USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1024 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 117 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 19 MET CE :methyl -149:sc= -0.701 (180deg=-1.4) USER MOD Set 2.2: A 115 MET CE :methyl -115:sc= -3.21 (180deg=-4.17!) USER MOD Set 3.1: A 110 HIS : no HD1:sc= -0.0791 X(o=-2,f=-2.2) USER MOD Set 3.2: A 113 LYS NZ :NH3+ -110:sc= -1.92 (180deg=-4.43!) USER MOD Set 4.1: A 94 HIS : no HD1:sc= -0.0797 X(o=-0.08,f=0) USER MOD Set 4.2: A 95 ASN : amide:sc= 0 K(o=-0.08,f=-0.77) USER MOD Set 5.1: A 9 GLN : amide:sc= -3.38 X(o=-7.7,f=-8.1!) USER MOD Set 5.2: A 10 GLN :FLIP amide:sc= -4.32! C(o=-13!,f=-7.7!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.821 X(o=-0.82,f=-0.91) USER MOD Single : A 34 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0392) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 49:sc= -0.585 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0295 USER MOD Single : A 44 ASN : amide:sc= -0.0579 K(o=-0.058,f=-1.9) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00132) USER MOD Single : A 92 THR OG1 : rot 76:sc= 0.4 USER MOD Single : A 93 THR OG1 : rot 95:sc= 1.25 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -136:sc= 0.0918 USER MOD Single : A 108 GLN : amide:sc= -8.02! C(o=-8!,f=-13!) USER MOD Single : A 112 TYR OH : rot 170:sc= 1.11 USER MOD Single : A 119 SER OG : rot 63:sc= 0.31 USER MOD Single : A 120 TYR OH : rot 120:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= -0.0137 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 150:sc= -1.02 USER MOD Single : A 130 GLN : amide:sc= -0.0924 K(o=-0.092,f=-1.3!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -19.064 8.051 1.198 1.00 0.00 N ATOM 78 CA GLN A 9 -19.052 7.615 -0.193 1.00 0.00 C ATOM 79 C GLN A 9 -18.252 8.581 -1.060 1.00 0.00 C ATOM 80 O GLN A 9 -17.290 8.187 -1.718 1.00 0.00 O ATOM 81 CB GLN A 9 -20.481 7.497 -0.724 1.00 0.00 C ATOM 82 CG GLN A 9 -20.571 6.829 -2.087 1.00 0.00 C ATOM 83 CD GLN A 9 -20.565 7.827 -3.228 1.00 0.00 C ATOM 84 OE1 GLN A 9 -21.617 8.291 -3.668 1.00 0.00 O ATOM 85 NE2 GLN A 9 -19.376 8.164 -3.713 1.00 0.00 N ATOM 0 HA GLN A 9 -18.574 6.637 -0.237 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -21.079 6.930 -0.011 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.920 8.493 -0.787 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -19.734 6.142 -2.206 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -21.482 6.233 -2.136 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -18.529 7.755 -3.318 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -19.309 8.832 -4.481 1.00 0.00 H new ATOM 94 N GLN A 10 -18.658 9.847 -1.056 1.00 0.00 N ATOM 95 CA GLN A 10 -17.979 10.868 -1.844 1.00 0.00 C ATOM 96 C GLN A 10 -16.476 10.845 -1.586 1.00 0.00 C ATOM 97 O GLN A 10 -15.677 11.068 -2.496 1.00 0.00 O ATOM 98 CB GLN A 10 -18.543 12.252 -1.518 1.00 0.00 C ATOM 99 CG GLN A 10 -19.953 12.474 -2.042 1.00 0.00 C ATOM 100 CD GLN A 10 -20.932 11.431 -1.541 1.00 0.00 C ATOM 101 OE1 GLN A 10 -21.118 10.371 -2.318 1.00 0.00 O flip ATOM 102 NE2 GLN A 10 -21.516 11.577 -0.467 1.00 0.00 N flip ATOM 0 H GLN A 10 -19.453 10.189 -0.516 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.151 10.652 -2.898 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.540 12.391 -0.437 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.884 13.012 -1.939 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.297 13.464 -1.741 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.938 12.459 -3.132 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.343 12.408 0.099 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -22.173 10.867 -0.143 1.00 0.00 H new ATOM 111 N ARG A 11 -16.098 10.575 -0.341 1.00 0.00 N ATOM 112 CA ARG A 11 -14.691 10.525 0.037 1.00 0.00 C ATOM 113 C ARG A 11 -14.022 9.274 -0.526 1.00 0.00 C ATOM 114 O ARG A 11 -12.883 9.323 -0.991 1.00 0.00 O ATOM 115 CB ARG A 11 -14.549 10.551 1.560 1.00 0.00 C ATOM 116 CG ARG A 11 -13.126 10.317 2.042 1.00 0.00 C ATOM 117 CD ARG A 11 -13.097 9.888 3.501 1.00 0.00 C ATOM 118 NE ARG A 11 -13.272 11.019 4.408 1.00 0.00 N ATOM 119 CZ ARG A 11 -12.272 11.600 5.061 1.00 0.00 C ATOM 120 NH1 ARG A 11 -11.031 11.159 4.907 1.00 0.00 N ATOM 121 NH2 ARG A 11 -12.512 12.625 5.869 1.00 0.00 N ATOM 0 H ARG A 11 -16.747 10.387 0.423 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.196 11.401 -0.382 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.896 11.515 1.933 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.199 9.790 1.990 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.653 9.551 1.427 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.544 11.230 1.918 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -13.884 9.155 3.679 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.149 9.395 3.715 1.00 0.00 H new ATOM 0 HE ARG A 11 -14.215 11.383 4.548 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -10.843 10.372 4.286 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -10.265 11.607 5.410 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.465 12.967 5.989 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -11.743 13.070 6.370 1.00 0.00 H new ATOM 135 N VAL A 12 -14.737 8.155 -0.480 1.00 0.00 N ATOM 136 CA VAL A 12 -14.213 6.892 -0.985 1.00 0.00 C ATOM 137 C VAL A 12 -13.824 7.006 -2.455 1.00 0.00 C ATOM 138 O VAL A 12 -12.665 6.810 -2.820 1.00 0.00 O ATOM 139 CB VAL A 12 -15.238 5.754 -0.824 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.726 4.477 -1.472 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.552 5.525 0.647 1.00 0.00 C ATOM 0 H VAL A 12 -15.681 8.097 -0.098 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.327 6.659 -0.395 1.00 0.00 H new ATOM 0 HB VAL A 12 -16.159 6.045 -1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.464 3.685 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.556 4.651 -2.534 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.790 4.179 -0.999 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -16.278 4.718 0.743 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.638 5.256 1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.965 6.437 1.077 1.00 0.00 H new ATOM 151 N LYS A 13 -14.802 7.326 -3.296 1.00 0.00 N ATOM 152 CA LYS A 13 -14.564 7.470 -4.727 1.00 0.00 C ATOM 153 C LYS A 13 -13.245 8.190 -4.990 1.00 0.00 C ATOM 154 O LYS A 13 -12.474 7.793 -5.863 1.00 0.00 O ATOM 155 CB LYS A 13 -15.716 8.236 -5.382 1.00 0.00 C ATOM 156 CG LYS A 13 -15.675 8.214 -6.900 1.00 0.00 C ATOM 157 CD LYS A 13 -16.068 6.853 -7.449 1.00 0.00 C ATOM 158 CE LYS A 13 -16.046 6.838 -8.970 1.00 0.00 C ATOM 159 NZ LYS A 13 -17.239 7.515 -9.549 1.00 0.00 N ATOM 0 H LYS A 13 -15.767 7.491 -3.011 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.505 6.472 -5.162 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.662 7.810 -5.046 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.693 9.271 -5.041 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.349 8.975 -7.294 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.672 8.469 -7.241 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.385 6.094 -7.067 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.065 6.591 -7.096 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.141 7.331 -9.325 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.007 5.807 -9.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.186 7.483 -10.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.102 7.029 -9.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.263 8.506 -9.234 1.00 0.00 H new ATOM 173 N ARG A 14 -12.994 9.250 -4.229 1.00 0.00 N ATOM 174 CA ARG A 14 -11.768 10.025 -4.380 1.00 0.00 C ATOM 175 C ARG A 14 -10.554 9.107 -4.489 1.00 0.00 C ATOM 176 O ARG A 14 -9.656 9.343 -5.297 1.00 0.00 O ATOM 177 CB ARG A 14 -11.594 10.980 -3.198 1.00 0.00 C ATOM 178 CG ARG A 14 -10.684 12.160 -3.496 1.00 0.00 C ATOM 179 CD ARG A 14 -11.286 13.076 -4.550 1.00 0.00 C ATOM 180 NE ARG A 14 -10.671 14.401 -4.540 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.045 15.378 -3.722 1.00 0.00 C ATOM 182 NH1 ARG A 14 -12.025 15.180 -2.851 1.00 0.00 N ATOM 183 NH2 ARG A 14 -10.436 16.556 -3.773 1.00 0.00 N ATOM 0 H ARG A 14 -13.623 9.592 -3.502 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.846 10.606 -5.299 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.573 11.354 -2.897 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -11.190 10.426 -2.351 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -10.507 12.724 -2.580 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -9.715 11.796 -3.839 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.162 12.626 -5.535 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -12.358 13.173 -4.377 1.00 0.00 H new ATOM 0 HE ARG A 14 -9.913 14.586 -5.197 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -12.494 14.275 -2.808 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -12.310 15.932 -2.224 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -9.681 16.711 -4.441 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.723 17.306 -3.145 1.00 0.00 H new ATOM 197 N TRP A 15 -10.534 8.062 -3.670 1.00 0.00 N ATOM 198 CA TRP A 15 -9.430 7.109 -3.674 1.00 0.00 C ATOM 199 C TRP A 15 -9.377 6.343 -4.991 1.00 0.00 C ATOM 200 O TRP A 15 -8.309 5.919 -5.431 1.00 0.00 O ATOM 201 CB TRP A 15 -9.569 6.131 -2.506 1.00 0.00 C ATOM 202 CG TRP A 15 -10.014 6.786 -1.233 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.662 8.027 -0.783 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.890 6.233 -0.245 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.268 8.278 0.424 1.00 0.00 N ATOM 206 CE2 TRP A 15 -11.027 7.194 0.776 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.574 5.020 -0.124 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.818 6.977 1.901 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -12.359 4.806 0.993 1.00 0.00 C ATOM 210 CH2 TRP A 15 -12.476 5.780 1.993 1.00 0.00 C ATOM 0 H TRP A 15 -11.269 7.853 -2.995 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.501 7.667 -3.562 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.284 5.354 -2.775 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.611 5.639 -2.338 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.004 8.710 -1.300 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -10.169 9.134 0.970 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.490 4.263 -0.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.909 7.726 2.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.891 3.872 1.097 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -13.098 5.583 2.854 1.00 0.00 H new ATOM 221 N GLY A 16 -10.538 6.168 -5.616 1.00 0.00 N ATOM 222 CA GLY A 16 -10.600 5.452 -6.877 1.00 0.00 C ATOM 223 C GLY A 16 -10.147 6.301 -8.048 1.00 0.00 C ATOM 224 O GLY A 16 -10.656 6.160 -9.161 1.00 0.00 O ATOM 0 H GLY A 16 -11.436 6.509 -5.272 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.976 4.560 -6.816 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.622 5.115 -7.050 1.00 0.00 H new ATOM 228 N PHE A 17 -9.188 7.187 -7.799 1.00 0.00 N ATOM 229 CA PHE A 17 -8.668 8.064 -8.842 1.00 0.00 C ATOM 230 C PHE A 17 -7.184 7.805 -9.080 1.00 0.00 C ATOM 231 O PHE A 17 -6.696 7.913 -10.204 1.00 0.00 O ATOM 232 CB PHE A 17 -8.887 9.530 -8.461 1.00 0.00 C ATOM 233 CG PHE A 17 -10.271 10.028 -8.765 1.00 0.00 C ATOM 234 CD1 PHE A 17 -10.833 9.831 -10.017 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.010 10.693 -7.801 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.106 10.288 -10.301 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.284 11.152 -8.078 1.00 0.00 C ATOM 238 CZ PHE A 17 -12.832 10.950 -9.330 1.00 0.00 C ATOM 0 H PHE A 17 -8.755 7.317 -6.884 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.208 7.851 -9.764 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.691 9.653 -7.396 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.163 10.147 -8.992 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.269 9.314 -10.780 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.586 10.855 -6.821 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -12.532 10.128 -11.280 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.850 11.668 -7.317 1.00 0.00 H new ATOM 0 HZ PHE A 17 -13.827 11.309 -9.549 1.00 0.00 H new ATOM 248 N GLY A 18 -6.470 7.463 -8.011 1.00 0.00 N ATOM 249 CA GLY A 18 -5.048 7.195 -8.124 1.00 0.00 C ATOM 250 C GLY A 18 -4.356 7.159 -6.775 1.00 0.00 C ATOM 251 O GLY A 18 -4.757 7.859 -5.846 1.00 0.00 O ATOM 0 H GLY A 18 -6.851 7.367 -7.070 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.900 6.241 -8.630 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.585 7.961 -8.746 1.00 0.00 H new ATOM 255 N MET A 19 -3.316 6.340 -6.667 1.00 0.00 N ATOM 256 CA MET A 19 -2.567 6.215 -5.422 1.00 0.00 C ATOM 257 C MET A 19 -2.424 7.570 -4.736 1.00 0.00 C ATOM 258 O MET A 19 -2.713 7.707 -3.547 1.00 0.00 O ATOM 259 CB MET A 19 -1.185 5.618 -5.690 1.00 0.00 C ATOM 260 CG MET A 19 -0.639 4.801 -4.530 1.00 0.00 C ATOM 261 SD MET A 19 0.517 3.524 -5.062 1.00 0.00 S ATOM 262 CE MET A 19 1.932 4.520 -5.523 1.00 0.00 C ATOM 0 H MET A 19 -2.972 5.753 -7.427 1.00 0.00 H new ATOM 0 HA MET A 19 -3.120 5.548 -4.760 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.237 4.985 -6.576 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.487 6.425 -5.915 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.140 5.466 -3.825 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.468 4.336 -3.997 1.00 0.00 H new ATOM 0 HE1 MET A 19 2.474 4.030 -6.332 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.593 5.501 -5.856 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.591 4.636 -4.663 1.00 0.00 H new ATOM 272 N ASP A 20 -1.978 8.567 -5.492 1.00 0.00 N ATOM 273 CA ASP A 20 -1.797 9.911 -4.956 1.00 0.00 C ATOM 274 C ASP A 20 -2.942 10.280 -4.017 1.00 0.00 C ATOM 275 O ASP A 20 -2.715 10.702 -2.884 1.00 0.00 O ATOM 276 CB ASP A 20 -1.707 10.929 -6.095 1.00 0.00 C ATOM 277 CG ASP A 20 -0.723 10.510 -7.169 1.00 0.00 C ATOM 278 OD1 ASP A 20 0.337 9.950 -6.817 1.00 0.00 O ATOM 279 OD2 ASP A 20 -1.012 10.741 -8.361 1.00 0.00 O ATOM 0 H ASP A 20 -1.735 8.470 -6.478 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.866 9.928 -4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.693 11.059 -6.541 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.409 11.897 -5.691 1.00 0.00 H new ATOM 284 N GLU A 21 -4.171 10.119 -4.498 1.00 0.00 N ATOM 285 CA GLU A 21 -5.350 10.437 -3.701 1.00 0.00 C ATOM 286 C GLU A 21 -5.458 9.509 -2.495 1.00 0.00 C ATOM 287 O GLU A 21 -5.462 9.960 -1.350 1.00 0.00 O ATOM 288 CB GLU A 21 -6.614 10.329 -4.556 1.00 0.00 C ATOM 289 CG GLU A 21 -6.620 11.264 -5.754 1.00 0.00 C ATOM 290 CD GLU A 21 -6.512 12.723 -5.356 1.00 0.00 C ATOM 291 OE1 GLU A 21 -5.388 13.174 -5.052 1.00 0.00 O ATOM 292 OE2 GLU A 21 -7.552 13.414 -5.350 1.00 0.00 O ATOM 0 H GLU A 21 -4.376 9.771 -5.435 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.249 11.461 -3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.719 9.302 -4.907 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.483 10.544 -3.934 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.790 11.009 -6.413 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.537 11.113 -6.323 1.00 0.00 H new ATOM 299 N ALA A 22 -5.545 8.210 -2.761 1.00 0.00 N ATOM 300 CA ALA A 22 -5.652 7.218 -1.698 1.00 0.00 C ATOM 301 C ALA A 22 -4.695 7.534 -0.554 1.00 0.00 C ATOM 302 O ALA A 22 -5.058 7.433 0.619 1.00 0.00 O ATOM 303 CB ALA A 22 -5.379 5.825 -2.247 1.00 0.00 C ATOM 0 H ALA A 22 -5.543 7.820 -3.703 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.669 7.250 -1.306 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.462 5.094 -1.443 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.105 5.592 -3.026 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.374 5.790 -2.667 1.00 0.00 H new ATOM 309 N LEU A 23 -3.471 7.917 -0.901 1.00 0.00 N ATOM 310 CA LEU A 23 -2.460 8.247 0.098 1.00 0.00 C ATOM 311 C LEU A 23 -2.860 9.491 0.886 1.00 0.00 C ATOM 312 O LEU A 23 -2.789 9.510 2.114 1.00 0.00 O ATOM 313 CB LEU A 23 -1.104 8.470 -0.574 1.00 0.00 C ATOM 314 CG LEU A 23 -0.578 7.311 -1.422 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.480 7.802 -2.398 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.016 6.211 -0.533 1.00 0.00 C ATOM 0 H LEU A 23 -3.155 8.007 -1.867 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.382 7.409 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.176 9.354 -1.207 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.369 8.691 0.200 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.409 6.899 -1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.843 6.964 -2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.046 8.554 -3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.310 8.240 -1.844 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.354 5.395 -1.154 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.802 6.610 0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.801 5.839 0.126 1.00 0.00 H new ATOM 328 N LYS A 24 -3.283 10.527 0.170 1.00 0.00 N ATOM 329 CA LYS A 24 -3.698 11.775 0.801 1.00 0.00 C ATOM 330 C LYS A 24 -4.596 11.503 2.004 1.00 0.00 C ATOM 331 O LYS A 24 -4.351 12.010 3.100 1.00 0.00 O ATOM 332 CB LYS A 24 -4.434 12.660 -0.207 1.00 0.00 C ATOM 333 CG LYS A 24 -3.514 13.330 -1.213 1.00 0.00 C ATOM 334 CD LYS A 24 -4.082 14.655 -1.693 1.00 0.00 C ATOM 335 CE LYS A 24 -3.189 15.298 -2.743 1.00 0.00 C ATOM 336 NZ LYS A 24 -3.920 16.318 -3.544 1.00 0.00 N ATOM 0 H LYS A 24 -3.348 10.527 -0.848 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.804 12.294 1.146 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.166 12.055 -0.743 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.989 13.427 0.333 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.537 13.495 -0.760 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.362 12.668 -2.066 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.077 14.496 -2.108 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.195 15.332 -0.846 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.333 15.765 -2.255 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.797 14.528 -3.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -3.277 16.733 -4.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.722 15.868 -4.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.273 17.067 -2.914 1.00 0.00 H new ATOM 350 N ASP A 25 -5.633 10.701 1.794 1.00 0.00 N ATOM 351 CA ASP A 25 -6.565 10.361 2.863 1.00 0.00 C ATOM 352 C ASP A 25 -5.952 9.337 3.813 1.00 0.00 C ATOM 353 O ASP A 25 -5.237 8.422 3.403 1.00 0.00 O ATOM 354 CB ASP A 25 -7.868 9.814 2.277 1.00 0.00 C ATOM 355 CG ASP A 25 -8.299 10.559 1.029 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.814 10.211 -0.068 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.123 11.490 1.149 1.00 0.00 O ATOM 0 H ASP A 25 -5.850 10.274 0.894 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.781 11.269 3.426 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.741 8.758 2.040 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.656 9.880 3.027 1.00 0.00 H new ATOM 362 N PRO A 26 -6.235 9.494 5.115 1.00 0.00 N ATOM 363 CA PRO A 26 -5.720 8.594 6.151 1.00 0.00 C ATOM 364 C PRO A 26 -6.352 7.208 6.080 1.00 0.00 C ATOM 365 O PRO A 26 -5.651 6.195 6.064 1.00 0.00 O ATOM 366 CB PRO A 26 -6.111 9.294 7.455 1.00 0.00 C ATOM 367 CG PRO A 26 -7.294 10.126 7.098 1.00 0.00 C ATOM 368 CD PRO A 26 -7.079 10.562 5.675 1.00 0.00 C ATOM 0 HA PRO A 26 -4.648 8.424 6.048 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -6.355 8.572 8.234 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.295 9.909 7.835 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.217 9.554 7.196 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -7.380 10.987 7.761 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -8.022 10.653 5.136 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.586 11.533 5.622 1.00 0.00 H new ATOM 376 N VAL A 27 -7.680 7.169 6.038 1.00 0.00 N ATOM 377 CA VAL A 27 -8.406 5.906 5.967 1.00 0.00 C ATOM 378 C VAL A 27 -8.134 5.189 4.650 1.00 0.00 C ATOM 379 O VAL A 27 -7.985 3.969 4.614 1.00 0.00 O ATOM 380 CB VAL A 27 -9.923 6.122 6.118 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.672 4.814 5.913 1.00 0.00 C ATOM 382 CG2 VAL A 27 -10.243 6.722 7.479 1.00 0.00 C ATOM 0 H VAL A 27 -8.275 7.997 6.052 1.00 0.00 H new ATOM 0 HA VAL A 27 -8.050 5.289 6.793 1.00 0.00 H new ATOM 0 HB VAL A 27 -10.250 6.824 5.351 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.743 4.987 6.024 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.468 4.430 4.913 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.343 4.086 6.655 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.319 6.868 7.568 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.902 6.047 8.264 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.737 7.682 7.581 1.00 0.00 H new ATOM 392 N GLY A 28 -8.070 5.957 3.566 1.00 0.00 N ATOM 393 CA GLY A 28 -7.815 5.378 2.260 1.00 0.00 C ATOM 394 C GLY A 28 -6.457 4.711 2.177 1.00 0.00 C ATOM 395 O GLY A 28 -6.253 3.802 1.372 1.00 0.00 O ATOM 0 H GLY A 28 -8.190 6.970 3.569 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.590 4.646 2.033 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.880 6.158 1.501 1.00 0.00 H new ATOM 399 N ARG A 29 -5.525 5.163 3.009 1.00 0.00 N ATOM 400 CA ARG A 29 -4.178 4.606 3.023 1.00 0.00 C ATOM 401 C ARG A 29 -4.187 3.176 3.556 1.00 0.00 C ATOM 402 O ARG A 29 -3.597 2.277 2.957 1.00 0.00 O ATOM 403 CB ARG A 29 -3.253 5.474 3.878 1.00 0.00 C ATOM 404 CG ARG A 29 -2.515 6.541 3.086 1.00 0.00 C ATOM 405 CD ARG A 29 -1.439 7.213 3.924 1.00 0.00 C ATOM 406 NE ARG A 29 -1.981 8.284 4.755 1.00 0.00 N ATOM 407 CZ ARG A 29 -1.274 9.338 5.149 1.00 0.00 C ATOM 408 NH1 ARG A 29 -0.004 9.461 4.789 1.00 0.00 N ATOM 409 NH2 ARG A 29 -1.838 10.272 5.904 1.00 0.00 N ATOM 0 H ARG A 29 -5.678 5.914 3.682 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.807 4.592 1.998 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.840 5.955 4.660 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.524 4.833 4.375 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.062 6.091 2.203 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.224 7.290 2.734 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.958 6.470 4.559 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.669 7.618 3.268 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.956 8.220 5.049 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.433 8.746 4.208 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.536 10.271 5.093 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -2.815 10.181 6.183 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.295 11.081 6.206 1.00 0.00 H new ATOM 423 N GLU A 30 -4.859 2.975 4.685 1.00 0.00 N ATOM 424 CA GLU A 30 -4.943 1.655 5.298 1.00 0.00 C ATOM 425 C GLU A 30 -5.849 0.734 4.486 1.00 0.00 C ATOM 426 O GLU A 30 -5.519 -0.428 4.250 1.00 0.00 O ATOM 427 CB GLU A 30 -5.465 1.766 6.733 1.00 0.00 C ATOM 428 CG GLU A 30 -6.980 1.820 6.826 1.00 0.00 C ATOM 429 CD GLU A 30 -7.472 1.946 8.255 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.192 1.035 9.062 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.137 2.956 8.566 1.00 0.00 O ATOM 0 H GLU A 30 -5.353 3.709 5.193 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.941 1.227 5.316 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.104 0.914 7.309 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.049 2.662 7.194 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.346 2.665 6.244 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.400 0.919 6.379 1.00 0.00 H new ATOM 438 N GLN A 31 -6.993 1.262 4.063 1.00 0.00 N ATOM 439 CA GLN A 31 -7.948 0.488 3.279 1.00 0.00 C ATOM 440 C GLN A 31 -7.270 -0.147 2.069 1.00 0.00 C ATOM 441 O GLN A 31 -7.258 -1.369 1.921 1.00 0.00 O ATOM 442 CB GLN A 31 -9.105 1.378 2.821 1.00 0.00 C ATOM 443 CG GLN A 31 -10.091 1.710 3.929 1.00 0.00 C ATOM 444 CD GLN A 31 -10.515 0.487 4.719 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.294 -0.337 4.240 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.002 0.363 5.938 1.00 0.00 N ATOM 0 H GLN A 31 -7.281 2.222 4.250 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.340 -0.307 3.913 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.701 2.306 2.415 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.636 0.880 2.010 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.641 2.436 4.605 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.973 2.182 3.496 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.360 1.070 6.295 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.250 -0.439 6.517 1.00 0.00 H new ATOM 455 N PHE A 32 -6.706 0.691 1.205 1.00 0.00 N ATOM 456 CA PHE A 32 -6.028 0.212 0.007 1.00 0.00 C ATOM 457 C PHE A 32 -4.965 -0.824 0.361 1.00 0.00 C ATOM 458 O PHE A 32 -4.755 -1.791 -0.372 1.00 0.00 O ATOM 459 CB PHE A 32 -5.386 1.381 -0.744 1.00 0.00 C ATOM 460 CG PHE A 32 -4.385 0.952 -1.778 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.753 0.099 -2.806 1.00 0.00 C ATOM 462 CD2 PHE A 32 -3.076 1.402 -1.723 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.834 -0.298 -3.759 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.152 1.009 -2.673 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.532 0.159 -3.693 1.00 0.00 C ATOM 0 H PHE A 32 -6.705 1.705 1.313 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.771 -0.260 -0.636 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.169 1.965 -1.228 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.896 2.038 -0.026 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.770 -0.260 -2.863 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.774 2.068 -0.928 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.133 -0.965 -4.554 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.134 1.366 -2.618 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.813 -0.148 -4.438 1.00 0.00 H new ATOM 475 N LEU A 33 -4.297 -0.615 1.490 1.00 0.00 N ATOM 476 CA LEU A 33 -3.254 -1.529 1.943 1.00 0.00 C ATOM 477 C LEU A 33 -3.828 -2.916 2.216 1.00 0.00 C ATOM 478 O LEU A 33 -3.354 -3.914 1.671 1.00 0.00 O ATOM 479 CB LEU A 33 -2.584 -0.985 3.206 1.00 0.00 C ATOM 480 CG LEU A 33 -1.850 -2.010 4.071 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.409 -2.163 3.611 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.904 -1.606 5.538 1.00 0.00 C ATOM 0 H LEU A 33 -4.459 0.180 2.109 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.509 -1.612 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.874 -0.212 2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.346 -0.502 3.818 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.349 -2.973 3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.097 -2.897 4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.392 -2.499 2.574 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.102 -1.203 3.690 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.377 -2.347 6.139 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.431 -0.632 5.665 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.943 -1.549 5.862 1.00 0.00 H new ATOM 494 N LYS A 34 -4.852 -2.972 3.060 1.00 0.00 N ATOM 495 CA LYS A 34 -5.494 -4.235 3.403 1.00 0.00 C ATOM 496 C LYS A 34 -5.614 -5.135 2.177 1.00 0.00 C ATOM 497 O LYS A 34 -5.167 -6.282 2.190 1.00 0.00 O ATOM 498 CB LYS A 34 -6.880 -3.981 4.000 1.00 0.00 C ATOM 499 CG LYS A 34 -6.862 -3.064 5.210 1.00 0.00 C ATOM 500 CD LYS A 34 -8.071 -3.294 6.102 1.00 0.00 C ATOM 501 CE LYS A 34 -7.936 -2.554 7.424 1.00 0.00 C ATOM 502 NZ LYS A 34 -6.961 -3.216 8.335 1.00 0.00 N ATOM 0 H LYS A 34 -5.256 -2.156 3.520 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.873 -4.740 4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.522 -3.546 3.234 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.324 -4.935 4.284 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.949 -3.233 5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.844 -2.025 4.880 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.973 -2.961 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.187 -4.361 6.291 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.618 -1.529 7.235 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.910 -2.501 7.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.997 -2.763 9.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.202 -4.223 8.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.002 -3.124 7.943 1.00 0.00 H new ATOM 516 N PHE A 35 -6.219 -4.607 1.118 1.00 0.00 N ATOM 517 CA PHE A 35 -6.397 -5.363 -0.116 1.00 0.00 C ATOM 518 C PHE A 35 -5.076 -5.969 -0.578 1.00 0.00 C ATOM 519 O PHE A 35 -5.018 -7.136 -0.970 1.00 0.00 O ATOM 520 CB PHE A 35 -6.968 -4.461 -1.213 1.00 0.00 C ATOM 521 CG PHE A 35 -6.957 -5.094 -2.575 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.797 -6.156 -2.868 1.00 0.00 C ATOM 523 CD2 PHE A 35 -6.104 -4.627 -3.563 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.789 -6.740 -4.121 1.00 0.00 C ATOM 525 CE2 PHE A 35 -6.092 -5.207 -4.817 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.935 -6.265 -5.096 1.00 0.00 C ATOM 0 H PHE A 35 -6.594 -3.659 1.090 1.00 0.00 H new ATOM 0 HA PHE A 35 -7.099 -6.173 0.082 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.992 -4.192 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.394 -3.535 -1.247 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.466 -6.532 -2.108 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.442 -3.801 -3.350 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.450 -7.567 -4.337 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.424 -4.833 -5.579 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.926 -6.720 -6.075 1.00 0.00 H new ATOM 536 N LEU A 36 -4.016 -5.170 -0.529 1.00 0.00 N ATOM 537 CA LEU A 36 -2.693 -5.627 -0.942 1.00 0.00 C ATOM 538 C LEU A 36 -2.284 -6.878 -0.172 1.00 0.00 C ATOM 539 O LEU A 36 -1.962 -7.906 -0.766 1.00 0.00 O ATOM 540 CB LEU A 36 -1.660 -4.520 -0.727 1.00 0.00 C ATOM 541 CG LEU A 36 -1.975 -3.172 -1.375 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.852 -2.179 -1.115 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.204 -3.340 -2.870 1.00 0.00 C ATOM 0 H LEU A 36 -4.046 -4.202 -0.207 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.735 -5.874 -2.003 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.541 -4.366 0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.700 -4.868 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.889 -2.781 -0.929 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.094 -1.225 -1.584 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.734 -2.036 -0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.078 -2.564 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.427 -2.370 -3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.307 -3.753 -3.331 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.042 -4.017 -3.036 1.00 0.00 H new ATOM 555 N GLU A 37 -2.301 -6.782 1.154 1.00 0.00 N ATOM 556 CA GLU A 37 -1.932 -7.908 2.005 1.00 0.00 C ATOM 557 C GLU A 37 -2.453 -9.220 1.427 1.00 0.00 C ATOM 558 O GLU A 37 -1.724 -10.210 1.351 1.00 0.00 O ATOM 559 CB GLU A 37 -2.481 -7.707 3.419 1.00 0.00 C ATOM 560 CG GLU A 37 -1.854 -6.535 4.155 1.00 0.00 C ATOM 561 CD GLU A 37 -2.154 -6.551 5.641 1.00 0.00 C ATOM 562 OE1 GLU A 37 -3.269 -6.972 6.016 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.276 -6.143 6.429 1.00 0.00 O ATOM 0 H GLU A 37 -2.566 -5.938 1.662 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.844 -7.957 2.049 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.559 -7.555 3.363 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.317 -8.617 3.996 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.774 -6.553 4.006 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.220 -5.603 3.724 1.00 0.00 H new ATOM 570 N SER A 38 -3.719 -9.221 1.022 1.00 0.00 N ATOM 571 CA SER A 38 -4.339 -10.412 0.455 1.00 0.00 C ATOM 572 C SER A 38 -3.519 -10.947 -0.716 1.00 0.00 C ATOM 573 O SER A 38 -3.115 -12.109 -0.723 1.00 0.00 O ATOM 574 CB SER A 38 -5.764 -10.101 -0.007 1.00 0.00 C ATOM 575 OG SER A 38 -6.688 -10.240 1.059 1.00 0.00 O ATOM 0 H SER A 38 -4.335 -8.410 1.076 1.00 0.00 H new ATOM 0 HA SER A 38 -4.375 -11.176 1.231 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.808 -9.086 -0.401 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.040 -10.771 -0.821 1.00 0.00 H new ATOM 0 HG SER A 38 -7.591 -10.034 0.738 1.00 0.00 H new ATOM 581 N GLU A 39 -3.279 -10.090 -1.703 1.00 0.00 N ATOM 582 CA GLU A 39 -2.508 -10.476 -2.879 1.00 0.00 C ATOM 583 C GLU A 39 -1.011 -10.410 -2.593 1.00 0.00 C ATOM 584 O GLU A 39 -0.192 -10.410 -3.513 1.00 0.00 O ATOM 585 CB GLU A 39 -2.854 -9.570 -4.062 1.00 0.00 C ATOM 586 CG GLU A 39 -2.632 -8.093 -3.784 1.00 0.00 C ATOM 587 CD GLU A 39 -3.471 -7.199 -4.676 1.00 0.00 C ATOM 588 OE1 GLU A 39 -4.529 -7.661 -5.151 1.00 0.00 O ATOM 589 OE2 GLU A 39 -3.069 -6.038 -4.899 1.00 0.00 O ATOM 0 H GLU A 39 -3.607 -9.124 -1.712 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.767 -11.504 -3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.252 -9.864 -4.922 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.897 -9.727 -4.335 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.869 -7.884 -2.741 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.578 -7.855 -3.926 1.00 0.00 H new ATOM 596 N PHE A 40 -0.660 -10.353 -1.313 1.00 0.00 N ATOM 597 CA PHE A 40 0.738 -10.284 -0.905 1.00 0.00 C ATOM 598 C PHE A 40 1.471 -9.178 -1.659 1.00 0.00 C ATOM 599 O PHE A 40 2.619 -9.348 -2.070 1.00 0.00 O ATOM 600 CB PHE A 40 1.429 -11.628 -1.149 1.00 0.00 C ATOM 601 CG PHE A 40 0.829 -12.413 -2.280 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.359 -13.105 -2.106 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.453 -12.461 -3.516 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.914 -13.829 -3.145 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.902 -13.183 -4.558 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.282 -13.869 -4.372 1.00 0.00 C ATOM 0 H PHE A 40 -1.325 -10.353 -0.540 1.00 0.00 H new ATOM 0 HA PHE A 40 0.769 -10.055 0.160 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.484 -11.452 -1.359 1.00 0.00 H new ATOM 0 HB3 PHE A 40 1.380 -12.224 -0.237 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.857 -13.078 -1.148 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.380 -11.928 -3.667 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.841 -14.363 -2.997 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.397 -13.211 -5.517 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.713 -14.435 -5.184 1.00 0.00 H new ATOM 616 N SER A 41 0.798 -8.046 -1.837 1.00 0.00 N ATOM 617 CA SER A 41 1.383 -6.913 -2.545 1.00 0.00 C ATOM 618 C SER A 41 1.500 -5.700 -1.627 1.00 0.00 C ATOM 619 O SER A 41 1.665 -4.571 -2.090 1.00 0.00 O ATOM 620 CB SER A 41 0.538 -6.559 -3.771 1.00 0.00 C ATOM 621 OG SER A 41 0.502 -7.635 -4.693 1.00 0.00 O ATOM 0 H SER A 41 -0.152 -7.889 -1.501 1.00 0.00 H new ATOM 0 HA SER A 41 2.383 -7.198 -2.871 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.476 -6.310 -3.458 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.949 -5.674 -4.256 1.00 0.00 H new ATOM 0 HG SER A 41 0.276 -8.463 -4.220 1.00 0.00 H new ATOM 627 N SER A 42 1.413 -5.942 -0.323 1.00 0.00 N ATOM 628 CA SER A 42 1.505 -4.871 0.661 1.00 0.00 C ATOM 629 C SER A 42 2.914 -4.289 0.700 1.00 0.00 C ATOM 630 O SER A 42 3.093 -3.073 0.769 1.00 0.00 O ATOM 631 CB SER A 42 1.116 -5.388 2.047 1.00 0.00 C ATOM 632 OG SER A 42 2.042 -6.356 2.509 1.00 0.00 O ATOM 0 H SER A 42 1.279 -6.871 0.076 1.00 0.00 H new ATOM 0 HA SER A 42 0.813 -4.082 0.368 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.074 -4.556 2.750 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.118 -5.824 2.009 1.00 0.00 H new ATOM 0 HG SER A 42 1.772 -6.669 3.397 1.00 0.00 H new ATOM 638 N GLU A 43 3.912 -5.166 0.656 1.00 0.00 N ATOM 639 CA GLU A 43 5.306 -4.740 0.687 1.00 0.00 C ATOM 640 C GLU A 43 5.515 -3.499 -0.176 1.00 0.00 C ATOM 641 O GLU A 43 5.960 -2.460 0.309 1.00 0.00 O ATOM 642 CB GLU A 43 6.219 -5.869 0.206 1.00 0.00 C ATOM 643 CG GLU A 43 6.008 -7.180 0.946 1.00 0.00 C ATOM 644 CD GLU A 43 6.981 -8.258 0.511 1.00 0.00 C ATOM 645 OE1 GLU A 43 8.038 -7.910 -0.055 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.685 -9.450 0.736 1.00 0.00 O ATOM 0 H GLU A 43 3.781 -6.176 0.599 1.00 0.00 H new ATOM 0 HA GLU A 43 5.560 -4.492 1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.052 -6.032 -0.859 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.258 -5.559 0.322 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.115 -7.010 2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.988 -7.527 0.779 1.00 0.00 H new ATOM 653 N ASN A 44 5.190 -3.617 -1.460 1.00 0.00 N ATOM 654 CA ASN A 44 5.343 -2.507 -2.392 1.00 0.00 C ATOM 655 C ASN A 44 5.028 -1.178 -1.711 1.00 0.00 C ATOM 656 O ASN A 44 5.870 -0.280 -1.660 1.00 0.00 O ATOM 657 CB ASN A 44 4.429 -2.701 -3.603 1.00 0.00 C ATOM 658 CG ASN A 44 4.817 -3.910 -4.433 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.698 -4.681 -4.051 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.161 -4.079 -5.574 1.00 0.00 N ATOM 0 H ASN A 44 4.819 -4.470 -1.878 1.00 0.00 H new ATOM 0 HA ASN A 44 6.380 -2.487 -2.727 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.399 -2.812 -3.263 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.464 -1.808 -4.228 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.379 -4.874 -6.175 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.438 -3.414 -5.850 1.00 0.00 H new ATOM 667 N LEU A 45 3.812 -1.060 -1.190 1.00 0.00 N ATOM 668 CA LEU A 45 3.386 0.159 -0.511 1.00 0.00 C ATOM 669 C LEU A 45 4.120 0.329 0.815 1.00 0.00 C ATOM 670 O LEU A 45 4.778 1.344 1.045 1.00 0.00 O ATOM 671 CB LEU A 45 1.875 0.130 -0.270 1.00 0.00 C ATOM 672 CG LEU A 45 1.316 1.242 0.617 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.469 2.594 -0.061 1.00 0.00 C ATOM 674 CD2 LEU A 45 -0.144 0.974 0.952 1.00 0.00 C ATOM 0 H LEU A 45 3.104 -1.793 -1.225 1.00 0.00 H new ATOM 0 HA LEU A 45 3.630 1.007 -1.151 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.372 0.176 -1.236 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.617 -0.829 0.178 1.00 0.00 H new ATOM 0 HG LEU A 45 1.885 1.259 1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.065 3.373 0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.525 2.789 -0.249 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.927 2.590 -1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.525 1.776 1.584 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.726 0.929 0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.228 0.024 1.481 1.00 0.00 H new ATOM 686 N ARG A 46 4.006 -0.671 1.682 1.00 0.00 N ATOM 687 CA ARG A 46 4.660 -0.632 2.984 1.00 0.00 C ATOM 688 C ARG A 46 6.027 0.039 2.886 1.00 0.00 C ATOM 689 O ARG A 46 6.382 0.873 3.719 1.00 0.00 O ATOM 690 CB ARG A 46 4.814 -2.047 3.544 1.00 0.00 C ATOM 691 CG ARG A 46 3.602 -2.528 4.325 1.00 0.00 C ATOM 692 CD ARG A 46 3.905 -3.806 5.092 1.00 0.00 C ATOM 693 NE ARG A 46 4.452 -3.531 6.418 1.00 0.00 N ATOM 694 CZ ARG A 46 3.733 -3.042 7.423 1.00 0.00 C ATOM 695 NH1 ARG A 46 2.445 -2.776 7.254 1.00 0.00 N ATOM 696 NH2 ARG A 46 4.303 -2.819 8.601 1.00 0.00 N ATOM 0 H ARG A 46 3.467 -1.519 1.506 1.00 0.00 H new ATOM 0 HA ARG A 46 4.035 -0.047 3.659 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.002 -2.736 2.721 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.690 -2.079 4.192 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.284 -1.751 5.021 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.772 -2.701 3.640 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.993 -4.394 5.191 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.614 -4.410 4.525 1.00 0.00 H new ATOM 0 HE ARG A 46 5.440 -3.725 6.582 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.003 -2.947 6.351 1.00 0.00 H new ATOM 0 HH12 ARG A 46 1.896 -2.401 8.027 1.00 0.00 H new ATOM 0 HH21 ARG A 46 5.293 -3.023 8.735 1.00 0.00 H new ATOM 0 HH22 ARG A 46 3.751 -2.444 9.372 1.00 0.00 H new ATOM 710 N PHE A 47 6.790 -0.331 1.863 1.00 0.00 N ATOM 711 CA PHE A 47 8.118 0.234 1.656 1.00 0.00 C ATOM 712 C PHE A 47 8.033 1.724 1.340 1.00 0.00 C ATOM 713 O PHE A 47 8.628 2.551 2.030 1.00 0.00 O ATOM 714 CB PHE A 47 8.837 -0.500 0.522 1.00 0.00 C ATOM 715 CG PHE A 47 9.963 0.288 -0.083 1.00 0.00 C ATOM 716 CD1 PHE A 47 10.960 0.823 0.718 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.027 0.494 -1.451 1.00 0.00 C ATOM 718 CE1 PHE A 47 11.998 1.549 0.165 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.062 1.219 -2.010 1.00 0.00 C ATOM 720 CZ PHE A 47 12.050 1.746 -1.201 1.00 0.00 C ATOM 0 H PHE A 47 6.511 -1.020 1.164 1.00 0.00 H new ATOM 0 HA PHE A 47 8.686 0.109 2.578 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.228 -1.444 0.901 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.115 -0.744 -0.257 1.00 0.00 H new ATOM 0 HD1 PHE A 47 10.925 0.671 1.787 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.258 0.083 -2.089 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.768 1.962 0.800 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.098 1.373 -3.078 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.861 2.311 -1.636 1.00 0.00 H new ATOM 730 N TRP A 48 7.288 2.058 0.292 1.00 0.00 N ATOM 731 CA TRP A 48 7.125 3.448 -0.117 1.00 0.00 C ATOM 732 C TRP A 48 6.893 4.348 1.092 1.00 0.00 C ATOM 733 O TRP A 48 7.610 5.329 1.295 1.00 0.00 O ATOM 734 CB TRP A 48 5.958 3.579 -1.097 1.00 0.00 C ATOM 735 CG TRP A 48 5.965 4.870 -1.860 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.835 5.233 -2.848 1.00 0.00 C ATOM 737 CD2 TRP A 48 5.060 5.967 -1.696 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.526 6.490 -3.308 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.441 6.962 -2.618 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.965 6.206 -0.861 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.765 8.174 -2.725 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.296 7.410 -0.969 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.696 8.381 -1.896 1.00 0.00 C ATOM 0 H TRP A 48 6.788 1.386 -0.289 1.00 0.00 H new ATOM 0 HA TRP A 48 8.043 3.765 -0.611 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.990 2.748 -1.802 1.00 0.00 H new ATOM 0 HB3 TRP A 48 5.020 3.495 -0.548 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.647 4.622 -3.214 1.00 0.00 H new ATOM 0 HE1 TRP A 48 7.024 6.991 -4.044 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.648 5.463 -0.144 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 5.073 8.925 -3.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.450 7.606 -0.327 1.00 0.00 H new ATOM 0 HH2 TRP A 48 3.150 9.311 -1.958 1.00 0.00 H new ATOM 754 N LEU A 49 5.888 4.009 1.892 1.00 0.00 N ATOM 755 CA LEU A 49 5.562 4.786 3.082 1.00 0.00 C ATOM 756 C LEU A 49 6.786 4.950 3.978 1.00 0.00 C ATOM 757 O LEU A 49 7.079 6.048 4.450 1.00 0.00 O ATOM 758 CB LEU A 49 4.432 4.112 3.862 1.00 0.00 C ATOM 759 CG LEU A 49 3.077 4.044 3.157 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.164 3.045 3.849 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.429 5.421 3.113 1.00 0.00 C ATOM 0 H LEU A 49 5.285 3.201 1.738 1.00 0.00 H new ATOM 0 HA LEU A 49 5.234 5.775 2.761 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.743 3.096 4.108 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.302 4.642 4.805 1.00 0.00 H new ATOM 0 HG LEU A 49 3.239 3.707 2.133 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.205 3.011 3.333 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.623 2.057 3.827 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.009 3.350 4.884 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.466 5.354 2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.281 5.786 4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.076 6.110 2.570 1.00 0.00 H new ATOM 773 N ALA A 50 7.498 3.851 4.205 1.00 0.00 N ATOM 774 CA ALA A 50 8.692 3.874 5.040 1.00 0.00 C ATOM 775 C ALA A 50 9.616 5.022 4.646 1.00 0.00 C ATOM 776 O ALA A 50 10.128 5.742 5.503 1.00 0.00 O ATOM 777 CB ALA A 50 9.428 2.546 4.945 1.00 0.00 C ATOM 0 H ALA A 50 7.268 2.934 3.822 1.00 0.00 H new ATOM 0 HA ALA A 50 8.380 4.031 6.072 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.318 2.577 5.574 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.773 1.742 5.282 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.721 2.365 3.911 1.00 0.00 H new ATOM 783 N VAL A 51 9.825 5.186 3.343 1.00 0.00 N ATOM 784 CA VAL A 51 10.687 6.247 2.836 1.00 0.00 C ATOM 785 C VAL A 51 10.110 7.622 3.152 1.00 0.00 C ATOM 786 O VAL A 51 10.802 8.487 3.689 1.00 0.00 O ATOM 787 CB VAL A 51 10.889 6.125 1.314 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.744 7.271 0.795 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.514 4.783 0.965 1.00 0.00 C ATOM 0 H VAL A 51 9.409 4.598 2.620 1.00 0.00 H new ATOM 0 HA VAL A 51 11.651 6.138 3.334 1.00 0.00 H new ATOM 0 HB VAL A 51 9.914 6.183 0.830 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.876 7.168 -0.282 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.252 8.219 1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.718 7.248 1.284 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.649 4.714 -0.114 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.482 4.693 1.459 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.859 3.979 1.300 1.00 0.00 H new ATOM 799 N GLU A 52 8.839 7.817 2.817 1.00 0.00 N ATOM 800 CA GLU A 52 8.170 9.088 3.065 1.00 0.00 C ATOM 801 C GLU A 52 8.493 9.609 4.463 1.00 0.00 C ATOM 802 O GLU A 52 8.710 10.805 4.656 1.00 0.00 O ATOM 803 CB GLU A 52 6.656 8.933 2.904 1.00 0.00 C ATOM 804 CG GLU A 52 6.212 8.759 1.462 1.00 0.00 C ATOM 805 CD GLU A 52 6.080 10.079 0.728 1.00 0.00 C ATOM 806 OE1 GLU A 52 4.980 10.671 0.764 1.00 0.00 O ATOM 807 OE2 GLU A 52 7.076 10.521 0.119 1.00 0.00 O ATOM 0 H GLU A 52 8.252 7.111 2.373 1.00 0.00 H new ATOM 0 HA GLU A 52 8.534 9.810 2.334 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.324 8.072 3.484 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.163 9.810 3.324 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.930 8.127 0.939 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.254 8.239 1.441 1.00 0.00 H new ATOM 814 N ASP A 53 8.522 8.702 5.433 1.00 0.00 N ATOM 815 CA ASP A 53 8.819 9.069 6.813 1.00 0.00 C ATOM 816 C ASP A 53 10.325 9.178 7.034 1.00 0.00 C ATOM 817 O ASP A 53 10.796 10.072 7.739 1.00 0.00 O ATOM 818 CB ASP A 53 8.223 8.041 7.776 1.00 0.00 C ATOM 819 CG ASP A 53 8.931 8.024 9.116 1.00 0.00 C ATOM 820 OD1 ASP A 53 9.909 7.260 9.262 1.00 0.00 O ATOM 821 OD2 ASP A 53 8.509 8.775 10.019 1.00 0.00 O ATOM 0 H ASP A 53 8.344 7.708 5.290 1.00 0.00 H new ATOM 0 HA ASP A 53 8.369 10.042 7.009 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.167 8.261 7.929 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.280 7.050 7.326 1.00 0.00 H new ATOM 826 N LEU A 54 11.074 8.263 6.430 1.00 0.00 N ATOM 827 CA LEU A 54 12.527 8.255 6.561 1.00 0.00 C ATOM 828 C LEU A 54 13.078 9.677 6.602 1.00 0.00 C ATOM 829 O LEU A 54 13.630 10.112 7.613 1.00 0.00 O ATOM 830 CB LEU A 54 13.160 7.484 5.401 1.00 0.00 C ATOM 831 CG LEU A 54 14.682 7.571 5.289 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.343 6.983 6.526 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.166 6.859 4.034 1.00 0.00 C ATOM 0 H LEU A 54 10.700 7.517 5.844 1.00 0.00 H new ATOM 0 HA LEU A 54 12.779 7.760 7.499 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.882 6.434 5.494 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.726 7.847 4.470 1.00 0.00 H new ATOM 0 HG LEU A 54 14.962 8.622 5.217 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.426 7.054 6.428 1.00 0.00 H new ATOM 0 HD12 LEU A 54 15.021 7.537 7.408 1.00 0.00 H new ATOM 0 HD13 LEU A 54 15.056 5.937 6.629 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.252 6.931 3.971 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.874 5.810 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.720 7.326 3.156 1.00 0.00 H new ATOM 845 N LYS A 55 12.922 10.399 5.498 1.00 0.00 N ATOM 846 CA LYS A 55 13.400 11.773 5.407 1.00 0.00 C ATOM 847 C LYS A 55 12.894 12.603 6.583 1.00 0.00 C ATOM 848 O LYS A 55 13.626 13.423 7.138 1.00 0.00 O ATOM 849 CB LYS A 55 12.947 12.407 4.090 1.00 0.00 C ATOM 850 CG LYS A 55 11.438 12.440 3.918 1.00 0.00 C ATOM 851 CD LYS A 55 11.047 12.660 2.466 1.00 0.00 C ATOM 852 CE LYS A 55 11.089 11.361 1.675 1.00 0.00 C ATOM 853 NZ LYS A 55 11.276 11.605 0.218 1.00 0.00 N ATOM 0 H LYS A 55 12.467 10.055 4.652 1.00 0.00 H new ATOM 0 HA LYS A 55 14.489 11.755 5.438 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.333 13.425 4.035 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.387 11.854 3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.010 11.503 4.273 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.018 13.236 4.533 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.044 13.084 2.418 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.722 13.386 2.012 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.901 10.736 2.046 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.163 10.808 1.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.299 10.696 -0.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.488 12.180 -0.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.172 12.110 0.063 1.00 0.00 H new ATOM 867 N LYS A 56 11.639 12.385 6.959 1.00 0.00 N ATOM 868 CA LYS A 56 11.035 13.110 8.071 1.00 0.00 C ATOM 869 C LYS A 56 11.782 12.832 9.371 1.00 0.00 C ATOM 870 O LYS A 56 11.976 13.730 10.191 1.00 0.00 O ATOM 871 CB LYS A 56 9.563 12.721 8.222 1.00 0.00 C ATOM 872 CG LYS A 56 8.740 12.955 6.967 1.00 0.00 C ATOM 873 CD LYS A 56 8.527 14.436 6.708 1.00 0.00 C ATOM 874 CE LYS A 56 8.013 14.688 5.299 1.00 0.00 C ATOM 875 NZ LYS A 56 7.541 16.090 5.122 1.00 0.00 N ATOM 0 H LYS A 56 11.019 11.711 6.510 1.00 0.00 H new ATOM 0 HA LYS A 56 11.101 14.176 7.855 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.501 11.668 8.496 1.00 0.00 H new ATOM 0 HB3 LYS A 56 9.128 13.291 9.043 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.243 12.504 6.112 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.774 12.460 7.067 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.816 14.834 7.432 1.00 0.00 H new ATOM 0 HD3 LYS A 56 9.465 14.971 6.855 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.806 14.478 4.581 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.196 14.000 5.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.199 16.221 4.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.767 16.283 5.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.327 16.746 5.304 1.00 0.00 H new ATOM 889 N ARG A 57 12.199 11.583 9.553 1.00 0.00 N ATOM 890 CA ARG A 57 12.925 11.187 10.754 1.00 0.00 C ATOM 891 C ARG A 57 14.129 12.096 10.986 1.00 0.00 C ATOM 892 O ARG A 57 14.746 12.602 10.048 1.00 0.00 O ATOM 893 CB ARG A 57 13.384 9.733 10.642 1.00 0.00 C ATOM 894 CG ARG A 57 12.246 8.728 10.710 1.00 0.00 C ATOM 895 CD ARG A 57 11.771 8.521 12.140 1.00 0.00 C ATOM 896 NE ARG A 57 11.007 7.285 12.290 1.00 0.00 N ATOM 897 CZ ARG A 57 10.433 6.909 13.427 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.537 7.669 14.509 1.00 0.00 N ATOM 899 NH2 ARG A 57 9.754 5.771 13.484 1.00 0.00 N ATOM 0 H ARG A 57 12.047 10.828 8.884 1.00 0.00 H new ATOM 0 HA ARG A 57 12.250 11.283 11.604 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.918 9.601 9.701 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.092 9.522 11.443 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.415 9.075 10.096 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.574 7.776 10.293 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.632 8.498 12.808 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.154 9.367 12.443 1.00 0.00 H new ATOM 0 HE ARG A 57 10.909 6.677 11.477 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.059 8.545 14.469 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.095 7.378 15.381 1.00 0.00 H new ATOM 0 HH21 ARG A 57 9.672 5.184 12.654 1.00 0.00 H new ATOM 0 HH22 ARG A 57 9.314 5.483 14.358 1.00 0.00 H new ATOM 913 N PRO A 58 14.473 12.308 12.265 1.00 0.00 N ATOM 914 CA PRO A 58 15.605 13.156 12.650 1.00 0.00 C ATOM 915 C PRO A 58 16.947 12.528 12.292 1.00 0.00 C ATOM 916 O PRO A 58 17.042 11.318 12.087 1.00 0.00 O ATOM 917 CB PRO A 58 15.458 13.275 14.169 1.00 0.00 C ATOM 918 CG PRO A 58 14.710 12.052 14.574 1.00 0.00 C ATOM 919 CD PRO A 58 13.782 11.737 13.433 1.00 0.00 C ATOM 0 HA PRO A 58 15.592 14.114 12.131 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.431 13.324 14.658 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.916 14.180 14.445 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.391 11.223 14.763 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.152 12.223 15.495 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.629 10.663 13.324 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.800 12.186 13.578 1.00 0.00 H new ATOM 927 N ILE A 59 17.983 13.358 12.218 1.00 0.00 N ATOM 928 CA ILE A 59 19.320 12.883 11.886 1.00 0.00 C ATOM 929 C ILE A 59 19.721 11.707 12.770 1.00 0.00 C ATOM 930 O ILE A 59 20.459 10.818 12.344 1.00 0.00 O ATOM 931 CB ILE A 59 20.368 14.001 12.033 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.750 13.494 11.616 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.396 14.515 13.465 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.921 13.370 10.118 1.00 0.00 C ATOM 0 H ILE A 59 17.921 14.363 12.384 1.00 0.00 H new ATOM 0 HA ILE A 59 19.290 12.559 10.846 1.00 0.00 H new ATOM 0 HB ILE A 59 20.092 14.826 11.376 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.510 14.172 12.005 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.925 12.521 12.075 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.142 15.305 13.553 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.415 14.911 13.729 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.651 13.698 14.140 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.924 13.006 9.895 1.00 0.00 H new ATOM 0 HD12 ILE A 59 21.185 12.669 9.724 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.778 14.346 9.653 1.00 0.00 H new ATOM 946 N LYS A 60 19.227 11.706 14.004 1.00 0.00 N ATOM 947 CA LYS A 60 19.530 10.638 14.949 1.00 0.00 C ATOM 948 C LYS A 60 18.898 9.322 14.504 1.00 0.00 C ATOM 949 O LYS A 60 19.425 8.246 14.783 1.00 0.00 O ATOM 950 CB LYS A 60 19.030 11.009 16.347 1.00 0.00 C ATOM 951 CG LYS A 60 17.516 11.058 16.458 1.00 0.00 C ATOM 952 CD LYS A 60 17.074 11.663 17.780 1.00 0.00 C ATOM 953 CE LYS A 60 17.112 13.183 17.738 1.00 0.00 C ATOM 954 NZ LYS A 60 16.235 13.789 18.778 1.00 0.00 N ATOM 0 H LYS A 60 18.615 12.434 14.373 1.00 0.00 H new ATOM 0 HA LYS A 60 20.612 10.509 14.979 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.415 10.286 17.065 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.438 11.981 16.624 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.108 11.644 15.634 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.110 10.051 16.364 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.063 11.330 18.014 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.721 11.304 18.580 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.137 13.525 17.883 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.798 13.527 16.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 16.289 14.826 18.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.253 13.484 18.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.550 13.481 19.720 1.00 0.00 H new ATOM 968 N GLU A 61 17.768 9.418 13.811 1.00 0.00 N ATOM 969 CA GLU A 61 17.066 8.235 13.328 1.00 0.00 C ATOM 970 C GLU A 61 17.049 8.197 11.803 1.00 0.00 C ATOM 971 O GLU A 61 16.345 7.389 11.198 1.00 0.00 O ATOM 972 CB GLU A 61 15.633 8.210 13.865 1.00 0.00 C ATOM 973 CG GLU A 61 15.537 7.794 15.324 1.00 0.00 C ATOM 974 CD GLU A 61 15.654 6.294 15.512 1.00 0.00 C ATOM 975 OE1 GLU A 61 14.794 5.562 14.981 1.00 0.00 O ATOM 976 OE2 GLU A 61 16.606 5.853 16.190 1.00 0.00 O ATOM 0 H GLU A 61 17.319 10.302 13.572 1.00 0.00 H new ATOM 0 HA GLU A 61 17.598 7.355 13.691 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.193 9.200 13.749 1.00 0.00 H new ATOM 0 HB3 GLU A 61 15.039 7.524 13.261 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.324 8.290 15.892 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.586 8.135 15.733 1.00 0.00 H new ATOM 983 N VAL A 62 17.831 9.078 11.186 1.00 0.00 N ATOM 984 CA VAL A 62 17.908 9.145 9.732 1.00 0.00 C ATOM 985 C VAL A 62 18.666 7.950 9.165 1.00 0.00 C ATOM 986 O VAL A 62 18.148 7.182 8.354 1.00 0.00 O ATOM 987 CB VAL A 62 18.595 10.443 9.266 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.359 10.208 7.972 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.571 11.555 9.095 1.00 0.00 C ATOM 0 H VAL A 62 18.420 9.755 11.671 1.00 0.00 H new ATOM 0 HA VAL A 62 16.884 9.130 9.360 1.00 0.00 H new ATOM 0 HB VAL A 62 19.308 10.751 10.030 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.837 11.136 7.658 1.00 0.00 H new ATOM 0 HG12 VAL A 62 20.119 9.444 8.132 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.668 9.876 7.197 1.00 0.00 H new ATOM 0 HG21 VAL A 62 18.073 12.465 8.766 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.832 11.258 8.350 1.00 0.00 H new ATOM 0 HG23 VAL A 62 17.073 11.740 10.047 1.00 0.00 H new ATOM 999 N PRO A 63 19.924 7.787 9.601 1.00 0.00 N ATOM 1000 CA PRO A 63 20.781 6.686 9.151 1.00 0.00 C ATOM 1001 C PRO A 63 20.317 5.335 9.684 1.00 0.00 C ATOM 1002 O PRO A 63 20.146 4.382 8.924 1.00 0.00 O ATOM 1003 CB PRO A 63 22.153 7.046 9.727 1.00 0.00 C ATOM 1004 CG PRO A 63 21.854 7.899 10.912 1.00 0.00 C ATOM 1005 CD PRO A 63 20.606 8.664 10.567 1.00 0.00 C ATOM 0 HA PRO A 63 20.773 6.581 8.066 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.709 6.153 10.012 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.761 7.581 8.997 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.705 7.290 11.804 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.681 8.577 11.124 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.990 8.847 11.448 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.838 9.636 10.133 1.00 0.00 H new ATOM 1013 N SER A 64 20.114 5.259 10.995 1.00 0.00 N ATOM 1014 CA SER A 64 19.673 4.023 11.631 1.00 0.00 C ATOM 1015 C SER A 64 18.536 3.382 10.840 1.00 0.00 C ATOM 1016 O SER A 64 18.427 2.158 10.772 1.00 0.00 O ATOM 1017 CB SER A 64 19.220 4.297 13.066 1.00 0.00 C ATOM 1018 OG SER A 64 20.331 4.493 13.923 1.00 0.00 O ATOM 0 H SER A 64 20.248 6.039 11.638 1.00 0.00 H new ATOM 0 HA SER A 64 20.515 3.331 11.649 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.581 5.180 13.087 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.621 3.461 13.427 1.00 0.00 H new ATOM 0 HG SER A 64 20.015 4.668 14.834 1.00 0.00 H new ATOM 1024 N ARG A 65 17.693 4.218 10.244 1.00 0.00 N ATOM 1025 CA ARG A 65 16.564 3.734 9.459 1.00 0.00 C ATOM 1026 C ARG A 65 17.011 3.327 8.058 1.00 0.00 C ATOM 1027 O ARG A 65 16.558 2.316 7.520 1.00 0.00 O ATOM 1028 CB ARG A 65 15.480 4.810 9.368 1.00 0.00 C ATOM 1029 CG ARG A 65 14.073 4.249 9.252 1.00 0.00 C ATOM 1030 CD ARG A 65 13.583 3.693 10.580 1.00 0.00 C ATOM 1031 NE ARG A 65 12.132 3.794 10.714 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.423 3.080 11.580 1.00 0.00 C ATOM 1033 NH1 ARG A 65 12.027 2.218 12.386 1.00 0.00 N ATOM 1034 NH2 ARG A 65 10.105 3.228 11.643 1.00 0.00 N ATOM 0 H ARG A 65 17.770 5.234 10.290 1.00 0.00 H new ATOM 0 HA ARG A 65 16.154 2.857 9.960 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.537 5.446 10.251 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.681 5.444 8.505 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.395 5.032 8.912 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.055 3.462 8.498 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.883 2.649 10.669 1.00 0.00 H new ATOM 0 HD3 ARG A 65 14.061 4.233 11.397 1.00 0.00 H new ATOM 0 HE ARG A 65 11.636 4.449 10.109 1.00 0.00 H new ATOM 0 HH11 ARG A 65 13.039 2.102 12.342 1.00 0.00 H new ATOM 0 HH12 ARG A 65 11.479 1.671 13.050 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.636 3.891 11.026 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.561 2.679 12.309 1.00 0.00 H new ATOM 1048 N VAL A 66 17.901 4.121 7.472 1.00 0.00 N ATOM 1049 CA VAL A 66 18.410 3.843 6.134 1.00 0.00 C ATOM 1050 C VAL A 66 18.572 2.345 5.908 1.00 0.00 C ATOM 1051 O VAL A 66 17.855 1.747 5.106 1.00 0.00 O ATOM 1052 CB VAL A 66 19.763 4.538 5.893 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.441 3.971 4.655 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.575 6.042 5.767 1.00 0.00 C ATOM 0 H VAL A 66 18.285 4.962 7.903 1.00 0.00 H new ATOM 0 HA VAL A 66 17.678 4.236 5.429 1.00 0.00 H new ATOM 0 HB VAL A 66 20.408 4.347 6.751 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.396 4.474 4.500 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.611 2.903 4.790 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.803 4.129 3.786 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.541 6.517 5.597 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.913 6.257 4.928 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.136 6.432 6.685 1.00 0.00 H new ATOM 1064 N GLN A 67 19.519 1.743 6.622 1.00 0.00 N ATOM 1065 CA GLN A 67 19.775 0.313 6.499 1.00 0.00 C ATOM 1066 C GLN A 67 18.515 -0.493 6.792 1.00 0.00 C ATOM 1067 O GLN A 67 18.164 -1.407 6.046 1.00 0.00 O ATOM 1068 CB GLN A 67 20.898 -0.109 7.448 1.00 0.00 C ATOM 1069 CG GLN A 67 20.464 -0.192 8.903 1.00 0.00 C ATOM 1070 CD GLN A 67 21.636 -0.337 9.854 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.484 -1.213 9.683 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.690 0.524 10.864 1.00 0.00 N ATOM 0 H GLN A 67 20.121 2.223 7.291 1.00 0.00 H new ATOM 0 HA GLN A 67 20.082 0.111 5.473 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.281 -1.080 7.135 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.721 0.601 7.363 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.900 0.704 9.162 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.791 -1.040 9.030 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.966 1.234 10.968 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.456 0.475 11.536 1.00 0.00 H new ATOM 1081 N GLU A 68 17.838 -0.148 7.883 1.00 0.00 N ATOM 1082 CA GLU A 68 16.617 -0.842 8.275 1.00 0.00 C ATOM 1083 C GLU A 68 15.659 -0.967 7.093 1.00 0.00 C ATOM 1084 O GLU A 68 15.419 -2.065 6.589 1.00 0.00 O ATOM 1085 CB GLU A 68 15.930 -0.103 9.425 1.00 0.00 C ATOM 1086 CG GLU A 68 16.558 -0.373 10.783 1.00 0.00 C ATOM 1087 CD GLU A 68 16.453 -1.829 11.194 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.372 -2.423 10.999 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.451 -2.373 11.712 1.00 0.00 O ATOM 0 H GLU A 68 18.114 0.607 8.510 1.00 0.00 H new ATOM 0 HA GLU A 68 16.890 -1.843 8.608 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.960 0.968 9.227 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.880 -0.392 9.456 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.608 -0.081 10.758 1.00 0.00 H new ATOM 0 HG3 GLU A 68 16.072 0.249 11.534 1.00 0.00 H new ATOM 1096 N ILE A 69 15.116 0.164 6.657 1.00 0.00 N ATOM 1097 CA ILE A 69 14.185 0.182 5.536 1.00 0.00 C ATOM 1098 C ILE A 69 14.668 -0.723 4.407 1.00 0.00 C ATOM 1099 O ILE A 69 13.872 -1.406 3.763 1.00 0.00 O ATOM 1100 CB ILE A 69 13.991 1.608 4.988 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.413 2.520 6.072 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.084 1.587 3.766 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.843 3.964 5.939 1.00 0.00 C ATOM 0 H ILE A 69 15.305 1.080 7.063 1.00 0.00 H new ATOM 0 HA ILE A 69 13.231 -0.187 5.912 1.00 0.00 H new ATOM 0 HB ILE A 69 14.962 2.002 4.688 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.325 2.469 6.036 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.718 2.147 7.050 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.956 2.602 3.390 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.533 0.967 2.990 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.112 1.177 4.041 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.396 4.552 6.740 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.929 4.028 6.005 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.514 4.354 4.976 1.00 0.00 H new ATOM 1115 N TRP A 70 15.975 -0.723 4.175 1.00 0.00 N ATOM 1116 CA TRP A 70 16.565 -1.546 3.125 1.00 0.00 C ATOM 1117 C TRP A 70 16.618 -3.010 3.546 1.00 0.00 C ATOM 1118 O TRP A 70 16.522 -3.909 2.711 1.00 0.00 O ATOM 1119 CB TRP A 70 17.971 -1.048 2.787 1.00 0.00 C ATOM 1120 CG TRP A 70 18.949 -2.156 2.538 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.520 -2.971 3.474 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.473 -2.568 1.271 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.367 -3.865 2.864 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.355 -3.639 1.513 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.281 -2.138 -0.045 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.043 -4.283 0.488 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 19.965 -2.778 -1.061 1.00 0.00 C ATOM 1128 CH2 TRP A 70 20.837 -3.842 -0.790 1.00 0.00 C ATOM 0 H TRP A 70 16.647 -0.163 4.699 1.00 0.00 H new ATOM 0 HA TRP A 70 15.936 -1.465 2.238 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.921 -0.412 1.903 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.336 -0.428 3.606 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.333 -2.920 4.537 1.00 0.00 H new ATOM 0 HE1 TRP A 70 20.916 -4.581 3.340 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.610 -1.320 -0.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.716 -5.102 0.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.825 -2.453 -2.081 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.356 -4.323 -1.606 1.00 0.00 H new ATOM 1139 N GLN A 71 16.772 -3.243 4.846 1.00 0.00 N ATOM 1140 CA GLN A 71 16.839 -4.599 5.376 1.00 0.00 C ATOM 1141 C GLN A 71 15.441 -5.181 5.560 1.00 0.00 C ATOM 1142 O GLN A 71 15.287 -6.337 5.952 1.00 0.00 O ATOM 1143 CB GLN A 71 17.589 -4.612 6.710 1.00 0.00 C ATOM 1144 CG GLN A 71 19.078 -4.336 6.573 1.00 0.00 C ATOM 1145 CD GLN A 71 19.875 -4.839 7.760 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.828 -4.259 8.845 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.615 -5.924 7.560 1.00 0.00 N ATOM 0 H GLN A 71 16.853 -2.510 5.551 1.00 0.00 H new ATOM 0 HA GLN A 71 17.379 -5.216 4.658 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.149 -3.866 7.372 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.450 -5.583 7.186 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.449 -4.809 5.664 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.236 -3.263 6.462 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.624 -6.373 6.644 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.174 -6.308 8.322 1.00 0.00 H new ATOM 1156 N GLU A 72 14.426 -4.372 5.275 1.00 0.00 N ATOM 1157 CA GLU A 72 13.041 -4.807 5.410 1.00 0.00 C ATOM 1158 C GLU A 72 12.491 -5.295 4.073 1.00 0.00 C ATOM 1159 O GLU A 72 11.966 -6.404 3.972 1.00 0.00 O ATOM 1160 CB GLU A 72 12.174 -3.666 5.945 1.00 0.00 C ATOM 1161 CG GLU A 72 10.702 -4.023 6.064 1.00 0.00 C ATOM 1162 CD GLU A 72 9.995 -3.231 7.145 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.682 -2.725 8.057 1.00 0.00 O ATOM 1164 OE2 GLU A 72 8.753 -3.116 7.079 1.00 0.00 O ATOM 0 H GLU A 72 14.537 -3.412 4.949 1.00 0.00 H new ATOM 0 HA GLU A 72 13.015 -5.635 6.118 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.547 -3.367 6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.278 -2.803 5.287 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.210 -3.844 5.108 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.606 -5.088 6.278 1.00 0.00 H new ATOM 1171 N PHE A 73 12.615 -4.458 3.048 1.00 0.00 N ATOM 1172 CA PHE A 73 12.129 -4.803 1.717 1.00 0.00 C ATOM 1173 C PHE A 73 13.292 -4.995 0.747 1.00 0.00 C ATOM 1174 O PHE A 73 13.260 -5.879 -0.111 1.00 0.00 O ATOM 1175 CB PHE A 73 11.190 -3.713 1.196 1.00 0.00 C ATOM 1176 CG PHE A 73 10.312 -3.119 2.260 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.835 -2.245 3.200 1.00 0.00 C ATOM 1178 CD2 PHE A 73 8.964 -3.434 2.320 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.030 -1.698 4.181 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.154 -2.889 3.298 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.687 -2.019 4.229 1.00 0.00 C ATOM 0 H PHE A 73 13.048 -3.537 3.114 1.00 0.00 H new ATOM 0 HA PHE A 73 11.580 -5.742 1.789 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.784 -2.920 0.742 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.562 -4.131 0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.884 -1.989 3.165 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.542 -4.113 1.594 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.450 -1.020 4.909 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.105 -3.143 3.334 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.055 -1.590 4.993 1.00 0.00 H new ATOM 1191 N LEU A 74 14.316 -4.161 0.888 1.00 0.00 N ATOM 1192 CA LEU A 74 15.489 -4.237 0.024 1.00 0.00 C ATOM 1193 C LEU A 74 16.462 -5.301 0.521 1.00 0.00 C ATOM 1194 O LEU A 74 17.635 -5.307 0.147 1.00 0.00 O ATOM 1195 CB LEU A 74 16.189 -2.879 -0.039 1.00 0.00 C ATOM 1196 CG LEU A 74 15.309 -1.687 -0.418 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.143 -0.419 -0.522 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.580 -1.957 -1.726 1.00 0.00 C ATOM 0 H LEU A 74 14.358 -3.424 1.592 1.00 0.00 H new ATOM 0 HA LEU A 74 15.156 -4.514 -0.976 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.638 -2.679 0.934 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.005 -2.946 -0.759 1.00 0.00 H new ATOM 0 HG LEU A 74 14.566 -1.545 0.366 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.500 0.418 -0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.618 -0.216 0.438 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.909 -0.549 -1.286 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.959 -1.098 -1.980 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.308 -2.126 -2.520 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.951 -2.840 -1.616 1.00 0.00 H new ATOM 1210 N ALA A 75 15.967 -6.201 1.364 1.00 0.00 N ATOM 1211 CA ALA A 75 16.792 -7.273 1.909 1.00 0.00 C ATOM 1212 C ALA A 75 16.311 -8.636 1.424 1.00 0.00 C ATOM 1213 O ALA A 75 15.115 -8.873 1.250 1.00 0.00 O ATOM 1214 CB ALA A 75 16.790 -7.220 3.429 1.00 0.00 C ATOM 0 H ALA A 75 14.999 -6.209 1.685 1.00 0.00 H new ATOM 0 HA ALA A 75 17.812 -7.130 1.553 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.410 -8.026 3.822 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.189 -6.261 3.760 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.770 -7.335 3.796 1.00 0.00 H new ATOM 1220 N PRO A 76 17.262 -9.555 1.201 1.00 0.00 N ATOM 1221 CA PRO A 76 16.958 -10.911 0.733 1.00 0.00 C ATOM 1222 C PRO A 76 16.261 -11.750 1.799 1.00 0.00 C ATOM 1223 O PRO A 76 15.222 -12.357 1.544 1.00 0.00 O ATOM 1224 CB PRO A 76 18.337 -11.493 0.412 1.00 0.00 C ATOM 1225 CG PRO A 76 19.281 -10.727 1.274 1.00 0.00 C ATOM 1226 CD PRO A 76 18.707 -9.342 1.388 1.00 0.00 C ATOM 0 HA PRO A 76 16.274 -10.905 -0.116 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.377 -12.560 0.631 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.580 -11.375 -0.644 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.378 -11.191 2.255 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.278 -10.701 0.834 1.00 0.00 H new ATOM 0 HD2 PRO A 76 18.925 -8.895 2.358 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.116 -8.674 0.630 1.00 0.00 H new ATOM 1234 N GLY A 77 16.840 -11.778 2.996 1.00 0.00 N ATOM 1235 CA GLY A 77 16.260 -12.545 4.083 1.00 0.00 C ATOM 1236 C GLY A 77 15.317 -11.720 4.936 1.00 0.00 C ATOM 1237 O GLY A 77 15.292 -11.860 6.158 1.00 0.00 O ATOM 0 H GLY A 77 17.700 -11.283 3.232 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.721 -13.399 3.674 1.00 0.00 H new ATOM 0 HA3 GLY A 77 17.058 -12.942 4.710 1.00 0.00 H new ATOM 1241 N ALA A 78 14.541 -10.855 4.291 1.00 0.00 N ATOM 1242 CA ALA A 78 13.593 -10.004 4.998 1.00 0.00 C ATOM 1243 C ALA A 78 12.158 -10.453 4.746 1.00 0.00 C ATOM 1244 O ALA A 78 11.857 -11.126 3.760 1.00 0.00 O ATOM 1245 CB ALA A 78 13.774 -8.552 4.582 1.00 0.00 C ATOM 0 H ALA A 78 14.551 -10.725 3.279 1.00 0.00 H new ATOM 0 HA ALA A 78 13.791 -10.092 6.066 1.00 0.00 H new ATOM 0 HB1 ALA A 78 13.059 -7.928 5.118 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.788 -8.229 4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.605 -8.457 3.509 1.00 0.00 H new ATOM 1251 N PRO A 79 11.249 -10.075 5.657 1.00 0.00 N ATOM 1252 CA PRO A 79 9.830 -10.428 5.554 1.00 0.00 C ATOM 1253 C PRO A 79 9.132 -9.699 4.412 1.00 0.00 C ATOM 1254 O PRO A 79 8.435 -10.313 3.605 1.00 0.00 O ATOM 1255 CB PRO A 79 9.256 -9.985 6.902 1.00 0.00 C ATOM 1256 CG PRO A 79 10.171 -8.905 7.367 1.00 0.00 C ATOM 1257 CD PRO A 79 11.537 -9.272 6.857 1.00 0.00 C ATOM 0 HA PRO A 79 9.688 -11.488 5.342 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.234 -9.620 6.797 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.227 -10.812 7.611 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.858 -7.935 6.981 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.167 -8.832 8.455 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.127 -8.388 6.617 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.102 -9.841 7.595 1.00 0.00 H new ATOM 1265 N SER A 80 9.325 -8.385 4.349 1.00 0.00 N ATOM 1266 CA SER A 80 8.711 -7.571 3.306 1.00 0.00 C ATOM 1267 C SER A 80 9.649 -7.418 2.113 1.00 0.00 C ATOM 1268 O SER A 80 9.477 -6.524 1.285 1.00 0.00 O ATOM 1269 CB SER A 80 8.339 -6.193 3.858 1.00 0.00 C ATOM 1270 OG SER A 80 7.124 -6.246 4.584 1.00 0.00 O ATOM 0 H SER A 80 9.902 -7.862 5.008 1.00 0.00 H new ATOM 0 HA SER A 80 7.805 -8.077 2.971 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.137 -5.829 4.505 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.245 -5.482 3.037 1.00 0.00 H new ATOM 0 HG SER A 80 6.909 -5.354 4.928 1.00 0.00 H new ATOM 1276 N ALA A 81 10.643 -8.297 2.033 1.00 0.00 N ATOM 1277 CA ALA A 81 11.608 -8.262 0.942 1.00 0.00 C ATOM 1278 C ALA A 81 10.907 -8.126 -0.406 1.00 0.00 C ATOM 1279 O ALA A 81 10.249 -9.058 -0.870 1.00 0.00 O ATOM 1280 CB ALA A 81 12.476 -9.511 0.964 1.00 0.00 C ATOM 0 H ALA A 81 10.801 -9.042 2.711 1.00 0.00 H new ATOM 0 HA ALA A 81 12.245 -7.388 1.081 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.192 -9.471 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.012 -9.565 1.911 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.846 -10.394 0.853 1.00 0.00 H new ATOM 1286 N ILE A 82 11.053 -6.962 -1.028 1.00 0.00 N ATOM 1287 CA ILE A 82 10.434 -6.705 -2.323 1.00 0.00 C ATOM 1288 C ILE A 82 11.373 -7.079 -3.465 1.00 0.00 C ATOM 1289 O ILE A 82 12.476 -7.576 -3.238 1.00 0.00 O ATOM 1290 CB ILE A 82 10.028 -5.227 -2.470 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.260 -4.325 -2.378 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.008 -4.850 -1.407 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.135 -3.048 -3.179 1.00 0.00 C ATOM 0 H ILE A 82 11.594 -6.181 -0.657 1.00 0.00 H new ATOM 0 HA ILE A 82 9.539 -7.325 -2.373 1.00 0.00 H new ATOM 0 HB ILE A 82 9.571 -5.087 -3.450 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.438 -4.073 -1.333 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.132 -4.878 -2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.731 -3.802 -1.524 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.121 -5.474 -1.516 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.440 -5.003 -0.418 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.045 -2.458 -3.067 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.987 -3.291 -4.231 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.283 -2.473 -2.817 1.00 0.00 H new ATOM 1305 N ASN A 83 10.929 -6.835 -4.693 1.00 0.00 N ATOM 1306 CA ASN A 83 11.730 -7.144 -5.872 1.00 0.00 C ATOM 1307 C ASN A 83 11.881 -5.917 -6.765 1.00 0.00 C ATOM 1308 O ASN A 83 10.896 -5.381 -7.275 1.00 0.00 O ATOM 1309 CB ASN A 83 11.093 -8.289 -6.662 1.00 0.00 C ATOM 1310 CG ASN A 83 11.948 -8.729 -7.834 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.176 -8.660 -7.782 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.301 -9.185 -8.901 1.00 0.00 N ATOM 0 H ASN A 83 10.018 -6.424 -4.898 1.00 0.00 H new ATOM 0 HA ASN A 83 12.721 -7.450 -5.536 1.00 0.00 H new ATOM 0 HB2 ASN A 83 10.928 -9.137 -5.998 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.115 -7.975 -7.027 1.00 0.00 H new ATOM 0 HD21 ASN A 83 11.823 -9.495 -9.720 1.00 0.00 H new ATOM 0 HD22 ASN A 83 10.282 -9.225 -8.901 1.00 0.00 H new ATOM 1319 N LEU A 84 13.120 -5.476 -6.952 1.00 0.00 N ATOM 1320 CA LEU A 84 13.401 -4.312 -7.784 1.00 0.00 C ATOM 1321 C LEU A 84 14.176 -4.711 -9.036 1.00 0.00 C ATOM 1322 O LEU A 84 14.808 -5.767 -9.076 1.00 0.00 O ATOM 1323 CB LEU A 84 14.193 -3.271 -6.990 1.00 0.00 C ATOM 1324 CG LEU A 84 13.431 -2.556 -5.874 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.383 -1.730 -5.023 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.333 -1.678 -6.455 1.00 0.00 C ATOM 0 H LEU A 84 13.946 -5.907 -6.538 1.00 0.00 H new ATOM 0 HA LEU A 84 12.449 -3.878 -8.091 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.062 -3.762 -6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.567 -2.520 -7.686 1.00 0.00 H new ATOM 0 HG LEU A 84 12.967 -3.309 -5.237 1.00 0.00 H new ATOM 0 HD11 LEU A 84 13.823 -1.228 -4.234 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.133 -2.384 -4.577 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.876 -0.985 -5.648 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.801 -1.177 -5.646 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.775 -0.932 -7.115 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.635 -2.295 -7.021 1.00 0.00 H new ATOM 1338 N ASP A 85 14.125 -3.860 -10.054 1.00 0.00 N ATOM 1339 CA ASP A 85 14.825 -4.122 -11.306 1.00 0.00 C ATOM 1340 C ASP A 85 16.318 -4.323 -11.062 1.00 0.00 C ATOM 1341 O ASP A 85 16.794 -4.200 -9.934 1.00 0.00 O ATOM 1342 CB ASP A 85 14.607 -2.970 -12.288 1.00 0.00 C ATOM 1343 CG ASP A 85 14.918 -3.363 -13.719 1.00 0.00 C ATOM 1344 OD1 ASP A 85 16.092 -3.239 -14.125 1.00 0.00 O ATOM 1345 OD2 ASP A 85 13.988 -3.793 -14.433 1.00 0.00 O ATOM 0 H ASP A 85 13.606 -2.982 -10.037 1.00 0.00 H new ATOM 0 HA ASP A 85 14.419 -5.037 -11.736 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.573 -2.632 -12.224 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.236 -2.127 -12.001 1.00 0.00 H new ATOM 1350 N SER A 86 17.049 -4.634 -12.128 1.00 0.00 N ATOM 1351 CA SER A 86 18.487 -4.857 -12.029 1.00 0.00 C ATOM 1352 C SER A 86 19.234 -3.533 -11.892 1.00 0.00 C ATOM 1353 O SER A 86 20.214 -3.433 -11.153 1.00 0.00 O ATOM 1354 CB SER A 86 18.992 -5.616 -13.257 1.00 0.00 C ATOM 1355 OG SER A 86 18.763 -4.876 -14.444 1.00 0.00 O ATOM 0 H SER A 86 16.670 -4.737 -13.069 1.00 0.00 H new ATOM 0 HA SER A 86 18.677 -5.455 -11.138 1.00 0.00 H new ATOM 0 HB2 SER A 86 20.058 -5.818 -13.151 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.490 -6.581 -13.324 1.00 0.00 H new ATOM 0 HG SER A 86 19.096 -5.382 -15.214 1.00 0.00 H new ATOM 1361 N LYS A 87 18.764 -2.519 -12.610 1.00 0.00 N ATOM 1362 CA LYS A 87 19.384 -1.200 -12.569 1.00 0.00 C ATOM 1363 C LYS A 87 19.043 -0.478 -11.270 1.00 0.00 C ATOM 1364 O LYS A 87 19.933 -0.062 -10.528 1.00 0.00 O ATOM 1365 CB LYS A 87 18.927 -0.362 -13.766 1.00 0.00 C ATOM 1366 CG LYS A 87 19.221 1.121 -13.617 1.00 0.00 C ATOM 1367 CD LYS A 87 18.867 1.888 -14.880 1.00 0.00 C ATOM 1368 CE LYS A 87 18.984 3.390 -14.671 1.00 0.00 C ATOM 1369 NZ LYS A 87 18.610 4.152 -15.894 1.00 0.00 N ATOM 0 H LYS A 87 17.955 -2.585 -13.228 1.00 0.00 H new ATOM 0 HA LYS A 87 20.465 -1.333 -12.617 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.417 -0.732 -14.667 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.855 -0.499 -13.907 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.656 1.522 -12.776 1.00 0.00 H new ATOM 0 HG3 LYS A 87 20.277 1.262 -13.388 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.527 1.580 -15.691 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.850 1.640 -15.185 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.341 3.693 -13.844 1.00 0.00 H new ATOM 0 HE3 LYS A 87 20.007 3.638 -14.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 18.703 5.171 -15.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.239 3.883 -16.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 17.626 3.935 -16.151 1.00 0.00 H new ATOM 1383 N SER A 88 17.750 -0.334 -11.000 1.00 0.00 N ATOM 1384 CA SER A 88 17.291 0.340 -9.790 1.00 0.00 C ATOM 1385 C SER A 88 17.928 -0.278 -8.549 1.00 0.00 C ATOM 1386 O SER A 88 18.518 0.422 -7.726 1.00 0.00 O ATOM 1387 CB SER A 88 15.767 0.266 -9.686 1.00 0.00 C ATOM 1388 OG SER A 88 15.263 1.288 -8.844 1.00 0.00 O ATOM 0 H SER A 88 17.001 -0.675 -11.603 1.00 0.00 H new ATOM 0 HA SER A 88 17.593 1.386 -9.850 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.327 0.358 -10.679 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.473 -0.709 -9.296 1.00 0.00 H new ATOM 0 HG SER A 88 14.287 1.220 -8.795 1.00 0.00 H new ATOM 1394 N TYR A 89 17.804 -1.595 -8.423 1.00 0.00 N ATOM 1395 CA TYR A 89 18.364 -2.309 -7.282 1.00 0.00 C ATOM 1396 C TYR A 89 19.869 -2.081 -7.182 1.00 0.00 C ATOM 1397 O TYR A 89 20.394 -1.785 -6.109 1.00 0.00 O ATOM 1398 CB TYR A 89 18.070 -3.806 -7.396 1.00 0.00 C ATOM 1399 CG TYR A 89 18.321 -4.571 -6.116 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.491 -4.409 -5.013 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.386 -5.456 -6.010 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.717 -5.105 -3.841 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.618 -6.158 -4.843 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.781 -5.979 -3.761 1.00 0.00 C ATOM 1405 OH TYR A 89 19.010 -6.675 -2.596 1.00 0.00 O ATOM 0 H TYR A 89 17.321 -2.189 -9.097 1.00 0.00 H new ATOM 0 HA TYR A 89 17.895 -1.921 -6.378 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.030 -3.942 -7.693 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.686 -4.229 -8.189 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.655 -3.728 -5.073 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.044 -5.598 -6.854 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.064 -4.965 -2.992 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.450 -6.843 -4.778 1.00 0.00 H new ATOM 0 HH TYR A 89 19.797 -7.248 -2.707 1.00 0.00 H new ATOM 1415 N ASP A 90 20.558 -2.221 -8.310 1.00 0.00 N ATOM 1416 CA ASP A 90 22.003 -2.030 -8.352 1.00 0.00 C ATOM 1417 C ASP A 90 22.381 -0.637 -7.857 1.00 0.00 C ATOM 1418 O ASP A 90 23.234 -0.488 -6.982 1.00 0.00 O ATOM 1419 CB ASP A 90 22.525 -2.238 -9.775 1.00 0.00 C ATOM 1420 CG ASP A 90 22.713 -3.704 -10.113 1.00 0.00 C ATOM 1421 OD1 ASP A 90 22.830 -4.520 -9.175 1.00 0.00 O ATOM 1422 OD2 ASP A 90 22.741 -4.035 -11.317 1.00 0.00 O ATOM 0 H ASP A 90 20.139 -2.466 -9.207 1.00 0.00 H new ATOM 0 HA ASP A 90 22.462 -2.767 -7.693 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.828 -1.791 -10.484 1.00 0.00 H new ATOM 0 HB3 ASP A 90 23.475 -1.717 -9.890 1.00 0.00 H new ATOM 1427 N LYS A 91 21.742 0.381 -8.425 1.00 0.00 N ATOM 1428 CA LYS A 91 22.010 1.762 -8.042 1.00 0.00 C ATOM 1429 C LYS A 91 21.693 1.989 -6.568 1.00 0.00 C ATOM 1430 O LYS A 91 22.473 2.605 -5.841 1.00 0.00 O ATOM 1431 CB LYS A 91 21.188 2.721 -8.906 1.00 0.00 C ATOM 1432 CG LYS A 91 21.680 4.157 -8.857 1.00 0.00 C ATOM 1433 CD LYS A 91 22.838 4.382 -9.815 1.00 0.00 C ATOM 1434 CE LYS A 91 23.496 5.734 -9.586 1.00 0.00 C ATOM 1435 NZ LYS A 91 22.583 6.860 -9.928 1.00 0.00 N ATOM 0 H LYS A 91 21.035 0.275 -9.152 1.00 0.00 H new ATOM 0 HA LYS A 91 23.070 1.958 -8.201 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.208 2.374 -9.939 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.148 2.691 -8.580 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.862 4.832 -9.109 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.994 4.401 -7.842 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.576 3.590 -9.687 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.479 4.320 -10.842 1.00 0.00 H new ATOM 0 HE2 LYS A 91 23.801 5.818 -8.543 1.00 0.00 H new ATOM 0 HE3 LYS A 91 24.401 5.804 -10.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 23.074 7.764 -9.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 22.298 6.785 -10.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.738 6.818 -9.323 1.00 0.00 H new ATOM 1449 N THR A 92 20.542 1.487 -6.130 1.00 0.00 N ATOM 1450 CA THR A 92 20.121 1.636 -4.743 1.00 0.00 C ATOM 1451 C THR A 92 21.092 0.939 -3.796 1.00 0.00 C ATOM 1452 O THR A 92 21.734 1.581 -2.964 1.00 0.00 O ATOM 1453 CB THR A 92 18.708 1.067 -4.520 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.768 1.748 -5.359 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.291 1.207 -3.064 1.00 0.00 C ATOM 0 H THR A 92 19.885 0.973 -6.717 1.00 0.00 H new ATOM 0 HA THR A 92 20.112 2.705 -4.529 1.00 0.00 H new ATOM 0 HB THR A 92 18.722 0.008 -4.776 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.859 1.426 -6.280 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.289 0.798 -2.931 1.00 0.00 H new ATOM 0 HG22 THR A 92 18.992 0.663 -2.431 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.293 2.261 -2.785 1.00 0.00 H new ATOM 1463 N THR A 93 21.196 -0.380 -3.929 1.00 0.00 N ATOM 1464 CA THR A 93 22.089 -1.165 -3.085 1.00 0.00 C ATOM 1465 C THR A 93 23.356 -0.385 -2.750 1.00 0.00 C ATOM 1466 O THR A 93 23.698 -0.211 -1.581 1.00 0.00 O ATOM 1467 CB THR A 93 22.480 -2.492 -3.763 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.304 -3.230 -4.110 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.359 -3.329 -2.846 1.00 0.00 C ATOM 0 H THR A 93 20.673 -0.927 -4.613 1.00 0.00 H new ATOM 0 HA THR A 93 21.546 -1.382 -2.165 1.00 0.00 H new ATOM 0 HB THR A 93 23.042 -2.261 -4.668 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.060 -3.038 -5.040 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.623 -4.261 -3.346 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.267 -2.776 -2.608 1.00 0.00 H new ATOM 0 HG23 THR A 93 22.818 -3.551 -1.926 1.00 0.00 H new ATOM 1477 N HIS A 94 24.048 0.083 -3.784 1.00 0.00 N ATOM 1478 CA HIS A 94 25.277 0.846 -3.599 1.00 0.00 C ATOM 1479 C HIS A 94 25.010 2.122 -2.807 1.00 0.00 C ATOM 1480 O HIS A 94 25.637 2.367 -1.778 1.00 0.00 O ATOM 1481 CB HIS A 94 25.896 1.192 -4.954 1.00 0.00 C ATOM 1482 CG HIS A 94 26.929 2.274 -4.881 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.258 2.029 -4.611 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.821 3.614 -5.046 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.923 3.170 -4.612 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.074 4.147 -4.874 1.00 0.00 N ATOM 0 H HIS A 94 23.779 -0.053 -4.758 1.00 0.00 H new ATOM 0 HA HIS A 94 25.977 0.230 -3.035 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.350 0.296 -5.377 1.00 0.00 H new ATOM 0 HB3 HIS A 94 25.105 1.501 -5.637 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.917 4.161 -5.271 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.981 3.285 -4.430 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.311 5.137 -4.938 1.00 0.00 H new ATOM 1494 N ASN A 95 24.076 2.931 -3.295 1.00 0.00 N ATOM 1495 CA ASN A 95 23.727 4.183 -2.633 1.00 0.00 C ATOM 1496 C ASN A 95 23.533 3.971 -1.135 1.00 0.00 C ATOM 1497 O ASN A 95 24.015 4.755 -0.318 1.00 0.00 O ATOM 1498 CB ASN A 95 22.453 4.770 -3.245 1.00 0.00 C ATOM 1499 CG ASN A 95 22.728 5.539 -4.523 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.754 5.340 -5.173 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.808 6.425 -4.889 1.00 0.00 N ATOM 0 H ASN A 95 23.547 2.742 -4.146 1.00 0.00 H new ATOM 0 HA ASN A 95 24.549 4.884 -2.779 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.748 3.965 -3.453 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.977 5.431 -2.521 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.938 6.973 -5.740 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.972 6.557 -4.319 1.00 0.00 H new ATOM 1508 N VAL A 96 22.825 2.903 -0.781 1.00 0.00 N ATOM 1509 CA VAL A 96 22.568 2.586 0.619 1.00 0.00 C ATOM 1510 C VAL A 96 23.816 2.799 1.468 1.00 0.00 C ATOM 1511 O VAL A 96 23.747 3.350 2.567 1.00 0.00 O ATOM 1512 CB VAL A 96 22.089 1.131 0.786 1.00 0.00 C ATOM 1513 CG1 VAL A 96 21.933 0.786 2.259 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.783 0.912 0.037 1.00 0.00 C ATOM 0 H VAL A 96 22.419 2.243 -1.444 1.00 0.00 H new ATOM 0 HA VAL A 96 21.782 3.261 0.958 1.00 0.00 H new ATOM 0 HB VAL A 96 22.842 0.467 0.360 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.594 -0.245 2.357 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.892 0.902 2.764 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.201 1.453 2.713 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.459 -0.121 0.165 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.020 1.584 0.431 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.933 1.116 -1.023 1.00 0.00 H new ATOM 1524 N LYS A 97 24.958 2.358 0.952 1.00 0.00 N ATOM 1525 CA LYS A 97 26.225 2.501 1.661 1.00 0.00 C ATOM 1526 C LYS A 97 26.265 3.809 2.444 1.00 0.00 C ATOM 1527 O LYS A 97 26.720 3.845 3.587 1.00 0.00 O ATOM 1528 CB LYS A 97 27.394 2.448 0.675 1.00 0.00 C ATOM 1529 CG LYS A 97 27.470 1.149 -0.109 1.00 0.00 C ATOM 1530 CD LYS A 97 28.273 0.095 0.635 1.00 0.00 C ATOM 1531 CE LYS A 97 27.886 -1.310 0.201 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.008 -2.273 0.375 1.00 0.00 N ATOM 0 H LYS A 97 25.033 1.898 0.045 1.00 0.00 H new ATOM 0 HA LYS A 97 26.314 1.674 2.365 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.307 3.280 -0.024 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.326 2.588 1.222 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.463 0.776 -0.295 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.926 1.336 -1.081 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.337 0.252 0.455 1.00 0.00 H new ATOM 0 HD3 LYS A 97 28.112 0.203 1.708 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.026 -1.645 0.781 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.579 -1.295 -0.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 28.704 -3.219 0.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.820 -1.967 -0.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.285 -2.306 1.377 1.00 0.00 H new ATOM 1546 N GLU A 98 25.785 4.881 1.822 1.00 0.00 N ATOM 1547 CA GLU A 98 25.766 6.191 2.462 1.00 0.00 C ATOM 1548 C GLU A 98 24.356 6.553 2.920 1.00 0.00 C ATOM 1549 O GLU A 98 23.442 6.733 2.115 1.00 0.00 O ATOM 1550 CB GLU A 98 26.293 7.260 1.503 1.00 0.00 C ATOM 1551 CG GLU A 98 25.596 7.263 0.152 1.00 0.00 C ATOM 1552 CD GLU A 98 26.062 8.395 -0.743 1.00 0.00 C ATOM 1553 OE1 GLU A 98 27.150 8.265 -1.343 1.00 0.00 O ATOM 1554 OE2 GLU A 98 25.341 9.409 -0.842 1.00 0.00 O ATOM 0 H GLU A 98 25.404 4.868 0.876 1.00 0.00 H new ATOM 0 HA GLU A 98 26.414 6.148 3.338 1.00 0.00 H new ATOM 0 HB2 GLU A 98 26.176 8.240 1.965 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.361 7.105 1.351 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.777 6.312 -0.348 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.520 7.344 0.303 1.00 0.00 H new ATOM 1561 N PRO A 99 24.174 6.662 4.244 1.00 0.00 N ATOM 1562 CA PRO A 99 22.878 7.003 4.839 1.00 0.00 C ATOM 1563 C PRO A 99 22.477 8.449 4.566 1.00 0.00 C ATOM 1564 O PRO A 99 23.258 9.373 4.790 1.00 0.00 O ATOM 1565 CB PRO A 99 23.108 6.786 6.337 1.00 0.00 C ATOM 1566 CG PRO A 99 24.575 6.964 6.525 1.00 0.00 C ATOM 1567 CD PRO A 99 25.219 6.462 5.262 1.00 0.00 C ATOM 0 HA PRO A 99 22.069 6.401 4.426 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.543 7.503 6.932 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.787 5.791 6.647 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.822 8.011 6.699 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.928 6.405 7.392 1.00 0.00 H new ATOM 0 HD2 PRO A 99 26.125 7.020 5.023 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.503 5.413 5.345 1.00 0.00 H new ATOM 1575 N GLY A 100 21.254 8.637 4.081 1.00 0.00 N ATOM 1576 CA GLY A 100 20.770 9.974 3.786 1.00 0.00 C ATOM 1577 C GLY A 100 19.263 10.083 3.899 1.00 0.00 C ATOM 1578 O GLY A 100 18.644 9.404 4.718 1.00 0.00 O ATOM 0 H GLY A 100 20.589 7.888 3.887 1.00 0.00 H new ATOM 0 HA2 GLY A 100 21.235 10.684 4.470 1.00 0.00 H new ATOM 0 HA3 GLY A 100 21.077 10.254 2.778 1.00 0.00 H new ATOM 1582 N ARG A 101 18.670 10.942 3.076 1.00 0.00 N ATOM 1583 CA ARG A 101 17.226 11.140 3.090 1.00 0.00 C ATOM 1584 C ARG A 101 16.603 10.693 1.771 1.00 0.00 C ATOM 1585 O ARG A 101 15.506 10.134 1.748 1.00 0.00 O ATOM 1586 CB ARG A 101 16.894 12.611 3.350 1.00 0.00 C ATOM 1587 CG ARG A 101 16.970 13.002 4.817 1.00 0.00 C ATOM 1588 CD ARG A 101 16.082 14.198 5.121 1.00 0.00 C ATOM 1589 NE ARG A 101 16.493 15.388 4.381 1.00 0.00 N ATOM 1590 CZ ARG A 101 17.240 16.355 4.902 1.00 0.00 C ATOM 1591 NH1 ARG A 101 17.656 16.273 6.158 1.00 0.00 N ATOM 1592 NH2 ARG A 101 17.573 17.407 4.165 1.00 0.00 N ATOM 0 H ARG A 101 19.167 11.512 2.391 1.00 0.00 H new ATOM 0 HA ARG A 101 16.809 10.533 3.893 1.00 0.00 H new ATOM 0 HB2 ARG A 101 17.581 13.236 2.780 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.891 12.820 2.979 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.669 12.157 5.436 1.00 0.00 H new ATOM 0 HG3 ARG A 101 18.002 13.237 5.079 1.00 0.00 H new ATOM 0 HD2 ARG A 101 15.049 13.955 4.872 1.00 0.00 H new ATOM 0 HD3 ARG A 101 16.111 14.408 6.190 1.00 0.00 H new ATOM 0 HE ARG A 101 16.190 15.482 3.412 1.00 0.00 H new ATOM 0 HH11 ARG A 101 17.403 15.466 6.727 1.00 0.00 H new ATOM 0 HH12 ARG A 101 18.229 17.017 6.555 1.00 0.00 H new ATOM 0 HH21 ARG A 101 17.255 17.473 3.198 1.00 0.00 H new ATOM 0 HH22 ARG A 101 18.147 18.149 4.565 1.00 0.00 H new ATOM 1606 N TYR A 102 17.310 10.943 0.674 1.00 0.00 N ATOM 1607 CA TYR A 102 16.825 10.569 -0.649 1.00 0.00 C ATOM 1608 C TYR A 102 17.641 9.414 -1.221 1.00 0.00 C ATOM 1609 O TYR A 102 17.614 9.154 -2.425 1.00 0.00 O ATOM 1610 CB TYR A 102 16.887 11.769 -1.596 1.00 0.00 C ATOM 1611 CG TYR A 102 16.515 13.079 -0.939 1.00 0.00 C ATOM 1612 CD1 TYR A 102 15.351 13.197 -0.190 1.00 0.00 C ATOM 1613 CD2 TYR A 102 17.329 14.198 -1.066 1.00 0.00 C ATOM 1614 CE1 TYR A 102 15.007 14.392 0.412 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.993 15.397 -0.466 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.831 15.489 0.271 1.00 0.00 C ATOM 1617 OH TYR A 102 15.492 16.681 0.870 1.00 0.00 O ATOM 0 H TYR A 102 18.220 11.403 0.675 1.00 0.00 H new ATOM 0 HA TYR A 102 15.789 10.245 -0.550 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.896 11.849 -2.002 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.218 11.592 -2.438 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.704 12.340 -0.076 1.00 0.00 H new ATOM 0 HD2 TYR A 102 18.239 14.130 -1.643 1.00 0.00 H new ATOM 0 HE1 TYR A 102 14.098 14.467 0.990 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.637 16.257 -0.574 1.00 0.00 H new ATOM 0 HH TYR A 102 16.178 17.352 0.674 1.00 0.00 H new ATOM 1627 N THR A 103 18.366 8.721 -0.349 1.00 0.00 N ATOM 1628 CA THR A 103 19.190 7.593 -0.765 1.00 0.00 C ATOM 1629 C THR A 103 18.370 6.570 -1.543 1.00 0.00 C ATOM 1630 O THR A 103 18.822 6.040 -2.558 1.00 0.00 O ATOM 1631 CB THR A 103 19.842 6.897 0.445 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.559 7.854 1.233 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.788 5.796 -0.009 1.00 0.00 C ATOM 0 H THR A 103 18.399 8.921 0.651 1.00 0.00 H new ATOM 0 HA THR A 103 19.972 7.994 -1.410 1.00 0.00 H new ATOM 0 HB THR A 103 19.052 6.450 1.048 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.430 7.483 1.486 1.00 0.00 H new ATOM 0 HG21 THR A 103 21.236 5.319 0.863 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.234 5.054 -0.584 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.573 6.225 -0.632 1.00 0.00 H new ATOM 1641 N PHE A 104 17.161 6.298 -1.062 1.00 0.00 N ATOM 1642 CA PHE A 104 16.278 5.338 -1.714 1.00 0.00 C ATOM 1643 C PHE A 104 15.304 6.045 -2.652 1.00 0.00 C ATOM 1644 O PHE A 104 14.282 5.481 -3.042 1.00 0.00 O ATOM 1645 CB PHE A 104 15.502 4.535 -0.668 1.00 0.00 C ATOM 1646 CG PHE A 104 16.386 3.779 0.283 1.00 0.00 C ATOM 1647 CD1 PHE A 104 17.002 2.602 -0.110 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.600 4.245 1.570 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.816 1.903 0.762 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.413 3.551 2.447 1.00 0.00 C ATOM 1651 CZ PHE A 104 18.021 2.379 2.042 1.00 0.00 C ATOM 0 H PHE A 104 16.771 6.729 -0.224 1.00 0.00 H new ATOM 0 HA PHE A 104 16.894 4.658 -2.302 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.866 5.213 -0.099 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.843 3.831 -1.177 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.844 2.226 -1.110 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.126 5.161 1.892 1.00 0.00 H new ATOM 0 HE1 PHE A 104 18.290 0.987 0.443 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.572 3.925 3.448 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.656 1.835 2.726 1.00 0.00 H new ATOM 1661 N GLU A 105 15.630 7.283 -3.010 1.00 0.00 N ATOM 1662 CA GLU A 105 14.784 8.068 -3.902 1.00 0.00 C ATOM 1663 C GLU A 105 14.455 7.284 -5.169 1.00 0.00 C ATOM 1664 O GLU A 105 13.287 7.068 -5.493 1.00 0.00 O ATOM 1665 CB GLU A 105 15.472 9.384 -4.267 1.00 0.00 C ATOM 1666 CG GLU A 105 14.596 10.326 -5.076 1.00 0.00 C ATOM 1667 CD GLU A 105 13.280 10.633 -4.389 1.00 0.00 C ATOM 1668 OE1 GLU A 105 13.261 11.529 -3.519 1.00 0.00 O ATOM 1669 OE2 GLU A 105 12.270 9.978 -4.720 1.00 0.00 O ATOM 0 H GLU A 105 16.473 7.764 -2.696 1.00 0.00 H new ATOM 0 HA GLU A 105 13.853 8.287 -3.379 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.783 9.887 -3.352 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.377 9.166 -4.834 1.00 0.00 H new ATOM 0 HG2 GLU A 105 15.135 11.257 -5.252 1.00 0.00 H new ATOM 0 HG3 GLU A 105 14.397 9.883 -6.052 1.00 0.00 H new ATOM 1676 N ASP A 106 15.493 6.862 -5.882 1.00 0.00 N ATOM 1677 CA ASP A 106 15.316 6.102 -7.114 1.00 0.00 C ATOM 1678 C ASP A 106 14.337 4.951 -6.907 1.00 0.00 C ATOM 1679 O ASP A 106 13.263 4.922 -7.507 1.00 0.00 O ATOM 1680 CB ASP A 106 16.661 5.561 -7.603 1.00 0.00 C ATOM 1681 CG ASP A 106 17.802 6.524 -7.339 1.00 0.00 C ATOM 1682 OD1 ASP A 106 17.748 7.662 -7.849 1.00 0.00 O ATOM 1683 OD2 ASP A 106 18.751 6.138 -6.623 1.00 0.00 O ATOM 0 H ASP A 106 16.466 7.033 -5.628 1.00 0.00 H new ATOM 0 HA ASP A 106 14.906 6.773 -7.869 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.869 4.612 -7.109 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.601 5.358 -8.672 1.00 0.00 H new ATOM 1688 N ALA A 107 14.715 4.004 -6.054 1.00 0.00 N ATOM 1689 CA ALA A 107 13.870 2.852 -5.767 1.00 0.00 C ATOM 1690 C ALA A 107 12.456 3.288 -5.396 1.00 0.00 C ATOM 1691 O ALA A 107 11.477 2.689 -5.839 1.00 0.00 O ATOM 1692 CB ALA A 107 14.477 2.017 -4.650 1.00 0.00 C ATOM 0 H ALA A 107 15.602 4.013 -5.550 1.00 0.00 H new ATOM 0 HA ALA A 107 13.810 2.243 -6.669 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.835 1.160 -4.446 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.464 1.667 -4.952 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.567 2.625 -3.750 1.00 0.00 H new ATOM 1698 N GLN A 108 12.359 4.332 -4.579 1.00 0.00 N ATOM 1699 CA GLN A 108 11.064 4.845 -4.148 1.00 0.00 C ATOM 1700 C GLN A 108 10.198 5.215 -5.347 1.00 0.00 C ATOM 1701 O GLN A 108 9.002 4.924 -5.374 1.00 0.00 O ATOM 1702 CB GLN A 108 11.251 6.065 -3.244 1.00 0.00 C ATOM 1703 CG GLN A 108 9.944 6.718 -2.824 1.00 0.00 C ATOM 1704 CD GLN A 108 9.410 6.168 -1.516 1.00 0.00 C ATOM 1705 OE1 GLN A 108 9.718 5.039 -1.132 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.606 6.966 -0.823 1.00 0.00 N ATOM 0 H GLN A 108 13.160 4.838 -4.203 1.00 0.00 H new ATOM 0 HA GLN A 108 10.559 4.059 -3.587 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.800 5.765 -2.352 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.865 6.801 -3.764 1.00 0.00 H new ATOM 0 HG2 GLN A 108 10.094 7.793 -2.727 1.00 0.00 H new ATOM 0 HG3 GLN A 108 9.200 6.569 -3.607 1.00 0.00 H new ATOM 0 HE21 GLN A 108 8.378 7.894 -1.179 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.217 6.651 0.066 1.00 0.00 H new ATOM 1715 N GLU A 109 10.809 5.857 -6.337 1.00 0.00 N ATOM 1716 CA GLU A 109 10.092 6.267 -7.539 1.00 0.00 C ATOM 1717 C GLU A 109 9.681 5.053 -8.368 1.00 0.00 C ATOM 1718 O GLU A 109 8.561 4.985 -8.876 1.00 0.00 O ATOM 1719 CB GLU A 109 10.959 7.204 -8.382 1.00 0.00 C ATOM 1720 CG GLU A 109 10.508 7.314 -9.829 1.00 0.00 C ATOM 1721 CD GLU A 109 11.237 8.407 -10.587 1.00 0.00 C ATOM 1722 OE1 GLU A 109 10.835 9.583 -10.464 1.00 0.00 O ATOM 1723 OE2 GLU A 109 12.209 8.086 -11.302 1.00 0.00 O ATOM 0 H GLU A 109 11.798 6.105 -6.331 1.00 0.00 H new ATOM 0 HA GLU A 109 9.191 6.797 -7.231 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.951 8.196 -7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.990 6.851 -8.357 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.671 6.360 -10.330 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.436 7.510 -9.857 1.00 0.00 H new ATOM 1730 N HIS A 110 10.595 4.098 -8.501 1.00 0.00 N ATOM 1731 CA HIS A 110 10.329 2.886 -9.268 1.00 0.00 C ATOM 1732 C HIS A 110 9.031 2.227 -8.809 1.00 0.00 C ATOM 1733 O HIS A 110 8.095 2.065 -9.592 1.00 0.00 O ATOM 1734 CB HIS A 110 11.491 1.903 -9.129 1.00 0.00 C ATOM 1735 CG HIS A 110 11.370 0.703 -10.017 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.362 0.783 -11.393 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.253 -0.612 -9.717 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.244 -0.431 -11.902 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.177 -1.295 -10.906 1.00 0.00 N ATOM 0 H HIS A 110 11.527 4.139 -8.088 1.00 0.00 H new ATOM 0 HA HIS A 110 10.224 3.165 -10.316 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.423 2.420 -9.356 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.555 1.573 -8.092 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.225 -1.043 -8.727 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.208 -0.675 -12.954 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.084 -2.306 -11.004 1.00 0.00 H new ATOM 1747 N ILE A 111 8.984 1.848 -7.536 1.00 0.00 N ATOM 1748 CA ILE A 111 7.802 1.207 -6.974 1.00 0.00 C ATOM 1749 C ILE A 111 6.558 2.063 -7.188 1.00 0.00 C ATOM 1750 O ILE A 111 5.502 1.558 -7.569 1.00 0.00 O ATOM 1751 CB ILE A 111 7.971 0.936 -5.467 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.153 -0.005 -5.226 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.693 0.350 -4.888 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.970 -1.375 -5.842 1.00 0.00 C ATOM 0 H ILE A 111 9.751 1.974 -6.875 1.00 0.00 H new ATOM 0 HA ILE A 111 7.681 0.257 -7.495 1.00 0.00 H new ATOM 0 HB ILE A 111 8.175 1.881 -4.963 1.00 0.00 H new ATOM 0 HG12 ILE A 111 10.057 0.449 -5.632 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.306 -0.116 -4.152 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.828 0.164 -3.823 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.872 1.053 -5.032 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.461 -0.587 -5.393 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.846 -1.989 -5.631 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.085 -1.849 -5.418 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.847 -1.276 -6.921 1.00 0.00 H new ATOM 1766 N TYR A 112 6.691 3.362 -6.942 1.00 0.00 N ATOM 1767 CA TYR A 112 5.578 4.289 -7.107 1.00 0.00 C ATOM 1768 C TYR A 112 4.963 4.160 -8.498 1.00 0.00 C ATOM 1769 O TYR A 112 3.772 3.884 -8.640 1.00 0.00 O ATOM 1770 CB TYR A 112 6.045 5.727 -6.876 1.00 0.00 C ATOM 1771 CG TYR A 112 5.026 6.768 -7.280 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.799 7.063 -8.618 1.00 0.00 C ATOM 1773 CD2 TYR A 112 4.289 7.455 -6.323 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.869 8.014 -8.992 1.00 0.00 C ATOM 1775 CE2 TYR A 112 3.356 8.406 -6.688 1.00 0.00 C ATOM 1776 CZ TYR A 112 3.150 8.683 -8.023 1.00 0.00 C ATOM 1777 OH TYR A 112 2.222 9.629 -8.391 1.00 0.00 O ATOM 0 H TYR A 112 7.559 3.796 -6.628 1.00 0.00 H new ATOM 0 HA TYR A 112 4.817 4.038 -6.368 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.285 5.857 -5.821 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.965 5.895 -7.436 1.00 0.00 H new ATOM 0 HD1 TYR A 112 5.359 6.540 -9.379 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.448 7.242 -5.276 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.706 8.232 -10.037 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.791 8.930 -5.932 1.00 0.00 H new ATOM 0 HH TYR A 112 1.693 9.890 -7.609 1.00 0.00 H new ATOM 1787 N LYS A 113 5.786 4.361 -9.522 1.00 0.00 N ATOM 1788 CA LYS A 113 5.327 4.267 -10.903 1.00 0.00 C ATOM 1789 C LYS A 113 4.687 2.908 -11.171 1.00 0.00 C ATOM 1790 O LYS A 113 3.977 2.729 -12.162 1.00 0.00 O ATOM 1791 CB LYS A 113 6.494 4.492 -11.866 1.00 0.00 C ATOM 1792 CG LYS A 113 7.179 5.836 -11.688 1.00 0.00 C ATOM 1793 CD LYS A 113 8.459 5.921 -12.502 1.00 0.00 C ATOM 1794 CE LYS A 113 9.516 4.960 -11.981 1.00 0.00 C ATOM 1795 NZ LYS A 113 9.383 3.607 -12.589 1.00 0.00 N ATOM 0 H LYS A 113 6.775 4.590 -9.421 1.00 0.00 H new ATOM 0 HA LYS A 113 4.577 5.041 -11.065 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.228 3.698 -11.726 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.130 4.412 -12.890 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.501 6.634 -11.990 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.406 5.993 -10.634 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.243 5.695 -13.546 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.845 6.940 -12.470 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.507 5.359 -12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.432 4.881 -10.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 9.050 2.934 -11.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 8.699 3.644 -13.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.307 3.297 -12.951 1.00 0.00 H new ATOM 1809 N LEU A 114 4.941 1.954 -10.282 1.00 0.00 N ATOM 1810 CA LEU A 114 4.388 0.611 -10.423 1.00 0.00 C ATOM 1811 C LEU A 114 3.068 0.484 -9.670 1.00 0.00 C ATOM 1812 O LEU A 114 2.005 0.358 -10.278 1.00 0.00 O ATOM 1813 CB LEU A 114 5.385 -0.428 -9.906 1.00 0.00 C ATOM 1814 CG LEU A 114 4.804 -1.798 -9.554 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.832 -2.717 -10.766 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.567 -2.419 -8.394 1.00 0.00 C ATOM 0 H LEU A 114 5.526 2.085 -9.457 1.00 0.00 H new ATOM 0 HA LEU A 114 4.200 0.431 -11.481 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.159 -0.567 -10.661 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.873 -0.024 -9.019 1.00 0.00 H new ATOM 0 HG LEU A 114 3.766 -1.664 -9.249 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.415 -3.687 -10.497 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.240 -2.278 -11.569 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.861 -2.845 -11.102 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.140 -3.393 -8.157 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.614 -2.540 -8.670 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.495 -1.770 -7.522 1.00 0.00 H new ATOM 1828 N MET A 115 3.143 0.521 -8.344 1.00 0.00 N ATOM 1829 CA MET A 115 1.952 0.414 -7.508 1.00 0.00 C ATOM 1830 C MET A 115 0.807 1.238 -8.085 1.00 0.00 C ATOM 1831 O MET A 115 -0.350 0.818 -8.057 1.00 0.00 O ATOM 1832 CB MET A 115 2.261 0.875 -6.082 1.00 0.00 C ATOM 1833 CG MET A 115 3.415 0.126 -5.437 1.00 0.00 C ATOM 1834 SD MET A 115 3.664 0.587 -3.712 1.00 0.00 S ATOM 1835 CE MET A 115 4.046 2.329 -3.879 1.00 0.00 C ATOM 0 H MET A 115 4.015 0.624 -7.825 1.00 0.00 H new ATOM 0 HA MET A 115 1.647 -0.632 -7.486 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.492 1.940 -6.096 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.369 0.750 -5.468 1.00 0.00 H new ATOM 0 HG2 MET A 115 3.227 -0.946 -5.499 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.329 0.323 -5.997 1.00 0.00 H new ATOM 0 HE1 MET A 115 5.072 2.509 -3.558 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.934 2.628 -4.921 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.364 2.912 -3.260 1.00 0.00 H new ATOM 1845 N LYS A 116 1.135 2.414 -8.610 1.00 0.00 N ATOM 1846 CA LYS A 116 0.134 3.298 -9.195 1.00 0.00 C ATOM 1847 C LYS A 116 -0.766 2.535 -10.161 1.00 0.00 C ATOM 1848 O LYS A 116 -1.992 2.617 -10.078 1.00 0.00 O ATOM 1849 CB LYS A 116 0.814 4.460 -9.924 1.00 0.00 C ATOM 1850 CG LYS A 116 1.624 4.028 -11.134 1.00 0.00 C ATOM 1851 CD LYS A 116 2.277 5.216 -11.820 1.00 0.00 C ATOM 1852 CE LYS A 116 1.310 5.915 -12.763 1.00 0.00 C ATOM 1853 NZ LYS A 116 1.284 5.274 -14.107 1.00 0.00 N ATOM 0 H LYS A 116 2.088 2.777 -8.642 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.482 3.694 -8.388 1.00 0.00 H new ATOM 0 HB2 LYS A 116 0.054 5.173 -10.242 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.469 4.982 -9.226 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.391 3.318 -10.825 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.976 3.509 -11.841 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.629 5.923 -11.069 1.00 0.00 H new ATOM 0 HD3 LYS A 116 3.152 4.880 -12.377 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.308 5.899 -12.334 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.596 6.962 -12.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.613 5.780 -14.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.234 5.312 -14.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 0.987 4.282 -14.013 1.00 0.00 H new ATOM 1867 N SER A 117 -0.151 1.793 -11.077 1.00 0.00 N ATOM 1868 CA SER A 117 -0.898 1.018 -12.060 1.00 0.00 C ATOM 1869 C SER A 117 -0.629 -0.475 -11.893 1.00 0.00 C ATOM 1870 O SER A 117 -0.892 -1.269 -12.796 1.00 0.00 O ATOM 1871 CB SER A 117 -0.527 1.459 -13.477 1.00 0.00 C ATOM 1872 OG SER A 117 -1.330 2.548 -13.899 1.00 0.00 O ATOM 0 H SER A 117 0.863 1.713 -11.158 1.00 0.00 H new ATOM 0 HA SER A 117 -1.961 1.199 -11.897 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.524 1.745 -13.509 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.651 0.623 -14.166 1.00 0.00 H new ATOM 0 HG SER A 117 -1.072 2.812 -14.807 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.103 -0.848 -10.731 1.00 0.00 N ATOM 1879 CA ASP A 118 0.201 -2.245 -10.444 1.00 0.00 C ATOM 1880 C ASP A 118 -0.858 -2.855 -9.531 1.00 0.00 C ATOM 1881 O ASP A 118 -1.533 -3.815 -9.902 1.00 0.00 O ATOM 1882 CB ASP A 118 1.581 -2.365 -9.796 1.00 0.00 C ATOM 1883 CG ASP A 118 1.704 -3.596 -8.919 1.00 0.00 C ATOM 1884 OD1 ASP A 118 1.614 -4.719 -9.457 1.00 0.00 O ATOM 1885 OD2 ASP A 118 1.888 -3.436 -7.694 1.00 0.00 O ATOM 0 H ASP A 118 0.121 -0.203 -9.973 1.00 0.00 H new ATOM 0 HA ASP A 118 0.201 -2.793 -11.386 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.343 -2.400 -10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.777 -1.475 -9.198 1.00 0.00 H new ATOM 1890 N SER A 119 -0.997 -2.292 -8.335 1.00 0.00 N ATOM 1891 CA SER A 119 -1.970 -2.783 -7.367 1.00 0.00 C ATOM 1892 C SER A 119 -3.255 -1.963 -7.424 1.00 0.00 C ATOM 1893 O SER A 119 -4.347 -2.508 -7.588 1.00 0.00 O ATOM 1894 CB SER A 119 -1.384 -2.737 -5.955 1.00 0.00 C ATOM 1895 OG SER A 119 -0.465 -3.796 -5.749 1.00 0.00 O ATOM 0 H SER A 119 -0.448 -1.495 -8.013 1.00 0.00 H new ATOM 0 HA SER A 119 -2.208 -3.816 -7.620 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.884 -1.782 -5.796 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.188 -2.801 -5.222 1.00 0.00 H new ATOM 0 HG SER A 119 0.292 -3.697 -6.364 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.117 -0.649 -7.287 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.265 0.249 -7.320 1.00 0.00 C ATOM 1903 C TYR A 120 -5.332 -0.267 -8.282 1.00 0.00 C ATOM 1904 O TYR A 120 -6.512 -0.369 -7.945 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.828 1.655 -7.732 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.930 2.468 -8.374 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.284 2.267 -9.703 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.617 3.437 -7.653 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.289 3.008 -10.294 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.625 4.181 -8.235 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.957 3.963 -9.556 1.00 0.00 C ATOM 1912 OH TYR A 120 -7.959 4.703 -10.141 1.00 0.00 O ATOM 0 H TYR A 120 -2.220 -0.182 -7.152 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.693 0.288 -6.318 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.462 2.185 -6.853 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.993 1.577 -8.428 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -4.765 1.519 -10.283 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.358 3.612 -6.619 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -6.550 2.840 -11.328 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -7.150 4.929 -7.659 1.00 0.00 H new ATOM 0 HH TYR A 120 -8.799 4.555 -9.658 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.908 -0.601 -9.510 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.809 -1.113 -10.546 1.00 0.00 C ATOM 1924 C PRO A 121 -6.714 -2.227 -10.029 1.00 0.00 C ATOM 1925 O PRO A 121 -7.936 -2.081 -9.996 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.853 -1.653 -11.613 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.601 -0.867 -11.432 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.516 -0.506 -9.980 1.00 0.00 C ATOM 0 HA PRO A 121 -6.487 -0.343 -10.912 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.673 -2.720 -11.480 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.262 -1.521 -12.615 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.732 -1.451 -11.736 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.615 0.029 -12.052 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.863 -1.189 -9.436 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.115 0.498 -9.841 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.106 -3.338 -9.627 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.858 -4.476 -9.112 1.00 0.00 C ATOM 1938 C ARG A 122 -7.754 -4.056 -7.950 1.00 0.00 C ATOM 1939 O ARG A 122 -8.947 -4.357 -7.933 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.903 -5.582 -8.659 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.423 -6.474 -9.792 1.00 0.00 C ATOM 1942 CD ARG A 122 -5.020 -7.850 -9.286 1.00 0.00 C ATOM 1943 NE ARG A 122 -4.071 -8.507 -10.182 1.00 0.00 N ATOM 1944 CZ ARG A 122 -3.835 -9.814 -10.171 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -4.474 -10.600 -9.316 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -2.957 -10.337 -11.017 1.00 0.00 N ATOM 0 H ARG A 122 -5.095 -3.474 -9.648 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.489 -4.856 -9.916 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.039 -5.128 -8.174 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.402 -6.197 -7.910 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.213 -6.576 -10.536 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.574 -6.006 -10.291 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.577 -7.756 -8.295 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.909 -8.472 -9.180 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.562 -7.931 -10.852 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -5.149 -10.202 -8.664 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -4.290 -11.603 -9.310 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -2.463 -9.735 -11.676 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -2.776 -11.341 -11.008 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.170 -3.359 -6.982 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.914 -2.898 -5.816 1.00 0.00 C ATOM 1962 C PHE A 123 -9.312 -2.432 -6.212 1.00 0.00 C ATOM 1963 O PHE A 123 -10.291 -2.716 -5.522 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.163 -1.760 -5.121 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.897 -1.189 -3.942 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.361 -2.016 -2.931 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.124 0.174 -3.844 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -9.037 -1.493 -1.844 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.799 0.702 -2.759 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.257 -0.133 -1.759 1.00 0.00 C ATOM 0 H PHE A 123 -6.183 -3.101 -6.982 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.011 -3.735 -5.125 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.191 -2.126 -4.791 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -6.976 -0.965 -5.843 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.193 -3.081 -2.993 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.770 0.832 -4.624 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.392 -2.148 -1.062 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.968 1.767 -2.694 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.786 0.277 -0.912 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.396 -1.715 -7.328 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.673 -1.210 -7.816 1.00 0.00 C ATOM 1982 C ILE A 124 -11.549 -2.344 -8.339 1.00 0.00 C ATOM 1983 O ILE A 124 -12.766 -2.336 -8.158 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.476 -0.171 -8.936 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.521 0.932 -8.475 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.815 0.420 -9.351 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -10.010 1.687 -7.259 1.00 0.00 C ATOM 0 H ILE A 124 -8.595 -1.471 -7.911 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.168 -0.732 -6.970 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.037 -0.669 -9.801 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -8.550 0.490 -8.252 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -9.370 1.636 -9.293 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.660 1.152 -10.143 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.467 -0.375 -9.714 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.280 0.906 -8.493 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -9.283 2.453 -6.989 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -10.967 2.158 -7.484 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -10.133 0.995 -6.426 1.00 0.00 H new ATOM 1999 N ARG A 125 -10.920 -3.319 -8.987 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.642 -4.461 -9.536 1.00 0.00 C ATOM 2001 C ARG A 125 -12.428 -5.182 -8.445 1.00 0.00 C ATOM 2002 O ARG A 125 -13.638 -5.379 -8.564 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.668 -5.433 -10.205 1.00 0.00 C ATOM 2004 CG ARG A 125 -9.717 -4.765 -11.184 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.384 -4.520 -12.529 1.00 0.00 C ATOM 2006 NE ARG A 125 -9.427 -4.087 -13.543 1.00 0.00 N ATOM 2007 CZ ARG A 125 -9.220 -4.736 -14.683 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -9.900 -5.842 -14.952 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -8.332 -4.280 -15.557 1.00 0.00 N ATOM 0 H ARG A 125 -9.913 -3.341 -9.145 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.345 -4.091 -10.282 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.086 -5.939 -9.434 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.237 -6.200 -10.730 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.373 -3.818 -10.769 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -8.836 -5.392 -11.322 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -10.876 -5.434 -12.862 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -11.160 -3.763 -12.416 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.888 -3.239 -13.366 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -10.584 -6.196 -14.283 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -9.740 -6.339 -15.828 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -7.807 -3.430 -15.354 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -8.174 -4.780 -16.432 1.00 0.00 H new ATOM 2023 N SER A 126 -11.733 -5.575 -7.382 1.00 0.00 N ATOM 2024 CA SER A 126 -12.365 -6.278 -6.272 1.00 0.00 C ATOM 2025 C SER A 126 -13.565 -5.496 -5.746 1.00 0.00 C ATOM 2026 O SER A 126 -13.718 -4.308 -6.029 1.00 0.00 O ATOM 2027 CB SER A 126 -11.357 -6.506 -5.144 1.00 0.00 C ATOM 2028 OG SER A 126 -11.889 -7.363 -4.150 1.00 0.00 O ATOM 0 H SER A 126 -10.732 -5.418 -7.266 1.00 0.00 H new ATOM 0 HA SER A 126 -12.714 -7.243 -6.638 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.443 -6.939 -5.551 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.085 -5.550 -4.697 1.00 0.00 H new ATOM 0 HG SER A 126 -11.225 -7.494 -3.441 1.00 0.00 H new ATOM 2034 N SER A 127 -14.414 -6.172 -4.979 1.00 0.00 N ATOM 2035 CA SER A 127 -15.603 -5.543 -4.416 1.00 0.00 C ATOM 2036 C SER A 127 -15.263 -4.789 -3.134 1.00 0.00 C ATOM 2037 O SER A 127 -15.822 -3.727 -2.859 1.00 0.00 O ATOM 2038 CB SER A 127 -16.677 -6.595 -4.132 1.00 0.00 C ATOM 2039 OG SER A 127 -17.438 -6.873 -5.295 1.00 0.00 O ATOM 0 H SER A 127 -14.301 -7.155 -4.733 1.00 0.00 H new ATOM 0 HA SER A 127 -15.987 -4.830 -5.146 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.208 -7.511 -3.773 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.335 -6.242 -3.338 1.00 0.00 H new ATOM 0 HG SER A 127 -18.116 -7.549 -5.088 1.00 0.00 H new ATOM 2045 N ALA A 128 -14.343 -5.345 -2.354 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.926 -4.725 -1.103 1.00 0.00 C ATOM 2047 C ALA A 128 -13.907 -3.205 -1.222 1.00 0.00 C ATOM 2048 O ALA A 128 -14.421 -2.498 -0.355 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.555 -5.241 -0.689 1.00 0.00 C ATOM 0 H ALA A 128 -13.872 -6.224 -2.566 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.651 -4.994 -0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -12.256 -4.769 0.247 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.599 -6.322 -0.553 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.827 -5.002 -1.464 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.312 -2.709 -2.301 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.224 -1.272 -2.533 1.00 0.00 C ATOM 2057 C TYR A 129 -14.610 -0.664 -2.721 1.00 0.00 C ATOM 2058 O TYR A 129 -14.920 0.387 -2.160 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.358 -0.984 -3.760 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.624 0.366 -4.386 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.692 0.551 -5.257 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -11.809 1.456 -4.109 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -13.939 1.783 -5.832 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.050 2.692 -4.678 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.116 2.850 -5.539 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.358 4.079 -6.109 1.00 0.00 O ATOM 0 H TYR A 129 -12.883 -3.281 -3.029 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.763 -0.816 -1.656 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.308 -1.042 -3.475 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.529 -1.761 -4.505 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.339 -0.282 -5.488 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -10.972 1.335 -3.437 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.772 1.910 -6.507 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.407 3.529 -4.450 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.056 4.786 -5.502 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.440 -1.334 -3.514 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.794 -0.861 -3.776 1.00 0.00 C ATOM 2078 C GLN A 130 -17.601 -0.774 -2.485 1.00 0.00 C ATOM 2079 O GLN A 130 -18.345 0.182 -2.270 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.497 -1.787 -4.770 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.742 -1.964 -6.077 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.054 -0.874 -7.083 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.173 -0.363 -7.135 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.063 -0.511 -7.890 1.00 0.00 N ATOM 0 H GLN A 130 -15.199 -2.205 -3.986 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.725 0.138 -4.207 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.638 -2.763 -4.307 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.489 -1.390 -4.984 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.671 -1.971 -5.875 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.992 -2.933 -6.508 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.151 -0.961 -7.812 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.214 0.218 -8.587 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.447 -1.780 -1.629 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.163 -1.817 -0.359 1.00 0.00 C ATOM 2095 C GLU A 131 -18.192 -0.436 0.290 1.00 0.00 C ATOM 2096 O GLU A 131 -19.260 0.097 0.595 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.512 -2.825 0.590 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.356 -4.212 -0.009 1.00 0.00 C ATOM 2099 CD GLU A 131 -18.585 -4.657 -0.778 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -19.670 -4.739 -0.166 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -18.461 -4.923 -1.992 1.00 0.00 O ATOM 0 H GLU A 131 -16.834 -2.579 -1.792 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.189 -2.127 -0.559 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.531 -2.453 0.884 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -18.111 -2.896 1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.493 -4.221 -0.674 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.152 -4.927 0.788 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.012 0.137 0.499 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.900 1.456 1.112 1.00 0.00 C ATOM 2110 C LEU A 132 -17.785 2.469 0.392 1.00 0.00 C ATOM 2111 O LEU A 132 -18.566 3.185 1.020 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.445 1.928 1.092 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.399 0.895 1.512 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.004 1.501 1.470 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -14.707 0.358 2.902 1.00 0.00 C ATOM 0 H LEU A 132 -16.119 -0.291 0.253 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.236 1.378 2.146 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.208 2.267 0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.356 2.794 1.748 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.434 0.064 0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.272 0.751 1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -12.783 1.836 0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -12.956 2.350 2.151 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -13.952 -0.376 3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.701 1.179 3.619 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.689 -0.114 2.900 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.660 2.521 -0.930 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.450 3.444 -1.737 1.00 0.00 C ATOM 2129 C LEU A 133 -19.921 3.394 -1.338 1.00 0.00 C ATOM 2130 O LEU A 133 -20.448 4.340 -0.752 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.301 3.109 -3.222 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.278 3.940 -3.998 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.793 3.181 -5.223 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.876 5.280 -4.402 1.00 0.00 C ATOM 0 H LEU A 133 -17.019 1.935 -1.465 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.079 4.453 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.028 2.058 -3.311 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.273 3.227 -3.700 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.423 4.127 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.066 3.788 -5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.326 2.247 -4.911 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.639 2.963 -5.875 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.134 5.858 -4.953 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.749 5.113 -5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.174 5.830 -3.509 1.00 0.00 H new