1.00 0.00 C ATOM 2334 CE LYS B 87 -0.987 17.258 -7.425 1.00 0.00 C ATOM 2335 NZ LYS B 87 -0.190 18.216 -8.243 1.00 0.00 N ATOM 0 H LYS B 87 0.545 14.632 -4.573 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.323 12.514 -4.885 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.550 13.611 -7.001 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -1.041 12.913 -7.227 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -2.141 14.848 -6.627 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -0.890 15.353 -5.509 1.00 0.00 H new ATOM 0 HD2 LYS B 87 0.611 15.827 -7.489 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.732 15.448 -8.549 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -2.032 17.300 -7.732 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -0.950 17.557 -6.378 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.833 18.837 -8.775 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 0.409 18.792 -7.618 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 0.411 17.688 -8.908 1.00 0.00 H new ATOM 2349 N GLU B 88 1.870 11.833 -5.289 1.00 0.00 N ATOM 2350 CA GLU B 88 2.811 10.730 -5.390 1.00 0.00 C ATOM 2351 C GLU B 88 2.620 9.759 -4.233 1.00 0.00 C ATOM 2352 O GLU B 88 2.584 8.544 -4.426 1.00 0.00 O ATOM 2353 CB GLU B 88 4.243 11.246 -5.429 1.00 0.00 C ATOM 2354 CG GLU B 88 4.705 11.586 -6.831 1.00 0.00 C ATOM 2355 CD GLU B 88 4.425 13.009 -7.206 1.00 0.00 C ATOM 2356 OE1 GLU B 88 3.273 13.300 -7.587 1.00 0.00 O ATOM 2357 OE2 GLU B 88 5.359 13.840 -7.120 1.00 0.00 O ATOM 0 H GLU B 88 2.301 12.752 -5.190 1.00 0.00 H new ATOM 0 HA GLU B 88 2.617 10.197 -6.321 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.322 12.133 -4.800 1.00 0.00 H new ATOM 0 HB3 GLU B 88 4.908 10.493 -5.005 1.00 0.00 H new ATOM 0 HG2 GLU B 88 5.776 11.398 -6.911 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.211 10.924 -7.542 1.00 0.00 H new ATOM 2364 N ARG B 89 2.481 10.302 -3.032 1.00 0.00 N ATOM 2365 CA ARG B 89 2.262 9.480 -1.849 1.00 0.00 C ATOM 2366 C ARG B 89 0.924 8.782 -1.963 1.00 0.00 C ATOM 2367 O ARG B 89 0.818 7.574 -1.765 1.00 0.00 O ATOM 2368 CB ARG B 89 2.280 10.348 -0.596 1.00 0.00 C ATOM 2369 CG ARG B 89 2.167 9.584 0.716 1.00 0.00 C ATOM 2370 CD ARG B 89 0.722 9.261 1.079 1.00 0.00 C ATOM 2371 NE ARG B 89 -0.194 10.373 0.820 1.00 0.00 N ATOM 2372 CZ ARG B 89 -0.410 11.372 1.669 1.00 0.00 C ATOM 2373 NH1 ARG B 89 0.302 11.464 2.780 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -1.324 12.288 1.393 1.00 0.00 N ATOM 0 H ARG B 89 2.516 11.305 -2.851 1.00 0.00 H new ATOM 0 HA ARG B 89 3.058 8.739 -1.777 1.00 0.00 H new ATOM 0 HB2 ARG B 89 3.205 10.925 -0.585 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.459 11.063 -0.655 1.00 0.00 H new ATOM 0 HG2 ARG B 89 2.736 8.657 0.644 1.00 0.00 H new ATOM 0 HG3 ARG B 89 2.617 10.173 1.516 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.396 8.389 0.511 1.00 0.00 H new ATOM 0 HD3 ARG B 89 0.669 8.992 2.134 1.00 0.00 H new ATOM 0 HE ARG B 89 -0.698 10.381 -0.067 1.00 0.00 H new ATOM 0 HH11 ARG B 89 1.018 10.767 2.986 1.00 0.00 H new ATOM 0 HH12 ARG B 89 0.135 12.232 3.431 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -1.862 12.227 0.529 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -1.490 13.055 2.044 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.096 9.569 -2.266 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.445 9.060 -2.426 1.00 0.00 C ATOM 2390 C ASP B 90 -1.518 8.046 -3.539 1.00 0.00 C ATOM 2391 O ASP B 90 -2.302 7.112 -3.471 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.417 10.212 -2.670 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.022 10.706 -1.377 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.967 10.053 -0.887 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -2.530 11.714 -0.831 1.00 0.00 O ATOM 0 H ASP B 90 -0.011 10.576 -2.407 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.732 8.554 -1.504 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.896 11.031 -3.166 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.210 9.885 -3.343 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.678 8.223 -4.538 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.623 7.306 -5.672 1.00 0.00 C ATOM 2402 C ALA B 91 -0.040 5.994 -5.224 1.00 0.00 C ATOM 2403 O ALA B 91 -0.558 4.919 -5.523 1.00 0.00 O ATOM 2404 CB ALA B 91 0.243 7.878 -6.772 1.00 0.00 C ATOM 0 H ALA B 91 -0.017 8.998 -4.593 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.634 7.159 -6.053 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.274 7.182 -7.610 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -0.173 8.829 -7.105 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.253 8.036 -6.395 1.00 0.00 H new ATOM 2410 N VAL B 92 1.058 6.111 -4.506 1.00 0.00 N ATOM 2411 CA VAL B 92 1.754 4.976 -3.962 1.00 0.00 C ATOM 2412 C VAL B 92 0.802 4.218 -3.062 1.00 0.00 C ATOM 2413 O VAL B 92 0.644 3.014 -3.181 1.00 0.00 O ATOM 2414 CB VAL B 92 2.977 5.464 -3.176 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.384 4.489 -2.092 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.138 5.726 -4.112 1.00 0.00 C ATOM 0 H VAL B 92 1.492 7.007 -4.285 1.00 0.00 H new ATOM 0 HA VAL B 92 2.098 4.314 -4.757 1.00 0.00 H new ATOM 0 HB VAL B 92 2.696 6.396 -2.686 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.254 4.877 -1.562 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.560 4.360 -1.391 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.632 3.528 -2.542 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.998 6.072 -3.538 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.398 4.806 -4.636 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.856 6.489 -4.837 1.00 0.00 H new ATOM 2426 N LYS B 93 0.137 4.971 -2.201 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.843 4.437 -1.273 1.00 0.00 C ATOM 2428 C LYS B 93 -1.977 3.797 -2.033 1.00 0.00 C ATOM 2429 O LYS B 93 -2.427 2.709 -1.692 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.388 5.585 -0.415 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.604 5.223 0.429 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.906 5.432 -0.337 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.392 6.863 -0.255 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.498 7.500 -1.599 1.00 0.00 N ATOM 0 H LYS B 93 0.265 5.980 -2.127 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.373 3.685 -0.639 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.595 5.936 0.245 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.650 6.417 -1.069 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -2.531 4.182 0.745 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.613 5.831 1.334 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.759 5.159 -1.382 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -4.671 4.766 0.062 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -5.366 6.887 0.234 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -3.709 7.442 0.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.668 8.520 -1.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -3.612 7.352 -2.124 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -5.287 7.073 -2.124 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.446 4.489 -3.056 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.545 3.992 -3.849 1.00 0.00 C ATOM 2450 C ASP B 94 -3.193 2.629 -4.418 1.00 0.00 C ATOM 2451 O ASP B 94 -3.921 1.654 -4.234 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.901 4.952 -4.976 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.960 5.952 -4.553 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -5.474 5.832 -3.413 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -5.274 6.858 -5.342 1.00 0.00 O ATOM 0 H ASP B 94 -2.081 5.394 -3.353 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.416 3.904 -3.200 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -3.005 5.485 -5.296 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -4.259 4.386 -5.836 1.00 0.00 H new ATOM 2460 N LEU B 95 -2.041 2.581 -5.081 1.00 0.00 N ATOM 2461 CA LEU B 95 -1.532 1.356 -5.678 1.00 0.00 C ATOM 2462 C LEU B 95 -1.293 0.307 -4.604 1.00 0.00 C ATOM 2463 O LEU B 95 -1.718 -0.836 -4.736 1.00 0.00 O ATOM 2464 CB LEU B 95 -0.240 1.649 -6.446 1.00 0.00 C ATOM 2465 CG LEU B 95 -0.326 1.458 -7.963 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -1.670 1.937 -8.497 1.00 0.00 C ATOM 2467 CD2 LEU B 95 0.805 2.202 -8.652 1.00 0.00 C ATOM 0 H LEU B 95 -1.436 3.391 -5.218 1.00 0.00 H new ATOM 0 HA LEU B 95 -2.272 0.966 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.060 2.677 -6.242 1.00 0.00 H new ATOM 0 HB3 LEU B 95 0.548 1.004 -6.059 1.00 0.00 H new ATOM 0 HG LEU B 95 -0.233 0.393 -8.177 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -1.706 1.791 -9.577 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -2.472 1.368 -8.027 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.795 2.996 -8.270 1.00 0.00 H new ATOM 0 HD21 LEU B 95 0.732 2.058 -9.730 1.00 0.00 H new ATOM 0 HD22 LEU B 95 0.734 3.265 -8.423 1.00 0.00 H new ATOM 0 HD23 LEU B 95 1.762 1.818 -8.299 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.632 0.724 -3.536 1.00 0.00 N ATOM 2480 CA LEU B 96 -0.328 -0.141 -2.406 1.00 0.00 C ATOM 2481 C LEU B 96 -1.592 -0.815 -1.890 1.00 0.00 C ATOM 2482 O LEU B 96 -1.684 -2.038 -1.848 1.00 0.00 O ATOM 2483 CB LEU B 96 0.319 0.695 -1.304 1.00 0.00 C ATOM 2484 CG LEU B 96 1.821 0.890 -1.459 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.335 1.881 -0.431 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.548 -0.441 -1.351 1.00 0.00 C ATOM 0 H LEU B 96 -0.289 1.678 -3.428 1.00 0.00 H new ATOM 0 HA LEU B 96 0.361 -0.924 -2.724 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -0.161 1.673 -1.278 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.124 0.219 -0.343 1.00 0.00 H new ATOM 0 HG LEU B 96 2.019 1.298 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.410 2.009 -0.555 1.00 0.00 H new ATOM 0 HD12 LEU B 96 1.837 2.840 -0.570 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.128 1.506 0.571 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.620 -0.280 -1.464 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.349 -0.886 -0.376 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.197 -1.112 -2.135 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.561 0.007 -1.527 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.845 -0.449 -1.020 1.00 0.00 C ATOM 2500 C GLN B 97 -4.541 -1.419 -1.982 1.00 0.00 C ATOM 2501 O GLN B 97 -5.044 -2.459 -1.568 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.714 0.778 -0.735 1.00 0.00 C ATOM 2503 CG GLN B 97 -6.201 0.592 -0.944 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.880 1.883 -1.364 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -6.179 2.697 -2.142 1.00 0.00 O flip ATOM 2506 NE2 GLN B 97 -8.022 2.149 -0.997 1.00 0.00 N flip ATOM 0 H GLN B 97 -2.478 1.022 -1.576 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.684 -1.011 -0.100 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.547 1.087 0.297 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.376 1.596 -1.372 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.368 -0.170 -1.705 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.654 0.227 -0.022 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -8.530 1.498 -0.399 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -8.462 3.021 -1.291 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.521 -1.090 -3.265 1.00 0.00 N ATOM 2516 CA GLN B 98 -5.183 -1.901 -4.289 1.00 0.00 C ATOM 2517 C GLN B 98 -4.454 -3.210 -4.591 1.00 0.00 C ATOM 2518 O GLN B 98 -5.085 -4.243 -4.813 1.00 0.00 O ATOM 2519 CB GLN B 98 -5.312 -1.094 -5.578 1.00 0.00 C ATOM 2520 CG GLN B 98 -6.335 0.026 -5.492 1.00 0.00 C ATOM 2521 CD GLN B 98 -6.163 1.060 -6.588 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -5.743 0.743 -7.700 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -6.483 2.307 -6.279 1.00 0.00 N ATOM 0 H GLN B 98 -4.051 -0.261 -3.629 1.00 0.00 H new ATOM 0 HA GLN B 98 -6.163 -2.163 -3.891 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -4.340 -0.669 -5.830 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.587 -1.765 -6.392 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -7.338 -0.398 -5.552 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -6.253 0.514 -4.521 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -6.828 2.529 -5.345 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -6.385 3.046 -6.975 1.00 0.00 H new ATOM 2532 N LEU B 99 -3.135 -3.164 -4.600 1.00 0.00 N ATOM 2533 CA LEU B 99 -2.327 -4.334 -4.926 1.00 0.00 C ATOM 2534 C LEU B 99 -2.087 -5.241 -3.730 1.00 0.00 C ATOM 2535 O LEU B 99 -1.719 -6.406 -3.896 1.00 0.00 O ATOM 2536 CB LEU B 99 -1.002 -3.868 -5.501 1.00 0.00 C ATOM 2537 CG LEU B 99 -1.105 -3.237 -6.883 1.00 0.00 C ATOM 2538 CD1 LEU B 99 -0.033 -2.185 -7.051 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.979 -4.308 -7.956 1.00 0.00 C ATOM 0 H LEU B 99 -2.594 -2.326 -4.385 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.879 -4.926 -5.656 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.557 -3.146 -4.817 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -0.323 -4.719 -5.553 1.00 0.00 H new ATOM 0 HG LEU B 99 -2.079 -2.759 -6.986 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -0.114 -1.739 -8.042 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -0.160 -1.412 -6.293 1.00 0.00 H new ATOM 0 HD13 LEU B 99 0.949 -2.645 -6.939 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -1.054 -3.847 -8.941 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -0.014 -4.806 -7.861 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -1.778 -5.039 -7.836 1.00 0.00 H new ATOM 2551 N LEU B 100 -2.285 -4.709 -2.535 1.00 0.00 N ATOM 2552 CA LEU B 100 -2.091 -5.479 -1.311 1.00 0.00 C ATOM 2553 C LEU B 100 -2.843 -6.808 -1.319 1.00 0.00 C ATOM 2554 O LEU B 100 -2.225 -7.854 -1.129 1.00 0.00 O ATOM 2555 CB LEU B 100 -2.509 -4.675 -0.089 1.00 0.00 C ATOM 2556 CG LEU B 100 -1.406 -3.855 0.553 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.993 -3.004 1.669 1.00 0.00 C ATOM 2558 CD2 LEU B 100 -0.308 -4.786 1.058 1.00 0.00 C ATOM 0 H LEU B 100 -2.581 -3.745 -2.383 1.00 0.00 H new ATOM 0 HA LEU B 100 -1.025 -5.699 -1.263 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -3.319 -4.004 -0.375 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.911 -5.361 0.657 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.958 -3.181 -0.178 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.202 -2.414 2.131 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.750 -2.336 1.258 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.449 -3.651 2.419 1.00 0.00 H new ATOM 0 HD21 LEU B 100 0.485 -4.197 1.519 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.724 -5.474 1.794 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.101 -5.353 0.222 1.00 0.00 H new ATOM 2570 N PRO B 101 -4.173 -6.807 -1.561 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.979 -8.036 -1.561 1.00 0.00 C ATOM 2572 C PRO B 101 -4.579 -9.049 -2.640 1.00 0.00 C ATOM 2573 O PRO B 101 -5.305 -10.005 -2.892 1.00 0.00 O ATOM 2574 CB PRO B 101 -6.409 -7.539 -1.794 1.00 0.00 C ATOM 2575 CG PRO B 101 -6.372 -6.102 -1.421 1.00 0.00 C ATOM 2576 CD PRO B 101 -5.014 -5.625 -1.821 1.00 0.00 C ATOM 0 HA PRO B 101 -4.843 -8.581 -0.627 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.710 -7.671 -2.833 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -7.124 -8.089 -1.182 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -7.153 -5.542 -1.936 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.536 -5.969 -0.352 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.981 -5.326 -2.869 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.697 -4.764 -1.233 1.00 0.00 H new ATOM 2584 N LYS B 102 -3.463 -8.821 -3.313 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.987 -9.775 -4.294 1.00 0.00 C ATOM 2586 C LYS B 102 -1.923 -10.661 -3.657 1.00 0.00 C ATOM 2587 O LYS B 102 -1.749 -11.815 -4.043 1.00 0.00 O ATOM 2588 CB LYS B 102 -2.419 -9.093 -5.543 1.00 0.00 C ATOM 2589 CG LYS B 102 -2.383 -10.029 -6.742 1.00 0.00 C ATOM 2590 CD LYS B 102 -1.124 -9.854 -7.596 1.00 0.00 C ATOM 2591 CE LYS B 102 -1.093 -8.531 -8.363 1.00 0.00 C ATOM 2592 NZ LYS B 102 0.189 -8.349 -9.116 1.00 0.00 N ATOM 0 H LYS B 102 -2.878 -7.993 -3.199 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.838 -10.375 -4.616 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -3.024 -8.219 -5.784 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -1.411 -8.735 -5.333 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -2.439 -11.060 -6.393 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -3.263 -9.853 -7.361 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -0.246 -9.914 -6.953 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -1.057 -10.679 -8.305 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -1.931 -8.496 -9.060 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -1.224 -7.704 -7.665 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 0.053 -7.644 -9.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 0.931 -8.021 -8.465 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 0.475 -9.255 -9.538 1.00 0.00 H new ATOM 2606 N PHE B 103 -1.219 -10.112 -2.669 1.00 0.00 N ATOM 2607 CA PHE B 103 -0.160 -10.846 -1.990 1.00 0.00 C ATOM 2608 C PHE B 103 -0.417 -10.941 -0.496 1.00 0.00 C ATOM 2609 O PHE B 103 0.266 -11.678 0.208 1.00 0.00 O ATOM 2610 CB PHE B 103 1.192 -10.189 -2.260 1.00 0.00 C ATOM 2611 CG PHE B 103 1.473 -10.030 -3.724 1.00 0.00 C ATOM 2612 CD1 PHE B 103 1.859 -11.118 -4.491 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.327 -8.798 -4.338 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.100 -10.978 -5.841 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.562 -8.653 -5.688 1.00 0.00 C ATOM 2616 CZ PHE B 103 1.950 -9.745 -6.442 1.00 0.00 C ATOM 0 H PHE B 103 -1.364 -9.163 -2.323 1.00 0.00 H new ATOM 0 HA PHE B 103 -0.147 -11.861 -2.387 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.219 -9.211 -1.780 1.00 0.00 H new ATOM 0 HB3 PHE B 103 1.981 -10.789 -1.805 1.00 0.00 H new ATOM 0 HD1 PHE B 103 1.972 -12.086 -4.026 1.00 0.00 H new ATOM 0 HD2 PHE B 103 1.026 -7.942 -3.753 1.00 0.00 H new ATOM 0 HE1 PHE B 103 2.406 -11.832 -6.427 1.00 0.00 H new ATOM 0 HE2 PHE B 103 1.443 -7.687 -6.157 1.00 0.00 H new ATOM 0 HZ PHE B 103 2.135 -9.633 -7.500 1.00 0.00 H new ATOM 2626 N LYS B 104 -1.399 -10.193 -0.023 1.00 0.00 N ATOM 2627 CA LYS B 104 -1.760 -10.186 1.387 1.00 0.00 C ATOM 2628 C LYS B 104 -2.146 -11.582 1.860 1.00 0.00 C ATOM 2629 O LYS B 104 -3.153 -12.127 1.427 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.934 -9.235 1.608 1.00 0.00 C ATOM 2631 CG LYS B 104 -2.731 -8.277 2.759 1.00 0.00 C ATOM 2632 CD LYS B 104 -3.871 -8.362 3.754 1.00 0.00 C ATOM 2633 CE LYS B 104 -3.620 -7.464 4.953 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.885 -6.971 5.558 1.00 0.00 N ATOM 0 H LYS B 104 -1.968 -9.575 -0.602 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.895 -9.853 1.961 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -3.103 -8.663 0.696 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -3.835 -9.821 1.789 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -1.790 -8.502 3.261 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -2.653 -7.259 2.378 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -4.803 -8.073 3.269 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -3.991 -9.393 4.087 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -3.050 -8.012 5.703 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -3.010 -6.614 4.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.705 -6.078 6.060 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -5.589 -6.812 4.809 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -5.248 -7.678 6.229 1.00 0.00 H new