USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=40 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= 0.162 K(o=1.6,f=-0.43) USER MOD Set 1.2: B 84 THR OG1 : rot 75:sc= 1.45 USER MOD Set 2.1: B 78 HIS : no HE2:sc= 0 X(o=0,f=-0.26) USER MOD Set 2.2: B 80 SER OG : rot -170:sc= 0 USER MOD Set 3.1: B 62 LYS NZ :NH3+ -174:sc= 1.2 (180deg=1.02) USER MOD Set 3.2: B 64 GLN : amide:sc= -2.15! C(o=-0.94!,f=-3.5!) USER MOD Set 4.1: B 54 LYS NZ :NH3+ 163:sc= 1.28 (180deg=-0.249) USER MOD Set 4.2: B 66 GLN : amide:sc= 0.48 K(o=-0.14,f=-18!) USER MOD Set 4.3: B 76 ASN : amide:sc= -1.9 K(o=-0.14,f=-12!) USER MOD Set 5.1: B 51 LYS NZ :NH3+ -162:sc= 2.12 (180deg=0.157) USER MOD Set 5.2: B 52 CYS SG : rot 3:sc= -0.191 USER MOD Set 6.1: B 45 HIS : no HD1:sc= -0.997 K(o=-0.95,f=-2) USER MOD Set 6.2: B 75 THR OG1 : rot 65:sc= 0.0421 USER MOD Set 7.1: A 409 SER OG : rot -86:sc= 1.45 USER MOD Set 7.2: A 410 GLN : amide:sc= -0.146 K(o=1.3,f=0.79) USER MOD Single : A 397 MET CE :methyl -126:sc= -0.248 (180deg=-1.16) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 TYR OH : rot -42:sc= -0.844 USER MOD Single : A 406 SER OG : rot -74:sc= 0.531 USER MOD Single : A 417 GLN : amide:sc= -0.278 X(o=-0.28,f=-0.19) USER MOD Single : A 418 MET CE :methyl -157:sc= -4.9! (180deg=-6.22!) USER MOD Single : A 419 THR OG1 : rot 180:sc= -0.0402 USER MOD Single : A 423 LYS NZ :NH3+ -141:sc= -2.64! (180deg=-4.84!) USER MOD Single : A 426 TYR OH : rot 180:sc= -0.315 USER MOD Single : A 429 MET CE :methyl 139:sc= -5.49! (180deg=-7.54!) USER MOD Single : A 431 GLN : amide:sc= -0.309 X(o=-0.31,f=-0.32) USER MOD Single : A 433 MET CE :methyl -142:sc= -3.59! (180deg=-4.12) USER MOD Single : B 13 LYS NZ :NH3+ -160:sc= -1.71! (180deg=-2.6!) USER MOD Single : B 14 LYS NZ :NH3+ -170:sc= 1.71 (180deg=1.29) USER MOD Single : B 17 GLN : amide:sc= -0.302 K(o=-0.3,f=-1.8!) USER MOD Single : B 18 LYS NZ :NH3+ -135:sc= 1.31 (180deg=1.19) USER MOD Single : B 19 LYS NZ :NH3+ -113:sc= 1.25 (180deg=-0.916) USER MOD Single : B 20 GLN : amide:sc= 0.572 K(o=0.57,f=0) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -127:sc= -3.13 (180deg=-9.79!) USER MOD Single : B 38 LYS NZ :NH3+ -107:sc= -1.21! (180deg=-5.07!) USER MOD Single : B 42 THR OG1 : rot -150:sc= -0.456 USER MOD Single : B 44 SER OG : rot 180:sc= 0 USER MOD Single : B 46 MET CE :methyl 165:sc= -0.106 (180deg=-0.328) USER MOD Single : B 47 TYR OH : rot 180:sc= -2.2! USER MOD Single : B 53 GLN :FLIP amide:sc= -3.47 F(o=-4.5!,f=-3.5) USER MOD Single : B 56 SER OG : rot 40:sc= 1.64 USER MOD Single : B 60 LYS NZ :NH3+ 146:sc= 0.534 (180deg=-3.35!) USER MOD Single : B 70 HIS : no HD1:sc= -3.12 K(o=-3.1,f=-4.3!) USER MOD Single : B 74 THR OG1 : rot 34:sc= 0.465 USER MOD Single : B 83 SER OG : rot -86:sc= 1.26 USER MOD Single : B 87 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.22) USER MOD Single : B 93 LYS NZ :NH3+ 151:sc= 0.456! (180deg=-0.843!) USER MOD Single : B 97 GLN :FLIP amide:sc= -0.683 F(o=-3!,f=-0.68) USER MOD Single : B 98 GLN : amide:sc= -0.0079 X(o=-0.0079,f=-0.23) USER MOD Single : B 102 LYS NZ :NH3+ -116:sc= 1.87 (180deg=-1.34) USER MOD Single : B 104 LYS NZ :NH3+ -163:sc= 2.38 (180deg=2.04) USER MOD ----------------------------------------------------------------- ATOM 58 N GLU A 382 10.080 11.713 12.119 1.00 0.00 N ATOM 59 CA GLU A 382 9.151 10.677 11.699 1.00 0.00 C ATOM 60 C GLU A 382 8.153 10.405 12.815 1.00 0.00 C ATOM 61 O GLU A 382 8.487 9.765 13.813 1.00 0.00 O ATOM 62 CB GLU A 382 9.913 9.392 11.348 1.00 0.00 C ATOM 63 CG GLU A 382 10.566 9.404 9.969 1.00 0.00 C ATOM 64 CD GLU A 382 11.505 10.576 9.756 1.00 0.00 C ATOM 65 OE1 GLU A 382 12.427 10.774 10.582 1.00 0.00 O ATOM 66 OE2 GLU A 382 11.326 11.302 8.760 1.00 0.00 O ATOM 0 HA GLU A 382 8.615 11.016 10.812 1.00 0.00 H new ATOM 0 HB2 GLU A 382 10.684 9.224 12.100 1.00 0.00 H new ATOM 0 HB3 GLU A 382 9.224 8.549 11.403 1.00 0.00 H new ATOM 0 HG2 GLU A 382 11.119 8.475 9.829 1.00 0.00 H new ATOM 0 HG3 GLU A 382 9.787 9.429 9.207 1.00 0.00 H new ATOM 73 N GLU A 383 6.938 10.906 12.658 1.00 0.00 N ATOM 74 CA GLU A 383 5.913 10.716 13.672 1.00 0.00 C ATOM 75 C GLU A 383 4.741 9.890 13.147 1.00 0.00 C ATOM 76 O GLU A 383 4.900 9.039 12.271 1.00 0.00 O ATOM 77 CB GLU A 383 5.416 12.069 14.211 1.00 0.00 C ATOM 78 CG GLU A 383 5.438 13.209 13.200 1.00 0.00 C ATOM 79 CD GLU A 383 4.669 12.898 11.931 1.00 0.00 C ATOM 80 OE1 GLU A 383 3.434 12.753 11.990 1.00 0.00 O ATOM 81 OE2 GLU A 383 5.308 12.802 10.867 1.00 0.00 O ATOM 0 H GLU A 383 6.639 11.444 11.844 1.00 0.00 H new ATOM 0 HA GLU A 383 6.370 10.160 14.491 1.00 0.00 H new ATOM 0 HB2 GLU A 383 4.396 11.946 14.576 1.00 0.00 H new ATOM 0 HB3 GLU A 383 6.029 12.350 15.067 1.00 0.00 H new ATOM 0 HG2 GLU A 383 5.018 14.103 13.661 1.00 0.00 H new ATOM 0 HG3 GLU A 383 6.472 13.438 12.943 1.00 0.00 H new ATOM 88 N ASP A 384 3.566 10.175 13.687 1.00 0.00 N ATOM 89 CA ASP A 384 2.336 9.481 13.339 1.00 0.00 C ATOM 90 C ASP A 384 1.168 10.375 13.724 1.00 0.00 C ATOM 91 O ASP A 384 0.222 9.953 14.386 1.00 0.00 O ATOM 92 CB ASP A 384 2.251 8.147 14.090 1.00 0.00 C ATOM 93 CG ASP A 384 1.521 7.072 13.310 1.00 0.00 C ATOM 94 OD1 ASP A 384 0.301 7.216 13.069 1.00 0.00 O ATOM 95 OD2 ASP A 384 2.162 6.062 12.940 1.00 0.00 O ATOM 0 H ASP A 384 3.438 10.904 14.388 1.00 0.00 H new ATOM 0 HA ASP A 384 2.312 9.269 12.270 1.00 0.00 H new ATOM 0 HB2 ASP A 384 3.259 7.801 14.319 1.00 0.00 H new ATOM 0 HB3 ASP A 384 1.744 8.304 15.042 1.00 0.00 H new ATOM 100 N ASP A 385 1.263 11.630 13.306 1.00 0.00 N ATOM 101 CA ASP A 385 0.263 12.639 13.634 1.00 0.00 C ATOM 102 C ASP A 385 -1.065 12.442 12.901 1.00 0.00 C ATOM 103 O ASP A 385 -2.093 12.953 13.342 1.00 0.00 O ATOM 104 CB ASP A 385 0.828 14.034 13.337 1.00 0.00 C ATOM 105 CG ASP A 385 -0.061 15.160 13.830 1.00 0.00 C ATOM 106 OD1 ASP A 385 -0.298 15.244 15.050 1.00 0.00 O ATOM 107 OD2 ASP A 385 -0.504 15.977 12.991 1.00 0.00 O ATOM 0 H ASP A 385 2.032 11.977 12.732 1.00 0.00 H new ATOM 0 HA ASP A 385 0.043 12.534 14.696 1.00 0.00 H new ATOM 0 HB2 ASP A 385 1.810 14.127 13.801 1.00 0.00 H new ATOM 0 HB3 ASP A 385 0.972 14.139 12.262 1.00 0.00 H new ATOM 112 N GLU A 386 -1.069 11.686 11.806 1.00 0.00 N ATOM 113 CA GLU A 386 -2.282 11.481 11.047 1.00 0.00 C ATOM 114 C GLU A 386 -2.025 10.475 9.957 1.00 0.00 C ATOM 115 O GLU A 386 -1.582 10.832 8.868 1.00 0.00 O ATOM 116 CB GLU A 386 -2.738 12.790 10.414 1.00 0.00 C ATOM 117 CG GLU A 386 -4.210 13.100 10.572 1.00 0.00 C ATOM 118 CD GLU A 386 -4.602 14.337 9.796 1.00 0.00 C ATOM 119 OE1 GLU A 386 -4.058 15.420 10.100 1.00 0.00 O ATOM 120 OE2 GLU A 386 -5.418 14.223 8.865 1.00 0.00 O ATOM 0 H GLU A 386 -0.247 11.211 11.433 1.00 0.00 H new ATOM 0 HA GLU A 386 -3.059 11.117 11.719 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -2.162 13.606 10.849 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -2.500 12.764 9.351 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -4.801 12.251 10.228 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -4.442 13.243 11.628 1.00 0.00 H new ATOM 127 N PHE A 387 -2.245 9.220 10.261 1.00 0.00 N ATOM 128 CA PHE A 387 -2.041 8.182 9.282 1.00 0.00 C ATOM 129 C PHE A 387 -3.239 7.252 9.252 1.00 0.00 C ATOM 130 O PHE A 387 -3.572 6.617 10.253 1.00 0.00 O ATOM 131 CB PHE A 387 -0.761 7.380 9.565 1.00 0.00 C ATOM 132 CG PHE A 387 0.520 8.128 9.307 1.00 0.00 C ATOM 133 CD1 PHE A 387 1.026 9.005 10.252 1.00 0.00 C ATOM 134 CD2 PHE A 387 1.221 7.952 8.123 1.00 0.00 C ATOM 135 CE1 PHE A 387 2.197 9.692 10.024 1.00 0.00 C ATOM 136 CE2 PHE A 387 2.394 8.639 7.892 1.00 0.00 C ATOM 137 CZ PHE A 387 2.881 9.509 8.844 1.00 0.00 C ATOM 0 H PHE A 387 -2.564 8.894 11.173 1.00 0.00 H new ATOM 0 HA PHE A 387 -1.928 8.660 8.309 1.00 0.00 H new ATOM 0 HB2 PHE A 387 -0.774 7.057 10.606 1.00 0.00 H new ATOM 0 HB3 PHE A 387 -0.770 6.479 8.951 1.00 0.00 H new ATOM 0 HD1 PHE A 387 0.495 9.152 11.181 1.00 0.00 H new ATOM 0 HD2 PHE A 387 0.844 7.270 7.375 1.00 0.00 H new ATOM 0 HE1 PHE A 387 2.578 10.374 10.770 1.00 0.00 H new ATOM 0 HE2 PHE A 387 2.931 8.496 6.966 1.00 0.00 H new ATOM 0 HZ PHE A 387 3.800 10.047 8.664 1.00 0.00 H new ATOM 147 N GLU A 388 -3.856 7.162 8.091 1.00 0.00 N ATOM 148 CA GLU A 388 -5.018 6.322 7.898 1.00 0.00 C ATOM 149 C GLU A 388 -4.551 4.941 7.560 1.00 0.00 C ATOM 150 O GLU A 388 -3.773 4.783 6.620 1.00 0.00 O ATOM 151 CB GLU A 388 -5.883 6.838 6.744 1.00 0.00 C ATOM 152 CG GLU A 388 -6.684 8.080 7.072 1.00 0.00 C ATOM 153 CD GLU A 388 -7.711 7.841 8.162 1.00 0.00 C ATOM 154 OE1 GLU A 388 -7.312 7.757 9.343 1.00 0.00 O ATOM 155 OE2 GLU A 388 -8.909 7.732 7.835 1.00 0.00 O ATOM 0 H GLU A 388 -3.565 7.670 7.256 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.613 6.328 8.812 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -5.240 7.050 5.890 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.569 6.048 6.438 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.005 8.873 7.385 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.190 8.430 6.172 1.00 0.00 H new ATOM 162 N GLU A 389 -4.975 3.949 8.319 1.00 0.00 N ATOM 163 CA GLU A 389 -4.569 2.599 8.014 1.00 0.00 C ATOM 164 C GLU A 389 -5.145 2.239 6.662 1.00 0.00 C ATOM 165 O GLU A 389 -6.346 2.010 6.520 1.00 0.00 O ATOM 166 CB GLU A 389 -5.029 1.610 9.089 1.00 0.00 C ATOM 167 CG GLU A 389 -3.890 1.065 9.934 1.00 0.00 C ATOM 168 CD GLU A 389 -3.793 -0.453 9.915 1.00 0.00 C ATOM 169 OE1 GLU A 389 -4.811 -1.128 10.174 1.00 0.00 O ATOM 170 OE2 GLU A 389 -2.689 -0.983 9.653 1.00 0.00 O ATOM 0 H GLU A 389 -5.585 4.051 9.130 1.00 0.00 H new ATOM 0 HA GLU A 389 -3.481 2.540 7.992 1.00 0.00 H new ATOM 0 HB2 GLU A 389 -5.751 2.102 9.740 1.00 0.00 H new ATOM 0 HB3 GLU A 389 -5.546 0.779 8.610 1.00 0.00 H new ATOM 0 HG2 GLU A 389 -2.950 1.486 9.577 1.00 0.00 H new ATOM 0 HG3 GLU A 389 -4.019 1.400 10.963 1.00 0.00 H new ATOM 177 N VAL A 390 -4.281 2.213 5.666 1.00 0.00 N ATOM 178 CA VAL A 390 -4.705 1.904 4.338 1.00 0.00 C ATOM 179 C VAL A 390 -4.924 0.416 4.236 1.00 0.00 C ATOM 180 O VAL A 390 -3.978 -0.371 4.323 1.00 0.00 O ATOM 181 CB VAL A 390 -3.702 2.309 3.246 1.00 0.00 C ATOM 182 CG1 VAL A 390 -4.373 2.286 1.884 1.00 0.00 C ATOM 183 CG2 VAL A 390 -3.111 3.668 3.514 1.00 0.00 C ATOM 0 H VAL A 390 -3.284 2.404 5.763 1.00 0.00 H new ATOM 0 HA VAL A 390 -5.615 2.478 4.166 1.00 0.00 H new ATOM 0 HB VAL A 390 -2.887 1.585 3.256 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -3.653 2.575 1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -4.740 1.281 1.676 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -5.209 2.986 1.878 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.407 3.921 2.722 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -3.907 4.412 3.543 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -2.591 3.656 4.472 1.00 0.00 H new ATOM 193 N ALA A 391 -6.160 0.041 4.079 1.00 0.00 N ATOM 194 CA ALA A 391 -6.515 -1.346 3.966 1.00 0.00 C ATOM 195 C ALA A 391 -6.132 -1.858 2.598 1.00 0.00 C ATOM 196 O ALA A 391 -6.189 -1.125 1.613 1.00 0.00 O ATOM 197 CB ALA A 391 -8.002 -1.543 4.218 1.00 0.00 C ATOM 0 H ALA A 391 -6.949 0.685 4.026 1.00 0.00 H new ATOM 0 HA ALA A 391 -5.971 -1.913 4.721 1.00 0.00 H new ATOM 0 HB1 ALA A 391 -8.249 -2.601 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -8.250 -1.197 5.221 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -8.574 -0.973 3.486 1.00 0.00 H new ATOM 203 N ASP A 392 -5.672 -3.085 2.572 1.00 0.00 N ATOM 204 CA ASP A 392 -5.289 -3.774 1.355 1.00 0.00 C ATOM 205 C ASP A 392 -6.526 -4.072 0.518 1.00 0.00 C ATOM 206 O ASP A 392 -6.925 -5.222 0.352 1.00 0.00 O ATOM 207 CB ASP A 392 -4.555 -5.070 1.706 1.00 0.00 C ATOM 208 CG ASP A 392 -5.113 -5.777 2.934 1.00 0.00 C ATOM 209 OD1 ASP A 392 -5.059 -5.190 4.043 1.00 0.00 O ATOM 210 OD2 ASP A 392 -5.566 -6.935 2.808 1.00 0.00 O ATOM 0 H ASP A 392 -5.549 -3.649 3.413 1.00 0.00 H new ATOM 0 HA ASP A 392 -4.621 -3.139 0.774 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -4.605 -5.748 0.854 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -3.502 -4.846 1.874 1.00 0.00 H new ATOM 215 N ASP A 393 -7.113 -3.016 -0.013 1.00 0.00 N ATOM 216 CA ASP A 393 -8.326 -3.121 -0.796 1.00 0.00 C ATOM 217 C ASP A 393 -8.045 -3.170 -2.292 1.00 0.00 C ATOM 218 O ASP A 393 -7.480 -2.237 -2.864 1.00 0.00 O ATOM 219 CB ASP A 393 -9.229 -1.939 -0.473 1.00 0.00 C ATOM 220 CG ASP A 393 -10.698 -2.247 -0.702 1.00 0.00 C ATOM 221 OD1 ASP A 393 -11.227 -3.168 -0.051 1.00 0.00 O ATOM 222 OD2 ASP A 393 -11.337 -1.566 -1.534 1.00 0.00 O ATOM 0 H ASP A 393 -6.762 -2.064 0.087 1.00 0.00 H new ATOM 0 HA ASP A 393 -8.818 -4.057 -0.533 1.00 0.00 H new ATOM 0 HB2 ASP A 393 -9.081 -1.647 0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 393 -8.940 -1.087 -1.088 1.00 0.00 H new ATOM 227 N PRO A 394 -8.442 -4.268 -2.941 1.00 0.00 N ATOM 228 CA PRO A 394 -8.252 -4.459 -4.374 1.00 0.00 C ATOM 229 C PRO A 394 -9.312 -3.733 -5.201 1.00 0.00 C ATOM 230 O PRO A 394 -10.327 -3.271 -4.675 1.00 0.00 O ATOM 231 CB PRO A 394 -8.405 -5.970 -4.534 1.00 0.00 C ATOM 232 CG PRO A 394 -9.368 -6.352 -3.470 1.00 0.00 C ATOM 233 CD PRO A 394 -9.105 -5.424 -2.314 1.00 0.00 C ATOM 0 HA PRO A 394 -7.298 -4.063 -4.722 1.00 0.00 H new ATOM 0 HB2 PRO A 394 -8.781 -6.230 -5.524 1.00 0.00 H new ATOM 0 HB3 PRO A 394 -7.451 -6.482 -4.411 1.00 0.00 H new ATOM 0 HG2 PRO A 394 -10.395 -6.255 -3.821 1.00 0.00 H new ATOM 0 HG3 PRO A 394 -9.229 -7.392 -3.174 1.00 0.00 H new ATOM 0 HD2 PRO A 394 -10.029 -5.134 -1.815 1.00 0.00 H new ATOM 0 HD3 PRO A 394 -8.469 -5.891 -1.562 1.00 0.00 H new ATOM 241 N ILE A 395 -9.078 -3.656 -6.497 1.00 0.00 N ATOM 242 CA ILE A 395 -10.007 -3.000 -7.404 1.00 0.00 C ATOM 243 C ILE A 395 -10.825 -4.047 -8.147 1.00 0.00 C ATOM 244 O ILE A 395 -10.280 -4.894 -8.853 1.00 0.00 O ATOM 245 CB ILE A 395 -9.271 -2.090 -8.422 1.00 0.00 C ATOM 246 CG1 ILE A 395 -8.820 -0.795 -7.744 1.00 0.00 C ATOM 247 CG2 ILE A 395 -10.152 -1.776 -9.631 1.00 0.00 C ATOM 248 CD1 ILE A 395 -9.953 -0.002 -7.129 1.00 0.00 C ATOM 0 H ILE A 395 -8.249 -4.041 -6.949 1.00 0.00 H new ATOM 0 HA ILE A 395 -10.666 -2.368 -6.808 1.00 0.00 H new ATOM 0 HB ILE A 395 -8.394 -2.630 -8.780 1.00 0.00 H new ATOM 0 HG12 ILE A 395 -8.094 -1.036 -6.968 1.00 0.00 H new ATOM 0 HG13 ILE A 395 -8.308 -0.171 -8.477 1.00 0.00 H new ATOM 0 HG21 ILE A 395 -9.605 -1.137 -10.324 1.00 0.00 H new ATOM 0 HG22 ILE A 395 -10.425 -2.704 -10.133 1.00 0.00 H new ATOM 0 HG23 ILE A 395 -11.055 -1.263 -9.300 1.00 0.00 H new ATOM 0 HD11 ILE A 395 -9.556 0.902 -6.667 1.00 0.00 H new ATOM 0 HD12 ILE A 395 -10.669 0.271 -7.904 1.00 0.00 H new ATOM 0 HD13 ILE A 395 -10.452 -0.607 -6.372 1.00 0.00 H new ATOM 260 N VAL A 396 -12.129 -3.991 -7.963 1.00 0.00 N ATOM 261 CA VAL A 396 -13.036 -4.916 -8.610 1.00 0.00 C ATOM 262 C VAL A 396 -14.030 -4.133 -9.456 1.00 0.00 C ATOM 263 O VAL A 396 -14.776 -3.294 -8.950 1.00 0.00 O ATOM 264 CB VAL A 396 -13.750 -5.833 -7.578 1.00 0.00 C ATOM 265 CG1 VAL A 396 -13.966 -5.117 -6.256 1.00 0.00 C ATOM 266 CG2 VAL A 396 -15.058 -6.384 -8.121 1.00 0.00 C ATOM 0 H VAL A 396 -12.588 -3.305 -7.363 1.00 0.00 H new ATOM 0 HA VAL A 396 -12.465 -5.577 -9.262 1.00 0.00 H new ATOM 0 HB VAL A 396 -13.090 -6.681 -7.395 1.00 0.00 H new ATOM 0 HG11 VAL A 396 -14.467 -5.787 -5.557 1.00 0.00 H new ATOM 0 HG12 VAL A 396 -13.003 -4.817 -5.843 1.00 0.00 H new ATOM 0 HG13 VAL A 396 -14.583 -4.233 -6.418 1.00 0.00 H new ATOM 0 HG21 VAL A 396 -15.525 -7.020 -7.369 1.00 0.00 H new ATOM 0 HG22 VAL A 396 -15.727 -5.559 -8.365 1.00 0.00 H new ATOM 0 HG23 VAL A 396 -14.861 -6.969 -9.019 1.00 0.00 H new ATOM 276 N MET A 397 -14.015 -4.392 -10.753 1.00 0.00 N ATOM 277 CA MET A 397 -14.879 -3.691 -11.670 1.00 0.00 C ATOM 278 C MET A 397 -16.267 -4.289 -11.640 1.00 0.00 C ATOM 279 O MET A 397 -16.431 -5.496 -11.487 1.00 0.00 O ATOM 280 CB MET A 397 -14.309 -3.748 -13.090 1.00 0.00 C ATOM 281 CG MET A 397 -12.795 -3.611 -13.142 1.00 0.00 C ATOM 282 SD MET A 397 -12.166 -3.389 -14.816 1.00 0.00 S ATOM 283 CE MET A 397 -12.619 -1.684 -15.113 1.00 0.00 C ATOM 0 H MET A 397 -13.409 -5.087 -11.190 1.00 0.00 H new ATOM 0 HA MET A 397 -14.940 -2.647 -11.362 1.00 0.00 H new ATOM 0 HB2 MET A 397 -14.596 -4.693 -13.551 1.00 0.00 H new ATOM 0 HB3 MET A 397 -14.758 -2.953 -13.686 1.00 0.00 H new ATOM 0 HG2 MET A 397 -12.491 -2.762 -12.530 1.00 0.00 H new ATOM 0 HG3 MET A 397 -12.340 -4.499 -12.703 1.00 0.00 H new ATOM 0 HE1 MET A 397 -13.200 -1.617 -16.033 1.00 0.00 H new ATOM 0 HE2 MET A 397 -13.217 -1.316 -14.279 1.00 0.00 H new ATOM 0 HE3 MET A 397 -11.717 -1.079 -15.208 1.00 0.00 H new ATOM 293 N VAL A 398 -17.253 -3.426 -11.732 1.00 0.00 N ATOM 294 CA VAL A 398 -18.637 -3.840 -11.747 1.00 0.00 C ATOM 295 C VAL A 398 -19.343 -3.196 -12.921 1.00 0.00 C ATOM 296 O VAL A 398 -19.397 -1.965 -13.026 1.00 0.00 O ATOM 297 CB VAL A 398 -19.368 -3.470 -10.450 1.00 0.00 C ATOM 298 CG1 VAL A 398 -20.839 -3.809 -10.578 1.00 0.00 C ATOM 299 CG2 VAL A 398 -18.754 -4.193 -9.263 1.00 0.00 C ATOM 0 H VAL A 398 -17.118 -2.417 -11.799 1.00 0.00 H new ATOM 0 HA VAL A 398 -18.654 -4.926 -11.838 1.00 0.00 H new ATOM 0 HB VAL A 398 -19.265 -2.398 -10.281 1.00 0.00 H new ATOM 0 HG11 VAL A 398 -21.355 -3.545 -9.655 1.00 0.00 H new ATOM 0 HG12 VAL A 398 -21.271 -3.249 -11.408 1.00 0.00 H new ATOM 0 HG13 VAL A 398 -20.951 -4.877 -10.764 1.00 0.00 H new ATOM 0 HG21 VAL A 398 -19.287 -3.917 -8.353 1.00 0.00 H new ATOM 0 HG22 VAL A 398 -18.829 -5.270 -9.414 1.00 0.00 H new ATOM 0 HG23 VAL A 398 -17.705 -3.912 -9.169 1.00 0.00 H new ATOM 309 N ALA A 399 -19.852 -4.032 -13.817 1.00 0.00 N ATOM 310 CA ALA A 399 -20.540 -3.576 -15.008 1.00 0.00 C ATOM 311 C ALA A 399 -19.590 -2.745 -15.867 1.00 0.00 C ATOM 312 O ALA A 399 -20.018 -1.861 -16.617 1.00 0.00 O ATOM 313 CB ALA A 399 -21.798 -2.793 -14.640 1.00 0.00 C ATOM 0 H ALA A 399 -19.797 -5.047 -13.734 1.00 0.00 H new ATOM 0 HA ALA A 399 -20.858 -4.441 -15.591 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -22.299 -2.460 -15.549 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -22.471 -3.433 -14.069 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -21.524 -1.926 -14.039 1.00 0.00 H new ATOM 319 N GLY A 400 -18.288 -3.024 -15.737 1.00 0.00 N ATOM 320 CA GLY A 400 -17.293 -2.303 -16.506 1.00 0.00 C ATOM 321 C GLY A 400 -16.783 -1.066 -15.790 1.00 0.00 C ATOM 322 O GLY A 400 -15.872 -0.392 -16.270 1.00 0.00 O ATOM 0 H GLY A 400 -17.912 -3.737 -15.112 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -16.454 -2.966 -16.720 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -17.722 -2.012 -17.465 1.00 0.00 H new ATOM 326 N ARG A 401 -17.369 -0.762 -14.641 1.00 0.00 N ATOM 327 CA ARG A 401 -16.962 0.399 -13.863 1.00 0.00 C ATOM 328 C ARG A 401 -16.003 -0.024 -12.760 1.00 0.00 C ATOM 329 O ARG A 401 -16.306 -0.923 -11.981 1.00 0.00 O ATOM 330 CB ARG A 401 -18.183 1.099 -13.266 1.00 0.00 C ATOM 331 CG ARG A 401 -18.820 2.111 -14.201 1.00 0.00 C ATOM 332 CD ARG A 401 -20.326 1.927 -14.278 1.00 0.00 C ATOM 333 NE ARG A 401 -20.706 0.886 -15.236 1.00 0.00 N ATOM 334 CZ ARG A 401 -21.891 0.828 -15.843 1.00 0.00 C ATOM 335 NH1 ARG A 401 -22.823 1.737 -15.575 1.00 0.00 N ATOM 336 NH2 ARG A 401 -22.143 -0.141 -16.714 1.00 0.00 N ATOM 0 H ARG A 401 -18.128 -1.303 -14.227 1.00 0.00 H new ATOM 0 HA ARG A 401 -16.453 1.101 -14.523 1.00 0.00 H new ATOM 0 HB2 ARG A 401 -18.926 0.348 -12.996 1.00 0.00 H new ATOM 0 HB3 ARG A 401 -17.889 1.602 -12.345 1.00 0.00 H new ATOM 0 HG2 ARG A 401 -18.593 3.120 -13.856 1.00 0.00 H new ATOM 0 HG3 ARG A 401 -18.389 2.010 -15.197 1.00 0.00 H new ATOM 0 HD2 ARG A 401 -20.710 1.668 -13.291 1.00 0.00 H new ATOM 0 HD3 ARG A 401 -20.792 2.870 -14.564 1.00 0.00 H new ATOM 0 HE ARG A 401 -20.022 0.161 -15.452 1.00 0.00 H new ATOM 0 HH11 ARG A 401 -22.632 2.481 -14.904 1.00 0.00 H new ATOM 0 HH12 ARG A 401 -23.729 1.691 -16.041 1.00 0.00 H new ATOM 0 HH21 ARG A 401 -21.430 -0.841 -16.919 1.00 0.00 H new ATOM 0 HH22 ARG A 401 -23.050 -0.186 -17.179 1.00 0.00 H new ATOM 350 N PRO A 402 -14.830 0.613 -12.683 1.00 0.00 N ATOM 351 CA PRO A 402 -13.816 0.283 -11.685 1.00 0.00 C ATOM 352 C PRO A 402 -14.185 0.754 -10.282 1.00 0.00 C ATOM 353 O PRO A 402 -14.205 1.951 -10.001 1.00 0.00 O ATOM 354 CB PRO A 402 -12.556 1.015 -12.176 1.00 0.00 C ATOM 355 CG PRO A 402 -12.898 1.570 -13.522 1.00 0.00 C ATOM 356 CD PRO A 402 -14.391 1.706 -13.556 1.00 0.00 C ATOM 0 HA PRO A 402 -13.691 -0.796 -11.597 1.00 0.00 H new ATOM 0 HB2 PRO A 402 -12.274 1.811 -11.486 1.00 0.00 H new ATOM 0 HB3 PRO A 402 -11.708 0.333 -12.240 1.00 0.00 H new ATOM 0 HG2 PRO A 402 -12.416 2.535 -13.678 1.00 0.00 H new ATOM 0 HG3 PRO A 402 -12.550 0.908 -14.315 1.00 0.00 H new ATOM 0 HD2 PRO A 402 -14.718 2.677 -13.186 1.00 0.00 H new ATOM 0 HD3 PRO A 402 -14.785 1.601 -14.567 1.00 0.00 H new ATOM 364 N PHE A 403 -14.489 -0.199 -9.416 1.00 0.00 N ATOM 365 CA PHE A 403 -14.829 0.093 -8.034 1.00 0.00 C ATOM 366 C PHE A 403 -13.844 -0.617 -7.122 1.00 0.00 C ATOM 367 O PHE A 403 -13.132 -1.518 -7.557 1.00 0.00 O ATOM 368 CB PHE A 403 -16.253 -0.375 -7.711 1.00 0.00 C ATOM 369 CG PHE A 403 -17.328 0.411 -8.406 1.00 0.00 C ATOM 370 CD1 PHE A 403 -17.560 1.738 -8.080 1.00 0.00 C ATOM 371 CD2 PHE A 403 -18.111 -0.183 -9.382 1.00 0.00 C ATOM 372 CE1 PHE A 403 -18.552 2.458 -8.719 1.00 0.00 C ATOM 373 CE2 PHE A 403 -19.103 0.531 -10.022 1.00 0.00 C ATOM 374 CZ PHE A 403 -19.325 1.853 -9.691 1.00 0.00 C ATOM 0 H PHE A 403 -14.507 -1.192 -9.650 1.00 0.00 H new ATOM 0 HA PHE A 403 -14.778 1.171 -7.879 1.00 0.00 H new ATOM 0 HB2 PHE A 403 -16.350 -1.425 -7.986 1.00 0.00 H new ATOM 0 HB3 PHE A 403 -16.410 -0.312 -6.634 1.00 0.00 H new ATOM 0 HD1 PHE A 403 -16.960 2.214 -7.319 1.00 0.00 H new ATOM 0 HD2 PHE A 403 -17.943 -1.217 -9.645 1.00 0.00 H new ATOM 0 HE1 PHE A 403 -18.722 3.492 -8.459 1.00 0.00 H new ATOM 0 HE2 PHE A 403 -19.706 0.056 -10.782 1.00 0.00 H new ATOM 0 HZ PHE A 403 -20.101 2.413 -10.191 1.00 0.00 H new ATOM 384 N SER A 404 -13.778 -0.206 -5.876 1.00 0.00 N ATOM 385 CA SER A 404 -12.893 -0.850 -4.930 1.00 0.00 C ATOM 386 C SER A 404 -13.654 -1.973 -4.237 1.00 0.00 C ATOM 387 O SER A 404 -14.880 -2.018 -4.296 1.00 0.00 O ATOM 388 CB SER A 404 -12.378 0.164 -3.915 1.00 0.00 C ATOM 389 OG SER A 404 -12.299 1.459 -4.490 1.00 0.00 O ATOM 0 H SER A 404 -14.323 0.567 -5.495 1.00 0.00 H new ATOM 0 HA SER A 404 -12.030 -1.266 -5.451 1.00 0.00 H new ATOM 0 HB2 SER A 404 -13.039 0.186 -3.049 1.00 0.00 H new ATOM 0 HB3 SER A 404 -11.394 -0.140 -3.557 1.00 0.00 H new ATOM 0 HG SER A 404 -11.968 2.094 -3.821 1.00 0.00 H new ATOM 395 N TYR A 405 -12.943 -2.872 -3.588 1.00 0.00 N ATOM 396 CA TYR A 405 -13.578 -3.985 -2.900 1.00 0.00 C ATOM 397 C TYR A 405 -14.429 -3.463 -1.756 1.00 0.00 C ATOM 398 O TYR A 405 -15.553 -3.916 -1.556 1.00 0.00 O ATOM 399 CB TYR A 405 -12.540 -4.979 -2.384 1.00 0.00 C ATOM 400 CG TYR A 405 -13.136 -6.306 -1.970 1.00 0.00 C ATOM 401 CD1 TYR A 405 -13.681 -6.486 -0.704 1.00 0.00 C ATOM 402 CD2 TYR A 405 -13.167 -7.376 -2.855 1.00 0.00 C ATOM 403 CE1 TYR A 405 -14.238 -7.694 -0.332 1.00 0.00 C ATOM 404 CE2 TYR A 405 -13.724 -8.584 -2.491 1.00 0.00 C ATOM 405 CZ TYR A 405 -14.259 -8.739 -1.229 1.00 0.00 C ATOM 406 OH TYR A 405 -14.821 -9.941 -0.869 1.00 0.00 O ATOM 0 H TYR A 405 -11.925 -2.857 -3.521 1.00 0.00 H new ATOM 0 HA TYR A 405 -14.216 -4.511 -3.610 1.00 0.00 H new ATOM 0 HB2 TYR A 405 -11.794 -5.150 -3.160 1.00 0.00 H new ATOM 0 HB3 TYR A 405 -12.020 -4.541 -1.532 1.00 0.00 H new ATOM 0 HD1 TYR A 405 -13.669 -5.668 0.001 1.00 0.00 H new ATOM 0 HD2 TYR A 405 -12.748 -7.260 -3.844 1.00 0.00 H new ATOM 0 HE1 TYR A 405 -14.655 -7.818 0.657 1.00 0.00 H new ATOM 0 HE2 TYR A 405 -13.741 -9.406 -3.192 1.00 0.00 H new ATOM 0 HH TYR A 405 -14.559 -10.163 0.049 1.00 0.00 H new ATOM 416 N SER A 406 -13.894 -2.493 -1.026 1.00 0.00 N ATOM 417 CA SER A 406 -14.606 -1.876 0.086 1.00 0.00 C ATOM 418 C SER A 406 -15.857 -1.167 -0.425 1.00 0.00 C ATOM 419 O SER A 406 -16.787 -0.893 0.325 1.00 0.00 O ATOM 420 CB SER A 406 -13.690 -0.884 0.806 1.00 0.00 C ATOM 421 OG SER A 406 -13.008 -0.055 -0.123 1.00 0.00 O ATOM 0 H SER A 406 -12.961 -2.114 -1.186 1.00 0.00 H new ATOM 0 HA SER A 406 -14.907 -2.651 0.791 1.00 0.00 H new ATOM 0 HB2 SER A 406 -14.278 -0.267 1.485 1.00 0.00 H new ATOM 0 HB3 SER A 406 -12.966 -1.427 1.414 1.00 0.00 H new ATOM 0 HG SER A 406 -12.298 -0.570 -0.561 1.00 0.00 H new ATOM 427 N GLU A 407 -15.869 -0.908 -1.723 1.00 0.00 N ATOM 428 CA GLU A 407 -16.979 -0.248 -2.380 1.00 0.00 C ATOM 429 C GLU A 407 -18.002 -1.270 -2.851 1.00 0.00 C ATOM 430 O GLU A 407 -19.190 -1.173 -2.552 1.00 0.00 O ATOM 431 CB GLU A 407 -16.454 0.568 -3.561 1.00 0.00 C ATOM 432 CG GLU A 407 -16.123 2.009 -3.208 1.00 0.00 C ATOM 433 CD GLU A 407 -17.371 2.855 -3.034 1.00 0.00 C ATOM 434 OE1 GLU A 407 -18.387 2.325 -2.545 1.00 0.00 O ATOM 435 OE2 GLU A 407 -17.354 4.043 -3.410 1.00 0.00 O ATOM 0 H GLU A 407 -15.103 -1.152 -2.351 1.00 0.00 H new ATOM 0 HA GLU A 407 -17.470 0.420 -1.673 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -15.560 0.085 -3.956 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -17.199 0.560 -4.357 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -15.539 2.031 -2.288 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -15.500 2.440 -3.992 1.00 0.00 H new ATOM 442 N VAL A 408 -17.516 -2.267 -3.570 1.00 0.00 N ATOM 443 CA VAL A 408 -18.361 -3.322 -4.101 1.00 0.00 C ATOM 444 C VAL A 408 -19.025 -4.125 -2.980 1.00 0.00 C ATOM 445 O VAL A 408 -20.159 -4.578 -3.116 1.00 0.00 O ATOM 446 CB VAL A 408 -17.542 -4.279 -4.994 1.00 0.00 C ATOM 447 CG1 VAL A 408 -18.421 -5.358 -5.575 1.00 0.00 C ATOM 448 CG2 VAL A 408 -16.839 -3.523 -6.108 1.00 0.00 C ATOM 0 H VAL A 408 -16.528 -2.368 -3.801 1.00 0.00 H new ATOM 0 HA VAL A 408 -19.138 -2.843 -4.696 1.00 0.00 H new ATOM 0 HB VAL A 408 -16.785 -4.747 -4.365 1.00 0.00 H new ATOM 0 HG11 VAL A 408 -17.821 -6.019 -6.200 1.00 0.00 H new ATOM 0 HG12 VAL A 408 -18.873 -5.934 -4.767 1.00 0.00 H new ATOM 0 HG13 VAL A 408 -19.206 -4.902 -6.178 1.00 0.00 H new ATOM 0 HG21 VAL A 408 -16.270 -4.223 -6.720 1.00 0.00 H new ATOM 0 HG22 VAL A 408 -17.579 -3.017 -6.728 1.00 0.00 H new ATOM 0 HG23 VAL A 408 -16.162 -2.786 -5.676 1.00 0.00 H new ATOM 458 N SER A 409 -18.325 -4.269 -1.864 1.00 0.00 N ATOM 459 CA SER A 409 -18.839 -5.038 -0.734 1.00 0.00 C ATOM 460 C SER A 409 -19.900 -4.269 0.040 1.00 0.00 C ATOM 461 O SER A 409 -20.852 -4.856 0.556 1.00 0.00 O ATOM 462 CB SER A 409 -17.700 -5.426 0.211 1.00 0.00 C ATOM 463 OG SER A 409 -16.968 -4.287 0.631 1.00 0.00 O ATOM 0 H SER A 409 -17.400 -3.865 -1.714 1.00 0.00 H new ATOM 0 HA SER A 409 -19.300 -5.938 -1.141 1.00 0.00 H new ATOM 0 HB2 SER A 409 -18.106 -5.941 1.082 1.00 0.00 H new ATOM 0 HB3 SER A 409 -17.031 -6.126 -0.290 1.00 0.00 H new ATOM 0 HG SER A 409 -16.268 -4.088 -0.025 1.00 0.00 H new ATOM 469 N GLN A 410 -19.736 -2.958 0.121 1.00 0.00 N ATOM 470 CA GLN A 410 -20.674 -2.127 0.859 1.00 0.00 C ATOM 471 C GLN A 410 -21.886 -1.772 0.011 1.00 0.00 C ATOM 472 O GLN A 410 -22.894 -1.293 0.529 1.00 0.00 O ATOM 473 CB GLN A 410 -19.994 -0.848 1.352 1.00 0.00 C ATOM 474 CG GLN A 410 -18.929 -1.076 2.421 1.00 0.00 C ATOM 475 CD GLN A 410 -19.259 -2.216 3.365 1.00 0.00 C ATOM 476 OE1 GLN A 410 -19.967 -2.036 4.353 1.00 0.00 O ATOM 477 NE2 GLN A 410 -18.726 -3.395 3.078 1.00 0.00 N ATOM 0 H GLN A 410 -18.966 -2.448 -0.313 1.00 0.00 H new ATOM 0 HA GLN A 410 -21.013 -2.704 1.719 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -19.536 -0.343 0.502 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -20.754 -0.176 1.750 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -17.975 -1.281 1.935 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -18.803 -0.160 2.999 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -18.144 -3.503 2.248 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -18.898 -4.195 3.687 1.00 0.00 H new ATOM 486 N ARG A 411 -21.790 -2.005 -1.290 1.00 0.00 N ATOM 487 CA ARG A 411 -22.887 -1.696 -2.191 1.00 0.00 C ATOM 488 C ARG A 411 -23.511 -2.958 -2.783 1.00 0.00 C ATOM 489 O ARG A 411 -23.016 -3.518 -3.775 1.00 0.00 O ATOM 490 CB ARG A 411 -22.417 -0.776 -3.312 1.00 0.00 C ATOM 491 CG ARG A 411 -21.914 0.571 -2.826 1.00 0.00 C ATOM 492 CD ARG A 411 -21.698 1.520 -3.986 1.00 0.00 C ATOM 493 NE ARG A 411 -20.729 2.567 -3.670 1.00 0.00 N ATOM 494 CZ ARG A 411 -20.940 3.865 -3.850 1.00 0.00 C ATOM 495 NH1 ARG A 411 -22.133 4.300 -4.250 1.00 0.00 N ATOM 496 NH2 ARG A 411 -19.960 4.730 -3.613 1.00 0.00 N ATOM 0 H ARG A 411 -20.968 -2.405 -1.742 1.00 0.00 H new ATOM 0 HA ARG A 411 -23.652 -1.187 -1.604 1.00 0.00 H new ATOM 0 HB2 ARG A 411 -21.621 -1.272 -3.867 1.00 0.00 H new ATOM 0 HB3 ARG A 411 -23.240 -0.617 -4.008 1.00 0.00 H new ATOM 0 HG2 ARG A 411 -22.632 1.001 -2.128 1.00 0.00 H new ATOM 0 HG3 ARG A 411 -20.980 0.439 -2.280 1.00 0.00 H new ATOM 0 HD2 ARG A 411 -21.353 0.958 -4.854 1.00 0.00 H new ATOM 0 HD3 ARG A 411 -22.648 1.978 -4.260 1.00 0.00 H new ATOM 0 HE ARG A 411 -19.829 2.281 -3.285 1.00 0.00 H new ATOM 0 HH11 ARG A 411 -22.888 3.635 -4.419 1.00 0.00 H new ATOM 0 HH12 ARG A 411 -22.292 5.298 -4.387 1.00 0.00 H new ATOM 0 HH21 ARG A 411 -19.051 4.396 -3.294 1.00 0.00 H new ATOM 0 HH22 ARG A 411 -20.117 5.729 -3.750 1.00 0.00 H new ATOM 510 N PRO A 412 -24.614 -3.423 -2.180 1.00 0.00 N ATOM 511 CA PRO A 412 -25.332 -4.604 -2.648 1.00 0.00 C ATOM 512 C PRO A 412 -25.832 -4.431 -4.079 1.00 0.00 C ATOM 513 O PRO A 412 -26.002 -5.409 -4.801 1.00 0.00 O ATOM 514 CB PRO A 412 -26.513 -4.728 -1.679 1.00 0.00 C ATOM 515 CG PRO A 412 -26.105 -3.956 -0.474 1.00 0.00 C ATOM 516 CD PRO A 412 -25.239 -2.840 -0.979 1.00 0.00 C ATOM 0 HA PRO A 412 -24.695 -5.488 -2.664 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -27.426 -4.324 -2.116 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -26.712 -5.771 -1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -26.975 -3.567 0.055 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -25.560 -4.587 0.229 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -25.824 -1.952 -1.219 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -24.494 -2.541 -0.241 1.00 0.00 H new ATOM 524 N GLU A 413 -26.045 -3.179 -4.490 1.00 0.00 N ATOM 525 CA GLU A 413 -26.519 -2.887 -5.836 1.00 0.00 C ATOM 526 C GLU A 413 -25.406 -3.157 -6.829 1.00 0.00 C ATOM 527 O GLU A 413 -25.655 -3.580 -7.952 1.00 0.00 O ATOM 528 CB GLU A 413 -26.971 -1.430 -5.979 1.00 0.00 C ATOM 529 CG GLU A 413 -27.512 -0.814 -4.705 1.00 0.00 C ATOM 530 CD GLU A 413 -26.431 -0.092 -3.930 1.00 0.00 C ATOM 531 OE1 GLU A 413 -25.713 -0.763 -3.167 1.00 0.00 O ATOM 532 OE2 GLU A 413 -26.283 1.132 -4.107 1.00 0.00 O ATOM 0 H GLU A 413 -25.896 -2.355 -3.908 1.00 0.00 H new ATOM 0 HA GLU A 413 -27.377 -3.529 -6.033 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -26.128 -0.833 -6.327 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -27.740 -1.375 -6.750 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -28.313 -0.116 -4.950 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -27.949 -1.593 -4.081 1.00 0.00 H new ATOM 539 N LEU A 414 -24.173 -2.917 -6.400 1.00 0.00 N ATOM 540 CA LEU A 414 -23.024 -3.148 -7.253 1.00 0.00 C ATOM 541 C LEU A 414 -22.911 -4.625 -7.561 1.00 0.00 C ATOM 542 O LEU A 414 -22.816 -5.014 -8.714 1.00 0.00 O ATOM 543 CB LEU A 414 -21.735 -2.648 -6.602 1.00 0.00 C ATOM 544 CG LEU A 414 -21.527 -1.135 -6.653 1.00 0.00 C ATOM 545 CD1 LEU A 414 -20.103 -0.786 -6.256 1.00 0.00 C ATOM 546 CD2 LEU A 414 -21.843 -0.595 -8.038 1.00 0.00 C ATOM 0 H LEU A 414 -23.948 -2.564 -5.470 1.00 0.00 H new ATOM 0 HA LEU A 414 -23.167 -2.589 -8.178 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -21.726 -2.965 -5.559 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -20.889 -3.132 -7.090 1.00 0.00 H new ATOM 0 HG LEU A 414 -22.210 -0.669 -5.943 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -19.968 0.295 -6.297 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -19.911 -1.138 -5.242 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -19.406 -1.264 -6.944 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -21.688 0.484 -8.052 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -21.187 -1.065 -8.770 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -22.881 -0.816 -8.287 1.00 0.00 H new ATOM 558 N VAL A 415 -22.977 -5.450 -6.530 1.00 0.00 N ATOM 559 CA VAL A 415 -22.887 -6.895 -6.721 1.00 0.00 C ATOM 560 C VAL A 415 -24.144 -7.401 -7.434 1.00 0.00 C ATOM 561 O VAL A 415 -24.142 -8.452 -8.073 1.00 0.00 O ATOM 562 CB VAL A 415 -22.685 -7.627 -5.370 1.00 0.00 C ATOM 563 CG1 VAL A 415 -22.665 -9.139 -5.546 1.00 0.00 C ATOM 564 CG2 VAL A 415 -21.396 -7.160 -4.711 1.00 0.00 C ATOM 0 H VAL A 415 -23.091 -5.153 -5.561 1.00 0.00 H new ATOM 0 HA VAL A 415 -22.017 -7.111 -7.342 1.00 0.00 H new ATOM 0 HB VAL A 415 -23.531 -7.379 -4.728 1.00 0.00 H new ATOM 0 HG11 VAL A 415 -22.521 -9.616 -4.577 1.00 0.00 H new ATOM 0 HG12 VAL A 415 -23.611 -9.468 -5.976 1.00 0.00 H new ATOM 0 HG13 VAL A 415 -21.848 -9.417 -6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 415 -21.263 -7.680 -3.762 1.00 0.00 H new ATOM 0 HG22 VAL A 415 -20.553 -7.379 -5.366 1.00 0.00 H new ATOM 0 HG23 VAL A 415 -21.447 -6.086 -4.532 1.00 0.00 H new ATOM 574 N ALA A 416 -25.203 -6.610 -7.349 1.00 0.00 N ATOM 575 CA ALA A 416 -26.469 -6.939 -7.984 1.00 0.00 C ATOM 576 C ALA A 416 -26.481 -6.497 -9.442 1.00 0.00 C ATOM 577 O ALA A 416 -27.367 -6.873 -10.209 1.00 0.00 O ATOM 578 CB ALA A 416 -27.605 -6.274 -7.237 1.00 0.00 C ATOM 0 H ALA A 416 -25.209 -5.726 -6.840 1.00 0.00 H new ATOM 0 HA ALA A 416 -26.596 -8.021 -7.954 1.00 0.00 H new ATOM 0 HB1 ALA A 416 -28.551 -6.524 -7.717 1.00 0.00 H new ATOM 0 HB2 ALA A 416 -27.617 -6.626 -6.205 1.00 0.00 H new ATOM 0 HB3 ALA A 416 -27.466 -5.193 -7.250 1.00 0.00 H new ATOM 584 N GLN A 417 -25.511 -5.674 -9.813 1.00 0.00 N ATOM 585 CA GLN A 417 -25.403 -5.191 -11.178 1.00 0.00 C ATOM 586 C GLN A 417 -24.100 -5.677 -11.761 1.00 0.00 C ATOM 587 O GLN A 417 -23.748 -5.358 -12.896 1.00 0.00 O ATOM 588 CB GLN A 417 -25.473 -3.662 -11.236 1.00 0.00 C ATOM 589 CG GLN A 417 -26.837 -3.105 -10.870 1.00 0.00 C ATOM 590 CD GLN A 417 -27.895 -3.420 -11.912 1.00 0.00 C ATOM 591 OE1 GLN A 417 -28.169 -2.613 -12.797 1.00 0.00 O ATOM 592 NE2 GLN A 417 -28.485 -4.603 -11.823 1.00 0.00 N ATOM 0 H GLN A 417 -24.787 -5.327 -9.184 1.00 0.00 H new ATOM 0 HA GLN A 417 -26.241 -5.578 -11.759 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -24.726 -3.246 -10.560 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -25.212 -3.332 -12.242 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -27.146 -3.514 -9.908 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -26.763 -2.024 -10.748 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -28.229 -5.245 -11.073 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -29.195 -4.871 -12.505 1.00 0.00 H new ATOM 601 N MET A 418 -23.384 -6.450 -10.963 1.00 0.00 N ATOM 602 CA MET A 418 -22.125 -6.992 -11.389 1.00 0.00 C ATOM 603 C MET A 418 -22.387 -8.289 -12.112 1.00 0.00 C ATOM 604 O MET A 418 -23.271 -9.066 -11.742 1.00 0.00 O ATOM 605 CB MET A 418 -21.167 -7.169 -10.201 1.00 0.00 C ATOM 606 CG MET A 418 -21.053 -8.581 -9.658 1.00 0.00 C ATOM 607 SD MET A 418 -20.296 -8.622 -8.019 1.00 0.00 S ATOM 608 CE MET A 418 -18.838 -7.618 -8.283 1.00 0.00 C ATOM 0 H MET A 418 -23.662 -6.711 -10.017 1.00 0.00 H new ATOM 0 HA MET A 418 -21.631 -6.301 -12.072 1.00 0.00 H new ATOM 0 HB2 MET A 418 -20.175 -6.834 -10.504 1.00 0.00 H new ATOM 0 HB3 MET A 418 -21.492 -6.513 -9.394 1.00 0.00 H new ATOM 0 HG2 MET A 418 -22.045 -9.031 -9.610 1.00 0.00 H new ATOM 0 HG3 MET A 418 -20.461 -9.186 -10.345 1.00 0.00 H new ATOM 0 HE1 MET A 418 -18.083 -7.869 -7.538 1.00 0.00 H new ATOM 0 HE2 MET A 418 -18.441 -7.808 -9.280 1.00 0.00 H new ATOM 0 HE3 MET A 418 -19.101 -6.564 -8.192 1.00 0.00 H new ATOM 618 N THR A 419 -21.633 -8.500 -13.152 1.00 0.00 N ATOM 619 CA THR A 419 -21.783 -9.689 -13.972 1.00 0.00 C ATOM 620 C THR A 419 -21.314 -10.916 -13.207 1.00 0.00 C ATOM 621 O THR A 419 -20.597 -10.783 -12.215 1.00 0.00 O ATOM 622 CB THR A 419 -20.977 -9.564 -15.280 1.00 0.00 C ATOM 623 OG1 THR A 419 -19.634 -9.169 -14.984 1.00 0.00 O ATOM 624 CG2 THR A 419 -21.615 -8.550 -16.218 1.00 0.00 C ATOM 0 H THR A 419 -20.899 -7.863 -13.462 1.00 0.00 H new ATOM 0 HA THR A 419 -22.839 -9.794 -14.220 1.00 0.00 H new ATOM 0 HB THR A 419 -20.973 -10.535 -15.775 1.00 0.00 H new ATOM 0 HG1 THR A 419 -19.124 -9.092 -15.818 1.00 0.00 H new ATOM 0 HG21 THR A 419 -21.027 -8.481 -17.133 1.00 0.00 H new ATOM 0 HG22 THR A 419 -22.629 -8.867 -16.461 1.00 0.00 H new ATOM 0 HG23 THR A 419 -21.647 -7.575 -15.732 1.00 0.00 H new ATOM 632 N PRO A 420 -21.741 -12.125 -13.614 1.00 0.00 N ATOM 633 CA PRO A 420 -21.299 -13.356 -12.965 1.00 0.00 C ATOM 634 C PRO A 420 -19.779 -13.384 -12.889 1.00 0.00 C ATOM 635 O PRO A 420 -19.198 -13.756 -11.872 1.00 0.00 O ATOM 636 CB PRO A 420 -21.826 -14.458 -13.886 1.00 0.00 C ATOM 637 CG PRO A 420 -23.003 -13.849 -14.568 1.00 0.00 C ATOM 638 CD PRO A 420 -22.687 -12.384 -14.716 1.00 0.00 C ATOM 0 HA PRO A 420 -21.660 -13.463 -11.942 1.00 0.00 H new ATOM 0 HB2 PRO A 420 -21.068 -14.769 -14.605 1.00 0.00 H new ATOM 0 HB3 PRO A 420 -22.111 -15.345 -13.320 1.00 0.00 H new ATOM 0 HG2 PRO A 420 -23.173 -14.311 -15.540 1.00 0.00 H new ATOM 0 HG3 PRO A 420 -23.911 -13.995 -13.983 1.00 0.00 H new ATOM 0 HD2 PRO A 420 -22.243 -12.165 -15.687 1.00 0.00 H new ATOM 0 HD3 PRO A 420 -23.583 -11.769 -14.629 1.00 0.00 H new ATOM 646 N GLU A 421 -19.154 -12.932 -13.969 1.00 0.00 N ATOM 647 CA GLU A 421 -17.709 -12.855 -14.064 1.00 0.00 C ATOM 648 C GLU A 421 -17.156 -11.918 -12.995 1.00 0.00 C ATOM 649 O GLU A 421 -16.223 -12.272 -12.273 1.00 0.00 O ATOM 650 CB GLU A 421 -17.294 -12.358 -15.452 1.00 0.00 C ATOM 651 CG GLU A 421 -17.861 -13.185 -16.599 1.00 0.00 C ATOM 652 CD GLU A 421 -19.168 -12.632 -17.136 1.00 0.00 C ATOM 653 OE1 GLU A 421 -20.156 -12.584 -16.373 1.00 0.00 O ATOM 654 OE2 GLU A 421 -19.206 -12.246 -18.321 1.00 0.00 O ATOM 0 H GLU A 421 -19.641 -12.608 -14.805 1.00 0.00 H new ATOM 0 HA GLU A 421 -17.300 -13.853 -13.906 1.00 0.00 H new ATOM 0 HB2 GLU A 421 -17.617 -11.324 -15.568 1.00 0.00 H new ATOM 0 HB3 GLU A 421 -16.206 -12.361 -15.518 1.00 0.00 H new ATOM 0 HG2 GLU A 421 -17.130 -13.226 -17.407 1.00 0.00 H new ATOM 0 HG3 GLU A 421 -18.018 -14.209 -16.259 1.00 0.00 H new ATOM 661 N GLU A 422 -17.746 -10.726 -12.881 1.00 0.00 N ATOM 662 CA GLU A 422 -17.312 -9.749 -11.904 1.00 0.00 C ATOM 663 C GLU A 422 -17.595 -10.245 -10.488 1.00 0.00 C ATOM 664 O GLU A 422 -16.790 -10.044 -9.584 1.00 0.00 O ATOM 665 CB GLU A 422 -17.998 -8.418 -12.189 1.00 0.00 C ATOM 666 CG GLU A 422 -17.383 -7.695 -13.378 1.00 0.00 C ATOM 667 CD GLU A 422 -18.276 -6.610 -13.931 1.00 0.00 C ATOM 668 OE1 GLU A 422 -19.518 -6.741 -13.812 1.00 0.00 O ATOM 669 OE2 GLU A 422 -17.748 -5.626 -14.493 1.00 0.00 O ATOM 0 H GLU A 422 -18.528 -10.422 -13.460 1.00 0.00 H new ATOM 0 HA GLU A 422 -16.234 -9.603 -11.980 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -19.057 -8.591 -12.380 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -17.933 -7.782 -11.306 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -16.431 -7.257 -13.078 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -17.168 -8.418 -14.165 1.00 0.00 H new ATOM 676 N LYS A 423 -18.742 -10.888 -10.302 1.00 0.00 N ATOM 677 CA LYS A 423 -19.111 -11.450 -9.006 1.00 0.00 C ATOM 678 C LYS A 423 -18.116 -12.518 -8.579 1.00 0.00 C ATOM 679 O LYS A 423 -17.652 -12.518 -7.442 1.00 0.00 O ATOM 680 CB LYS A 423 -20.513 -12.056 -9.066 1.00 0.00 C ATOM 681 CG LYS A 423 -21.220 -12.087 -7.721 1.00 0.00 C ATOM 682 CD LYS A 423 -22.439 -12.997 -7.744 1.00 0.00 C ATOM 683 CE LYS A 423 -22.049 -14.460 -7.596 1.00 0.00 C ATOM 684 NZ LYS A 423 -21.585 -15.050 -8.880 1.00 0.00 N ATOM 0 H LYS A 423 -19.436 -11.034 -11.035 1.00 0.00 H new ATOM 0 HA LYS A 423 -19.099 -10.642 -8.275 1.00 0.00 H new ATOM 0 HB2 LYS A 423 -21.117 -11.485 -9.771 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -20.444 -13.072 -9.455 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -20.526 -12.429 -6.953 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -21.526 -11.077 -7.448 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -23.118 -12.718 -6.938 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -22.981 -12.857 -8.680 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -21.259 -14.550 -6.850 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -22.903 -15.026 -7.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -21.942 -16.023 -8.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -21.943 -14.481 -9.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -20.545 -15.059 -8.902 1.00 0.00 H new ATOM 698 N GLU A 424 -17.780 -13.415 -9.498 1.00 0.00 N ATOM 699 CA GLU A 424 -16.836 -14.484 -9.201 1.00 0.00 C ATOM 700 C GLU A 424 -15.473 -13.883 -8.926 1.00 0.00 C ATOM 701 O GLU A 424 -14.744 -14.332 -8.044 1.00 0.00 O ATOM 702 CB GLU A 424 -16.757 -15.486 -10.353 1.00 0.00 C ATOM 703 CG GLU A 424 -17.614 -16.728 -10.144 1.00 0.00 C ATOM 704 CD GLU A 424 -19.039 -16.406 -9.730 1.00 0.00 C ATOM 705 OE1 GLU A 424 -19.292 -16.244 -8.516 1.00 0.00 O ATOM 706 OE2 GLU A 424 -19.919 -16.303 -10.610 1.00 0.00 O ATOM 0 H GLU A 424 -18.145 -13.424 -10.450 1.00 0.00 H new ATOM 0 HA GLU A 424 -17.181 -15.024 -8.319 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -17.067 -14.992 -11.274 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -15.719 -15.790 -10.488 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -17.632 -17.309 -11.066 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -17.153 -17.356 -9.381 1.00 0.00 H new ATOM 713 N ALA A 425 -15.147 -12.848 -9.689 1.00 0.00 N ATOM 714 CA ALA A 425 -13.895 -12.140 -9.524 1.00 0.00 C ATOM 715 C ALA A 425 -13.855 -11.494 -8.147 1.00 0.00 C ATOM 716 O ALA A 425 -12.882 -11.635 -7.415 1.00 0.00 O ATOM 717 CB ALA A 425 -13.740 -11.095 -10.616 1.00 0.00 C ATOM 0 H ALA A 425 -15.741 -12.482 -10.433 1.00 0.00 H new ATOM 0 HA ALA A 425 -13.065 -12.842 -9.605 1.00 0.00 H new ATOM 0 HB1 ALA A 425 -12.795 -10.568 -10.483 1.00 0.00 H new ATOM 0 HB2 ALA A 425 -13.750 -11.583 -11.591 1.00 0.00 H new ATOM 0 HB3 ALA A 425 -14.564 -10.384 -10.558 1.00 0.00 H new ATOM 723 N TYR A 426 -14.944 -10.809 -7.798 1.00 0.00 N ATOM 724 CA TYR A 426 -15.069 -10.154 -6.509 1.00 0.00 C ATOM 725 C TYR A 426 -14.924 -11.174 -5.387 1.00 0.00 C ATOM 726 O TYR A 426 -14.190 -10.955 -4.422 1.00 0.00 O ATOM 727 CB TYR A 426 -16.430 -9.449 -6.422 1.00 0.00 C ATOM 728 CG TYR A 426 -16.859 -9.091 -5.017 1.00 0.00 C ATOM 729 CD1 TYR A 426 -16.444 -7.906 -4.426 1.00 0.00 C ATOM 730 CD2 TYR A 426 -17.674 -9.941 -4.282 1.00 0.00 C ATOM 731 CE1 TYR A 426 -16.829 -7.579 -3.141 1.00 0.00 C ATOM 732 CE2 TYR A 426 -18.063 -9.622 -2.999 1.00 0.00 C ATOM 733 CZ TYR A 426 -17.638 -8.443 -2.431 1.00 0.00 C ATOM 734 OH TYR A 426 -18.020 -8.130 -1.148 1.00 0.00 O ATOM 0 H TYR A 426 -15.758 -10.697 -8.403 1.00 0.00 H new ATOM 0 HA TYR A 426 -14.278 -9.412 -6.403 1.00 0.00 H new ATOM 0 HB2 TYR A 426 -16.393 -8.539 -7.021 1.00 0.00 H new ATOM 0 HB3 TYR A 426 -17.188 -10.093 -6.867 1.00 0.00 H new ATOM 0 HD1 TYR A 426 -15.810 -7.229 -4.980 1.00 0.00 H new ATOM 0 HD2 TYR A 426 -18.009 -10.868 -4.723 1.00 0.00 H new ATOM 0 HE1 TYR A 426 -16.499 -6.653 -2.694 1.00 0.00 H new ATOM 0 HE2 TYR A 426 -18.699 -10.294 -2.442 1.00 0.00 H new ATOM 0 HH TYR A 426 -18.589 -8.844 -0.793 1.00 0.00 H new ATOM 744 N ILE A 427 -15.622 -12.295 -5.529 1.00 0.00 N ATOM 745 CA ILE A 427 -15.570 -13.354 -4.535 1.00 0.00 C ATOM 746 C ILE A 427 -14.145 -13.898 -4.408 1.00 0.00 C ATOM 747 O ILE A 427 -13.592 -13.965 -3.309 1.00 0.00 O ATOM 748 CB ILE A 427 -16.546 -14.505 -4.873 1.00 0.00 C ATOM 749 CG1 ILE A 427 -17.994 -14.018 -4.754 1.00 0.00 C ATOM 750 CG2 ILE A 427 -16.311 -15.700 -3.956 1.00 0.00 C ATOM 751 CD1 ILE A 427 -19.018 -15.008 -5.268 1.00 0.00 C ATOM 0 H ILE A 427 -16.230 -12.492 -6.324 1.00 0.00 H new ATOM 0 HA ILE A 427 -15.877 -12.923 -3.582 1.00 0.00 H new ATOM 0 HB ILE A 427 -16.363 -14.823 -5.899 1.00 0.00 H new ATOM 0 HG12 ILE A 427 -18.208 -13.798 -3.708 1.00 0.00 H new ATOM 0 HG13 ILE A 427 -18.099 -13.083 -5.304 1.00 0.00 H new ATOM 0 HG21 ILE A 427 -17.009 -16.498 -4.212 1.00 0.00 H new ATOM 0 HG22 ILE A 427 -15.289 -16.058 -4.080 1.00 0.00 H new ATOM 0 HG23 ILE A 427 -16.467 -15.400 -2.920 1.00 0.00 H new ATOM 0 HD11 ILE A 427 -20.018 -14.591 -5.150 1.00 0.00 H new ATOM 0 HD12 ILE A 427 -18.831 -15.210 -6.323 1.00 0.00 H new ATOM 0 HD13 ILE A 427 -18.943 -15.936 -4.702 1.00 0.00 H new ATOM 763 N ALA A 428 -13.549 -14.248 -5.545 1.00 0.00 N ATOM 764 CA ALA A 428 -12.191 -14.784 -5.581 1.00 0.00 C ATOM 765 C ALA A 428 -11.186 -13.794 -4.995 1.00 0.00 C ATOM 766 O ALA A 428 -10.235 -14.184 -4.314 1.00 0.00 O ATOM 767 CB ALA A 428 -11.811 -15.147 -7.011 1.00 0.00 C ATOM 0 H ALA A 428 -13.990 -14.169 -6.461 1.00 0.00 H new ATOM 0 HA ALA A 428 -12.165 -15.684 -4.967 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -10.797 -15.546 -7.028 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -12.503 -15.898 -7.392 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -11.861 -14.257 -7.638 1.00 0.00 H new ATOM 773 N MET A 429 -11.401 -12.511 -5.265 1.00 0.00 N ATOM 774 CA MET A 429 -10.528 -11.459 -4.758 1.00 0.00 C ATOM 775 C MET A 429 -10.650 -11.353 -3.248 1.00 0.00 C ATOM 776 O MET A 429 -9.672 -11.089 -2.549 1.00 0.00 O ATOM 777 CB MET A 429 -10.893 -10.117 -5.395 1.00 0.00 C ATOM 778 CG MET A 429 -10.374 -9.958 -6.812 1.00 0.00 C ATOM 779 SD MET A 429 -11.131 -8.569 -7.675 1.00 0.00 S ATOM 780 CE MET A 429 -10.924 -7.274 -6.461 1.00 0.00 C ATOM 0 H MET A 429 -12.177 -12.174 -5.835 1.00 0.00 H new ATOM 0 HA MET A 429 -9.500 -11.712 -5.016 1.00 0.00 H new ATOM 0 HB2 MET A 429 -11.978 -10.009 -5.400 1.00 0.00 H new ATOM 0 HB3 MET A 429 -10.495 -9.311 -4.778 1.00 0.00 H new ATOM 0 HG2 MET A 429 -9.293 -9.819 -6.786 1.00 0.00 H new ATOM 0 HG3 MET A 429 -10.564 -10.875 -7.370 1.00 0.00 H new ATOM 0 HE1 MET A 429 -10.633 -6.350 -6.961 1.00 0.00 H new ATOM 0 HE2 MET A 429 -11.863 -7.119 -5.930 1.00 0.00 H new ATOM 0 HE3 MET A 429 -10.149 -7.562 -5.751 1.00 0.00 H new ATOM 790 N GLY A 430 -11.857 -11.579 -2.756 1.00 0.00 N ATOM 791 CA GLY A 430 -12.114 -11.498 -1.342 1.00 0.00 C ATOM 792 C GLY A 430 -11.522 -12.651 -0.575 1.00 0.00 C ATOM 793 O GLY A 430 -10.993 -12.449 0.506 1.00 0.00 O ATOM 0 H GLY A 430 -12.670 -11.820 -3.322 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -11.707 -10.563 -0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -13.191 -11.470 -1.174 1.00 0.00 H new ATOM 797 N GLN A 431 -11.589 -13.850 -1.145 1.00 0.00 N ATOM 798 CA GLN A 431 -11.068 -15.051 -0.489 1.00 0.00 C ATOM 799 C GLN A 431 -9.618 -14.886 -0.042 1.00 0.00 C ATOM 800 O GLN A 431 -9.272 -15.221 1.086 1.00 0.00 O ATOM 801 CB GLN A 431 -11.180 -16.267 -1.412 1.00 0.00 C ATOM 802 CG GLN A 431 -12.609 -16.629 -1.788 1.00 0.00 C ATOM 803 CD GLN A 431 -13.525 -16.800 -0.587 1.00 0.00 C ATOM 804 OE1 GLN A 431 -14.722 -16.523 -0.669 1.00 0.00 O ATOM 805 NE2 GLN A 431 -12.982 -17.261 0.530 1.00 0.00 N ATOM 0 H GLN A 431 -12.000 -14.019 -2.063 1.00 0.00 H new ATOM 0 HA GLN A 431 -11.679 -15.208 0.400 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -10.614 -16.072 -2.323 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -10.715 -17.124 -0.925 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -13.014 -15.852 -2.437 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -12.602 -17.554 -2.365 1.00 0.00 H new ATOM 0 HE21 GLN A 431 -11.986 -17.480 0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 431 -13.560 -17.397 1.359 1.00 0.00 H new ATOM 814 N ARG A 432 -8.773 -14.336 -0.911 1.00 0.00 N ATOM 815 CA ARG A 432 -7.363 -14.164 -0.573 1.00 0.00 C ATOM 816 C ARG A 432 -7.179 -13.206 0.606 1.00 0.00 C ATOM 817 O ARG A 432 -6.153 -13.236 1.278 1.00 0.00 O ATOM 818 CB ARG A 432 -6.552 -13.688 -1.780 1.00 0.00 C ATOM 819 CG ARG A 432 -5.089 -14.099 -1.697 1.00 0.00 C ATOM 820 CD ARG A 432 -4.274 -13.597 -2.882 1.00 0.00 C ATOM 821 NE ARG A 432 -4.579 -14.327 -4.112 1.00 0.00 N ATOM 822 CZ ARG A 432 -4.954 -13.740 -5.246 1.00 0.00 C ATOM 823 NH1 ARG A 432 -5.104 -12.420 -5.293 1.00 0.00 N ATOM 824 NH2 ARG A 432 -5.187 -14.473 -6.331 1.00 0.00 N ATOM 0 H ARG A 432 -9.035 -14.006 -1.840 1.00 0.00 H new ATOM 0 HA ARG A 432 -6.986 -15.142 -0.275 1.00 0.00 H new ATOM 0 HB2 ARG A 432 -6.990 -14.096 -2.691 1.00 0.00 H new ATOM 0 HB3 ARG A 432 -6.618 -12.602 -1.853 1.00 0.00 H new ATOM 0 HG2 ARG A 432 -4.658 -13.712 -0.774 1.00 0.00 H new ATOM 0 HG3 ARG A 432 -5.022 -15.186 -1.649 1.00 0.00 H new ATOM 0 HD2 ARG A 432 -4.472 -12.536 -3.033 1.00 0.00 H new ATOM 0 HD3 ARG A 432 -3.212 -13.695 -2.658 1.00 0.00 H new ATOM 0 HE ARG A 432 -4.500 -15.344 -4.100 1.00 0.00 H new ATOM 0 HH11 ARG A 432 -4.932 -11.857 -4.460 1.00 0.00 H new ATOM 0 HH12 ARG A 432 -5.391 -11.970 -6.162 1.00 0.00 H new ATOM 0 HH21 ARG A 432 -5.078 -15.487 -6.295 1.00 0.00 H new ATOM 0 HH22 ARG A 432 -5.474 -14.022 -7.199 1.00 0.00 H new ATOM 838 N MET A 433 -8.163 -12.346 0.838 1.00 0.00 N ATOM 839 CA MET A 433 -8.108 -11.408 1.957 1.00 0.00 C ATOM 840 C MET A 433 -8.870 -11.968 3.153 1.00 0.00 C ATOM 841 O MET A 433 -8.513 -11.729 4.303 1.00 0.00 O ATOM 842 CB MET A 433 -8.706 -10.061 1.560 1.00 0.00 C ATOM 843 CG MET A 433 -7.947 -9.358 0.451 1.00 0.00 C ATOM 844 SD MET A 433 -8.775 -7.858 -0.105 1.00 0.00 S ATOM 845 CE MET A 433 -10.368 -8.501 -0.606 1.00 0.00 C ATOM 0 H MET A 433 -9.007 -12.277 0.269 1.00 0.00 H new ATOM 0 HA MET A 433 -7.062 -11.265 2.229 1.00 0.00 H new ATOM 0 HB2 MET A 433 -9.738 -10.211 1.243 1.00 0.00 H new ATOM 0 HB3 MET A 433 -8.733 -9.413 2.436 1.00 0.00 H new ATOM 0 HG2 MET A 433 -6.946 -9.108 0.802 1.00 0.00 H new ATOM 0 HG3 MET A 433 -7.829 -10.038 -0.392 1.00 0.00 H new ATOM 0 HE1 MET A 433 -10.705 -7.980 -1.502 1.00 0.00 H new ATOM 0 HE2 MET A 433 -10.280 -9.567 -0.817 1.00 0.00 H new ATOM 0 HE3 MET A 433 -11.090 -8.348 0.196 1.00 0.00 H new ATOM 855 N PHE A 434 -9.931 -12.708 2.856 1.00 0.00 N ATOM 856 CA PHE A 434 -10.778 -13.312 3.874 1.00 0.00 C ATOM 857 C PHE A 434 -10.011 -14.359 4.670 1.00 0.00 C ATOM 858 O PHE A 434 -10.118 -14.417 5.893 1.00 0.00 O ATOM 859 CB PHE A 434 -12.020 -13.930 3.221 1.00 0.00 C ATOM 860 CG PHE A 434 -13.180 -12.980 3.115 1.00 0.00 C ATOM 861 CD1 PHE A 434 -13.508 -12.141 4.168 1.00 0.00 C ATOM 862 CD2 PHE A 434 -13.941 -12.926 1.959 1.00 0.00 C ATOM 863 CE1 PHE A 434 -14.573 -11.267 4.070 1.00 0.00 C ATOM 864 CE2 PHE A 434 -15.008 -12.053 1.855 1.00 0.00 C ATOM 865 CZ PHE A 434 -15.324 -11.223 2.912 1.00 0.00 C ATOM 0 H PHE A 434 -10.228 -12.906 1.900 1.00 0.00 H new ATOM 0 HA PHE A 434 -11.095 -12.534 4.568 1.00 0.00 H new ATOM 0 HB2 PHE A 434 -11.758 -14.283 2.224 1.00 0.00 H new ATOM 0 HB3 PHE A 434 -12.327 -14.802 3.798 1.00 0.00 H new ATOM 0 HD1 PHE A 434 -12.924 -12.171 5.076 1.00 0.00 H new ATOM 0 HD2 PHE A 434 -13.698 -13.573 1.129 1.00 0.00 H new ATOM 0 HE1 PHE A 434 -14.818 -10.619 4.898 1.00 0.00 H new ATOM 0 HE2 PHE A 434 -15.594 -12.020 0.948 1.00 0.00 H new ATOM 0 HZ PHE A 434 -16.157 -10.540 2.833 1.00 0.00 H new ATOM 875 N GLU A 435 -9.221 -15.161 3.971 1.00 0.00 N ATOM 876 CA GLU A 435 -8.416 -16.193 4.611 1.00 0.00 C ATOM 877 C GLU A 435 -7.026 -15.636 4.915 1.00 0.00 C ATOM 878 O GLU A 435 -6.022 -16.348 4.853 1.00 0.00 O ATOM 879 CB GLU A 435 -8.305 -17.427 3.704 1.00 0.00 C ATOM 880 CG GLU A 435 -9.566 -18.285 3.655 1.00 0.00 C ATOM 881 CD GLU A 435 -10.597 -17.787 2.656 1.00 0.00 C ATOM 882 OE1 GLU A 435 -10.416 -18.020 1.438 1.00 0.00 O ATOM 883 OE2 GLU A 435 -11.601 -17.181 3.083 1.00 0.00 O ATOM 0 H GLU A 435 -9.120 -15.117 2.957 1.00 0.00 H new ATOM 0 HA GLU A 435 -8.897 -16.494 5.542 1.00 0.00 H new ATOM 0 HB2 GLU A 435 -8.063 -17.100 2.693 1.00 0.00 H new ATOM 0 HB3 GLU A 435 -7.474 -18.043 4.048 1.00 0.00 H new ATOM 0 HG2 GLU A 435 -9.290 -19.309 3.401 1.00 0.00 H new ATOM 0 HG3 GLU A 435 -10.016 -18.313 4.647 1.00 0.00 H new ATOM 890 N ASP A 436 -6.989 -14.349 5.240 1.00 0.00 N ATOM 891 CA ASP A 436 -5.746 -13.650 5.542 1.00 0.00 C ATOM 892 C ASP A 436 -6.021 -12.495 6.504 1.00 0.00 C ATOM 893 O ASP A 436 -5.755 -11.330 6.203 1.00 0.00 O ATOM 894 CB ASP A 436 -5.127 -13.126 4.240 1.00 0.00 C ATOM 895 CG ASP A 436 -3.744 -12.533 4.419 1.00 0.00 C ATOM 896 OD1 ASP A 436 -2.786 -13.303 4.639 1.00 0.00 O ATOM 897 OD2 ASP A 436 -3.607 -11.299 4.306 1.00 0.00 O ATOM 0 H ASP A 436 -7.820 -13.761 5.302 1.00 0.00 H new ATOM 0 HA ASP A 436 -5.046 -14.338 6.017 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -5.072 -13.942 3.520 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -5.785 -12.369 3.814 1.00 0.00 H new ATOM 1036 N GLU B 7 7.660 -6.880 -12.521 1.00 0.00 N ATOM 1037 CA GLU B 7 6.849 -5.829 -13.123 1.00 0.00 C ATOM 1038 C GLU B 7 6.815 -4.596 -12.219 1.00 0.00 C ATOM 1039 O GLU B 7 6.013 -4.519 -11.292 1.00 0.00 O ATOM 1040 CB GLU B 7 5.413 -6.327 -13.386 1.00 0.00 C ATOM 1041 CG GLU B 7 5.046 -7.603 -12.633 1.00 0.00 C ATOM 1042 CD GLU B 7 3.553 -7.752 -12.380 1.00 0.00 C ATOM 1043 OE1 GLU B 7 2.769 -7.606 -13.337 1.00 0.00 O ATOM 1044 OE2 GLU B 7 3.163 -8.027 -11.217 1.00 0.00 O ATOM 0 HA GLU B 7 7.303 -5.557 -14.076 1.00 0.00 H new ATOM 0 HB2 GLU B 7 4.711 -5.540 -13.109 1.00 0.00 H new ATOM 0 HB3 GLU B 7 5.291 -6.501 -14.455 1.00 0.00 H new ATOM 0 HG2 GLU B 7 5.398 -8.464 -13.201 1.00 0.00 H new ATOM 0 HG3 GLU B 7 5.571 -7.615 -11.678 1.00 0.00 H new ATOM 1051 N VAL B 8 7.720 -3.653 -12.467 1.00 0.00 N ATOM 1052 CA VAL B 8 7.775 -2.425 -11.685 1.00 0.00 C ATOM 1053 C VAL B 8 6.486 -1.648 -11.846 1.00 0.00 C ATOM 1054 O VAL B 8 6.043 -1.366 -12.958 1.00 0.00 O ATOM 1055 CB VAL B 8 8.970 -1.557 -12.071 1.00 0.00 C ATOM 1056 CG1 VAL B 8 8.888 -0.197 -11.390 1.00 0.00 C ATOM 1057 CG2 VAL B 8 10.232 -2.283 -11.671 1.00 0.00 C ATOM 0 H VAL B 8 8.424 -3.717 -13.203 1.00 0.00 H new ATOM 0 HA VAL B 8 7.899 -2.704 -10.639 1.00 0.00 H new ATOM 0 HB VAL B 8 8.971 -1.382 -13.147 1.00 0.00 H new ATOM 0 HG11 VAL B 8 9.749 0.407 -11.678 1.00 0.00 H new ATOM 0 HG12 VAL B 8 7.972 0.308 -11.696 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.885 -0.331 -10.308 1.00 0.00 H new ATOM 0 HG21 VAL B 8 11.099 -1.679 -11.938 1.00 0.00 H new ATOM 0 HG22 VAL B 8 10.227 -2.455 -10.595 1.00 0.00 H new ATOM 0 HG23 VAL B 8 10.282 -3.240 -12.191 1.00 0.00 H new ATOM 1067 N LEU B 9 5.900 -1.312 -10.721 1.00 0.00 N ATOM 1068 CA LEU B 9 4.641 -0.611 -10.690 1.00 0.00 C ATOM 1069 C LEU B 9 4.830 0.891 -10.712 1.00 0.00 C ATOM 1070 O LEU B 9 4.330 1.579 -11.599 1.00 0.00 O ATOM 1071 CB LEU B 9 3.882 -1.031 -9.434 1.00 0.00 C ATOM 1072 CG LEU B 9 4.147 -2.475 -9.016 1.00 0.00 C ATOM 1073 CD1 LEU B 9 3.958 -2.671 -7.526 1.00 0.00 C ATOM 1074 CD2 LEU B 9 3.248 -3.412 -9.784 1.00 0.00 C ATOM 0 H LEU B 9 6.285 -1.518 -9.799 1.00 0.00 H new ATOM 0 HA LEU B 9 4.073 -0.873 -11.583 1.00 0.00 H new ATOM 0 HB2 LEU B 9 4.157 -0.368 -8.614 1.00 0.00 H new ATOM 0 HB3 LEU B 9 2.813 -0.901 -9.604 1.00 0.00 H new ATOM 0 HG LEU B 9 5.187 -2.702 -9.250 1.00 0.00 H new ATOM 0 HD11 LEU B 9 4.156 -3.711 -7.268 1.00 0.00 H new ATOM 0 HD12 LEU B 9 4.648 -2.025 -6.984 1.00 0.00 H new ATOM 0 HD13 LEU B 9 2.934 -2.418 -7.253 1.00 0.00 H new ATOM 0 HD21 LEU B 9 3.446 -4.439 -9.477 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.206 -3.166 -9.579 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.441 -3.308 -10.852 1.00 0.00 H new ATOM 1086 N LEU B 10 5.551 1.402 -9.735 1.00 0.00 N ATOM 1087 CA LEU B 10 5.758 2.833 -9.648 1.00 0.00 C ATOM 1088 C LEU B 10 7.141 3.204 -9.132 1.00 0.00 C ATOM 1089 O LEU B 10 7.611 2.674 -8.125 1.00 0.00 O ATOM 1090 CB LEU B 10 4.700 3.417 -8.731 1.00 0.00 C ATOM 1091 CG LEU B 10 4.432 4.909 -8.889 1.00 0.00 C ATOM 1092 CD1 LEU B 10 3.604 5.181 -10.136 1.00 0.00 C ATOM 1093 CD2 LEU B 10 3.732 5.437 -7.648 1.00 0.00 C ATOM 0 H LEU B 10 5.998 0.856 -8.999 1.00 0.00 H new ATOM 0 HA LEU B 10 5.680 3.242 -10.655 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.766 2.880 -8.898 1.00 0.00 H new ATOM 0 HB3 LEU B 10 4.997 3.228 -7.699 1.00 0.00 H new ATOM 0 HG LEU B 10 5.383 5.428 -9.005 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.425 6.252 -10.228 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.143 4.826 -11.015 1.00 0.00 H new ATOM 0 HD13 LEU B 10 2.650 4.659 -10.060 1.00 0.00 H new ATOM 0 HD21 LEU B 10 3.542 6.504 -7.764 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.786 4.912 -7.513 1.00 0.00 H new ATOM 0 HD23 LEU B 10 4.365 5.274 -6.776 1.00 0.00 H new ATOM 1105 N ILE B 11 7.785 4.107 -9.853 1.00 0.00 N ATOM 1106 CA ILE B 11 9.090 4.627 -9.481 1.00 0.00 C ATOM 1107 C ILE B 11 8.936 6.069 -9.019 1.00 0.00 C ATOM 1108 O ILE B 11 8.731 6.965 -9.837 1.00 0.00 O ATOM 1109 CB ILE B 11 10.075 4.589 -10.668 1.00 0.00 C ATOM 1110 CG1 ILE B 11 10.328 3.146 -11.105 1.00 0.00 C ATOM 1111 CG2 ILE B 11 11.381 5.284 -10.304 1.00 0.00 C ATOM 1112 CD1 ILE B 11 11.071 3.033 -12.417 1.00 0.00 C ATOM 0 H ILE B 11 7.415 4.502 -10.718 1.00 0.00 H new ATOM 0 HA ILE B 11 9.489 4.002 -8.682 1.00 0.00 H new ATOM 0 HB ILE B 11 9.629 5.126 -11.505 1.00 0.00 H new ATOM 0 HG12 ILE B 11 10.898 2.635 -10.329 1.00 0.00 H new ATOM 0 HG13 ILE B 11 9.373 2.629 -11.192 1.00 0.00 H new ATOM 0 HG21 ILE B 11 12.062 5.247 -11.154 1.00 0.00 H new ATOM 0 HG22 ILE B 11 11.180 6.324 -10.045 1.00 0.00 H new ATOM 0 HG23 ILE B 11 11.836 4.780 -9.452 1.00 0.00 H new ATOM 0 HD11 ILE B 11 11.215 1.981 -12.664 1.00 0.00 H new ATOM 0 HD12 ILE B 11 10.493 3.515 -13.205 1.00 0.00 H new ATOM 0 HD13 ILE B 11 12.042 3.521 -12.329 1.00 0.00 H new ATOM 1124 N VAL B 12 9.006 6.300 -7.718 1.00 0.00 N ATOM 1125 CA VAL B 12 8.862 7.645 -7.203 1.00 0.00 C ATOM 1126 C VAL B 12 10.207 8.186 -6.763 1.00 0.00 C ATOM 1127 O VAL B 12 11.006 7.462 -6.184 1.00 0.00 O ATOM 1128 CB VAL B 12 7.890 7.694 -6.011 1.00 0.00 C ATOM 1129 CG1 VAL B 12 7.333 9.093 -5.835 1.00 0.00 C ATOM 1130 CG2 VAL B 12 6.769 6.685 -6.187 1.00 0.00 C ATOM 0 H VAL B 12 9.160 5.582 -7.010 1.00 0.00 H new ATOM 0 HA VAL B 12 8.458 8.259 -8.008 1.00 0.00 H new ATOM 0 HB VAL B 12 8.442 7.430 -5.109 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.648 9.108 -4.987 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.151 9.790 -5.653 1.00 0.00 H new ATOM 0 HG13 VAL B 12 6.799 9.388 -6.738 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.094 6.738 -5.332 1.00 0.00 H new ATOM 0 HG22 VAL B 12 6.217 6.910 -7.100 1.00 0.00 H new ATOM 0 HG23 VAL B 12 7.190 5.682 -6.256 1.00 0.00 H new ATOM 1140 N LYS B 13 10.465 9.445 -7.060 1.00 0.00 N ATOM 1141 CA LYS B 13 11.712 10.080 -6.668 1.00 0.00 C ATOM 1142 C LYS B 13 11.450 11.127 -5.602 1.00 0.00 C ATOM 1143 O LYS B 13 10.302 11.460 -5.332 1.00 0.00 O ATOM 1144 CB LYS B 13 12.428 10.694 -7.863 1.00 0.00 C ATOM 1145 CG LYS B 13 12.535 9.750 -9.038 1.00 0.00 C ATOM 1146 CD LYS B 13 13.362 8.513 -8.709 1.00 0.00 C ATOM 1147 CE LYS B 13 14.853 8.795 -8.794 1.00 0.00 C ATOM 1148 NZ LYS B 13 15.526 8.659 -7.474 1.00 0.00 N ATOM 0 H LYS B 13 9.826 10.052 -7.574 1.00 0.00 H new ATOM 0 HA LYS B 13 12.367 9.312 -6.256 1.00 0.00 H new ATOM 0 HB2 LYS B 13 11.897 11.594 -8.174 1.00 0.00 H new ATOM 0 HB3 LYS B 13 13.429 11.003 -7.560 1.00 0.00 H new ATOM 0 HG2 LYS B 13 11.536 9.445 -9.349 1.00 0.00 H new ATOM 0 HG3 LYS B 13 12.986 10.272 -9.882 1.00 0.00 H new ATOM 0 HD2 LYS B 13 13.114 8.166 -7.706 1.00 0.00 H new ATOM 0 HD3 LYS B 13 13.104 7.709 -9.398 1.00 0.00 H new ATOM 0 HE2 LYS B 13 15.311 8.108 -9.506 1.00 0.00 H new ATOM 0 HE3 LYS B 13 15.009 9.803 -9.178 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.431 9.170 -7.492 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 14.917 9.058 -6.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 15.700 7.653 -7.275 1.00 0.00 H new ATOM 1162 N LYS B 14 12.525 11.635 -5.008 1.00 0.00 N ATOM 1163 CA LYS B 14 12.440 12.603 -3.920 1.00 0.00 C ATOM 1164 C LYS B 14 11.686 12.023 -2.737 1.00 0.00 C ATOM 1165 O LYS B 14 11.187 12.750 -1.875 1.00 0.00 O ATOM 1166 CB LYS B 14 11.814 13.907 -4.386 1.00 0.00 C ATOM 1167 CG LYS B 14 12.824 14.946 -4.854 1.00 0.00 C ATOM 1168 CD LYS B 14 13.016 14.930 -6.357 1.00 0.00 C ATOM 1169 CE LYS B 14 13.986 13.837 -6.793 1.00 0.00 C ATOM 1170 NZ LYS B 14 15.246 13.824 -5.990 1.00 0.00 N ATOM 0 H LYS B 14 13.480 11.387 -5.267 1.00 0.00 H new ATOM 0 HA LYS B 14 13.456 12.827 -3.594 1.00 0.00 H new ATOM 0 HB2 LYS B 14 11.122 13.695 -5.201 1.00 0.00 H new ATOM 0 HB3 LYS B 14 11.226 14.328 -3.570 1.00 0.00 H new ATOM 0 HG2 LYS B 14 12.492 15.937 -4.544 1.00 0.00 H new ATOM 0 HG3 LYS B 14 13.782 14.763 -4.366 1.00 0.00 H new ATOM 0 HD2 LYS B 14 12.053 14.777 -6.845 1.00 0.00 H new ATOM 0 HD3 LYS B 14 13.390 15.900 -6.686 1.00 0.00 H new ATOM 0 HE2 LYS B 14 13.496 12.867 -6.706 1.00 0.00 H new ATOM 0 HE3 LYS B 14 14.233 13.976 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 15.933 13.181 -6.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 15.644 14.784 -5.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 15.039 13.498 -5.024 1.00 0.00 H new ATOM 1184 N VAL B 15 11.624 10.701 -2.702 1.00 0.00 N ATOM 1185 CA VAL B 15 10.957 10.003 -1.619 1.00 0.00 C ATOM 1186 C VAL B 15 11.861 10.037 -0.392 1.00 0.00 C ATOM 1187 O VAL B 15 12.818 9.275 -0.295 1.00 0.00 O ATOM 1188 CB VAL B 15 10.622 8.550 -2.028 1.00 0.00 C ATOM 1189 CG1 VAL B 15 9.797 7.853 -0.963 1.00 0.00 C ATOM 1190 CG2 VAL B 15 9.869 8.550 -3.342 1.00 0.00 C ATOM 0 H VAL B 15 12.028 10.091 -3.413 1.00 0.00 H new ATOM 0 HA VAL B 15 10.013 10.496 -1.386 1.00 0.00 H new ATOM 0 HB VAL B 15 11.559 8.004 -2.141 1.00 0.00 H new ATOM 0 HG11 VAL B 15 9.578 6.834 -1.281 1.00 0.00 H new ATOM 0 HG12 VAL B 15 10.356 7.829 -0.027 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.863 8.395 -0.814 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.635 7.524 -3.627 1.00 0.00 H new ATOM 0 HG22 VAL B 15 8.944 9.116 -3.231 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.485 9.009 -4.115 1.00 0.00 H new ATOM 1200 N ARG B 16 11.557 10.939 0.532 1.00 0.00 N ATOM 1201 CA ARG B 16 12.364 11.133 1.722 1.00 0.00 C ATOM 1202 C ARG B 16 12.051 10.130 2.825 1.00 0.00 C ATOM 1203 O ARG B 16 11.052 10.251 3.528 1.00 0.00 O ATOM 1204 CB ARG B 16 12.189 12.565 2.257 1.00 0.00 C ATOM 1205 CG ARG B 16 12.311 13.640 1.185 1.00 0.00 C ATOM 1206 CD ARG B 16 12.630 15.012 1.770 1.00 0.00 C ATOM 1207 NE ARG B 16 14.048 15.155 2.122 1.00 0.00 N ATOM 1208 CZ ARG B 16 14.983 15.669 1.315 1.00 0.00 C ATOM 1209 NH1 ARG B 16 14.658 16.088 0.096 1.00 0.00 N ATOM 1210 NH2 ARG B 16 16.243 15.769 1.731 1.00 0.00 N ATOM 0 H ARG B 16 10.745 11.554 0.475 1.00 0.00 H new ATOM 0 HA ARG B 16 13.400 10.969 1.424 1.00 0.00 H new ATOM 0 HB2 ARG B 16 11.212 12.648 2.733 1.00 0.00 H new ATOM 0 HB3 ARG B 16 12.936 12.748 3.029 1.00 0.00 H new ATOM 0 HG2 ARG B 16 13.093 13.358 0.479 1.00 0.00 H new ATOM 0 HG3 ARG B 16 11.379 13.696 0.623 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.358 15.783 1.049 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.020 15.176 2.658 1.00 0.00 H new ATOM 0 HE ARG B 16 14.341 14.840 3.047 1.00 0.00 H new ATOM 0 HH11 ARG B 16 13.693 16.018 -0.227 1.00 0.00 H new ATOM 0 HH12 ARG B 16 15.374 16.479 -0.516 1.00 0.00 H new ATOM 0 HH21 ARG B 16 16.498 15.453 2.667 1.00 0.00 H new ATOM 0 HH22 ARG B 16 16.954 16.161 1.114 1.00 0.00 H new ATOM 1224 N GLN B 17 12.914 9.140 2.968 1.00 0.00 N ATOM 1225 CA GLN B 17 12.780 8.154 4.024 1.00 0.00 C ATOM 1226 C GLN B 17 13.713 8.593 5.132 1.00 0.00 C ATOM 1227 O GLN B 17 14.903 8.791 4.889 1.00 0.00 O ATOM 1228 CB GLN B 17 13.142 6.752 3.531 1.00 0.00 C ATOM 1229 CG GLN B 17 12.723 5.628 4.468 1.00 0.00 C ATOM 1230 CD GLN B 17 13.725 5.373 5.578 1.00 0.00 C ATOM 1231 OE1 GLN B 17 14.917 5.634 5.432 1.00 0.00 O ATOM 1232 NE2 GLN B 17 13.248 4.846 6.693 1.00 0.00 N ATOM 0 H GLN B 17 13.721 8.998 2.361 1.00 0.00 H new ATOM 0 HA GLN B 17 11.748 8.096 4.371 1.00 0.00 H new ATOM 0 HB2 GLN B 17 12.676 6.591 2.559 1.00 0.00 H new ATOM 0 HB3 GLN B 17 14.220 6.700 3.381 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.756 5.872 4.909 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.589 4.713 3.891 1.00 0.00 H new ATOM 0 HE21 GLN B 17 12.252 4.644 6.776 1.00 0.00 H new ATOM 0 HE22 GLN B 17 13.876 4.642 7.470 1.00 0.00 H new ATOM 1241 N LYS B 18 13.173 8.793 6.326 1.00 0.00 N ATOM 1242 CA LYS B 18 13.970 9.272 7.450 1.00 0.00 C ATOM 1243 C LYS B 18 14.482 10.674 7.131 1.00 0.00 C ATOM 1244 O LYS B 18 15.514 11.102 7.645 1.00 0.00 O ATOM 1245 CB LYS B 18 15.140 8.328 7.764 1.00 0.00 C ATOM 1246 CG LYS B 18 14.858 7.353 8.898 1.00 0.00 C ATOM 1247 CD LYS B 18 14.398 8.075 10.157 1.00 0.00 C ATOM 1248 CE LYS B 18 15.436 9.074 10.648 1.00 0.00 C ATOM 1249 NZ LYS B 18 14.829 10.113 11.516 1.00 0.00 N ATOM 0 H LYS B 18 12.189 8.632 6.543 1.00 0.00 H new ATOM 0 HA LYS B 18 13.339 9.300 8.338 1.00 0.00 H new ATOM 0 HB2 LYS B 18 15.389 7.763 6.866 1.00 0.00 H new ATOM 0 HB3 LYS B 18 16.016 8.924 8.020 1.00 0.00 H new ATOM 0 HG2 LYS B 18 14.093 6.642 8.586 1.00 0.00 H new ATOM 0 HG3 LYS B 18 15.758 6.778 9.116 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.461 8.594 9.956 1.00 0.00 H new ATOM 0 HD3 LYS B 18 14.197 7.345 10.941 1.00 0.00 H new ATOM 0 HE2 LYS B 18 16.215 8.548 11.200 1.00 0.00 H new ATOM 0 HE3 LYS B 18 15.917 9.549 9.793 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 15.190 11.049 11.242 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.795 10.096 11.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 15.076 9.924 12.508 1.00 0.00 H new ATOM 1263 N LYS B 19 13.731 11.349 6.247 1.00 0.00 N ATOM 1264 CA LYS B 19 14.005 12.716 5.793 1.00 0.00 C ATOM 1265 C LYS B 19 14.973 12.775 4.608 1.00 0.00 C ATOM 1266 O LYS B 19 15.203 13.852 4.075 1.00 0.00 O ATOM 1267 CB LYS B 19 14.520 13.607 6.930 1.00 0.00 C ATOM 1268 CG LYS B 19 13.970 15.026 6.895 1.00 0.00 C ATOM 1269 CD LYS B 19 12.480 15.040 7.181 1.00 0.00 C ATOM 1270 CE LYS B 19 12.157 14.182 8.388 1.00 0.00 C ATOM 1271 NZ LYS B 19 10.714 13.828 8.456 1.00 0.00 N ATOM 0 H LYS B 19 12.897 10.947 5.819 1.00 0.00 H new ATOM 0 HA LYS B 19 13.044 13.101 5.452 1.00 0.00 H new ATOM 0 HB2 LYS B 19 14.259 13.150 7.884 1.00 0.00 H new ATOM 0 HB3 LYS B 19 15.608 13.648 6.883 1.00 0.00 H new ATOM 0 HG2 LYS B 19 14.491 15.640 7.630 1.00 0.00 H new ATOM 0 HG3 LYS B 19 14.160 15.469 5.918 1.00 0.00 H new ATOM 0 HD2 LYS B 19 12.148 16.063 7.357 1.00 0.00 H new ATOM 0 HD3 LYS B 19 11.934 14.673 6.312 1.00 0.00 H new ATOM 0 HE2 LYS B 19 12.752 13.269 8.352 1.00 0.00 H new ATOM 0 HE3 LYS B 19 12.442 14.713 9.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 10.281 14.292 9.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 10.237 14.147 7.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 10.613 12.797 8.547 1.00 0.00 H new ATOM 1285 N GLN B 20 15.503 11.642 4.159 1.00 0.00 N ATOM 1286 CA GLN B 20 16.439 11.658 3.034 1.00 0.00 C ATOM 1287 C GLN B 20 15.692 11.300 1.754 1.00 0.00 C ATOM 1288 O GLN B 20 15.068 10.242 1.666 1.00 0.00 O ATOM 1289 CB GLN B 20 17.631 10.716 3.291 1.00 0.00 C ATOM 1290 CG GLN B 20 17.363 9.248 3.001 1.00 0.00 C ATOM 1291 CD GLN B 20 18.231 8.321 3.823 1.00 0.00 C ATOM 1292 OE1 GLN B 20 19.372 8.037 3.465 1.00 0.00 O ATOM 1293 NE2 GLN B 20 17.686 7.822 4.919 1.00 0.00 N ATOM 0 H GLN B 20 15.308 10.718 4.545 1.00 0.00 H new ATOM 0 HA GLN B 20 16.855 12.659 2.922 1.00 0.00 H new ATOM 0 HB2 GLN B 20 18.472 11.044 2.680 1.00 0.00 H new ATOM 0 HB3 GLN B 20 17.935 10.815 4.333 1.00 0.00 H new ATOM 0 HG2 GLN B 20 16.314 9.028 3.200 1.00 0.00 H new ATOM 0 HG3 GLN B 20 17.534 9.054 1.942 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.735 8.084 5.181 1.00 0.00 H new ATOM 0 HE22 GLN B 20 18.216 7.175 5.503 1.00 0.00 H new ATOM 1302 N ASP B 21 15.723 12.185 0.766 1.00 0.00 N ATOM 1303 CA ASP B 21 14.986 11.938 -0.465 1.00 0.00 C ATOM 1304 C ASP B 21 15.727 11.010 -1.404 1.00 0.00 C ATOM 1305 O ASP B 21 16.907 11.186 -1.702 1.00 0.00 O ATOM 1306 CB ASP B 21 14.596 13.246 -1.175 1.00 0.00 C ATOM 1307 CG ASP B 21 15.606 13.760 -2.182 1.00 0.00 C ATOM 1308 OD1 ASP B 21 16.529 14.492 -1.775 1.00 0.00 O ATOM 1309 OD2 ASP B 21 15.436 13.479 -3.393 1.00 0.00 O ATOM 0 H ASP B 21 16.240 13.064 0.791 1.00 0.00 H new ATOM 0 HA ASP B 21 14.065 11.433 -0.172 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.644 13.094 -1.684 1.00 0.00 H new ATOM 0 HB3 ASP B 21 14.435 14.016 -0.421 1.00 0.00 H new ATOM 1314 N GLY B 22 15.027 9.969 -1.795 1.00 0.00 N ATOM 1315 CA GLY B 22 15.557 9.021 -2.719 1.00 0.00 C ATOM 1316 C GLY B 22 14.515 8.571 -3.706 1.00 0.00 C ATOM 1317 O GLY B 22 14.027 9.359 -4.520 1.00 0.00 O ATOM 0 H GLY B 22 14.079 9.766 -1.477 1.00 0.00 H new ATOM 0 HA2 GLY B 22 16.398 9.463 -3.253 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.942 8.158 -2.176 1.00 0.00 H new ATOM 1321 N ALA B 23 14.152 7.313 -3.625 1.00 0.00 N ATOM 1322 CA ALA B 23 13.186 6.745 -4.526 1.00 0.00 C ATOM 1323 C ALA B 23 12.413 5.617 -3.880 1.00 0.00 C ATOM 1324 O ALA B 23 12.990 4.767 -3.205 1.00 0.00 O ATOM 1325 CB ALA B 23 13.894 6.233 -5.755 1.00 0.00 C ATOM 0 H ALA B 23 14.518 6.659 -2.934 1.00 0.00 H new ATOM 0 HA ALA B 23 12.474 7.525 -4.796 1.00 0.00 H new ATOM 0 HB1 ALA B 23 13.165 5.801 -6.441 1.00 0.00 H new ATOM 0 HB2 ALA B 23 14.412 7.057 -6.246 1.00 0.00 H new ATOM 0 HB3 ALA B 23 14.617 5.470 -5.467 1.00 0.00 H new ATOM 1331 N LEU B 24 11.114 5.607 -4.100 1.00 0.00 N ATOM 1332 CA LEU B 24 10.269 4.566 -3.566 1.00 0.00 C ATOM 1333 C LEU B 24 9.834 3.705 -4.743 1.00 0.00 C ATOM 1334 O LEU B 24 8.989 4.107 -5.544 1.00 0.00 O ATOM 1335 CB LEU B 24 9.061 5.161 -2.850 1.00 0.00 C ATOM 1336 CG LEU B 24 8.556 4.354 -1.652 1.00 0.00 C ATOM 1337 CD1 LEU B 24 7.081 4.607 -1.415 1.00 0.00 C ATOM 1338 CD2 LEU B 24 8.830 2.873 -1.824 1.00 0.00 C ATOM 0 H LEU B 24 10.622 6.313 -4.648 1.00 0.00 H new ATOM 0 HA LEU B 24 10.807 3.970 -2.829 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.317 6.165 -2.511 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.247 5.265 -3.568 1.00 0.00 H new ATOM 0 HG LEU B 24 9.106 4.690 -0.773 1.00 0.00 H new ATOM 0 HD11 LEU B 24 6.745 4.023 -0.559 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.921 5.667 -1.217 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.515 4.314 -2.299 1.00 0.00 H new ATOM 0 HD21 LEU B 24 8.458 2.331 -0.955 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.326 2.511 -2.720 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.903 2.710 -1.921 1.00 0.00 H new ATOM 1350 N TYR B 25 10.445 2.547 -4.863 1.00 0.00 N ATOM 1351 CA TYR B 25 10.170 1.644 -5.967 1.00 0.00 C ATOM 1352 C TYR B 25 9.162 0.565 -5.620 1.00 0.00 C ATOM 1353 O TYR B 25 9.456 -0.345 -4.845 1.00 0.00 O ATOM 1354 CB TYR B 25 11.459 0.959 -6.407 1.00 0.00 C ATOM 1355 CG TYR B 25 12.266 1.730 -7.412 1.00 0.00 C ATOM 1356 CD1 TYR B 25 12.766 2.985 -7.113 1.00 0.00 C ATOM 1357 CD2 TYR B 25 12.535 1.191 -8.660 1.00 0.00 C ATOM 1358 CE1 TYR B 25 13.512 3.687 -8.033 1.00 0.00 C ATOM 1359 CE2 TYR B 25 13.282 1.883 -9.585 1.00 0.00 C ATOM 1360 CZ TYR B 25 13.771 3.133 -9.269 1.00 0.00 C ATOM 1361 OH TYR B 25 14.516 3.832 -10.192 1.00 0.00 O ATOM 0 H TYR B 25 11.143 2.203 -4.204 1.00 0.00 H new ATOM 0 HA TYR B 25 9.749 2.257 -6.764 1.00 0.00 H new ATOM 0 HB2 TYR B 25 12.077 0.777 -5.527 1.00 0.00 H new ATOM 0 HB3 TYR B 25 11.211 -0.015 -6.830 1.00 0.00 H new ATOM 0 HD1 TYR B 25 12.568 3.420 -6.144 1.00 0.00 H new ATOM 0 HD2 TYR B 25 12.152 0.213 -8.910 1.00 0.00 H new ATOM 0 HE1 TYR B 25 13.893 4.667 -7.788 1.00 0.00 H new ATOM 0 HE2 TYR B 25 13.484 1.450 -10.553 1.00 0.00 H new ATOM 0 HH TYR B 25 14.607 3.300 -11.010 1.00 0.00 H new ATOM 1371 N LEU B 26 7.975 0.660 -6.190 1.00 0.00 N ATOM 1372 CA LEU B 26 6.984 -0.375 -5.988 1.00 0.00 C ATOM 1373 C LEU B 26 7.209 -1.400 -7.070 1.00 0.00 C ATOM 1374 O LEU B 26 6.944 -1.124 -8.240 1.00 0.00 O ATOM 1375 CB LEU B 26 5.544 0.134 -6.106 1.00 0.00 C ATOM 1376 CG LEU B 26 5.262 1.504 -5.524 1.00 0.00 C ATOM 1377 CD1 LEU B 26 3.880 1.971 -5.938 1.00 0.00 C ATOM 1378 CD2 LEU B 26 5.352 1.483 -4.017 1.00 0.00 C ATOM 0 H LEU B 26 7.678 1.432 -6.787 1.00 0.00 H new ATOM 0 HA LEU B 26 7.098 -0.772 -4.979 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.273 0.149 -7.162 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.887 -0.586 -5.618 1.00 0.00 H new ATOM 0 HG LEU B 26 6.014 2.193 -5.909 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.687 2.957 -5.515 1.00 0.00 H new ATOM 0 HD12 LEU B 26 3.825 2.026 -7.025 1.00 0.00 H new ATOM 0 HD13 LEU B 26 3.133 1.266 -5.572 1.00 0.00 H new ATOM 0 HD21 LEU B 26 5.145 2.479 -3.626 1.00 0.00 H new ATOM 0 HD22 LEU B 26 4.622 0.778 -3.619 1.00 0.00 H new ATOM 0 HD23 LEU B 26 6.354 1.176 -3.717 1.00 0.00 H new ATOM 1390 N MET B 27 7.737 -2.548 -6.720 1.00 0.00 N ATOM 1391 CA MET B 27 7.973 -3.559 -7.721 1.00 0.00 C ATOM 1392 C MET B 27 6.918 -4.630 -7.654 1.00 0.00 C ATOM 1393 O MET B 27 6.159 -4.706 -6.688 1.00 0.00 O ATOM 1394 CB MET B 27 9.372 -4.166 -7.610 1.00 0.00 C ATOM 1395 CG MET B 27 10.417 -3.444 -8.440 1.00 0.00 C ATOM 1396 SD MET B 27 12.042 -3.444 -7.666 1.00 0.00 S ATOM 1397 CE MET B 27 11.719 -2.380 -6.268 1.00 0.00 C ATOM 0 H MET B 27 8.007 -2.802 -5.770 1.00 0.00 H new ATOM 0 HA MET B 27 7.913 -3.070 -8.693 1.00 0.00 H new ATOM 0 HB2 MET B 27 9.681 -4.157 -6.565 1.00 0.00 H new ATOM 0 HB3 MET B 27 9.331 -5.210 -7.921 1.00 0.00 H new ATOM 0 HG2 MET B 27 10.486 -3.916 -9.420 1.00 0.00 H new ATOM 0 HG3 MET B 27 10.097 -2.415 -8.604 1.00 0.00 H new ATOM 0 HE1 MET B 27 12.453 -1.575 -6.247 1.00 0.00 H new ATOM 0 HE2 MET B 27 10.718 -1.957 -6.356 1.00 0.00 H new ATOM 0 HE3 MET B 27 11.788 -2.959 -5.347 1.00 0.00 H new ATOM 1407 N ALA B 28 6.953 -5.491 -8.657 1.00 0.00 N ATOM 1408 CA ALA B 28 5.972 -6.540 -8.847 1.00 0.00 C ATOM 1409 C ALA B 28 5.494 -7.201 -7.565 1.00 0.00 C ATOM 1410 O ALA B 28 4.297 -7.229 -7.300 1.00 0.00 O ATOM 1411 CB ALA B 28 6.537 -7.606 -9.746 1.00 0.00 C ATOM 0 H ALA B 28 7.678 -5.478 -9.374 1.00 0.00 H new ATOM 0 HA ALA B 28 5.106 -6.048 -9.290 1.00 0.00 H new ATOM 0 HB1 ALA B 28 5.796 -8.393 -9.887 1.00 0.00 H new ATOM 0 HB2 ALA B 28 6.791 -7.170 -10.712 1.00 0.00 H new ATOM 0 HB3 ALA B 28 7.433 -8.028 -9.291 1.00 0.00 H new ATOM 1417 N GLU B 29 6.422 -7.718 -6.774 1.00 0.00 N ATOM 1418 CA GLU B 29 6.066 -8.399 -5.537 1.00 0.00 C ATOM 1419 C GLU B 29 6.798 -7.800 -4.343 1.00 0.00 C ATOM 1420 O GLU B 29 6.648 -8.272 -3.208 1.00 0.00 O ATOM 1421 CB GLU B 29 6.411 -9.894 -5.634 1.00 0.00 C ATOM 1422 CG GLU B 29 6.134 -10.524 -6.994 1.00 0.00 C ATOM 1423 CD GLU B 29 4.703 -10.999 -7.147 1.00 0.00 C ATOM 1424 OE1 GLU B 29 4.258 -11.841 -6.339 1.00 0.00 O ATOM 1425 OE2 GLU B 29 4.017 -10.537 -8.080 1.00 0.00 O ATOM 0 H GLU B 29 7.423 -7.680 -6.965 1.00 0.00 H new ATOM 0 HA GLU B 29 4.993 -8.273 -5.392 1.00 0.00 H new ATOM 0 HB2 GLU B 29 7.466 -10.026 -5.396 1.00 0.00 H new ATOM 0 HB3 GLU B 29 5.843 -10.434 -4.876 1.00 0.00 H new ATOM 0 HG2 GLU B 29 6.355 -9.798 -7.776 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.809 -11.367 -7.142 1.00 0.00 H new ATOM 1432 N ARG B 30 7.554 -6.735 -4.566 1.00 0.00 N ATOM 1433 CA ARG B 30 8.329 -6.154 -3.483 1.00 0.00 C ATOM 1434 C ARG B 30 8.454 -4.645 -3.607 1.00 0.00 C ATOM 1435 O ARG B 30 8.645 -4.108 -4.690 1.00 0.00 O ATOM 1436 CB ARG B 30 9.727 -6.785 -3.448 1.00 0.00 C ATOM 1437 CG ARG B 30 10.597 -6.415 -4.643 1.00 0.00 C ATOM 1438 CD ARG B 30 11.904 -7.189 -4.655 1.00 0.00 C ATOM 1439 NE ARG B 30 13.002 -6.405 -5.226 1.00 0.00 N ATOM 1440 CZ ARG B 30 13.465 -6.558 -6.469 1.00 0.00 C ATOM 1441 NH1 ARG B 30 12.895 -7.425 -7.294 1.00 0.00 N ATOM 1442 NH2 ARG B 30 14.490 -5.824 -6.892 1.00 0.00 N ATOM 0 H ARG B 30 7.646 -6.265 -5.467 1.00 0.00 H new ATOM 0 HA ARG B 30 7.798 -6.364 -2.555 1.00 0.00 H new ATOM 0 HB2 ARG B 30 10.232 -6.476 -2.533 1.00 0.00 H new ATOM 0 HB3 ARG B 30 9.625 -7.869 -3.406 1.00 0.00 H new ATOM 0 HG2 ARG B 30 10.050 -6.612 -5.565 1.00 0.00 H new ATOM 0 HG3 ARG B 30 10.809 -5.346 -4.621 1.00 0.00 H new ATOM 0 HD2 ARG B 30 12.160 -7.483 -3.637 1.00 0.00 H new ATOM 0 HD3 ARG B 30 11.777 -8.106 -5.230 1.00 0.00 H new ATOM 0 HE ARG B 30 13.441 -5.697 -4.637 1.00 0.00 H new ATOM 0 HH11 ARG B 30 12.098 -7.979 -6.980 1.00 0.00 H new ATOM 0 HH12 ARG B 30 13.253 -7.538 -8.242 1.00 0.00 H new ATOM 0 HH21 ARG B 30 14.923 -5.144 -6.267 1.00 0.00 H new ATOM 0 HH22 ARG B 30 14.844 -5.941 -7.842 1.00 0.00 H new ATOM 1456 N ILE B 31 8.342 -3.965 -2.487 1.00 0.00 N ATOM 1457 CA ILE B 31 8.484 -2.527 -2.460 1.00 0.00 C ATOM 1458 C ILE B 31 9.859 -2.200 -1.890 1.00 0.00 C ATOM 1459 O ILE B 31 10.181 -2.563 -0.757 1.00 0.00 O ATOM 1460 CB ILE B 31 7.358 -1.845 -1.644 1.00 0.00 C ATOM 1461 CG1 ILE B 31 7.604 -0.340 -1.539 1.00 0.00 C ATOM 1462 CG2 ILE B 31 7.224 -2.465 -0.262 1.00 0.00 C ATOM 1463 CD1 ILE B 31 6.479 0.412 -0.863 1.00 0.00 C ATOM 0 H ILE B 31 8.152 -4.388 -1.579 1.00 0.00 H new ATOM 0 HA ILE B 31 8.396 -2.136 -3.474 1.00 0.00 H new ATOM 0 HB ILE B 31 6.419 -2.005 -2.173 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.528 -0.169 -0.986 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.752 0.066 -2.540 1.00 0.00 H new ATOM 0 HG21 ILE B 31 6.425 -1.964 0.286 1.00 0.00 H new ATOM 0 HG22 ILE B 31 6.988 -3.525 -0.360 1.00 0.00 H new ATOM 0 HG23 ILE B 31 8.163 -2.351 0.280 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.723 1.474 -0.824 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.557 0.272 -1.427 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.345 0.033 0.150 1.00 0.00 H new ATOM 1475 N ALA B 32 10.689 -1.563 -2.693 1.00 0.00 N ATOM 1476 CA ALA B 32 12.037 -1.233 -2.260 1.00 0.00 C ATOM 1477 C ALA B 32 12.335 0.247 -2.414 1.00 0.00 C ATOM 1478 O ALA B 32 12.008 0.861 -3.422 1.00 0.00 O ATOM 1479 CB ALA B 32 13.057 -2.066 -3.020 1.00 0.00 C ATOM 0 H ALA B 32 10.459 -1.265 -3.641 1.00 0.00 H new ATOM 0 HA ALA B 32 12.108 -1.470 -1.198 1.00 0.00 H new ATOM 0 HB1 ALA B 32 14.061 -1.807 -2.684 1.00 0.00 H new ATOM 0 HB2 ALA B 32 12.874 -3.124 -2.834 1.00 0.00 H new ATOM 0 HB3 ALA B 32 12.968 -1.865 -4.088 1.00 0.00 H new ATOM 1485 N TRP B 33 12.957 0.809 -1.401 1.00 0.00 N ATOM 1486 CA TRP B 33 13.313 2.210 -1.393 1.00 0.00 C ATOM 1487 C TRP B 33 14.833 2.374 -1.356 1.00 0.00 C ATOM 1488 O TRP B 33 15.545 1.541 -0.786 1.00 0.00 O ATOM 1489 CB TRP B 33 12.666 2.877 -0.168 1.00 0.00 C ATOM 1490 CG TRP B 33 12.978 4.340 -0.006 1.00 0.00 C ATOM 1491 CD1 TRP B 33 12.151 5.394 -0.257 1.00 0.00 C ATOM 1492 CD2 TRP B 33 14.212 4.905 0.450 1.00 0.00 C ATOM 1493 NE1 TRP B 33 12.802 6.576 0.011 1.00 0.00 N ATOM 1494 CE2 TRP B 33 14.069 6.298 0.443 1.00 0.00 C ATOM 1495 CE3 TRP B 33 15.422 4.357 0.856 1.00 0.00 C ATOM 1496 CZ2 TRP B 33 15.097 7.153 0.831 1.00 0.00 C ATOM 1497 CZ3 TRP B 33 16.442 5.191 1.230 1.00 0.00 C ATOM 1498 CH2 TRP B 33 16.278 6.583 1.219 1.00 0.00 C ATOM 0 H TRP B 33 13.231 0.305 -0.557 1.00 0.00 H new ATOM 0 HA TRP B 33 12.948 2.688 -2.302 1.00 0.00 H new ATOM 0 HB2 TRP B 33 11.585 2.756 -0.235 1.00 0.00 H new ATOM 0 HB3 TRP B 33 12.991 2.349 0.729 1.00 0.00 H new ATOM 0 HD1 TRP B 33 11.135 5.313 -0.614 1.00 0.00 H new ATOM 0 HE1 TRP B 33 12.404 7.509 -0.095 1.00 0.00 H new ATOM 0 HE3 TRP B 33 15.557 3.286 0.877 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 14.967 8.225 0.826 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 17.387 4.770 1.538 1.00 0.00 H new ATOM 0 HH2 TRP B 33 17.099 7.216 1.522 1.00 0.00 H new ATOM 1509 N ALA B 34 15.317 3.446 -1.975 1.00 0.00 N ATOM 1510 CA ALA B 34 16.737 3.779 -1.991 1.00 0.00 C ATOM 1511 C ALA B 34 16.895 5.292 -2.080 1.00 0.00 C ATOM 1512 O ALA B 34 16.034 5.952 -2.633 1.00 0.00 O ATOM 1513 CB ALA B 34 17.434 3.112 -3.148 1.00 0.00 C ATOM 0 H ALA B 34 14.733 4.111 -2.482 1.00 0.00 H new ATOM 0 HA ALA B 34 17.196 3.416 -1.071 1.00 0.00 H new ATOM 0 HB1 ALA B 34 18.491 3.376 -3.137 1.00 0.00 H new ATOM 0 HB2 ALA B 34 17.329 2.030 -3.061 1.00 0.00 H new ATOM 0 HB3 ALA B 34 16.986 3.446 -4.084 1.00 0.00 H new ATOM 1519 N PRO B 35 17.970 5.870 -1.523 1.00 0.00 N ATOM 1520 CA PRO B 35 18.179 7.322 -1.559 1.00 0.00 C ATOM 1521 C PRO B 35 18.616 7.814 -2.938 1.00 0.00 C ATOM 1522 O PRO B 35 18.972 7.015 -3.810 1.00 0.00 O ATOM 1523 CB PRO B 35 19.278 7.551 -0.521 1.00 0.00 C ATOM 1524 CG PRO B 35 20.021 6.257 -0.435 1.00 0.00 C ATOM 1525 CD PRO B 35 19.056 5.166 -0.821 1.00 0.00 C ATOM 0 HA PRO B 35 17.262 7.872 -1.347 1.00 0.00 H new ATOM 0 HB2 PRO B 35 19.939 8.364 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO B 35 18.854 7.825 0.445 1.00 0.00 H new ATOM 0 HG2 PRO B 35 20.883 6.263 -1.102 1.00 0.00 H new ATOM 0 HG3 PRO B 35 20.400 6.097 0.574 1.00 0.00 H new ATOM 0 HD2 PRO B 35 19.530 4.425 -1.464 1.00 0.00 H new ATOM 0 HD3 PRO B 35 18.684 4.636 0.056 1.00 0.00 H new ATOM 1533 N GLU B 36 18.570 9.128 -3.136 1.00 0.00 N ATOM 1534 CA GLU B 36 18.950 9.719 -4.409 1.00 0.00 C ATOM 1535 C GLU B 36 20.429 9.490 -4.691 1.00 0.00 C ATOM 1536 O GLU B 36 21.272 9.612 -3.802 1.00 0.00 O ATOM 1537 CB GLU B 36 18.627 11.217 -4.424 1.00 0.00 C ATOM 1538 CG GLU B 36 18.425 11.782 -5.822 1.00 0.00 C ATOM 1539 CD GLU B 36 17.399 11.003 -6.620 1.00 0.00 C ATOM 1540 OE1 GLU B 36 17.752 9.945 -7.182 1.00 0.00 O ATOM 1541 OE2 GLU B 36 16.226 11.440 -6.689 1.00 0.00 O ATOM 0 H GLU B 36 18.273 9.801 -2.430 1.00 0.00 H new ATOM 0 HA GLU B 36 18.373 9.233 -5.196 1.00 0.00 H new ATOM 0 HB2 GLU B 36 17.726 11.392 -3.837 1.00 0.00 H new ATOM 0 HB3 GLU B 36 19.436 11.760 -3.935 1.00 0.00 H new ATOM 0 HG2 GLU B 36 18.109 12.823 -5.748 1.00 0.00 H new ATOM 0 HG3 GLU B 36 19.376 11.775 -6.354 1.00 0.00 H new ATOM 1548 N GLY B 37 20.731 9.137 -5.933 1.00 0.00 N ATOM 1549 CA GLY B 37 22.105 8.889 -6.319 1.00 0.00 C ATOM 1550 C GLY B 37 22.615 7.552 -5.814 1.00 0.00 C ATOM 1551 O GLY B 37 23.822 7.358 -5.639 1.00 0.00 O ATOM 0 H GLY B 37 20.048 9.018 -6.681 1.00 0.00 H new ATOM 0 HA2 GLY B 37 22.185 8.919 -7.406 1.00 0.00 H new ATOM 0 HA3 GLY B 37 22.738 9.687 -5.931 1.00 0.00 H new ATOM 1555 N LYS B 38 21.705 6.622 -5.568 1.00 0.00 N ATOM 1556 CA LYS B 38 22.099 5.312 -5.089 1.00 0.00 C ATOM 1557 C LYS B 38 21.776 4.232 -6.106 1.00 0.00 C ATOM 1558 O LYS B 38 20.681 4.180 -6.661 1.00 0.00 O ATOM 1559 CB LYS B 38 21.452 4.999 -3.745 1.00 0.00 C ATOM 1560 CG LYS B 38 22.391 4.287 -2.783 1.00 0.00 C ATOM 1561 CD LYS B 38 23.654 5.104 -2.525 1.00 0.00 C ATOM 1562 CE LYS B 38 24.895 4.431 -3.101 1.00 0.00 C ATOM 1563 NZ LYS B 38 25.293 5.002 -4.421 1.00 0.00 N ATOM 0 H LYS B 38 20.701 6.750 -5.691 1.00 0.00 H new ATOM 0 HA LYS B 38 23.180 5.327 -4.948 1.00 0.00 H new ATOM 0 HB2 LYS B 38 21.109 5.927 -3.288 1.00 0.00 H new ATOM 0 HB3 LYS B 38 20.570 4.379 -3.908 1.00 0.00 H new ATOM 0 HG2 LYS B 38 21.876 4.104 -1.840 1.00 0.00 H new ATOM 0 HG3 LYS B 38 22.663 3.314 -3.192 1.00 0.00 H new ATOM 0 HD2 LYS B 38 23.541 6.095 -2.965 1.00 0.00 H new ATOM 0 HD3 LYS B 38 23.782 5.244 -1.452 1.00 0.00 H new ATOM 0 HE2 LYS B 38 25.722 4.538 -2.398 1.00 0.00 H new ATOM 0 HE3 LYS B 38 24.707 3.363 -3.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 25.064 4.324 -5.176 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 24.777 5.890 -4.585 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 26.316 5.190 -4.424 1.00 0.00 H new ATOM 1577 N ASP B 39 22.762 3.385 -6.338 1.00 0.00 N ATOM 1578 CA ASP B 39 22.671 2.282 -7.284 1.00 0.00 C ATOM 1579 C ASP B 39 22.106 1.031 -6.620 1.00 0.00 C ATOM 1580 O ASP B 39 21.742 0.067 -7.293 1.00 0.00 O ATOM 1581 CB ASP B 39 24.070 1.985 -7.832 1.00 0.00 C ATOM 1582 CG ASP B 39 25.111 1.892 -6.725 1.00 0.00 C ATOM 1583 OD1 ASP B 39 25.334 2.911 -6.019 1.00 0.00 O ATOM 1584 OD2 ASP B 39 25.695 0.807 -6.544 1.00 0.00 O ATOM 0 H ASP B 39 23.665 3.443 -5.867 1.00 0.00 H new ATOM 0 HA ASP B 39 21.998 2.567 -8.093 1.00 0.00 H new ATOM 0 HB2 ASP B 39 24.049 1.048 -8.389 1.00 0.00 H new ATOM 0 HB3 ASP B 39 24.357 2.767 -8.534 1.00 0.00 H new ATOM 1589 N ARG B 40 22.043 1.045 -5.299 1.00 0.00 N ATOM 1590 CA ARG B 40 21.531 -0.092 -4.548 1.00 0.00 C ATOM 1591 C ARG B 40 20.409 0.347 -3.619 1.00 0.00 C ATOM 1592 O ARG B 40 20.410 1.476 -3.126 1.00 0.00 O ATOM 1593 CB ARG B 40 22.650 -0.756 -3.738 1.00 0.00 C ATOM 1594 CG ARG B 40 23.242 -1.992 -4.402 1.00 0.00 C ATOM 1595 CD ARG B 40 24.134 -1.627 -5.578 1.00 0.00 C ATOM 1596 NE ARG B 40 24.737 -2.806 -6.202 1.00 0.00 N ATOM 1597 CZ ARG B 40 25.803 -2.759 -7.003 1.00 0.00 C ATOM 1598 NH1 ARG B 40 26.386 -1.597 -7.277 1.00 0.00 N ATOM 1599 NH2 ARG B 40 26.284 -3.880 -7.535 1.00 0.00 N ATOM 0 H ARG B 40 22.340 1.832 -4.722 1.00 0.00 H new ATOM 0 HA ARG B 40 21.138 -0.818 -5.259 1.00 0.00 H new ATOM 0 HB2 ARG B 40 23.445 -0.029 -3.571 1.00 0.00 H new ATOM 0 HB3 ARG B 40 22.261 -1.033 -2.758 1.00 0.00 H new ATOM 0 HG2 ARG B 40 23.819 -2.557 -3.670 1.00 0.00 H new ATOM 0 HG3 ARG B 40 22.437 -2.642 -4.744 1.00 0.00 H new ATOM 0 HD2 ARG B 40 23.549 -1.084 -6.321 1.00 0.00 H new ATOM 0 HD3 ARG B 40 24.922 -0.954 -5.239 1.00 0.00 H new ATOM 0 HE ARG B 40 24.318 -3.717 -6.013 1.00 0.00 H new ATOM 0 HH11 ARG B 40 26.019 -0.735 -6.874 1.00 0.00 H new ATOM 0 HH12 ARG B 40 27.201 -1.567 -7.890 1.00 0.00 H new ATOM 0 HH21 ARG B 40 25.838 -4.774 -7.330 1.00 0.00 H new ATOM 0 HH22 ARG B 40 27.099 -3.845 -8.147 1.00 0.00 H new ATOM 1613 N PHE B 41 19.457 -0.548 -3.386 1.00 0.00 N ATOM 1614 CA PHE B 41 18.328 -0.258 -2.515 1.00 0.00 C ATOM 1615 C PHE B 41 18.762 -0.265 -1.056 1.00 0.00 C ATOM 1616 O PHE B 41 19.801 -0.825 -0.707 1.00 0.00 O ATOM 1617 CB PHE B 41 17.201 -1.270 -2.736 1.00 0.00 C ATOM 1618 CG PHE B 41 16.533 -1.142 -4.076 1.00 0.00 C ATOM 1619 CD1 PHE B 41 15.831 0.005 -4.408 1.00 0.00 C ATOM 1620 CD2 PHE B 41 16.609 -2.167 -5.005 1.00 0.00 C ATOM 1621 CE1 PHE B 41 15.217 0.127 -5.640 1.00 0.00 C ATOM 1622 CE2 PHE B 41 15.998 -2.051 -6.239 1.00 0.00 C ATOM 1623 CZ PHE B 41 15.301 -0.902 -6.557 1.00 0.00 C ATOM 0 H PHE B 41 19.446 -1.484 -3.791 1.00 0.00 H new ATOM 0 HA PHE B 41 17.955 0.736 -2.763 1.00 0.00 H new ATOM 0 HB2 PHE B 41 17.604 -2.278 -2.635 1.00 0.00 H new ATOM 0 HB3 PHE B 41 16.453 -1.145 -1.953 1.00 0.00 H new ATOM 0 HD1 PHE B 41 15.763 0.814 -3.695 1.00 0.00 H new ATOM 0 HD2 PHE B 41 17.153 -3.068 -4.762 1.00 0.00 H new ATOM 0 HE1 PHE B 41 14.672 1.026 -5.885 1.00 0.00 H new ATOM 0 HE2 PHE B 41 16.065 -2.858 -6.954 1.00 0.00 H new ATOM 0 HZ PHE B 41 14.823 -0.808 -7.521 1.00 0.00 H new ATOM 1633 N THR B 42 17.963 0.361 -0.213 1.00 0.00 N ATOM 1634 CA THR B 42 18.258 0.444 1.205 1.00 0.00 C ATOM 1635 C THR B 42 17.189 -0.265 2.037 1.00 0.00 C ATOM 1636 O THR B 42 17.494 -0.949 3.012 1.00 0.00 O ATOM 1637 CB THR B 42 18.364 1.921 1.629 1.00 0.00 C ATOM 1638 OG1 THR B 42 19.402 2.558 0.875 1.00 0.00 O ATOM 1639 CG2 THR B 42 18.650 2.063 3.116 1.00 0.00 C ATOM 0 H THR B 42 17.097 0.823 -0.489 1.00 0.00 H new ATOM 0 HA THR B 42 19.210 -0.056 1.385 1.00 0.00 H new ATOM 0 HB THR B 42 17.405 2.399 1.429 1.00 0.00 H new ATOM 0 HG1 THR B 42 19.800 3.277 1.409 1.00 0.00 H new ATOM 0 HG21 THR B 42 18.717 3.120 3.374 1.00 0.00 H new ATOM 0 HG22 THR B 42 17.845 1.600 3.687 1.00 0.00 H new ATOM 0 HG23 THR B 42 19.593 1.571 3.354 1.00 0.00 H new ATOM 1647 N ILE B 43 15.939 -0.116 1.631 1.00 0.00 N ATOM 1648 CA ILE B 43 14.828 -0.723 2.347 1.00 0.00 C ATOM 1649 C ILE B 43 13.996 -1.593 1.408 1.00 0.00 C ATOM 1650 O ILE B 43 13.547 -1.131 0.363 1.00 0.00 O ATOM 1651 CB ILE B 43 13.958 0.377 3.003 1.00 0.00 C ATOM 1652 CG1 ILE B 43 14.470 0.679 4.412 1.00 0.00 C ATOM 1653 CG2 ILE B 43 12.485 -0.009 3.043 1.00 0.00 C ATOM 1654 CD1 ILE B 43 13.850 1.912 5.026 1.00 0.00 C ATOM 0 H ILE B 43 15.667 0.421 0.808 1.00 0.00 H new ATOM 0 HA ILE B 43 15.223 -1.365 3.134 1.00 0.00 H new ATOM 0 HB ILE B 43 14.040 1.274 2.390 1.00 0.00 H new ATOM 0 HG12 ILE B 43 14.269 -0.178 5.055 1.00 0.00 H new ATOM 0 HG13 ILE B 43 15.552 0.805 4.378 1.00 0.00 H new ATOM 0 HG21 ILE B 43 11.912 0.791 3.511 1.00 0.00 H new ATOM 0 HG22 ILE B 43 12.123 -0.168 2.027 1.00 0.00 H new ATOM 0 HG23 ILE B 43 12.365 -0.926 3.619 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.259 2.066 6.025 1.00 0.00 H new ATOM 0 HD12 ILE B 43 14.073 2.779 4.405 1.00 0.00 H new ATOM 0 HD13 ILE B 43 12.770 1.782 5.092 1.00 0.00 H new ATOM 1666 N SER B 44 13.838 -2.864 1.758 1.00 0.00 N ATOM 1667 CA SER B 44 13.061 -3.789 0.942 1.00 0.00 C ATOM 1668 C SER B 44 12.000 -4.510 1.769 1.00 0.00 C ATOM 1669 O SER B 44 12.305 -5.113 2.798 1.00 0.00 O ATOM 1670 CB SER B 44 13.989 -4.805 0.273 1.00 0.00 C ATOM 1671 OG SER B 44 15.032 -4.150 -0.430 1.00 0.00 O ATOM 0 H SER B 44 14.237 -3.277 2.601 1.00 0.00 H new ATOM 0 HA SER B 44 12.548 -3.209 0.175 1.00 0.00 H new ATOM 0 HB2 SER B 44 14.413 -5.468 1.027 1.00 0.00 H new ATOM 0 HB3 SER B 44 13.417 -5.429 -0.414 1.00 0.00 H new ATOM 0 HG SER B 44 15.614 -4.818 -0.848 1.00 0.00 H new ATOM 1677 N HIS B 45 10.756 -4.441 1.312 1.00 0.00 N ATOM 1678 CA HIS B 45 9.639 -5.094 1.979 1.00 0.00 C ATOM 1679 C HIS B 45 8.809 -5.813 0.938 1.00 0.00 C ATOM 1680 O HIS B 45 8.535 -5.276 -0.132 1.00 0.00 O ATOM 1681 CB HIS B 45 8.751 -4.086 2.722 1.00 0.00 C ATOM 1682 CG HIS B 45 9.464 -3.262 3.750 1.00 0.00 C ATOM 1683 ND1 HIS B 45 10.062 -3.776 4.879 1.00 0.00 N ATOM 1684 CD2 HIS B 45 9.656 -1.921 3.803 1.00 0.00 C ATOM 1685 CE1 HIS B 45 10.588 -2.755 5.568 1.00 0.00 C ATOM 1686 NE2 HIS B 45 10.369 -1.607 4.956 1.00 0.00 N ATOM 0 H HIS B 45 10.494 -3.931 0.469 1.00 0.00 H new ATOM 0 HA HIS B 45 10.038 -5.793 2.714 1.00 0.00 H new ATOM 0 HB2 HIS B 45 8.295 -3.417 1.992 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.940 -4.627 3.209 1.00 0.00 H new ATOM 0 HD2 HIS B 45 9.311 -1.210 3.067 1.00 0.00 H new ATOM 0 HE1 HIS B 45 11.121 -2.858 6.502 1.00 0.00 H new ATOM 0 HE2 HIS B 45 10.662 -0.680 5.264 1.00 0.00 H new ATOM 1694 N MET B 46 8.434 -7.034 1.229 1.00 0.00 N ATOM 1695 CA MET B 46 7.625 -7.799 0.307 1.00 0.00 C ATOM 1696 C MET B 46 6.162 -7.584 0.641 1.00 0.00 C ATOM 1697 O MET B 46 5.773 -7.672 1.802 1.00 0.00 O ATOM 1698 CB MET B 46 8.003 -9.274 0.371 1.00 0.00 C ATOM 1699 CG MET B 46 9.233 -9.612 -0.455 1.00 0.00 C ATOM 1700 SD MET B 46 9.226 -11.309 -1.059 1.00 0.00 S ATOM 1701 CE MET B 46 7.947 -11.213 -2.310 1.00 0.00 C ATOM 0 H MET B 46 8.674 -7.520 2.093 1.00 0.00 H new ATOM 0 HA MET B 46 7.804 -7.462 -0.714 1.00 0.00 H new ATOM 0 HB2 MET B 46 8.183 -9.552 1.410 1.00 0.00 H new ATOM 0 HB3 MET B 46 7.162 -9.874 0.022 1.00 0.00 H new ATOM 0 HG2 MET B 46 9.294 -8.930 -1.303 1.00 0.00 H new ATOM 0 HG3 MET B 46 10.126 -9.450 0.149 1.00 0.00 H new ATOM 0 HE1 MET B 46 8.001 -12.091 -2.953 1.00 0.00 H new ATOM 0 HE2 MET B 46 6.970 -11.175 -1.829 1.00 0.00 H new ATOM 0 HE3 MET B 46 8.091 -10.314 -2.910 1.00 0.00 H new ATOM 1711 N TYR B 47 5.358 -7.305 -0.379 1.00 0.00 N ATOM 1712 CA TYR B 47 3.928 -7.030 -0.198 1.00 0.00 C ATOM 1713 C TYR B 47 3.216 -8.132 0.591 1.00 0.00 C ATOM 1714 O TYR B 47 2.193 -7.890 1.220 1.00 0.00 O ATOM 1715 CB TYR B 47 3.240 -6.871 -1.550 1.00 0.00 C ATOM 1716 CG TYR B 47 3.519 -5.571 -2.272 1.00 0.00 C ATOM 1717 CD1 TYR B 47 4.811 -5.200 -2.616 1.00 0.00 C ATOM 1718 CD2 TYR B 47 2.478 -4.721 -2.623 1.00 0.00 C ATOM 1719 CE1 TYR B 47 5.059 -4.019 -3.285 1.00 0.00 C ATOM 1720 CE2 TYR B 47 2.717 -3.541 -3.294 1.00 0.00 C ATOM 1721 CZ TYR B 47 4.009 -3.194 -3.622 1.00 0.00 C ATOM 1722 OH TYR B 47 4.254 -2.015 -4.283 1.00 0.00 O ATOM 0 H TYR B 47 5.671 -7.262 -1.349 1.00 0.00 H new ATOM 0 HA TYR B 47 3.861 -6.104 0.372 1.00 0.00 H new ATOM 0 HB2 TYR B 47 3.545 -7.697 -2.193 1.00 0.00 H new ATOM 0 HB3 TYR B 47 2.164 -6.962 -1.404 1.00 0.00 H new ATOM 0 HD1 TYR B 47 5.636 -5.846 -2.356 1.00 0.00 H new ATOM 0 HD2 TYR B 47 1.464 -4.989 -2.366 1.00 0.00 H new ATOM 0 HE1 TYR B 47 6.071 -3.743 -3.543 1.00 0.00 H new ATOM 0 HE2 TYR B 47 1.896 -2.892 -3.561 1.00 0.00 H new ATOM 0 HH TYR B 47 3.407 -1.550 -4.448 1.00 0.00 H new ATOM 1732 N ALA B 48 3.760 -9.338 0.534 1.00 0.00 N ATOM 1733 CA ALA B 48 3.188 -10.483 1.236 1.00 0.00 C ATOM 1734 C ALA B 48 3.280 -10.329 2.754 1.00 0.00 C ATOM 1735 O ALA B 48 2.461 -10.883 3.485 1.00 0.00 O ATOM 1736 CB ALA B 48 3.877 -11.763 0.792 1.00 0.00 C ATOM 0 H ALA B 48 4.605 -9.553 0.004 1.00 0.00 H new ATOM 0 HA ALA B 48 2.130 -10.533 0.979 1.00 0.00 H new ATOM 0 HB1 ALA B 48 3.444 -12.612 1.321 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.741 -11.896 -0.281 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.942 -11.700 1.017 1.00 0.00 H new ATOM 1742 N ASP B 49 4.279 -9.589 3.229 1.00 0.00 N ATOM 1743 CA ASP B 49 4.448 -9.377 4.664 1.00 0.00 C ATOM 1744 C ASP B 49 3.779 -8.080 5.080 1.00 0.00 C ATOM 1745 O ASP B 49 3.359 -7.927 6.220 1.00 0.00 O ATOM 1746 CB ASP B 49 5.941 -9.375 5.039 1.00 0.00 C ATOM 1747 CG ASP B 49 6.338 -8.230 5.964 1.00 0.00 C ATOM 1748 OD1 ASP B 49 6.068 -8.316 7.186 1.00 0.00 O ATOM 1749 OD2 ASP B 49 6.927 -7.248 5.465 1.00 0.00 O ATOM 0 H ASP B 49 4.979 -9.129 2.646 1.00 0.00 H new ATOM 0 HA ASP B 49 3.971 -10.197 5.200 1.00 0.00 H new ATOM 0 HB2 ASP B 49 6.187 -10.321 5.520 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.536 -9.317 4.127 1.00 0.00 H new ATOM 1754 N ILE B 50 3.655 -7.158 4.142 1.00 0.00 N ATOM 1755 CA ILE B 50 3.032 -5.882 4.427 1.00 0.00 C ATOM 1756 C ILE B 50 1.553 -6.064 4.743 1.00 0.00 C ATOM 1757 O ILE B 50 0.736 -6.294 3.852 1.00 0.00 O ATOM 1758 CB ILE B 50 3.188 -4.887 3.264 1.00 0.00 C ATOM 1759 CG1 ILE B 50 4.599 -4.959 2.688 1.00 0.00 C ATOM 1760 CG2 ILE B 50 2.892 -3.479 3.746 1.00 0.00 C ATOM 1761 CD1 ILE B 50 4.811 -4.045 1.508 1.00 0.00 C ATOM 0 H ILE B 50 3.977 -7.270 3.181 1.00 0.00 H new ATOM 0 HA ILE B 50 3.544 -5.469 5.296 1.00 0.00 H new ATOM 0 HB ILE B 50 2.479 -5.151 2.479 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.316 -4.704 3.469 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.808 -5.985 2.386 1.00 0.00 H new ATOM 0 HG21 ILE B 50 3.004 -2.780 2.918 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.871 -3.431 4.125 1.00 0.00 H new ATOM 0 HG23 ILE B 50 3.588 -3.213 4.542 1.00 0.00 H new ATOM 0 HD11 ILE B 50 5.835 -4.147 1.148 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.118 -4.314 0.711 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.633 -3.013 1.811 1.00 0.00 H new ATOM 1773 N LYS B 51 1.234 -5.975 6.026 1.00 0.00 N ATOM 1774 CA LYS B 51 -0.128 -6.120 6.507 1.00 0.00 C ATOM 1775 C LYS B 51 -1.042 -5.087 5.873 1.00 0.00 C ATOM 1776 O LYS B 51 -1.970 -5.418 5.139 1.00 0.00 O ATOM 1777 CB LYS B 51 -0.159 -5.946 8.027 1.00 0.00 C ATOM 1778 CG LYS B 51 -1.560 -5.779 8.587 1.00 0.00 C ATOM 1779 CD LYS B 51 -1.551 -5.008 9.890 1.00 0.00 C ATOM 1780 CE LYS B 51 -2.968 -4.738 10.367 1.00 0.00 C ATOM 1781 NZ LYS B 51 -3.546 -3.508 9.749 1.00 0.00 N ATOM 0 H LYS B 51 1.916 -5.800 6.764 1.00 0.00 H new ATOM 0 HA LYS B 51 -0.480 -7.115 6.235 1.00 0.00 H new ATOM 0 HB2 LYS B 51 0.310 -6.812 8.494 1.00 0.00 H new ATOM 0 HB3 LYS B 51 0.439 -5.075 8.298 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -2.183 -5.259 7.860 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -2.008 -6.760 8.747 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.009 -5.573 10.648 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -1.022 -4.065 9.756 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.599 -5.594 10.128 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -2.971 -4.633 11.452 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.364 -3.190 10.308 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -2.826 -2.758 9.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.851 -3.718 8.777 1.00 0.00 H new ATOM 1795 N CYS B 52 -0.759 -3.833 6.167 1.00 0.00 N ATOM 1796 CA CYS B 52 -1.547 -2.726 5.661 1.00 0.00 C ATOM 1797 C CYS B 52 -0.653 -1.515 5.527 1.00 0.00 C ATOM 1798 O CYS B 52 0.563 -1.606 5.697 1.00 0.00 O ATOM 1799 CB CYS B 52 -2.716 -2.418 6.607 1.00 0.00 C ATOM 1800 SG CYS B 52 -3.945 -3.743 6.741 1.00 0.00 S ATOM 0 H CYS B 52 0.021 -3.553 6.762 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.961 -2.991 4.688 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -2.318 -2.208 7.600 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -3.214 -1.511 6.265 1.00 0.00 H new ATOM 0 HG CYS B 52 -3.566 -4.761 6.027 1.00 0.00 H new ATOM 1806 N GLN B 53 -1.241 -0.390 5.217 1.00 0.00 N ATOM 1807 CA GLN B 53 -0.488 0.833 5.075 1.00 0.00 C ATOM 1808 C GLN B 53 -1.092 1.887 5.980 1.00 0.00 C ATOM 1809 O GLN B 53 -2.039 1.610 6.697 1.00 0.00 O ATOM 1810 CB GLN B 53 -0.496 1.318 3.625 1.00 0.00 C ATOM 1811 CG GLN B 53 -0.395 0.208 2.593 1.00 0.00 C ATOM 1812 CD GLN B 53 -1.544 0.244 1.608 1.00 0.00 C ATOM 1813 OE1 GLN B 53 -2.563 -0.573 1.838 1.00 0.00 O flip ATOM 1814 NE2 GLN B 53 -1.517 1.005 0.647 1.00 0.00 N flip ATOM 0 H GLN B 53 -2.244 -0.293 5.057 1.00 0.00 H new ATOM 0 HA GLN B 53 0.548 0.648 5.358 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -1.413 1.881 3.448 1.00 0.00 H new ATOM 0 HB3 GLN B 53 0.335 2.009 3.481 1.00 0.00 H new ATOM 0 HG2 GLN B 53 0.548 0.299 2.054 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -0.381 -0.757 3.099 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -0.715 1.618 0.505 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -2.297 1.025 -0.010 1.00 0.00 H new ATOM 1823 N LYS B 54 -0.505 3.061 5.984 1.00 0.00 N ATOM 1824 CA LYS B 54 -0.994 4.189 6.747 1.00 0.00 C ATOM 1825 C LYS B 54 -0.577 5.431 5.989 1.00 0.00 C ATOM 1826 O LYS B 54 0.453 5.419 5.328 1.00 0.00 O ATOM 1827 CB LYS B 54 -0.468 4.171 8.184 1.00 0.00 C ATOM 1828 CG LYS B 54 -1.217 3.182 9.069 1.00 0.00 C ATOM 1829 CD LYS B 54 -0.668 3.133 10.479 1.00 0.00 C ATOM 1830 CE LYS B 54 -1.166 4.299 11.308 1.00 0.00 C ATOM 1831 NZ LYS B 54 -0.102 4.815 12.204 1.00 0.00 N ATOM 0 H LYS B 54 0.339 3.264 5.449 1.00 0.00 H new ATOM 0 HA LYS B 54 -2.079 4.156 6.848 1.00 0.00 H new ATOM 0 HB2 LYS B 54 0.592 3.916 8.176 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -0.552 5.171 8.610 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -2.271 3.456 9.103 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -1.160 2.188 8.626 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -0.962 2.196 10.953 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.421 3.146 10.447 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -1.508 5.097 10.649 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -2.025 3.986 11.902 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -0.361 5.765 12.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 0.005 4.178 13.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 0.797 4.865 11.683 1.00 0.00 H new ATOM 1845 N ILE B 55 -1.369 6.484 6.024 1.00 0.00 N ATOM 1846 CA ILE B 55 -1.041 7.671 5.240 1.00 0.00 C ATOM 1847 C ILE B 55 -1.477 8.961 5.878 1.00 0.00 C ATOM 1848 O ILE B 55 -2.421 8.978 6.649 1.00 0.00 O ATOM 1849 CB ILE B 55 -1.782 7.634 3.895 1.00 0.00 C ATOM 1850 CG1 ILE B 55 -3.283 7.476 4.139 1.00 0.00 C ATOM 1851 CG2 ILE B 55 -1.269 6.517 3.023 1.00 0.00 C ATOM 1852 CD1 ILE B 55 -4.132 7.819 2.945 1.00 0.00 C ATOM 0 H ILE B 55 -2.227 6.549 6.572 1.00 0.00 H new ATOM 0 HA ILE B 55 0.045 7.648 5.147 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.600 8.573 3.372 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -3.487 6.447 4.435 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -3.575 8.112 4.975 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -1.812 6.515 2.078 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.206 6.664 2.831 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.418 5.563 3.529 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -5.184 7.682 3.195 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.958 8.857 2.661 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.870 7.166 2.112 1.00 0.00 H new ATOM 1864 N SER B 56 -0.788 10.036 5.532 1.00 0.00 N ATOM 1865 CA SER B 56 -1.181 11.357 5.969 1.00 0.00 C ATOM 1866 C SER B 56 -2.267 11.784 4.991 1.00 0.00 C ATOM 1867 O SER B 56 -1.970 12.169 3.861 1.00 0.00 O ATOM 1868 CB SER B 56 0.009 12.313 5.930 1.00 0.00 C ATOM 1869 OG SER B 56 0.650 12.258 4.669 1.00 0.00 O ATOM 0 H SER B 56 0.048 10.015 4.948 1.00 0.00 H new ATOM 0 HA SER B 56 -1.539 11.365 6.998 1.00 0.00 H new ATOM 0 HB2 SER B 56 -0.328 13.330 6.129 1.00 0.00 H new ATOM 0 HB3 SER B 56 0.718 12.053 6.716 1.00 0.00 H new ATOM 0 HG SER B 56 -0.025 12.191 3.962 1.00 0.00 H new ATOM 1875 N PRO B 57 -3.534 11.686 5.395 1.00 0.00 N ATOM 1876 CA PRO B 57 -4.672 11.959 4.516 1.00 0.00 C ATOM 1877 C PRO B 57 -4.716 13.384 3.982 1.00 0.00 C ATOM 1878 O PRO B 57 -4.062 14.289 4.513 1.00 0.00 O ATOM 1879 CB PRO B 57 -5.881 11.643 5.397 1.00 0.00 C ATOM 1880 CG PRO B 57 -5.330 10.791 6.472 1.00 0.00 C ATOM 1881 CD PRO B 57 -3.983 11.357 6.749 1.00 0.00 C ATOM 0 HA PRO B 57 -4.626 11.361 3.606 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -6.330 12.551 5.799 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.658 11.124 4.836 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -5.961 10.817 7.361 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -5.265 9.749 6.158 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -4.029 12.235 7.393 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -3.326 10.638 7.238 1.00 0.00 H new ATOM 1889 N GLU B 58 -5.469 13.540 2.898 1.00 0.00 N ATOM 1890 CA GLU B 58 -5.653 14.811 2.210 1.00 0.00 C ATOM 1891 C GLU B 58 -5.971 15.937 3.189 1.00 0.00 C ATOM 1892 O GLU B 58 -7.102 16.083 3.652 1.00 0.00 O ATOM 1893 CB GLU B 58 -6.768 14.682 1.165 1.00 0.00 C ATOM 1894 CG GLU B 58 -6.537 13.570 0.143 1.00 0.00 C ATOM 1895 CD GLU B 58 -6.878 12.187 0.678 1.00 0.00 C ATOM 1896 OE1 GLU B 58 -5.979 11.536 1.266 1.00 0.00 O ATOM 1897 OE2 GLU B 58 -8.037 11.759 0.527 1.00 0.00 O ATOM 0 H GLU B 58 -5.979 12.770 2.465 1.00 0.00 H new ATOM 0 HA GLU B 58 -4.718 15.063 1.710 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -7.713 14.500 1.677 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -6.869 15.631 0.638 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -7.139 13.769 -0.743 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -5.493 13.584 -0.171 1.00 0.00 H new ATOM 1904 N GLY B 59 -4.954 16.725 3.490 1.00 0.00 N ATOM 1905 CA GLY B 59 -5.092 17.824 4.416 1.00 0.00 C ATOM 1906 C GLY B 59 -3.786 18.087 5.124 1.00 0.00 C ATOM 1907 O GLY B 59 -3.473 19.222 5.484 1.00 0.00 O ATOM 0 H GLY B 59 -4.017 16.619 3.100 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -5.409 18.720 3.882 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -5.869 17.596 5.146 1.00 0.00 H new ATOM 1911 N LYS B 60 -3.015 17.024 5.320 1.00 0.00 N ATOM 1912 CA LYS B 60 -1.720 17.131 5.967 1.00 0.00 C ATOM 1913 C LYS B 60 -0.690 17.710 5.007 1.00 0.00 C ATOM 1914 O LYS B 60 -0.571 17.261 3.868 1.00 0.00 O ATOM 1915 CB LYS B 60 -1.261 15.766 6.483 1.00 0.00 C ATOM 1916 CG LYS B 60 -1.765 15.464 7.878 1.00 0.00 C ATOM 1917 CD LYS B 60 -0.805 14.568 8.637 1.00 0.00 C ATOM 1918 CE LYS B 60 -0.421 15.163 9.984 1.00 0.00 C ATOM 1919 NZ LYS B 60 -1.563 15.837 10.666 1.00 0.00 N ATOM 0 H LYS B 60 -3.268 16.077 5.038 1.00 0.00 H new ATOM 0 HA LYS B 60 -1.817 17.805 6.818 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -1.608 14.990 5.801 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -0.172 15.730 6.480 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -1.903 16.396 8.425 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -2.741 14.983 7.817 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -1.263 13.591 8.789 1.00 0.00 H new ATOM 0 HD3 LYS B 60 0.093 14.410 8.040 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -0.035 14.373 10.628 1.00 0.00 H new ATOM 0 HE3 LYS B 60 0.386 15.882 9.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -1.476 15.712 11.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -1.553 16.852 10.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -2.458 15.418 10.341 1.00 0.00 H new ATOM 1933 N ALA B 61 0.039 18.718 5.476 1.00 0.00 N ATOM 1934 CA ALA B 61 1.062 19.377 4.670 1.00 0.00 C ATOM 1935 C ALA B 61 2.184 18.415 4.299 1.00 0.00 C ATOM 1936 O ALA B 61 2.745 18.494 3.210 1.00 0.00 O ATOM 1937 CB ALA B 61 1.619 20.577 5.411 1.00 0.00 C ATOM 0 H ALA B 61 -0.061 19.099 6.417 1.00 0.00 H new ATOM 0 HA ALA B 61 0.595 19.715 3.745 1.00 0.00 H new ATOM 0 HB1 ALA B 61 2.381 21.060 4.800 1.00 0.00 H new ATOM 0 HB2 ALA B 61 0.815 21.284 5.615 1.00 0.00 H new ATOM 0 HB3 ALA B 61 2.062 20.250 6.352 1.00 0.00 H new ATOM 1943 N LYS B 62 2.524 17.525 5.222 1.00 0.00 N ATOM 1944 CA LYS B 62 3.561 16.539 4.970 1.00 0.00 C ATOM 1945 C LYS B 62 2.950 15.363 4.235 1.00 0.00 C ATOM 1946 O LYS B 62 2.023 14.736 4.745 1.00 0.00 O ATOM 1947 CB LYS B 62 4.186 16.041 6.277 1.00 0.00 C ATOM 1948 CG LYS B 62 4.967 17.095 7.045 1.00 0.00 C ATOM 1949 CD LYS B 62 6.052 16.461 7.909 1.00 0.00 C ATOM 1950 CE LYS B 62 5.489 15.397 8.841 1.00 0.00 C ATOM 1951 NZ LYS B 62 6.542 14.786 9.688 1.00 0.00 N ATOM 0 H LYS B 62 2.098 17.467 6.147 1.00 0.00 H new ATOM 0 HA LYS B 62 4.344 17.006 4.372 1.00 0.00 H new ATOM 0 HB2 LYS B 62 3.395 15.654 6.919 1.00 0.00 H new ATOM 0 HB3 LYS B 62 4.851 15.207 6.052 1.00 0.00 H new ATOM 0 HG2 LYS B 62 5.420 17.797 6.345 1.00 0.00 H new ATOM 0 HG3 LYS B 62 4.286 17.668 7.675 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.812 16.016 7.267 1.00 0.00 H new ATOM 0 HD3 LYS B 62 6.545 17.235 8.498 1.00 0.00 H new ATOM 0 HE2 LYS B 62 4.724 15.841 9.478 1.00 0.00 H new ATOM 0 HE3 LYS B 62 5.002 14.620 8.252 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 6.136 13.999 10.233 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.310 14.429 9.084 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 6.920 15.501 10.342 1.00 0.00 H new ATOM 1965 N ILE B 63 3.447 15.062 3.046 1.00 0.00 N ATOM 1966 CA ILE B 63 2.917 13.952 2.288 1.00 0.00 C ATOM 1967 C ILE B 63 3.678 12.692 2.666 1.00 0.00 C ATOM 1968 O ILE B 63 4.692 12.361 2.063 1.00 0.00 O ATOM 1969 CB ILE B 63 3.007 14.208 0.778 1.00 0.00 C ATOM 1970 CG1 ILE B 63 2.107 15.380 0.393 1.00 0.00 C ATOM 1971 CG2 ILE B 63 2.590 12.962 0.015 1.00 0.00 C ATOM 1972 CD1 ILE B 63 2.722 16.750 0.566 1.00 0.00 C ATOM 0 H ILE B 63 4.208 15.567 2.593 1.00 0.00 H new ATOM 0 HA ILE B 63 1.861 13.831 2.528 1.00 0.00 H new ATOM 0 HB ILE B 63 4.038 14.453 0.521 1.00 0.00 H new ATOM 0 HG12 ILE B 63 1.810 15.262 -0.649 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.197 15.330 0.991 1.00 0.00 H new ATOM 0 HG21 ILE B 63 2.657 13.152 -1.056 1.00 0.00 H new ATOM 0 HG22 ILE B 63 3.250 12.136 0.279 1.00 0.00 H new ATOM 0 HG23 ILE B 63 1.563 12.703 0.274 1.00 0.00 H new ATOM 0 HD11 ILE B 63 2.003 17.512 0.266 1.00 0.00 H new ATOM 0 HD12 ILE B 63 2.992 16.898 1.612 1.00 0.00 H new ATOM 0 HD13 ILE B 63 3.615 16.829 -0.054 1.00 0.00 H new ATOM 1984 N GLN B 64 3.208 11.997 3.683 1.00 0.00 N ATOM 1985 CA GLN B 64 3.895 10.806 4.138 1.00 0.00 C ATOM 1986 C GLN B 64 3.023 9.559 4.090 1.00 0.00 C ATOM 1987 O GLN B 64 1.802 9.605 4.255 1.00 0.00 O ATOM 1988 CB GLN B 64 4.459 11.015 5.545 1.00 0.00 C ATOM 1989 CG GLN B 64 3.618 11.924 6.425 1.00 0.00 C ATOM 1990 CD GLN B 64 4.350 12.332 7.684 1.00 0.00 C ATOM 1991 OE1 GLN B 64 5.571 12.493 7.682 1.00 0.00 O ATOM 1992 NE2 GLN B 64 3.612 12.498 8.772 1.00 0.00 N ATOM 0 H GLN B 64 2.364 12.233 4.204 1.00 0.00 H new ATOM 0 HA GLN B 64 4.717 10.637 3.443 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.557 10.045 6.033 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.462 11.434 5.464 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.339 12.815 5.863 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.693 11.414 6.693 1.00 0.00 H new ATOM 0 HE21 GLN B 64 2.603 12.355 8.731 1.00 0.00 H new ATOM 0 HE22 GLN B 64 4.053 12.769 9.651 1.00 0.00 H new ATOM 2001 N LEU B 65 3.691 8.450 3.852 1.00 0.00 N ATOM 2002 CA LEU B 65 3.075 7.141 3.765 1.00 0.00 C ATOM 2003 C LEU B 65 3.686 6.257 4.842 1.00 0.00 C ATOM 2004 O LEU B 65 4.766 6.554 5.335 1.00 0.00 O ATOM 2005 CB LEU B 65 3.341 6.532 2.388 1.00 0.00 C ATOM 2006 CG LEU B 65 2.502 5.306 2.032 1.00 0.00 C ATOM 2007 CD1 LEU B 65 1.217 5.712 1.316 1.00 0.00 C ATOM 2008 CD2 LEU B 65 3.321 4.346 1.193 1.00 0.00 C ATOM 0 H LEU B 65 4.701 8.432 3.710 1.00 0.00 H new ATOM 0 HA LEU B 65 1.998 7.223 3.908 1.00 0.00 H new ATOM 0 HB2 LEU B 65 3.169 7.299 1.633 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.394 6.258 2.330 1.00 0.00 H new ATOM 0 HG LEU B 65 2.213 4.799 2.953 1.00 0.00 H new ATOM 0 HD11 LEU B 65 0.638 4.821 1.074 1.00 0.00 H new ATOM 0 HD12 LEU B 65 0.629 6.361 1.964 1.00 0.00 H new ATOM 0 HD13 LEU B 65 1.465 6.244 0.398 1.00 0.00 H new ATOM 0 HD21 LEU B 65 2.716 3.474 0.943 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.638 4.843 0.276 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.199 4.029 1.756 1.00 0.00 H new ATOM 2020 N GLN B 66 3.007 5.194 5.212 1.00 0.00 N ATOM 2021 CA GLN B 66 3.506 4.288 6.229 1.00 0.00 C ATOM 2022 C GLN B 66 3.196 2.849 5.851 1.00 0.00 C ATOM 2023 O GLN B 66 2.068 2.521 5.501 1.00 0.00 O ATOM 2024 CB GLN B 66 2.879 4.628 7.572 1.00 0.00 C ATOM 2025 CG GLN B 66 3.644 4.104 8.775 1.00 0.00 C ATOM 2026 CD GLN B 66 3.050 4.591 10.084 1.00 0.00 C ATOM 2027 OE1 GLN B 66 1.842 4.776 10.195 1.00 0.00 O ATOM 2028 NE2 GLN B 66 3.889 4.816 11.077 1.00 0.00 N ATOM 0 H GLN B 66 2.101 4.932 4.822 1.00 0.00 H new ATOM 0 HA GLN B 66 4.588 4.399 6.304 1.00 0.00 H new ATOM 0 HB2 GLN B 66 2.794 5.712 7.655 1.00 0.00 H new ATOM 0 HB3 GLN B 66 1.866 4.226 7.598 1.00 0.00 H new ATOM 0 HG2 GLN B 66 3.642 3.014 8.759 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.685 4.421 8.709 1.00 0.00 H new ATOM 0 HE21 GLN B 66 4.887 4.651 10.948 1.00 0.00 H new ATOM 0 HE22 GLN B 66 3.539 5.155 11.973 1.00 0.00 H new ATOM 2037 N LEU B 67 4.208 2.005 5.887 1.00 0.00 N ATOM 2038 CA LEU B 67 4.043 0.599 5.566 1.00 0.00 C ATOM 2039 C LEU B 67 3.966 -0.221 6.838 1.00 0.00 C ATOM 2040 O LEU B 67 4.970 -0.405 7.517 1.00 0.00 O ATOM 2041 CB LEU B 67 5.213 0.091 4.727 1.00 0.00 C ATOM 2042 CG LEU B 67 5.274 0.608 3.297 1.00 0.00 C ATOM 2043 CD1 LEU B 67 6.456 -0.013 2.575 1.00 0.00 C ATOM 2044 CD2 LEU B 67 3.977 0.304 2.561 1.00 0.00 C ATOM 0 H LEU B 67 5.161 2.270 6.137 1.00 0.00 H new ATOM 0 HA LEU B 67 3.119 0.493 4.997 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.141 0.360 5.231 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.170 -0.998 4.699 1.00 0.00 H new ATOM 0 HG LEU B 67 5.404 1.690 3.319 1.00 0.00 H new ATOM 0 HD11 LEU B 67 6.495 0.361 1.552 1.00 0.00 H new ATOM 0 HD12 LEU B 67 7.378 0.251 3.093 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.345 -1.097 2.561 1.00 0.00 H new ATOM 0 HD21 LEU B 67 4.041 0.682 1.540 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.815 -0.774 2.540 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.145 0.786 3.075 1.00 0.00 H new ATOM 2056 N VAL B 68 2.783 -0.703 7.165 1.00 0.00 N ATOM 2057 CA VAL B 68 2.611 -1.513 8.354 1.00 0.00 C ATOM 2058 C VAL B 68 2.718 -2.976 7.987 1.00 0.00 C ATOM 2059 O VAL B 68 1.787 -3.559 7.436 1.00 0.00 O ATOM 2060 CB VAL B 68 1.265 -1.256 9.047 1.00 0.00 C ATOM 2061 CG1 VAL B 68 1.230 -1.971 10.383 1.00 0.00 C ATOM 2062 CG2 VAL B 68 1.038 0.232 9.228 1.00 0.00 C ATOM 0 H VAL B 68 1.931 -0.549 6.627 1.00 0.00 H new ATOM 0 HA VAL B 68 3.398 -1.237 9.055 1.00 0.00 H new ATOM 0 HB VAL B 68 0.463 -1.646 8.421 1.00 0.00 H new ATOM 0 HG11 VAL B 68 0.273 -1.785 10.870 1.00 0.00 H new ATOM 0 HG12 VAL B 68 1.355 -3.042 10.226 1.00 0.00 H new ATOM 0 HG13 VAL B 68 2.037 -1.600 11.015 1.00 0.00 H new ATOM 0 HG21 VAL B 68 0.080 0.397 9.721 1.00 0.00 H new ATOM 0 HG22 VAL B 68 1.837 0.650 9.840 1.00 0.00 H new ATOM 0 HG23 VAL B 68 1.034 0.721 8.254 1.00 0.00 H new ATOM 2072 N LEU B 69 3.855 -3.565 8.289 1.00 0.00 N ATOM 2073 CA LEU B 69 4.098 -4.951 7.951 1.00 0.00 C ATOM 2074 C LEU B 69 3.615 -5.883 9.054 1.00 0.00 C ATOM 2075 O LEU B 69 3.383 -5.454 10.187 1.00 0.00 O ATOM 2076 CB LEU B 69 5.582 -5.167 7.710 1.00 0.00 C ATOM 2077 CG LEU B 69 6.337 -3.946 7.187 1.00 0.00 C ATOM 2078 CD1 LEU B 69 7.822 -4.195 7.226 1.00 0.00 C ATOM 2079 CD2 LEU B 69 5.906 -3.581 5.784 1.00 0.00 C ATOM 0 H LEU B 69 4.628 -3.104 8.769 1.00 0.00 H new ATOM 0 HA LEU B 69 3.540 -5.182 7.044 1.00 0.00 H new ATOM 0 HB2 LEU B 69 6.043 -5.488 8.644 1.00 0.00 H new ATOM 0 HB3 LEU B 69 5.704 -5.983 6.998 1.00 0.00 H new ATOM 0 HG LEU B 69 6.097 -3.105 7.838 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.348 -3.317 6.851 1.00 0.00 H new ATOM 0 HD12 LEU B 69 8.131 -4.392 8.253 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.063 -5.056 6.603 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.465 -2.708 5.447 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.102 -4.418 5.114 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.840 -3.353 5.778 1.00 0.00 H new ATOM 2091 N HIS B 70 3.474 -7.156 8.717 1.00 0.00 N ATOM 2092 CA HIS B 70 3.029 -8.166 9.673 1.00 0.00 C ATOM 2093 C HIS B 70 4.156 -8.510 10.630 1.00 0.00 C ATOM 2094 O HIS B 70 3.917 -8.944 11.756 1.00 0.00 O ATOM 2095 CB HIS B 70 2.575 -9.443 8.958 1.00 0.00 C ATOM 2096 CG HIS B 70 1.188 -9.374 8.406 1.00 0.00 C ATOM 2097 ND1 HIS B 70 0.070 -9.104 9.166 1.00 0.00 N ATOM 2098 CD2 HIS B 70 0.749 -9.533 7.133 1.00 0.00 C ATOM 2099 CE1 HIS B 70 -0.992 -9.099 8.351 1.00 0.00 C ATOM 2100 NE2 HIS B 70 -0.635 -9.359 7.106 1.00 0.00 N ATOM 0 H HIS B 70 3.662 -7.519 7.782 1.00 0.00 H new ATOM 0 HA HIS B 70 2.185 -7.752 10.225 1.00 0.00 H new ATOM 0 HB2 HIS B 70 3.268 -9.657 8.144 1.00 0.00 H new ATOM 0 HB3 HIS B 70 2.636 -10.278 9.656 1.00 0.00 H new ATOM 0 HD2 HIS B 70 1.370 -9.758 6.278 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -2.006 -8.908 8.669 1.00 0.00 H new ATOM 0 HE2 HIS B 70 -1.246 -9.420 6.292 1.00 0.00 H new ATOM 2108 N ALA B 71 5.385 -8.321 10.160 1.00 0.00 N ATOM 2109 CA ALA B 71 6.572 -8.607 10.955 1.00 0.00 C ATOM 2110 C ALA B 71 6.610 -7.784 12.238 1.00 0.00 C ATOM 2111 O ALA B 71 7.190 -8.211 13.237 1.00 0.00 O ATOM 2112 CB ALA B 71 7.826 -8.356 10.131 1.00 0.00 C ATOM 0 H ALA B 71 5.585 -7.968 9.224 1.00 0.00 H new ATOM 0 HA ALA B 71 6.532 -9.658 11.242 1.00 0.00 H new ATOM 0 HB1 ALA B 71 8.707 -8.573 10.735 1.00 0.00 H new ATOM 0 HB2 ALA B 71 7.820 -9.002 9.253 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.851 -7.313 9.814 1.00 0.00 H new ATOM 2118 N GLY B 72 5.998 -6.608 12.212 1.00 0.00 N ATOM 2119 CA GLY B 72 5.999 -5.761 13.381 1.00 0.00 C ATOM 2120 C GLY B 72 6.883 -4.576 13.141 1.00 0.00 C ATOM 2121 O GLY B 72 7.512 -4.043 14.053 1.00 0.00 O ATOM 0 H GLY B 72 5.504 -6.229 11.404 1.00 0.00 H new ATOM 0 HA2 GLY B 72 4.984 -5.431 13.605 1.00 0.00 H new ATOM 0 HA3 GLY B 72 6.351 -6.320 14.248 1.00 0.00 H new ATOM 2125 N ASP B 73 6.907 -4.167 11.888 1.00 0.00 N ATOM 2126 CA ASP B 73 7.707 -3.060 11.446 1.00 0.00 C ATOM 2127 C ASP B 73 6.829 -2.162 10.631 1.00 0.00 C ATOM 2128 O ASP B 73 5.996 -2.633 9.857 1.00 0.00 O ATOM 2129 CB ASP B 73 8.879 -3.532 10.580 1.00 0.00 C ATOM 2130 CG ASP B 73 9.794 -2.388 10.173 1.00 0.00 C ATOM 2131 OD1 ASP B 73 9.464 -1.675 9.198 1.00 0.00 O ATOM 2132 OD2 ASP B 73 10.837 -2.203 10.829 1.00 0.00 O ATOM 0 H ASP B 73 6.362 -4.605 11.145 1.00 0.00 H new ATOM 0 HA ASP B 73 8.116 -2.542 12.313 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.455 -4.278 11.128 1.00 0.00 H new ATOM 0 HB3 ASP B 73 8.493 -4.021 9.686 1.00 0.00 H new ATOM 2137 N THR B 74 6.961 -0.889 10.839 1.00 0.00 N ATOM 2138 CA THR B 74 6.188 0.050 10.089 1.00 0.00 C ATOM 2139 C THR B 74 7.121 1.164 9.606 1.00 0.00 C ATOM 2140 O THR B 74 7.718 1.868 10.423 1.00 0.00 O ATOM 2141 CB THR B 74 5.050 0.630 10.943 1.00 0.00 C ATOM 2142 OG1 THR B 74 5.574 1.218 12.141 1.00 0.00 O ATOM 2143 CG2 THR B 74 4.036 -0.445 11.303 1.00 0.00 C ATOM 0 H THR B 74 7.597 -0.477 11.522 1.00 0.00 H new ATOM 0 HA THR B 74 5.731 -0.450 9.235 1.00 0.00 H new ATOM 0 HB THR B 74 4.549 1.398 10.354 1.00 0.00 H new ATOM 0 HG1 THR B 74 6.449 1.618 11.954 1.00 0.00 H new ATOM 0 HG21 THR B 74 3.241 -0.008 11.908 1.00 0.00 H new ATOM 0 HG22 THR B 74 3.610 -0.863 10.391 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.529 -1.235 11.869 1.00 0.00 H new ATOM 2151 N THR B 75 7.245 1.333 8.299 1.00 0.00 N ATOM 2152 CA THR B 75 8.146 2.343 7.751 1.00 0.00 C ATOM 2153 C THR B 75 7.392 3.501 7.097 1.00 0.00 C ATOM 2154 O THR B 75 6.505 3.291 6.273 1.00 0.00 O ATOM 2155 CB THR B 75 9.125 1.702 6.739 1.00 0.00 C ATOM 2156 OG1 THR B 75 10.125 0.950 7.442 1.00 0.00 O ATOM 2157 CG2 THR B 75 9.802 2.750 5.866 1.00 0.00 C ATOM 0 H THR B 75 6.739 0.790 7.600 1.00 0.00 H new ATOM 0 HA THR B 75 8.711 2.755 8.587 1.00 0.00 H new ATOM 0 HB THR B 75 8.547 1.044 6.090 1.00 0.00 H new ATOM 0 HG1 THR B 75 9.702 0.199 7.908 1.00 0.00 H new ATOM 0 HG21 THR B 75 10.481 2.259 5.169 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.046 3.302 5.308 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.364 3.440 6.495 1.00 0.00 H new ATOM 2165 N ASN B 76 7.754 4.728 7.474 1.00 0.00 N ATOM 2166 CA ASN B 76 7.112 5.918 6.924 1.00 0.00 C ATOM 2167 C ASN B 76 7.971 6.529 5.814 1.00 0.00 C ATOM 2168 O ASN B 76 9.190 6.661 5.952 1.00 0.00 O ATOM 2169 CB ASN B 76 6.842 6.989 8.005 1.00 0.00 C ATOM 2170 CG ASN B 76 6.187 6.461 9.273 1.00 0.00 C ATOM 2171 OD1 ASN B 76 6.446 5.345 9.722 1.00 0.00 O ATOM 2172 ND2 ASN B 76 5.329 7.276 9.869 1.00 0.00 N ATOM 0 H ASN B 76 8.487 4.921 8.157 1.00 0.00 H new ATOM 0 HA ASN B 76 6.153 5.597 6.517 1.00 0.00 H new ATOM 0 HB2 ASN B 76 7.787 7.464 8.271 1.00 0.00 H new ATOM 0 HB3 ASN B 76 6.205 7.764 7.579 1.00 0.00 H new ATOM 0 HD21 ASN B 76 4.860 6.985 10.727 1.00 0.00 H new ATOM 0 HD22 ASN B 76 5.137 8.195 9.470 1.00 0.00 H new ATOM 2179 N PHE B 77 7.321 6.883 4.715 1.00 0.00 N ATOM 2180 CA PHE B 77 7.979 7.500 3.565 1.00 0.00 C ATOM 2181 C PHE B 77 7.435 8.912 3.372 1.00 0.00 C ATOM 2182 O PHE B 77 6.226 9.104 3.353 1.00 0.00 O ATOM 2183 CB PHE B 77 7.729 6.680 2.296 1.00 0.00 C ATOM 2184 CG PHE B 77 8.416 5.345 2.284 1.00 0.00 C ATOM 2185 CD1 PHE B 77 9.794 5.263 2.385 1.00 0.00 C ATOM 2186 CD2 PHE B 77 7.685 4.175 2.161 1.00 0.00 C ATOM 2187 CE1 PHE B 77 10.431 4.039 2.364 1.00 0.00 C ATOM 2188 CE2 PHE B 77 8.319 2.947 2.137 1.00 0.00 C ATOM 2189 CZ PHE B 77 9.693 2.880 2.239 1.00 0.00 C ATOM 0 H PHE B 77 6.317 6.751 4.592 1.00 0.00 H new ATOM 0 HA PHE B 77 9.052 7.535 3.751 1.00 0.00 H new ATOM 0 HB2 PHE B 77 6.656 6.526 2.182 1.00 0.00 H new ATOM 0 HB3 PHE B 77 8.062 7.256 1.433 1.00 0.00 H new ATOM 0 HD1 PHE B 77 10.377 6.167 2.481 1.00 0.00 H new ATOM 0 HD2 PHE B 77 6.609 4.223 2.083 1.00 0.00 H new ATOM 0 HE1 PHE B 77 11.507 3.988 2.445 1.00 0.00 H new ATOM 0 HE2 PHE B 77 7.739 2.041 2.039 1.00 0.00 H new ATOM 0 HZ PHE B 77 10.190 1.922 2.221 1.00 0.00 H new ATOM 2199 N HIS B 78 8.313 9.892 3.216 1.00 0.00 N ATOM 2200 CA HIS B 78 7.879 11.278 3.052 1.00 0.00 C ATOM 2201 C HIS B 78 8.086 11.763 1.617 1.00 0.00 C ATOM 2202 O HIS B 78 9.213 11.971 1.177 1.00 0.00 O ATOM 2203 CB HIS B 78 8.634 12.182 4.031 1.00 0.00 C ATOM 2204 CG HIS B 78 8.155 13.603 4.043 1.00 0.00 C ATOM 2205 ND1 HIS B 78 8.994 14.694 4.086 1.00 0.00 N ATOM 2206 CD2 HIS B 78 6.894 14.102 4.025 1.00 0.00 C ATOM 2207 CE1 HIS B 78 8.235 15.797 4.096 1.00 0.00 C ATOM 2208 NE2 HIS B 78 6.953 15.493 4.060 1.00 0.00 N ATOM 0 H HIS B 78 9.324 9.758 3.199 1.00 0.00 H new ATOM 0 HA HIS B 78 6.812 11.325 3.268 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.541 11.770 5.036 1.00 0.00 H new ATOM 0 HB3 HIS B 78 9.694 12.169 3.778 1.00 0.00 H new ATOM 0 HD1 HIS B 78 10.013 14.667 4.107 1.00 0.00 H new ATOM 0 HD2 HIS B 78 5.989 13.514 3.989 1.00 0.00 H new ATOM 0 HE1 HIS B 78 8.623 16.804 4.129 1.00 0.00 H new ATOM 2216 N PHE B 79 6.992 11.949 0.902 1.00 0.00 N ATOM 2217 CA PHE B 79 7.035 12.422 -0.475 1.00 0.00 C ATOM 2218 C PHE B 79 6.996 13.945 -0.472 1.00 0.00 C ATOM 2219 O PHE B 79 6.026 14.552 -0.024 1.00 0.00 O ATOM 2220 CB PHE B 79 5.858 11.857 -1.266 1.00 0.00 C ATOM 2221 CG PHE B 79 5.764 10.356 -1.225 1.00 0.00 C ATOM 2222 CD1 PHE B 79 5.175 9.715 -0.148 1.00 0.00 C ATOM 2223 CD2 PHE B 79 6.251 9.590 -2.269 1.00 0.00 C ATOM 2224 CE1 PHE B 79 5.074 8.340 -0.113 1.00 0.00 C ATOM 2225 CE2 PHE B 79 6.147 8.214 -2.243 1.00 0.00 C ATOM 2226 CZ PHE B 79 5.558 7.588 -1.164 1.00 0.00 C ATOM 0 H PHE B 79 6.050 11.778 1.255 1.00 0.00 H new ATOM 0 HA PHE B 79 7.954 12.083 -0.953 1.00 0.00 H new ATOM 0 HB2 PHE B 79 4.933 12.281 -0.875 1.00 0.00 H new ATOM 0 HB3 PHE B 79 5.942 12.178 -2.304 1.00 0.00 H new ATOM 0 HD1 PHE B 79 4.790 10.299 0.675 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.718 10.074 -3.114 1.00 0.00 H new ATOM 0 HE1 PHE B 79 4.617 7.853 0.735 1.00 0.00 H new ATOM 0 HE2 PHE B 79 6.526 7.628 -3.067 1.00 0.00 H new ATOM 0 HZ PHE B 79 5.476 6.511 -1.142 1.00 0.00 H new ATOM 2236 N SER B 80 8.060 14.558 -0.951 1.00 0.00 N ATOM 2237 CA SER B 80 8.170 16.005 -0.946 1.00 0.00 C ATOM 2238 C SER B 80 8.433 16.588 -2.331 1.00 0.00 C ATOM 2239 O SER B 80 8.974 17.691 -2.434 1.00 0.00 O ATOM 2240 CB SER B 80 9.291 16.420 0.007 1.00 0.00 C ATOM 2241 OG SER B 80 9.371 15.532 1.111 1.00 0.00 O ATOM 0 H SER B 80 8.865 14.075 -1.351 1.00 0.00 H new ATOM 0 HA SER B 80 7.211 16.402 -0.613 1.00 0.00 H new ATOM 0 HB2 SER B 80 10.242 16.431 -0.526 1.00 0.00 H new ATOM 0 HB3 SER B 80 9.114 17.435 0.363 1.00 0.00 H new ATOM 0 HG SER B 80 9.982 15.900 1.783 1.00 0.00 H new ATOM 2247 N ASN B 81 8.058 15.891 -3.397 1.00 0.00 N ATOM 2248 CA ASN B 81 8.290 16.422 -4.724 1.00 0.00 C ATOM 2249 C ASN B 81 7.096 17.305 -5.087 1.00 0.00 C ATOM 2250 O ASN B 81 6.244 16.931 -5.884 1.00 0.00 O ATOM 2251 CB ASN B 81 8.511 15.283 -5.719 1.00 0.00 C ATOM 2252 CG ASN B 81 8.860 15.771 -7.103 1.00 0.00 C ATOM 2253 OD1 ASN B 81 10.021 16.055 -7.409 1.00 0.00 O ATOM 2254 ND2 ASN B 81 7.860 15.847 -7.951 1.00 0.00 N ATOM 0 H ASN B 81 7.603 14.979 -3.367 1.00 0.00 H new ATOM 0 HA ASN B 81 9.195 17.029 -4.756 1.00 0.00 H new ATOM 0 HB2 ASN B 81 9.311 14.639 -5.354 1.00 0.00 H new ATOM 0 HB3 ASN B 81 7.609 14.673 -5.771 1.00 0.00 H new ATOM 0 HD21 ASN B 81 8.027 16.152 -8.910 1.00 0.00 H new ATOM 0 HD22 ASN B 81 6.917 15.601 -7.651 1.00 0.00 H new ATOM 2261 N GLU B 82 7.051 18.453 -4.396 1.00 0.00 N ATOM 2262 CA GLU B 82 6.012 19.500 -4.493 1.00 0.00 C ATOM 2263 C GLU B 82 4.894 19.251 -5.517 1.00 0.00 C ATOM 2264 O GLU B 82 3.749 18.990 -5.134 1.00 0.00 O ATOM 2265 CB GLU B 82 6.664 20.868 -4.744 1.00 0.00 C ATOM 2266 CG GLU B 82 8.030 20.803 -5.414 1.00 0.00 C ATOM 2267 CD GLU B 82 7.944 20.872 -6.926 1.00 0.00 C ATOM 2268 OE1 GLU B 82 7.737 19.814 -7.556 1.00 0.00 O ATOM 2269 OE2 GLU B 82 8.063 21.980 -7.478 1.00 0.00 O ATOM 0 H GLU B 82 7.774 18.693 -3.718 1.00 0.00 H new ATOM 0 HA GLU B 82 5.507 19.474 -3.527 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.997 21.466 -5.365 1.00 0.00 H new ATOM 0 HB3 GLU B 82 6.765 21.389 -3.792 1.00 0.00 H new ATOM 0 HG2 GLU B 82 8.647 21.625 -5.051 1.00 0.00 H new ATOM 0 HG3 GLU B 82 8.529 19.878 -5.124 1.00 0.00 H new ATOM 2276 N SER B 83 5.231 19.329 -6.797 1.00 0.00 N ATOM 2277 CA SER B 83 4.269 19.162 -7.883 1.00 0.00 C ATOM 2278 C SER B 83 3.406 17.902 -7.746 1.00 0.00 C ATOM 2279 O SER B 83 2.210 17.921 -8.068 1.00 0.00 O ATOM 2280 CB SER B 83 5.010 19.144 -9.223 1.00 0.00 C ATOM 2281 OG SER B 83 6.201 18.382 -9.137 1.00 0.00 O ATOM 0 H SER B 83 6.183 19.511 -7.115 1.00 0.00 H new ATOM 0 HA SER B 83 3.586 20.010 -7.833 1.00 0.00 H new ATOM 0 HB2 SER B 83 4.363 18.727 -9.994 1.00 0.00 H new ATOM 0 HB3 SER B 83 5.248 20.164 -9.524 1.00 0.00 H new ATOM 0 HG SER B 83 6.931 18.951 -8.814 1.00 0.00 H new ATOM 2287 N THR B 84 3.982 16.818 -7.256 1.00 0.00 N ATOM 2288 CA THR B 84 3.244 15.578 -7.128 1.00 0.00 C ATOM 2289 C THR B 84 3.306 14.987 -5.735 1.00 0.00 C ATOM 2290 O THR B 84 2.824 13.882 -5.549 1.00 0.00 O ATOM 2291 CB THR B 84 3.786 14.523 -8.096 1.00 0.00 C ATOM 2292 OG1 THR B 84 5.215 14.476 -8.022 1.00 0.00 O ATOM 2293 CG2 THR B 84 3.384 14.836 -9.514 1.00 0.00 C ATOM 0 H THR B 84 4.952 16.773 -6.943 1.00 0.00 H new ATOM 0 HA THR B 84 2.209 15.834 -7.356 1.00 0.00 H new ATOM 0 HB THR B 84 3.365 13.559 -7.809 1.00 0.00 H new ATOM 0 HG1 THR B 84 5.485 14.018 -7.199 1.00 0.00 H new ATOM 0 HG21 THR B 84 3.781 14.072 -10.182 1.00 0.00 H new ATOM 0 HG22 THR B 84 2.297 14.853 -9.589 1.00 0.00 H new ATOM 0 HG23 THR B 84 3.783 15.810 -9.799 1.00 0.00 H new ATOM 2301 N ALA B 85 3.854 15.731 -4.774 1.00 0.00 N ATOM 2302 CA ALA B 85 4.025 15.248 -3.396 1.00 0.00 C ATOM 2303 C ALA B 85 2.881 14.332 -2.956 1.00 0.00 C ATOM 2304 O ALA B 85 3.051 13.119 -2.850 1.00 0.00 O ATOM 2305 CB ALA B 85 4.169 16.430 -2.454 1.00 0.00 C ATOM 0 H ALA B 85 4.192 16.682 -4.924 1.00 0.00 H new ATOM 0 HA ALA B 85 4.934 14.647 -3.361 1.00 0.00 H new ATOM 0 HB1 ALA B 85 4.296 16.069 -1.433 1.00 0.00 H new ATOM 0 HB2 ALA B 85 5.040 17.020 -2.741 1.00 0.00 H new ATOM 0 HB3 ALA B 85 3.275 17.051 -2.511 1.00 0.00 H new ATOM 2311 N VAL B 86 1.717 14.919 -2.724 1.00 0.00 N ATOM 2312 CA VAL B 86 0.517 14.176 -2.334 1.00 0.00 C ATOM 2313 C VAL B 86 0.193 13.030 -3.294 1.00 0.00 C ATOM 2314 O VAL B 86 -0.060 11.908 -2.855 1.00 0.00 O ATOM 2315 CB VAL B 86 -0.672 15.152 -2.226 1.00 0.00 C ATOM 2316 CG1 VAL B 86 -1.984 14.492 -2.622 1.00 0.00 C ATOM 2317 CG2 VAL B 86 -0.795 15.700 -0.816 1.00 0.00 C ATOM 0 H VAL B 86 1.572 15.926 -2.800 1.00 0.00 H new ATOM 0 HA VAL B 86 0.709 13.716 -1.365 1.00 0.00 H new ATOM 0 HB VAL B 86 -0.472 15.969 -2.919 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -2.796 15.214 -2.532 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -1.920 14.145 -3.653 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -2.178 13.644 -1.965 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -1.641 16.386 -0.765 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.952 14.877 -0.118 1.00 0.00 H new ATOM 0 HG23 VAL B 86 0.119 16.231 -0.551 1.00 0.00 H new ATOM 2327 N LYS B 87 0.244 13.307 -4.590 1.00 0.00 N ATOM 2328 CA LYS B 87 -0.066 12.304 -5.605 1.00 0.00 C ATOM 2329 C LYS B 87 0.888 11.119 -5.503 1.00 0.00 C ATOM 2330 O LYS B 87 0.494 9.988 -5.740 1.00 0.00 O ATOM 2331 CB LYS B 87 0.018 12.923 -7.005 1.00 0.00 C ATOM 2332 CG LYS B 87 -0.655 14.283 -7.117 1.00 0.00 C ATOM 2333 CD LYS B 87 -0.458 14.891 -8.498 1.00 0.00 C ATOM 2334 CE LYS B 87 -1.111 16.262 -8.608 1.00 0.00 C ATOM 2335 NZ LYS B 87 -0.390 17.296 -7.814 1.00 0.00 N ATOM 0 H LYS B 87 0.498 14.221 -4.966 1.00 0.00 H new ATOM 0 HA LYS B 87 -1.082 11.947 -5.433 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.067 13.023 -7.286 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -0.440 12.241 -7.722 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -1.721 14.181 -6.912 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -0.248 14.955 -6.361 1.00 0.00 H new ATOM 0 HD2 LYS B 87 0.608 14.978 -8.709 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -0.879 14.226 -9.252 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -1.140 16.565 -9.655 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -2.144 16.199 -8.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -0.830 18.225 -7.973 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -0.442 17.057 -6.803 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 0.606 17.329 -8.111 1.00 0.00 H new ATOM 2349 N GLU B 88 2.136 11.391 -5.149 1.00 0.00 N ATOM 2350 CA GLU B 88 3.145 10.354 -4.995 1.00 0.00 C ATOM 2351 C GLU B 88 2.716 9.360 -3.926 1.00 0.00 C ATOM 2352 O GLU B 88 2.593 8.161 -4.186 1.00 0.00 O ATOM 2353 CB GLU B 88 4.476 10.979 -4.600 1.00 0.00 C ATOM 2354 CG GLU B 88 5.188 11.698 -5.722 1.00 0.00 C ATOM 2355 CD GLU B 88 6.104 12.779 -5.198 1.00 0.00 C ATOM 2356 OE1 GLU B 88 6.912 12.499 -4.290 1.00 0.00 O ATOM 2357 OE2 GLU B 88 6.002 13.915 -5.685 1.00 0.00 O ATOM 0 H GLU B 88 2.476 12.334 -4.961 1.00 0.00 H new ATOM 0 HA GLU B 88 3.257 9.832 -5.945 1.00 0.00 H new ATOM 0 HB2 GLU B 88 4.305 11.683 -3.785 1.00 0.00 H new ATOM 0 HB3 GLU B 88 5.130 10.197 -4.214 1.00 0.00 H new ATOM 0 HG2 GLU B 88 5.767 10.981 -6.305 1.00 0.00 H new ATOM 0 HG3 GLU B 88 4.454 12.138 -6.396 1.00 0.00 H new ATOM 2364 N ARG B 89 2.482 9.875 -2.722 1.00 0.00 N ATOM 2365 CA ARG B 89 2.048 9.053 -1.599 1.00 0.00 C ATOM 2366 C ARG B 89 0.750 8.355 -1.941 1.00 0.00 C ATOM 2367 O ARG B 89 0.598 7.163 -1.709 1.00 0.00 O ATOM 2368 CB ARG B 89 1.861 9.919 -0.349 1.00 0.00 C ATOM 2369 CG ARG B 89 0.857 9.381 0.661 1.00 0.00 C ATOM 2370 CD ARG B 89 0.389 10.483 1.603 1.00 0.00 C ATOM 2371 NE ARG B 89 -1.062 10.482 1.786 1.00 0.00 N ATOM 2372 CZ ARG B 89 -1.930 10.959 0.890 1.00 0.00 C ATOM 2373 NH1 ARG B 89 -1.492 11.522 -0.227 1.00 0.00 N ATOM 2374 NH2 ARG B 89 -3.236 10.905 1.127 1.00 0.00 N ATOM 0 H ARG B 89 2.587 10.865 -2.500 1.00 0.00 H new ATOM 0 HA ARG B 89 2.813 8.304 -1.396 1.00 0.00 H new ATOM 0 HB2 ARG B 89 2.826 10.031 0.145 1.00 0.00 H new ATOM 0 HB3 ARG B 89 1.544 10.915 -0.659 1.00 0.00 H new ATOM 0 HG2 ARG B 89 0.000 8.957 0.137 1.00 0.00 H new ATOM 0 HG3 ARG B 89 1.311 8.574 1.236 1.00 0.00 H new ATOM 0 HD2 ARG B 89 0.875 10.360 2.571 1.00 0.00 H new ATOM 0 HD3 ARG B 89 0.702 11.450 1.210 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.434 10.093 2.652 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -0.490 11.592 -0.404 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -2.157 11.885 -0.910 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -3.580 10.498 1.997 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -3.895 11.271 0.439 1.00 0.00 H new ATOM 2388 N ASP B 90 -0.172 9.114 -2.510 1.00 0.00 N ATOM 2389 CA ASP B 90 -1.470 8.588 -2.889 1.00 0.00 C ATOM 2390 C ASP B 90 -1.364 7.485 -3.923 1.00 0.00 C ATOM 2391 O ASP B 90 -2.048 6.477 -3.828 1.00 0.00 O ATOM 2392 CB ASP B 90 -2.373 9.707 -3.407 1.00 0.00 C ATOM 2393 CG ASP B 90 -3.212 10.296 -2.303 1.00 0.00 C ATOM 2394 OD1 ASP B 90 -3.821 9.505 -1.547 1.00 0.00 O ATOM 2395 OD2 ASP B 90 -3.236 11.537 -2.161 1.00 0.00 O ATOM 0 H ASP B 90 -0.042 10.104 -2.720 1.00 0.00 H new ATOM 0 HA ASP B 90 -1.911 8.155 -1.991 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -1.762 10.489 -3.858 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -3.023 9.318 -4.191 1.00 0.00 H new ATOM 2400 N ALA B 91 -0.472 7.670 -4.867 1.00 0.00 N ATOM 2401 CA ALA B 91 -0.272 6.707 -5.951 1.00 0.00 C ATOM 2402 C ALA B 91 0.326 5.433 -5.427 1.00 0.00 C ATOM 2403 O ALA B 91 -0.174 4.338 -5.682 1.00 0.00 O ATOM 2404 CB ALA B 91 0.653 7.285 -7.000 1.00 0.00 C ATOM 0 H ALA B 91 0.139 8.485 -4.915 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.245 6.493 -6.393 1.00 0.00 H new ATOM 0 HB1 ALA B 91 0.794 6.559 -7.801 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.216 8.196 -7.409 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.617 7.517 -6.547 1.00 0.00 H new ATOM 2410 N VAL B 92 1.422 5.596 -4.718 1.00 0.00 N ATOM 2411 CA VAL B 92 2.117 4.490 -4.116 1.00 0.00 C ATOM 2412 C VAL B 92 1.144 3.715 -3.247 1.00 0.00 C ATOM 2413 O VAL B 92 1.051 2.499 -3.329 1.00 0.00 O ATOM 2414 CB VAL B 92 3.282 5.032 -3.283 1.00 0.00 C ATOM 2415 CG1 VAL B 92 3.697 4.066 -2.199 1.00 0.00 C ATOM 2416 CG2 VAL B 92 4.458 5.362 -4.175 1.00 0.00 C ATOM 0 H VAL B 92 1.854 6.504 -4.545 1.00 0.00 H new ATOM 0 HA VAL B 92 2.514 3.821 -4.879 1.00 0.00 H new ATOM 0 HB VAL B 92 2.939 5.944 -2.794 1.00 0.00 H new ATOM 0 HG11 VAL B 92 4.526 4.490 -1.632 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.855 3.885 -1.531 1.00 0.00 H new ATOM 0 HG13 VAL B 92 4.010 3.125 -2.651 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.278 5.746 -3.568 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.783 4.462 -4.697 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.161 6.116 -4.904 1.00 0.00 H new ATOM 2426 N LYS B 93 0.390 4.466 -2.463 1.00 0.00 N ATOM 2427 CA LYS B 93 -0.623 3.933 -1.569 1.00 0.00 C ATOM 2428 C LYS B 93 -1.691 3.207 -2.352 1.00 0.00 C ATOM 2429 O LYS B 93 -2.119 2.121 -1.974 1.00 0.00 O ATOM 2430 CB LYS B 93 -1.263 5.102 -0.838 1.00 0.00 C ATOM 2431 CG LYS B 93 -2.433 4.735 0.036 1.00 0.00 C ATOM 2432 CD LYS B 93 -3.197 5.980 0.425 1.00 0.00 C ATOM 2433 CE LYS B 93 -4.392 6.217 -0.472 1.00 0.00 C ATOM 2434 NZ LYS B 93 -4.032 6.833 -1.781 1.00 0.00 N ATOM 0 H LYS B 93 0.466 5.483 -2.429 1.00 0.00 H new ATOM 0 HA LYS B 93 -0.163 3.233 -0.871 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -0.505 5.586 -0.222 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -1.593 5.836 -1.573 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.091 4.045 -0.493 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -2.082 4.219 0.930 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -3.532 5.891 1.459 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -2.532 6.842 0.378 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -4.897 5.268 -0.651 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -5.102 6.864 0.043 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -4.719 6.538 -2.504 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -4.046 7.869 -1.693 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -3.080 6.522 -2.061 1.00 0.00 H new ATOM 2448 N ASP B 94 -2.129 3.825 -3.433 1.00 0.00 N ATOM 2449 CA ASP B 94 -3.149 3.234 -4.267 1.00 0.00 C ATOM 2450 C ASP B 94 -2.687 1.884 -4.769 1.00 0.00 C ATOM 2451 O ASP B 94 -3.356 0.873 -4.565 1.00 0.00 O ATOM 2452 CB ASP B 94 -3.509 4.139 -5.436 1.00 0.00 C ATOM 2453 CG ASP B 94 -4.665 5.062 -5.096 1.00 0.00 C ATOM 2454 OD1 ASP B 94 -4.805 5.436 -3.904 1.00 0.00 O ATOM 2455 OD2 ASP B 94 -5.448 5.391 -6.005 1.00 0.00 O ATOM 0 H ASP B 94 -1.793 4.734 -3.751 1.00 0.00 H new ATOM 0 HA ASP B 94 -4.046 3.105 -3.662 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -2.640 4.733 -5.717 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -3.772 3.530 -6.301 1.00 0.00 H new ATOM 2460 N LEU B 95 -1.516 1.879 -5.394 1.00 0.00 N ATOM 2461 CA LEU B 95 -0.928 0.657 -5.915 1.00 0.00 C ATOM 2462 C LEU B 95 -0.721 -0.339 -4.786 1.00 0.00 C ATOM 2463 O LEU B 95 -1.085 -1.502 -4.899 1.00 0.00 O ATOM 2464 CB LEU B 95 0.397 0.963 -6.619 1.00 0.00 C ATOM 2465 CG LEU B 95 0.413 0.675 -8.125 1.00 0.00 C ATOM 2466 CD1 LEU B 95 -0.917 1.049 -8.764 1.00 0.00 C ATOM 2467 CD2 LEU B 95 1.548 1.435 -8.791 1.00 0.00 C ATOM 0 H LEU B 95 -0.954 2.715 -5.552 1.00 0.00 H new ATOM 0 HA LEU B 95 -1.607 0.218 -6.646 1.00 0.00 H new ATOM 0 HB2 LEU B 95 0.640 2.014 -6.463 1.00 0.00 H new ATOM 0 HB3 LEU B 95 1.186 0.380 -6.145 1.00 0.00 H new ATOM 0 HG LEU B 95 0.570 -0.394 -8.267 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -0.880 0.835 -9.832 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -1.717 0.468 -8.305 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -1.107 2.112 -8.613 1.00 0.00 H new ATOM 0 HD21 LEU B 95 1.550 1.223 -9.860 1.00 0.00 H new ATOM 0 HD22 LEU B 95 1.411 2.505 -8.633 1.00 0.00 H new ATOM 0 HD23 LEU B 95 2.498 1.123 -8.358 1.00 0.00 H new ATOM 2479 N LEU B 96 -0.166 0.147 -3.689 1.00 0.00 N ATOM 2480 CA LEU B 96 0.091 -0.666 -2.511 1.00 0.00 C ATOM 2481 C LEU B 96 -1.181 -1.366 -2.040 1.00 0.00 C ATOM 2482 O LEU B 96 -1.259 -2.592 -2.031 1.00 0.00 O ATOM 2483 CB LEU B 96 0.653 0.228 -1.408 1.00 0.00 C ATOM 2484 CG LEU B 96 2.154 0.467 -1.497 1.00 0.00 C ATOM 2485 CD1 LEU B 96 2.588 1.493 -0.469 1.00 0.00 C ATOM 2486 CD2 LEU B 96 2.918 -0.832 -1.322 1.00 0.00 C ATOM 0 H LEU B 96 0.121 1.121 -3.589 1.00 0.00 H new ATOM 0 HA LEU B 96 0.816 -1.441 -2.760 1.00 0.00 H new ATOM 0 HB2 LEU B 96 0.141 1.190 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU B 96 0.425 -0.221 -0.441 1.00 0.00 H new ATOM 0 HG LEU B 96 2.382 0.858 -2.488 1.00 0.00 H new ATOM 0 HD11 LEU B 96 3.664 1.652 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU B 96 2.068 2.433 -0.651 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.345 1.132 0.530 1.00 0.00 H new ATOM 0 HD21 LEU B 96 3.988 -0.637 -1.389 1.00 0.00 H new ATOM 0 HD22 LEU B 96 2.688 -1.261 -0.347 1.00 0.00 H new ATOM 0 HD23 LEU B 96 2.627 -1.533 -2.104 1.00 0.00 H new ATOM 2498 N GLN B 97 -2.171 -0.566 -1.676 1.00 0.00 N ATOM 2499 CA GLN B 97 -3.461 -1.054 -1.205 1.00 0.00 C ATOM 2500 C GLN B 97 -4.127 -2.020 -2.192 1.00 0.00 C ATOM 2501 O GLN B 97 -4.591 -3.087 -1.803 1.00 0.00 O ATOM 2502 CB GLN B 97 -4.358 0.151 -0.906 1.00 0.00 C ATOM 2503 CG GLN B 97 -5.837 -0.054 -1.151 1.00 0.00 C ATOM 2504 CD GLN B 97 -6.504 1.197 -1.696 1.00 0.00 C ATOM 2505 OE1 GLN B 97 -5.777 1.954 -2.509 1.00 0.00 O flip ATOM 2506 NE2 GLN B 97 -7.659 1.483 -1.394 1.00 0.00 N flip ATOM 0 H GLN B 97 -2.102 0.451 -1.699 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.302 -1.633 -0.295 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.217 0.435 0.137 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.021 0.991 -1.514 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -5.977 -0.875 -1.854 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.321 -0.346 -0.219 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -8.187 0.877 -0.766 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -8.091 2.327 -1.771 1.00 0.00 H new ATOM 2515 N GLN B 98 -4.133 -1.652 -3.465 1.00 0.00 N ATOM 2516 CA GLN B 98 -4.772 -2.461 -4.504 1.00 0.00 C ATOM 2517 C GLN B 98 -4.026 -3.760 -4.798 1.00 0.00 C ATOM 2518 O GLN B 98 -4.644 -4.797 -5.041 1.00 0.00 O ATOM 2519 CB GLN B 98 -4.879 -1.657 -5.796 1.00 0.00 C ATOM 2520 CG GLN B 98 -5.942 -0.573 -5.759 1.00 0.00 C ATOM 2521 CD GLN B 98 -5.713 0.500 -6.806 1.00 0.00 C ATOM 2522 OE1 GLN B 98 -5.198 0.227 -7.891 1.00 0.00 O ATOM 2523 NE2 GLN B 98 -6.087 1.729 -6.487 1.00 0.00 N ATOM 0 H GLN B 98 -3.701 -0.794 -3.809 1.00 0.00 H new ATOM 0 HA GLN B 98 -5.759 -2.725 -4.124 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -3.913 -1.198 -6.008 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -5.096 -2.338 -6.619 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -6.922 -1.024 -5.914 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -5.955 -0.115 -4.770 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -6.510 1.913 -5.577 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -5.952 2.492 -7.151 1.00 0.00 H new ATOM 2532 N LEU B 99 -2.707 -3.699 -4.786 1.00 0.00 N ATOM 2533 CA LEU B 99 -1.886 -4.858 -5.100 1.00 0.00 C ATOM 2534 C LEU B 99 -1.736 -5.819 -3.930 1.00 0.00 C ATOM 2535 O LEU B 99 -1.617 -7.020 -4.142 1.00 0.00 O ATOM 2536 CB LEU B 99 -0.506 -4.402 -5.552 1.00 0.00 C ATOM 2537 CG LEU B 99 -0.422 -3.889 -6.985 1.00 0.00 C ATOM 2538 CD1 LEU B 99 0.665 -2.838 -7.096 1.00 0.00 C ATOM 2539 CD2 LEU B 99 -0.146 -5.041 -7.940 1.00 0.00 C ATOM 0 H LEU B 99 -2.178 -2.856 -4.561 1.00 0.00 H new ATOM 0 HA LEU B 99 -2.397 -5.397 -5.898 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -0.165 -3.613 -4.881 1.00 0.00 H new ATOM 0 HB3 LEU B 99 0.187 -5.236 -5.442 1.00 0.00 H new ATOM 0 HG LEU B 99 -1.376 -3.436 -7.256 1.00 0.00 H new ATOM 0 HD11 LEU B 99 0.718 -2.477 -8.123 1.00 0.00 H new ATOM 0 HD12 LEU B 99 0.436 -2.006 -6.430 1.00 0.00 H new ATOM 0 HD13 LEU B 99 1.623 -3.275 -6.815 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -0.088 -4.662 -8.960 1.00 0.00 H new ATOM 0 HD22 LEU B 99 0.799 -5.515 -7.675 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -0.951 -5.773 -7.870 1.00 0.00 H new ATOM 2551 N LEU B 100 -1.741 -5.293 -2.711 1.00 0.00 N ATOM 2552 CA LEU B 100 -1.568 -6.104 -1.497 1.00 0.00 C ATOM 2553 C LEU B 100 -2.303 -7.458 -1.535 1.00 0.00 C ATOM 2554 O LEU B 100 -1.671 -8.497 -1.317 1.00 0.00 O ATOM 2555 CB LEU B 100 -1.998 -5.315 -0.269 1.00 0.00 C ATOM 2556 CG LEU B 100 -0.925 -4.409 0.318 1.00 0.00 C ATOM 2557 CD1 LEU B 100 -1.506 -3.587 1.459 1.00 0.00 C ATOM 2558 CD2 LEU B 100 0.266 -5.238 0.777 1.00 0.00 C ATOM 0 H LEU B 100 -1.864 -4.297 -2.529 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.504 -6.336 -1.444 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.864 -4.706 -0.531 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -2.322 -6.016 0.500 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.575 -3.718 -0.449 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -0.732 -2.941 1.873 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -2.327 -2.975 1.085 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -1.876 -4.255 2.237 1.00 0.00 H new ATOM 0 HD21 LEU B 100 1.028 -4.580 1.195 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -0.057 -5.949 1.538 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.681 -5.780 -0.073 1.00 0.00 H new ATOM 2570 N PRO B 101 -3.626 -7.487 -1.820 1.00 0.00 N ATOM 2571 CA PRO B 101 -4.401 -8.742 -1.869 1.00 0.00 C ATOM 2572 C PRO B 101 -3.937 -9.722 -2.951 1.00 0.00 C ATOM 2573 O PRO B 101 -4.578 -10.742 -3.186 1.00 0.00 O ATOM 2574 CB PRO B 101 -5.832 -8.278 -2.159 1.00 0.00 C ATOM 2575 CG PRO B 101 -5.681 -6.924 -2.751 1.00 0.00 C ATOM 2576 CD PRO B 101 -4.487 -6.319 -2.081 1.00 0.00 C ATOM 0 HA PRO B 101 -4.287 -9.297 -0.938 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -6.336 -8.957 -2.848 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -6.430 -8.247 -1.248 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -5.537 -6.982 -3.830 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -6.573 -6.321 -2.581 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -3.993 -5.588 -2.721 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.759 -5.804 -1.160 1.00 0.00 H new ATOM 2584 N LYS B 102 -2.857 -9.392 -3.636 1.00 0.00 N ATOM 2585 CA LYS B 102 -2.298 -10.260 -4.659 1.00 0.00 C ATOM 2586 C LYS B 102 -1.149 -11.080 -4.072 1.00 0.00 C ATOM 2587 O LYS B 102 -0.781 -12.128 -4.601 1.00 0.00 O ATOM 2588 CB LYS B 102 -1.810 -9.422 -5.851 1.00 0.00 C ATOM 2589 CG LYS B 102 -0.944 -10.182 -6.843 1.00 0.00 C ATOM 2590 CD LYS B 102 -0.134 -9.224 -7.722 1.00 0.00 C ATOM 2591 CE LYS B 102 0.897 -9.950 -8.585 1.00 0.00 C ATOM 2592 NZ LYS B 102 2.061 -9.078 -8.937 1.00 0.00 N ATOM 0 H LYS B 102 -2.345 -8.520 -3.501 1.00 0.00 H new ATOM 0 HA LYS B 102 -3.070 -10.944 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -2.677 -9.022 -6.377 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -1.245 -8.570 -5.473 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -0.267 -10.845 -6.305 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -1.574 -10.811 -7.472 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -0.813 -8.665 -8.366 1.00 0.00 H new ATOM 0 HD3 LYS B 102 0.375 -8.497 -7.088 1.00 0.00 H new ATOM 0 HE2 LYS B 102 1.255 -10.832 -8.054 1.00 0.00 H new ATOM 0 HE3 LYS B 102 0.419 -10.300 -9.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 2.087 -8.932 -9.966 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 1.963 -8.159 -8.460 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 2.943 -9.536 -8.630 1.00 0.00 H new ATOM 2606 N PHE B 103 -0.608 -10.609 -2.951 1.00 0.00 N ATOM 2607 CA PHE B 103 0.518 -11.264 -2.304 1.00 0.00 C ATOM 2608 C PHE B 103 0.112 -11.857 -0.972 1.00 0.00 C ATOM 2609 O PHE B 103 0.627 -12.898 -0.559 1.00 0.00 O ATOM 2610 CB PHE B 103 1.644 -10.260 -2.115 1.00 0.00 C ATOM 2611 CG PHE B 103 1.814 -9.373 -3.306 1.00 0.00 C ATOM 2612 CD1 PHE B 103 2.642 -9.744 -4.345 1.00 0.00 C ATOM 2613 CD2 PHE B 103 1.131 -8.173 -3.394 1.00 0.00 C ATOM 2614 CE1 PHE B 103 2.788 -8.933 -5.446 1.00 0.00 C ATOM 2615 CE2 PHE B 103 1.274 -7.359 -4.495 1.00 0.00 C ATOM 2616 CZ PHE B 103 2.103 -7.739 -5.522 1.00 0.00 C ATOM 0 H PHE B 103 -0.936 -9.770 -2.472 1.00 0.00 H new ATOM 0 HA PHE B 103 0.861 -12.081 -2.940 1.00 0.00 H new ATOM 0 HB2 PHE B 103 1.440 -9.649 -1.235 1.00 0.00 H new ATOM 0 HB3 PHE B 103 2.576 -10.793 -1.925 1.00 0.00 H new ATOM 0 HD1 PHE B 103 3.180 -10.679 -4.293 1.00 0.00 H new ATOM 0 HD2 PHE B 103 0.478 -7.871 -2.589 1.00 0.00 H new ATOM 0 HE1 PHE B 103 3.441 -9.232 -6.253 1.00 0.00 H new ATOM 0 HE2 PHE B 103 0.736 -6.424 -4.551 1.00 0.00 H new ATOM 0 HZ PHE B 103 2.218 -7.104 -6.388 1.00 0.00 H new ATOM 2626 N LYS B 104 -0.812 -11.188 -0.305 1.00 0.00 N ATOM 2627 CA LYS B 104 -1.301 -11.650 0.977 1.00 0.00 C ATOM 2628 C LYS B 104 -1.993 -12.988 0.818 1.00 0.00 C ATOM 2629 O LYS B 104 -2.947 -13.114 0.057 1.00 0.00 O ATOM 2630 CB LYS B 104 -2.255 -10.630 1.573 1.00 0.00 C ATOM 2631 CG LYS B 104 -1.590 -9.301 1.846 1.00 0.00 C ATOM 2632 CD LYS B 104 -2.603 -8.252 2.254 1.00 0.00 C ATOM 2633 CE LYS B 104 -2.798 -8.219 3.761 1.00 0.00 C ATOM 2634 NZ LYS B 104 -4.128 -8.748 4.159 1.00 0.00 N ATOM 0 H LYS B 104 -1.238 -10.321 -0.633 1.00 0.00 H new ATOM 0 HA LYS B 104 -0.455 -11.772 1.654 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -3.092 -10.480 0.891 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -2.667 -11.023 2.502 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -0.848 -9.419 2.635 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -1.058 -8.968 0.955 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -2.273 -7.273 1.908 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -3.557 -8.457 1.768 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -2.015 -8.806 4.241 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -2.693 -7.195 4.118 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -4.342 -8.452 5.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -4.856 -8.376 3.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -4.118 -9.787 4.107 1.00 0.00 H new