USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1099 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 32 THR OG1 : rot -171:sc= 0.479 USER MOD Set 1.2: A 99 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 33 SER OG : rot 180:sc= 0.401 USER MOD Set 2.2: A 70 SER OG : rot -131:sc= 0.43 USER MOD Single : A 11 ASN : amide:sc= -2.29! C(o=-2.3!,f=-5.6!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -144:sc= -0.364 (180deg=-1.37) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -156:sc= -0.298 (180deg=-1.03) USER MOD Single : A 23 SER OG : rot 110:sc= 1.24 USER MOD Single : A 30 ASN : amide:sc= -0.594 X(o=-0.59,f=-0.31) USER MOD Single : A 34 MET CE :methyl -155:sc= -1.19 (180deg=-1.73) USER MOD Single : A 36 SER OG : rot 160:sc=-0.00665 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.5!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 165:sc=-0.000999 (180deg=-0.122) USER MOD Single : A 58 THR OG1 : rot -21:sc= -1.34 USER MOD Single : A 60 SER OG : rot 180:sc= 0.137 USER MOD Single : A 61 ASN : amide:sc= -4.95! C(o=-4.9!,f=-6.4!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -6.55! C(o=-6.6!,f=-6.4!) USER MOD Single : A 76 THR OG1 : rot 92:sc= 1.17 USER MOD Single : A 77 SER OG : rot 92:sc= 1.13 USER MOD Single : A 79 GLN :FLIP amide:sc= 0 F(o=-1.6,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.16) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.0085) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.973 X(o=-0.97,f=-0.92) USER MOD Single : A 96 TYR OH : rot 180:sc= -3.61! USER MOD Single : A 97 CYS SG : rot 35:sc= 0.0798 USER MOD Single : A 102 THR OG1 : rot 95:sc= 0.0648 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= -3.44 K(o=-3.4,f=-7.4!) USER MOD Single : A 118 LYS NZ :NH3+ -169:sc= -1.48 (180deg=-1.8) USER MOD Single : A 121 ASN :FLIP amide:sc= 0 F(o=-0.52,f=0) USER MOD Single : A 122 THR OG1 : rot 23:sc= 0.935 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot -150:sc= -0.652 USER MOD Single : A 129 ASN : amide:sc= -0.0285 K(o=-0.028,f=-1.2) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0742 USER MOD Single : A 137 THR OG1 : rot -43:sc= 0.966 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 109 N ARG A 10 1.680 0.095 9.141 1.00 63.01 N ATOM 110 CA ARG A 10 1.315 -0.585 10.378 1.00 12.21 C ATOM 111 C ARG A 10 0.582 0.362 11.323 1.00 12.11 C ATOM 112 O ARG A 10 -0.392 -0.021 11.970 1.00 24.22 O ATOM 113 CB ARG A 10 2.561 -1.145 11.065 1.00 4.44 C ATOM 114 CG ARG A 10 3.042 -2.462 10.478 1.00 54.32 C ATOM 115 CD ARG A 10 4.340 -2.919 11.123 1.00 73.44 C ATOM 116 NE ARG A 10 4.248 -2.944 12.581 1.00 54.33 N ATOM 117 CZ ARG A 10 3.542 -3.842 13.257 1.00 33.21 C ATOM 118 NH1 ARG A 10 2.870 -4.785 12.612 1.00 44.31 N ATOM 119 NH2 ARG A 10 3.507 -3.798 14.583 1.00 73.12 N ATOM 0 HA ARG A 10 0.647 -1.409 10.126 1.00 12.21 H new ATOM 0 HB2 ARG A 10 3.364 -0.411 10.995 1.00 4.44 H new ATOM 0 HB3 ARG A 10 2.349 -1.286 12.125 1.00 4.44 H new ATOM 0 HG2 ARG A 10 2.276 -3.225 10.618 1.00 54.32 H new ATOM 0 HG3 ARG A 10 3.188 -2.351 9.404 1.00 54.32 H new ATOM 0 HD2 ARG A 10 4.595 -3.914 10.759 1.00 73.44 H new ATOM 0 HD3 ARG A 10 5.148 -2.253 10.822 1.00 73.44 H new ATOM 0 HE ARG A 10 4.754 -2.232 13.108 1.00 54.33 H new ATOM 0 HH11 ARG A 10 2.894 -4.822 11.593 1.00 44.31 H new ATOM 0 HH12 ARG A 10 2.329 -5.473 13.135 1.00 44.31 H new ATOM 0 HH21 ARG A 10 4.023 -3.074 15.083 1.00 73.12 H new ATOM 0 HH22 ARG A 10 2.964 -4.488 15.102 1.00 73.12 H new ATOM 133 N ASN A 11 1.058 1.601 11.397 1.00 12.42 N ATOM 134 CA ASN A 11 0.448 2.603 12.264 1.00 1.42 C ATOM 135 C ASN A 11 -0.956 2.956 11.784 1.00 12.34 C ATOM 136 O ASN A 11 -1.837 3.269 12.585 1.00 73.30 O ATOM 137 CB ASN A 11 1.316 3.863 12.311 1.00 35.22 C ATOM 138 CG ASN A 11 0.973 4.842 11.206 1.00 61.32 C ATOM 139 OD1 ASN A 11 -0.159 5.319 11.112 1.00 62.53 O ATOM 140 ND2 ASN A 11 1.951 5.147 10.361 1.00 45.45 N ATOM 0 H ASN A 11 1.863 1.935 10.868 1.00 12.42 H new ATOM 0 HA ASN A 11 0.374 2.183 13.267 1.00 1.42 H new ATOM 0 HB2 ASN A 11 1.191 4.351 13.277 1.00 35.22 H new ATOM 0 HB3 ASN A 11 2.366 3.581 12.230 1.00 35.22 H new ATOM 0 HD21 ASN A 11 1.779 5.800 9.597 1.00 45.45 H new ATOM 0 HD22 ASN A 11 2.874 4.728 10.476 1.00 45.45 H new ATOM 147 N VAL A 12 -1.157 2.906 10.471 1.00 32.51 N ATOM 148 CA VAL A 12 -2.454 3.218 9.884 1.00 61.34 C ATOM 149 C VAL A 12 -3.458 2.102 10.144 1.00 55.13 C ATOM 150 O VAL A 12 -4.511 2.327 10.742 1.00 43.34 O ATOM 151 CB VAL A 12 -2.341 3.448 8.365 1.00 62.24 C ATOM 152 CG1 VAL A 12 -1.601 2.295 7.703 1.00 0.33 C ATOM 153 CG2 VAL A 12 -3.721 3.630 7.750 1.00 25.21 C ATOM 0 H VAL A 12 -0.438 2.652 9.794 1.00 32.51 H new ATOM 0 HA VAL A 12 -2.804 4.135 10.359 1.00 61.34 H new ATOM 0 HB VAL A 12 -1.769 4.360 8.195 1.00 62.24 H new ATOM 0 HG11 VAL A 12 -1.531 2.476 6.630 1.00 0.33 H new ATOM 0 HG12 VAL A 12 -0.599 2.217 8.124 1.00 0.33 H new ATOM 0 HG13 VAL A 12 -2.142 1.366 7.880 1.00 0.33 H new ATOM 0 HG21 VAL A 12 -3.623 3.791 6.677 1.00 25.21 H new ATOM 0 HG22 VAL A 12 -4.320 2.737 7.929 1.00 25.21 H new ATOM 0 HG23 VAL A 12 -4.210 4.492 8.203 1.00 25.21 H new ATOM 163 N GLU A 13 -3.128 0.896 9.692 1.00 45.14 N ATOM 164 CA GLU A 13 -4.002 -0.256 9.876 1.00 4.24 C ATOM 165 C GLU A 13 -4.506 -0.331 11.315 1.00 72.02 C ATOM 166 O GLU A 13 -5.700 -0.511 11.556 1.00 54.44 O ATOM 167 CB GLU A 13 -3.265 -1.546 9.514 1.00 30.22 C ATOM 168 CG GLU A 13 -1.954 -1.728 10.260 1.00 62.33 C ATOM 169 CD GLU A 13 -1.186 -2.953 9.799 1.00 10.55 C ATOM 170 OE1 GLU A 13 -0.920 -3.065 8.585 1.00 73.41 O ATOM 171 OE2 GLU A 13 -0.852 -3.799 10.656 1.00 24.11 O ATOM 0 H GLU A 13 -2.261 0.692 9.195 1.00 45.14 H new ATOM 0 HA GLU A 13 -4.860 -0.139 9.214 1.00 4.24 H new ATOM 0 HB2 GLU A 13 -3.914 -2.396 9.724 1.00 30.22 H new ATOM 0 HB3 GLU A 13 -3.067 -1.553 8.442 1.00 30.22 H new ATOM 0 HG2 GLU A 13 -1.335 -0.842 10.121 1.00 62.33 H new ATOM 0 HG3 GLU A 13 -2.156 -1.811 11.328 1.00 62.33 H new ATOM 178 N ILE A 14 -3.588 -0.193 12.265 1.00 41.34 N ATOM 179 CA ILE A 14 -3.939 -0.244 13.678 1.00 14.03 C ATOM 180 C ILE A 14 -4.852 0.915 14.061 1.00 53.40 C ATOM 181 O ILE A 14 -5.727 0.774 14.915 1.00 75.42 O ATOM 182 CB ILE A 14 -2.685 -0.211 14.571 1.00 14.24 C ATOM 183 CG1 ILE A 14 -1.963 1.130 14.426 1.00 71.15 C ATOM 184 CG2 ILE A 14 -1.754 -1.362 14.220 1.00 2.43 C ATOM 185 CD1 ILE A 14 -0.774 1.280 15.350 1.00 54.53 C ATOM 0 H ILE A 14 -2.596 -0.045 12.082 1.00 41.34 H new ATOM 0 HA ILE A 14 -4.465 -1.185 13.838 1.00 14.03 H new ATOM 0 HB ILE A 14 -2.994 -0.324 15.610 1.00 14.24 H new ATOM 0 HG12 ILE A 14 -1.628 1.243 13.395 1.00 71.15 H new ATOM 0 HG13 ILE A 14 -2.669 1.937 14.622 1.00 71.15 H new ATOM 0 HG21 ILE A 14 -0.872 -1.325 14.860 1.00 2.43 H new ATOM 0 HG22 ILE A 14 -2.273 -2.309 14.371 1.00 2.43 H new ATOM 0 HG23 ILE A 14 -1.449 -1.278 13.177 1.00 2.43 H new ATOM 0 HD11 ILE A 14 -0.311 2.254 15.192 1.00 54.53 H new ATOM 0 HD12 ILE A 14 -1.105 1.199 16.385 1.00 54.53 H new ATOM 0 HD13 ILE A 14 -0.048 0.495 15.139 1.00 54.53 H new ATOM 197 N TRP A 15 -4.643 2.061 13.422 1.00 13.43 N ATOM 198 CA TRP A 15 -5.449 3.246 13.695 1.00 72.40 C ATOM 199 C TRP A 15 -6.885 3.049 13.218 1.00 44.43 C ATOM 200 O TRP A 15 -7.822 3.606 13.790 1.00 23.01 O ATOM 201 CB TRP A 15 -4.836 4.472 13.017 1.00 73.54 C ATOM 202 CG TRP A 15 -5.704 5.692 13.099 1.00 64.03 C ATOM 203 CD1 TRP A 15 -6.086 6.351 14.232 1.00 5.15 C ATOM 204 CD2 TRP A 15 -6.297 6.396 12.003 1.00 51.31 C ATOM 205 NE1 TRP A 15 -6.880 7.423 13.907 1.00 73.12 N ATOM 206 CE2 TRP A 15 -7.026 7.473 12.546 1.00 4.01 C ATOM 207 CE3 TRP A 15 -6.283 6.224 10.616 1.00 52.31 C ATOM 208 CZ2 TRP A 15 -7.732 8.371 11.750 1.00 64.11 C ATOM 209 CZ3 TRP A 15 -6.986 7.115 9.827 1.00 1.34 C ATOM 210 CH2 TRP A 15 -7.701 8.178 10.395 1.00 2.21 C ATOM 0 H TRP A 15 -3.923 2.195 12.712 1.00 13.43 H new ATOM 0 HA TRP A 15 -5.463 3.406 14.773 1.00 72.40 H new ATOM 0 HB2 TRP A 15 -3.872 4.689 13.477 1.00 73.54 H new ATOM 0 HB3 TRP A 15 -4.644 4.241 11.969 1.00 73.54 H new ATOM 0 HD1 TRP A 15 -5.805 6.070 15.236 1.00 5.15 H new ATOM 0 HE1 TRP A 15 -7.294 8.077 14.572 1.00 73.12 H new ATOM 0 HE3 TRP A 15 -5.733 5.409 10.169 1.00 52.31 H new ATOM 0 HZ2 TRP A 15 -8.284 9.190 12.186 1.00 64.11 H new ATOM 0 HZ3 TRP A 15 -6.984 6.990 8.754 1.00 1.34 H new ATOM 0 HH2 TRP A 15 -8.238 8.858 9.751 1.00 2.21 H new ATOM 221 N LYS A 16 -7.050 2.253 12.166 1.00 3.41 N ATOM 222 CA LYS A 16 -8.371 1.982 11.612 1.00 24.03 C ATOM 223 C LYS A 16 -9.080 0.891 12.408 1.00 13.24 C ATOM 224 O LYS A 16 -10.297 0.937 12.592 1.00 32.54 O ATOM 225 CB LYS A 16 -8.255 1.564 10.145 1.00 74.33 C ATOM 226 CG LYS A 16 -7.197 2.335 9.375 1.00 41.12 C ATOM 227 CD LYS A 16 -7.784 3.561 8.695 1.00 73.32 C ATOM 228 CE LYS A 16 -6.991 3.944 7.455 1.00 25.20 C ATOM 229 NZ LYS A 16 -7.842 4.623 6.439 1.00 60.41 N ATOM 0 H LYS A 16 -6.285 1.785 11.680 1.00 3.41 H new ATOM 0 HA LYS A 16 -8.960 2.897 11.677 1.00 24.03 H new ATOM 0 HB2 LYS A 16 -8.025 0.500 10.096 1.00 74.33 H new ATOM 0 HB3 LYS A 16 -9.220 1.704 9.659 1.00 74.33 H new ATOM 0 HG2 LYS A 16 -6.402 2.641 10.055 1.00 41.12 H new ATOM 0 HG3 LYS A 16 -6.744 1.685 8.627 1.00 41.12 H new ATOM 0 HD2 LYS A 16 -8.820 3.364 8.419 1.00 73.32 H new ATOM 0 HD3 LYS A 16 -7.794 4.397 9.395 1.00 73.32 H new ATOM 0 HE2 LYS A 16 -6.169 4.602 7.738 1.00 25.20 H new ATOM 0 HE3 LYS A 16 -6.547 3.050 7.018 1.00 25.20 H new ATOM 0 HZ1 LYS A 16 -7.264 4.868 5.610 1.00 60.41 H new ATOM 0 HZ2 LYS A 16 -8.612 3.986 6.149 1.00 60.41 H new ATOM 0 HZ3 LYS A 16 -8.246 5.490 6.848 1.00 60.41 H new ATOM 243 N ILE A 17 -8.314 -0.086 12.878 1.00 5.41 N ATOM 244 CA ILE A 17 -8.870 -1.186 13.657 1.00 63.13 C ATOM 245 C ILE A 17 -9.406 -0.695 14.997 1.00 65.53 C ATOM 246 O ILE A 17 -10.291 -1.314 15.588 1.00 52.23 O ATOM 247 CB ILE A 17 -7.819 -2.285 13.907 1.00 15.34 C ATOM 248 CG1 ILE A 17 -8.488 -3.661 13.940 1.00 2.11 C ATOM 249 CG2 ILE A 17 -7.077 -2.020 15.209 1.00 65.44 C ATOM 250 CD1 ILE A 17 -9.170 -4.032 12.643 1.00 74.24 C ATOM 0 H ILE A 17 -7.306 -0.139 12.733 1.00 5.41 H new ATOM 0 HA ILE A 17 -9.690 -1.605 13.073 1.00 63.13 H new ATOM 0 HB ILE A 17 -7.097 -2.271 13.090 1.00 15.34 H new ATOM 0 HG12 ILE A 17 -7.737 -4.415 14.175 1.00 2.11 H new ATOM 0 HG13 ILE A 17 -9.222 -3.680 14.746 1.00 2.11 H new ATOM 0 HG21 ILE A 17 -6.338 -2.804 15.373 1.00 65.44 H new ATOM 0 HG22 ILE A 17 -6.575 -1.054 15.152 1.00 65.44 H new ATOM 0 HG23 ILE A 17 -7.786 -2.011 16.037 1.00 65.44 H new ATOM 0 HD11 ILE A 17 -9.622 -5.019 12.739 1.00 74.24 H new ATOM 0 HD12 ILE A 17 -9.944 -3.299 12.416 1.00 74.24 H new ATOM 0 HD13 ILE A 17 -8.436 -4.046 11.837 1.00 74.24 H new ATOM 262 N LYS A 18 -8.865 0.422 15.471 1.00 41.03 N ATOM 263 CA LYS A 18 -9.291 1.000 16.741 1.00 64.42 C ATOM 264 C LYS A 18 -10.406 2.018 16.528 1.00 5.50 C ATOM 265 O LYS A 18 -11.532 1.826 16.986 1.00 52.14 O ATOM 266 CB LYS A 18 -8.105 1.664 17.445 1.00 73.22 C ATOM 267 CG LYS A 18 -7.252 2.519 16.524 1.00 2.31 C ATOM 268 CD LYS A 18 -7.420 3.999 16.823 1.00 1.01 C ATOM 269 CE LYS A 18 -6.397 4.481 17.841 1.00 11.13 C ATOM 270 NZ LYS A 18 -6.813 4.168 19.236 1.00 32.15 N ATOM 0 H LYS A 18 -8.130 0.946 14.995 1.00 41.03 H new ATOM 0 HA LYS A 18 -9.674 0.195 17.369 1.00 64.42 H new ATOM 0 HB2 LYS A 18 -8.478 2.284 18.260 1.00 73.22 H new ATOM 0 HB3 LYS A 18 -7.480 0.891 17.892 1.00 73.22 H new ATOM 0 HG2 LYS A 18 -6.204 2.241 16.635 1.00 2.31 H new ATOM 0 HG3 LYS A 18 -7.525 2.323 15.487 1.00 2.31 H new ATOM 0 HD2 LYS A 18 -7.316 4.572 15.901 1.00 1.01 H new ATOM 0 HD3 LYS A 18 -8.426 4.183 17.201 1.00 1.01 H new ATOM 0 HE2 LYS A 18 -5.433 4.015 17.636 1.00 11.13 H new ATOM 0 HE3 LYS A 18 -6.259 5.557 17.736 1.00 11.13 H new ATOM 0 HZ1 LYS A 18 -6.518 4.940 19.868 1.00 32.15 H new ATOM 0 HZ2 LYS A 18 -7.847 4.065 19.275 1.00 32.15 H new ATOM 0 HZ3 LYS A 18 -6.365 3.281 19.541 1.00 32.15 H new ATOM 284 N LYS A 19 -10.085 3.103 15.831 1.00 44.11 N ATOM 285 CA LYS A 19 -11.059 4.152 15.554 1.00 44.00 C ATOM 286 C LYS A 19 -12.403 3.553 15.150 1.00 25.14 C ATOM 287 O LYS A 19 -13.458 4.118 15.440 1.00 2.22 O ATOM 288 CB LYS A 19 -10.545 5.075 14.446 1.00 34.24 C ATOM 289 CG LYS A 19 -11.379 6.333 14.269 1.00 61.43 C ATOM 290 CD LYS A 19 -10.997 7.401 15.278 1.00 11.44 C ATOM 291 CE LYS A 19 -12.052 8.494 15.358 1.00 42.13 C ATOM 292 NZ LYS A 19 -11.574 9.671 16.134 1.00 24.05 N ATOM 0 H LYS A 19 -9.156 3.279 15.447 1.00 44.11 H new ATOM 0 HA LYS A 19 -11.199 4.733 16.465 1.00 44.00 H new ATOM 0 HB2 LYS A 19 -9.516 5.359 14.669 1.00 34.24 H new ATOM 0 HB3 LYS A 19 -10.527 4.525 13.505 1.00 34.24 H new ATOM 0 HG2 LYS A 19 -11.245 6.721 13.259 1.00 61.43 H new ATOM 0 HG3 LYS A 19 -12.436 6.089 14.379 1.00 61.43 H new ATOM 0 HD2 LYS A 19 -10.868 6.946 16.260 1.00 11.44 H new ATOM 0 HD3 LYS A 19 -10.038 7.839 15.001 1.00 11.44 H new ATOM 0 HE2 LYS A 19 -12.325 8.810 14.351 1.00 42.13 H new ATOM 0 HE3 LYS A 19 -12.954 8.095 15.822 1.00 42.13 H new ATOM 0 HZ1 LYS A 19 -12.322 10.393 16.165 1.00 24.05 H new ATOM 0 HZ2 LYS A 19 -11.338 9.375 17.103 1.00 24.05 H new ATOM 0 HZ3 LYS A 19 -10.728 10.068 15.677 1.00 24.05 H new ATOM 306 N LEU A 20 -12.356 2.407 14.481 1.00 72.01 N ATOM 307 CA LEU A 20 -13.571 1.731 14.037 1.00 24.31 C ATOM 308 C LEU A 20 -14.133 0.841 15.142 1.00 65.32 C ATOM 309 O LEU A 20 -15.193 1.123 15.701 1.00 4.34 O ATOM 310 CB LEU A 20 -13.286 0.894 12.789 1.00 40.03 C ATOM 311 CG LEU A 20 -14.476 0.132 12.205 1.00 53.44 C ATOM 312 CD1 LEU A 20 -15.445 1.091 11.530 1.00 45.43 C ATOM 313 CD2 LEU A 20 -14.002 -0.927 11.223 1.00 65.05 C ATOM 0 H LEU A 20 -11.491 1.926 14.234 1.00 72.01 H new ATOM 0 HA LEU A 20 -14.313 2.492 13.795 1.00 24.31 H new ATOM 0 HB2 LEU A 20 -12.888 1.553 12.017 1.00 40.03 H new ATOM 0 HB3 LEU A 20 -12.503 0.175 13.029 1.00 40.03 H new ATOM 0 HG LEU A 20 -14.999 -0.366 13.021 1.00 53.44 H new ATOM 0 HD11 LEU A 20 -16.285 0.531 11.120 1.00 45.43 H new ATOM 0 HD12 LEU A 20 -15.811 1.812 12.261 1.00 45.43 H new ATOM 0 HD13 LEU A 20 -14.933 1.618 10.725 1.00 45.43 H new ATOM 0 HD21 LEU A 20 -14.863 -1.459 10.818 1.00 65.05 H new ATOM 0 HD22 LEU A 20 -13.454 -0.450 10.410 1.00 65.05 H new ATOM 0 HD23 LEU A 20 -13.348 -1.632 11.736 1.00 65.05 H new ATOM 325 N ILE A 21 -13.414 -0.234 15.452 1.00 42.53 N ATOM 326 CA ILE A 21 -13.839 -1.162 16.492 1.00 53.12 C ATOM 327 C ILE A 21 -14.411 -0.418 17.693 1.00 11.01 C ATOM 328 O ILE A 21 -15.395 -0.849 18.294 1.00 13.10 O ATOM 329 CB ILE A 21 -12.674 -2.053 16.961 1.00 1.14 C ATOM 330 CG1 ILE A 21 -13.208 -3.360 17.551 1.00 13.31 C ATOM 331 CG2 ILE A 21 -11.820 -1.314 17.982 1.00 74.53 C ATOM 332 CD1 ILE A 21 -13.590 -3.252 19.011 1.00 12.43 C ATOM 0 H ILE A 21 -12.535 -0.483 14.998 1.00 42.53 H new ATOM 0 HA ILE A 21 -14.614 -1.792 16.055 1.00 53.12 H new ATOM 0 HB ILE A 21 -12.050 -2.293 16.100 1.00 1.14 H new ATOM 0 HG12 ILE A 21 -14.079 -3.679 16.978 1.00 13.31 H new ATOM 0 HG13 ILE A 21 -12.451 -4.136 17.438 1.00 13.31 H new ATOM 0 HG21 ILE A 21 -11.001 -1.957 18.304 1.00 74.53 H new ATOM 0 HG22 ILE A 21 -11.415 -0.408 17.530 1.00 74.53 H new ATOM 0 HG23 ILE A 21 -12.432 -1.047 18.843 1.00 74.53 H new ATOM 0 HD11 ILE A 21 -13.960 -4.215 19.362 1.00 12.43 H new ATOM 0 HD12 ILE A 21 -12.716 -2.964 19.595 1.00 12.43 H new ATOM 0 HD13 ILE A 21 -14.369 -2.499 19.128 1.00 12.43 H new ATOM 344 N LYS A 22 -13.789 0.705 18.038 1.00 12.13 N ATOM 345 CA LYS A 22 -14.238 1.513 19.166 1.00 4.40 C ATOM 346 C LYS A 22 -15.495 2.299 18.807 1.00 32.41 C ATOM 347 O LYS A 22 -16.540 2.135 19.436 1.00 53.23 O ATOM 348 CB LYS A 22 -13.130 2.475 19.603 1.00 53.23 C ATOM 349 CG LYS A 22 -12.201 1.894 20.654 1.00 4.31 C ATOM 350 CD LYS A 22 -11.638 2.977 21.559 1.00 51.31 C ATOM 351 CE LYS A 22 -12.552 3.243 22.746 1.00 45.34 C ATOM 352 NZ LYS A 22 -13.643 4.197 22.404 1.00 42.35 N ATOM 0 H LYS A 22 -12.972 1.076 17.552 1.00 12.13 H new ATOM 0 HA LYS A 22 -14.475 0.841 19.991 1.00 4.40 H new ATOM 0 HB2 LYS A 22 -12.544 2.761 18.730 1.00 53.23 H new ATOM 0 HB3 LYS A 22 -13.584 3.385 19.995 1.00 53.23 H new ATOM 0 HG2 LYS A 22 -12.741 1.162 21.254 1.00 4.31 H new ATOM 0 HG3 LYS A 22 -11.383 1.365 20.165 1.00 4.31 H new ATOM 0 HD2 LYS A 22 -10.653 2.678 21.917 1.00 51.31 H new ATOM 0 HD3 LYS A 22 -11.504 3.896 20.988 1.00 51.31 H new ATOM 0 HE2 LYS A 22 -12.986 2.303 23.088 1.00 45.34 H new ATOM 0 HE3 LYS A 22 -11.966 3.643 23.573 1.00 45.34 H new ATOM 0 HZ1 LYS A 22 -13.981 4.663 23.270 1.00 42.35 H new ATOM 0 HZ2 LYS A 22 -13.282 4.915 21.744 1.00 42.35 H new ATOM 0 HZ3 LYS A 22 -14.429 3.681 21.959 1.00 42.35 H new ATOM 366 N SER A 23 -15.386 3.150 17.792 1.00 3.10 N ATOM 367 CA SER A 23 -16.514 3.962 17.351 1.00 52.25 C ATOM 368 C SER A 23 -17.750 3.097 17.122 1.00 34.34 C ATOM 369 O SER A 23 -18.880 3.545 17.318 1.00 13.55 O ATOM 370 CB SER A 23 -16.158 4.712 16.065 1.00 12.32 C ATOM 371 OG SER A 23 -15.238 5.758 16.324 1.00 30.22 O ATOM 0 H SER A 23 -14.528 3.295 17.260 1.00 3.10 H new ATOM 0 HA SER A 23 -16.738 4.685 18.136 1.00 52.25 H new ATOM 0 HB2 SER A 23 -15.730 4.018 15.342 1.00 12.32 H new ATOM 0 HB3 SER A 23 -17.063 5.122 15.617 1.00 12.32 H new ATOM 0 HG SER A 23 -14.367 5.530 15.937 1.00 30.22 H new ATOM 377 N LEU A 24 -17.527 1.855 16.708 1.00 44.41 N ATOM 378 CA LEU A 24 -18.622 0.926 16.452 1.00 22.35 C ATOM 379 C LEU A 24 -19.179 0.369 17.759 1.00 30.53 C ATOM 380 O LEU A 24 -20.375 0.470 18.028 1.00 53.43 O ATOM 381 CB LEU A 24 -18.145 -0.221 15.558 1.00 31.10 C ATOM 382 CG LEU A 24 -19.236 -1.140 15.009 1.00 61.14 C ATOM 383 CD1 LEU A 24 -20.377 -0.324 14.422 1.00 53.31 C ATOM 384 CD2 LEU A 24 -18.660 -2.084 13.962 1.00 41.23 C ATOM 0 H LEU A 24 -16.598 1.468 16.542 1.00 44.41 H new ATOM 0 HA LEU A 24 -19.417 1.470 15.942 1.00 22.35 H new ATOM 0 HB2 LEU A 24 -17.598 0.204 14.716 1.00 31.10 H new ATOM 0 HB3 LEU A 24 -17.438 -0.827 16.124 1.00 31.10 H new ATOM 0 HG LEU A 24 -19.630 -1.737 15.832 1.00 61.14 H new ATOM 0 HD11 LEU A 24 -21.144 -0.996 14.036 1.00 53.31 H new ATOM 0 HD12 LEU A 24 -20.807 0.311 15.197 1.00 53.31 H new ATOM 0 HD13 LEU A 24 -19.999 0.299 13.611 1.00 53.31 H new ATOM 0 HD21 LEU A 24 -19.450 -2.731 13.582 1.00 41.23 H new ATOM 0 HD22 LEU A 24 -18.240 -1.504 13.141 1.00 41.23 H new ATOM 0 HD23 LEU A 24 -17.877 -2.694 14.413 1.00 41.23 H new ATOM 396 N GLU A 25 -18.302 -0.219 18.567 1.00 60.00 N ATOM 397 CA GLU A 25 -18.708 -0.791 19.846 1.00 62.43 C ATOM 398 C GLU A 25 -19.318 0.276 20.750 1.00 4.12 C ATOM 399 O GLU A 25 -20.108 -0.029 21.643 1.00 51.11 O ATOM 400 CB GLU A 25 -17.510 -1.440 20.542 1.00 2.20 C ATOM 401 CG GLU A 25 -16.742 -0.490 21.446 1.00 52.01 C ATOM 402 CD GLU A 25 -15.496 -1.122 22.033 1.00 24.42 C ATOM 403 OE1 GLU A 25 -15.438 -2.368 22.100 1.00 73.24 O ATOM 404 OE2 GLU A 25 -14.578 -0.372 22.426 1.00 24.52 O ATOM 0 H GLU A 25 -17.308 -0.312 18.359 1.00 60.00 H new ATOM 0 HA GLU A 25 -19.463 -1.553 19.651 1.00 62.43 H new ATOM 0 HB2 GLU A 25 -17.859 -2.287 21.132 1.00 2.20 H new ATOM 0 HB3 GLU A 25 -16.832 -1.836 19.786 1.00 2.20 H new ATOM 0 HG2 GLU A 25 -16.462 0.398 20.879 1.00 52.01 H new ATOM 0 HG3 GLU A 25 -17.393 -0.159 22.255 1.00 52.01 H new ATOM 411 N ALA A 26 -18.945 1.530 20.511 1.00 24.41 N ATOM 412 CA ALA A 26 -19.456 2.643 21.302 1.00 74.33 C ATOM 413 C ALA A 26 -20.907 2.946 20.949 1.00 54.23 C ATOM 414 O ALA A 26 -21.656 3.484 21.764 1.00 23.14 O ATOM 415 CB ALA A 26 -18.591 3.877 21.096 1.00 31.12 C ATOM 0 H ALA A 26 -18.291 1.800 19.776 1.00 24.41 H new ATOM 0 HA ALA A 26 -19.418 2.358 22.353 1.00 74.33 H new ATOM 0 HB1 ALA A 26 -18.984 4.700 21.692 1.00 31.12 H new ATOM 0 HB2 ALA A 26 -17.569 3.660 21.405 1.00 31.12 H new ATOM 0 HB3 ALA A 26 -18.600 4.156 20.042 1.00 31.12 H new ATOM 421 N ALA A 27 -21.299 2.598 19.727 1.00 41.42 N ATOM 422 CA ALA A 27 -22.663 2.832 19.266 1.00 5.54 C ATOM 423 C ALA A 27 -23.554 1.629 19.553 1.00 2.32 C ATOM 424 O ALA A 27 -23.291 0.523 19.080 1.00 4.41 O ATOM 425 CB ALA A 27 -22.668 3.154 17.779 1.00 14.33 C ATOM 0 H ALA A 27 -20.692 2.153 19.039 1.00 41.42 H new ATOM 0 HA ALA A 27 -23.064 3.685 19.813 1.00 5.54 H new ATOM 0 HB1 ALA A 27 -23.692 3.326 17.448 1.00 14.33 H new ATOM 0 HB2 ALA A 27 -22.073 4.049 17.599 1.00 14.33 H new ATOM 0 HB3 ALA A 27 -22.243 2.318 17.224 1.00 14.33 H new ATOM 431 N ARG A 28 -24.608 1.852 20.330 1.00 22.33 N ATOM 432 CA ARG A 28 -25.537 0.784 20.682 1.00 53.41 C ATOM 433 C ARG A 28 -26.981 1.226 20.462 1.00 65.43 C ATOM 434 O ARG A 28 -27.247 2.390 20.168 1.00 3.34 O ATOM 435 CB ARG A 28 -25.337 0.364 22.139 1.00 34.21 C ATOM 436 CG ARG A 28 -24.495 -0.892 22.301 1.00 35.14 C ATOM 437 CD ARG A 28 -23.010 -0.569 22.319 1.00 42.43 C ATOM 438 NE ARG A 28 -22.665 0.364 23.389 1.00 52.54 N ATOM 439 CZ ARG A 28 -22.591 0.019 24.670 1.00 53.21 C ATOM 440 NH1 ARG A 28 -22.836 -1.231 25.038 1.00 63.23 N ATOM 441 NH2 ARG A 28 -22.272 0.925 25.585 1.00 21.31 N ATOM 0 H ARG A 28 -24.841 2.762 20.728 1.00 22.33 H new ATOM 0 HA ARG A 28 -25.333 -0.069 20.035 1.00 53.41 H new ATOM 0 HB2 ARG A 28 -24.863 1.182 22.682 1.00 34.21 H new ATOM 0 HB3 ARG A 28 -26.312 0.199 22.598 1.00 34.21 H new ATOM 0 HG2 ARG A 28 -24.769 -1.398 23.226 1.00 35.14 H new ATOM 0 HG3 ARG A 28 -24.708 -1.582 21.485 1.00 35.14 H new ATOM 0 HD2 ARG A 28 -22.440 -1.490 22.444 1.00 42.43 H new ATOM 0 HD3 ARG A 28 -22.720 -0.142 21.359 1.00 42.43 H new ATOM 0 HE ARG A 28 -22.470 1.334 23.139 1.00 52.54 H new ATOM 0 HH11 ARG A 28 -23.082 -1.930 24.337 1.00 63.23 H new ATOM 0 HH12 ARG A 28 -22.779 -1.494 26.022 1.00 63.23 H new ATOM 0 HH21 ARG A 28 -22.083 1.888 25.305 1.00 21.31 H new ATOM 0 HH22 ARG A 28 -22.216 0.659 26.568 1.00 21.31 H new ATOM 455 N GLY A 29 -27.910 0.286 20.606 1.00 60.02 N ATOM 456 CA GLY A 29 -29.315 0.597 20.420 1.00 75.13 C ATOM 457 C GLY A 29 -30.189 0.013 21.511 1.00 70.40 C ATOM 458 O GLY A 29 -29.877 -1.039 22.068 1.00 33.13 O ATOM 0 H GLY A 29 -27.715 -0.685 20.848 1.00 60.02 H new ATOM 0 HA2 GLY A 29 -29.444 1.679 20.396 1.00 75.13 H new ATOM 0 HA3 GLY A 29 -29.643 0.215 19.453 1.00 75.13 H new ATOM 462 N ASN A 30 -31.287 0.697 21.819 1.00 44.20 N ATOM 463 CA ASN A 30 -32.207 0.240 22.854 1.00 44.03 C ATOM 464 C ASN A 30 -32.666 -1.189 22.580 1.00 31.54 C ATOM 465 O ASN A 30 -32.804 -1.995 23.500 1.00 14.52 O ATOM 466 CB ASN A 30 -33.419 1.170 22.934 1.00 62.11 C ATOM 467 CG ASN A 30 -33.924 1.581 21.564 1.00 11.35 C ATOM 468 OD1 ASN A 30 -33.592 2.656 21.066 1.00 42.44 O ATOM 469 ND2 ASN A 30 -34.733 0.725 20.951 1.00 21.23 N ATOM 0 H ASN A 30 -31.561 1.569 21.367 1.00 44.20 H new ATOM 0 HA ASN A 30 -31.680 0.257 23.808 1.00 44.03 H new ATOM 0 HB2 ASN A 30 -34.221 0.672 23.479 1.00 62.11 H new ATOM 0 HB3 ASN A 30 -33.153 2.061 23.503 1.00 62.11 H new ATOM 0 HD21 ASN A 30 -35.106 0.948 20.028 1.00 21.23 H new ATOM 0 HD22 ASN A 30 -34.981 -0.155 21.403 1.00 21.23 H new ATOM 476 N GLY A 31 -32.900 -1.498 21.308 1.00 12.51 N ATOM 477 CA GLY A 31 -33.340 -2.829 20.937 1.00 74.35 C ATOM 478 C GLY A 31 -32.612 -3.362 19.718 1.00 0.22 C ATOM 479 O GLY A 31 -33.058 -3.170 18.587 1.00 62.43 O ATOM 0 H GLY A 31 -32.792 -0.849 20.528 1.00 12.51 H new ATOM 0 HA2 GLY A 31 -33.183 -3.507 21.776 1.00 74.35 H new ATOM 0 HA3 GLY A 31 -34.411 -2.812 20.738 1.00 74.35 H new ATOM 483 N THR A 32 -31.487 -4.031 19.949 1.00 63.21 N ATOM 484 CA THR A 32 -30.694 -4.590 18.861 1.00 4.21 C ATOM 485 C THR A 32 -29.799 -5.719 19.359 1.00 40.05 C ATOM 486 O THR A 32 -29.282 -5.669 20.475 1.00 62.22 O ATOM 487 CB THR A 32 -29.819 -3.513 18.192 1.00 4.24 C ATOM 488 OG1 THR A 32 -28.616 -4.103 17.687 1.00 53.11 O ATOM 489 CG2 THR A 32 -29.471 -2.409 19.180 1.00 15.23 C ATOM 0 H THR A 32 -31.104 -4.199 20.880 1.00 63.21 H new ATOM 0 HA THR A 32 -31.397 -4.983 18.126 1.00 4.21 H new ATOM 0 HB THR A 32 -30.384 -3.078 17.368 1.00 4.24 H new ATOM 0 HG1 THR A 32 -28.006 -3.397 17.387 1.00 53.11 H new ATOM 0 HG21 THR A 32 -28.853 -1.660 18.686 1.00 15.23 H new ATOM 0 HG22 THR A 32 -30.387 -1.942 19.542 1.00 15.23 H new ATOM 0 HG23 THR A 32 -28.923 -2.833 20.022 1.00 15.23 H new ATOM 497 N SER A 33 -29.618 -6.736 18.522 1.00 23.20 N ATOM 498 CA SER A 33 -28.787 -7.881 18.878 1.00 54.12 C ATOM 499 C SER A 33 -27.489 -7.878 18.077 1.00 23.12 C ATOM 500 O SER A 33 -27.473 -8.234 16.899 1.00 4.33 O ATOM 501 CB SER A 33 -29.548 -9.185 18.634 1.00 65.20 C ATOM 502 OG SER A 33 -30.493 -9.038 17.590 1.00 64.14 O ATOM 0 H SER A 33 -30.035 -6.791 17.593 1.00 23.20 H new ATOM 0 HA SER A 33 -28.540 -7.806 19.937 1.00 54.12 H new ATOM 0 HB2 SER A 33 -28.844 -9.978 18.382 1.00 65.20 H new ATOM 0 HB3 SER A 33 -30.057 -9.489 19.549 1.00 65.20 H new ATOM 0 HG SER A 33 -30.964 -9.886 17.454 1.00 64.14 H new ATOM 508 N MET A 34 -26.400 -7.475 18.727 1.00 35.51 N ATOM 509 CA MET A 34 -25.097 -7.428 18.076 1.00 40.21 C ATOM 510 C MET A 34 -24.393 -8.779 18.170 1.00 51.52 C ATOM 511 O MET A 34 -24.155 -9.290 19.264 1.00 13.23 O ATOM 512 CB MET A 34 -24.226 -6.341 18.710 1.00 2.41 C ATOM 513 CG MET A 34 -25.015 -5.131 19.185 1.00 70.53 C ATOM 514 SD MET A 34 -25.134 -3.843 17.929 1.00 72.41 S ATOM 515 CE MET A 34 -25.309 -2.385 18.954 1.00 32.22 C ATOM 0 H MET A 34 -26.396 -7.177 19.702 1.00 35.51 H new ATOM 0 HA MET A 34 -25.252 -7.192 17.023 1.00 40.21 H new ATOM 0 HB2 MET A 34 -23.685 -6.767 19.555 1.00 2.41 H new ATOM 0 HB3 MET A 34 -23.479 -6.016 17.985 1.00 2.41 H new ATOM 0 HG2 MET A 34 -26.018 -5.446 19.473 1.00 70.53 H new ATOM 0 HG3 MET A 34 -24.542 -4.721 20.077 1.00 70.53 H new ATOM 0 HE1 MET A 34 -25.821 -1.604 18.392 1.00 32.22 H new ATOM 0 HE2 MET A 34 -25.890 -2.633 19.843 1.00 32.22 H new ATOM 0 HE3 MET A 34 -24.323 -2.029 19.252 1.00 32.22 H new ATOM 525 N ILE A 35 -24.063 -9.349 17.016 1.00 4.15 N ATOM 526 CA ILE A 35 -23.386 -10.640 16.970 1.00 41.04 C ATOM 527 C ILE A 35 -21.886 -10.466 16.752 1.00 31.45 C ATOM 528 O ILE A 35 -21.458 -9.696 15.892 1.00 34.10 O ATOM 529 CB ILE A 35 -23.955 -11.534 15.853 1.00 73.35 C ATOM 530 CG1 ILE A 35 -25.380 -11.973 16.197 1.00 24.14 C ATOM 531 CG2 ILE A 35 -23.060 -12.745 15.636 1.00 43.42 C ATOM 532 CD1 ILE A 35 -26.178 -12.430 14.997 1.00 51.23 C ATOM 0 H ILE A 35 -24.253 -8.938 16.102 1.00 4.15 H new ATOM 0 HA ILE A 35 -23.558 -11.122 17.933 1.00 41.04 H new ATOM 0 HB ILE A 35 -23.985 -10.959 14.928 1.00 73.35 H new ATOM 0 HG12 ILE A 35 -25.336 -12.784 16.924 1.00 24.14 H new ATOM 0 HG13 ILE A 35 -25.901 -11.144 16.675 1.00 24.14 H new ATOM 0 HG21 ILE A 35 -23.476 -13.367 14.843 1.00 43.42 H new ATOM 0 HG22 ILE A 35 -22.062 -12.413 15.351 1.00 43.42 H new ATOM 0 HG23 ILE A 35 -23.001 -13.323 16.558 1.00 43.42 H new ATOM 0 HD11 ILE A 35 -27.177 -12.726 15.316 1.00 51.23 H new ATOM 0 HD12 ILE A 35 -26.253 -11.614 14.278 1.00 51.23 H new ATOM 0 HD13 ILE A 35 -25.679 -13.280 14.531 1.00 51.23 H new ATOM 544 N SER A 36 -21.093 -11.188 17.537 1.00 24.30 N ATOM 545 CA SER A 36 -19.640 -11.113 17.431 1.00 14.13 C ATOM 546 C SER A 36 -19.026 -12.509 17.386 1.00 31.25 C ATOM 547 O SER A 36 -19.265 -13.334 18.270 1.00 54.12 O ATOM 548 CB SER A 36 -19.063 -10.327 18.610 1.00 51.43 C ATOM 549 OG SER A 36 -19.885 -9.220 18.937 1.00 11.03 O ATOM 0 H SER A 36 -21.431 -11.831 18.253 1.00 24.30 H new ATOM 0 HA SER A 36 -19.393 -10.597 16.503 1.00 14.13 H new ATOM 0 HB2 SER A 36 -18.968 -10.982 19.476 1.00 51.43 H new ATOM 0 HB3 SER A 36 -18.060 -9.979 18.363 1.00 51.43 H new ATOM 0 HG SER A 36 -19.694 -8.930 19.854 1.00 11.03 H new ATOM 555 N LEU A 37 -18.234 -12.767 16.352 1.00 4.43 N ATOM 556 CA LEU A 37 -17.583 -14.062 16.190 1.00 2.22 C ATOM 557 C LEU A 37 -16.137 -13.892 15.737 1.00 62.45 C ATOM 558 O LEU A 37 -15.865 -13.254 14.719 1.00 14.32 O ATOM 559 CB LEU A 37 -18.350 -14.916 15.180 1.00 72.12 C ATOM 560 CG LEU A 37 -17.577 -16.084 14.565 1.00 42.24 C ATOM 561 CD1 LEU A 37 -17.872 -17.373 15.315 1.00 22.24 C ATOM 562 CD2 LEU A 37 -17.920 -16.232 13.089 1.00 20.34 C ATOM 0 H LEU A 37 -18.027 -12.096 15.612 1.00 4.43 H new ATOM 0 HA LEU A 37 -17.583 -14.565 17.157 1.00 2.22 H new ATOM 0 HB2 LEU A 37 -19.239 -15.313 15.670 1.00 72.12 H new ATOM 0 HB3 LEU A 37 -18.693 -14.268 14.373 1.00 72.12 H new ATOM 0 HG LEU A 37 -16.511 -15.875 14.650 1.00 42.24 H new ATOM 0 HD11 LEU A 37 -17.313 -18.193 14.863 1.00 22.24 H new ATOM 0 HD12 LEU A 37 -17.575 -17.263 16.358 1.00 22.24 H new ATOM 0 HD13 LEU A 37 -18.939 -17.589 15.262 1.00 22.24 H new ATOM 0 HD21 LEU A 37 -17.361 -17.068 12.668 1.00 20.34 H new ATOM 0 HD22 LEU A 37 -18.988 -16.419 12.981 1.00 20.34 H new ATOM 0 HD23 LEU A 37 -17.656 -15.316 12.561 1.00 20.34 H new ATOM 574 N ILE A 38 -15.212 -14.471 16.496 1.00 30.13 N ATOM 575 CA ILE A 38 -13.795 -14.387 16.170 1.00 43.31 C ATOM 576 C ILE A 38 -13.122 -15.751 16.283 1.00 52.41 C ATOM 577 O ILE A 38 -13.364 -16.496 17.232 1.00 23.31 O ATOM 578 CB ILE A 38 -13.063 -13.389 17.089 1.00 71.35 C ATOM 579 CG1 ILE A 38 -13.777 -12.035 17.078 1.00 22.40 C ATOM 580 CG2 ILE A 38 -11.613 -13.234 16.654 1.00 33.22 C ATOM 581 CD1 ILE A 38 -14.806 -11.887 18.175 1.00 52.31 C ATOM 0 H ILE A 38 -15.420 -15.003 17.341 1.00 30.13 H new ATOM 0 HA ILE A 38 -13.730 -14.036 15.140 1.00 43.31 H new ATOM 0 HB ILE A 38 -13.076 -13.777 18.107 1.00 71.35 H new ATOM 0 HG12 ILE A 38 -13.036 -11.242 17.176 1.00 22.40 H new ATOM 0 HG13 ILE A 38 -14.264 -11.898 16.113 1.00 22.40 H new ATOM 0 HG21 ILE A 38 -11.109 -12.526 17.312 1.00 33.22 H new ATOM 0 HG22 ILE A 38 -11.112 -14.200 16.708 1.00 33.22 H new ATOM 0 HG23 ILE A 38 -11.578 -12.864 15.629 1.00 33.22 H new ATOM 0 HD11 ILE A 38 -15.272 -10.904 18.107 1.00 52.31 H new ATOM 0 HD12 ILE A 38 -15.568 -12.658 18.065 1.00 52.31 H new ATOM 0 HD13 ILE A 38 -14.321 -11.992 19.145 1.00 52.31 H new ATOM 593 N ILE A 39 -12.277 -16.069 15.308 1.00 62.22 N ATOM 594 CA ILE A 39 -11.567 -17.343 15.300 1.00 73.31 C ATOM 595 C ILE A 39 -10.273 -17.245 14.499 1.00 21.53 C ATOM 596 O ILE A 39 -10.103 -16.370 13.651 1.00 40.11 O ATOM 597 CB ILE A 39 -12.438 -18.469 14.712 1.00 11.41 C ATOM 598 CG1 ILE A 39 -12.197 -18.597 13.206 1.00 24.04 C ATOM 599 CG2 ILE A 39 -13.909 -18.204 14.996 1.00 22.15 C ATOM 600 CD1 ILE A 39 -12.527 -17.342 12.432 1.00 42.55 C ATOM 0 H ILE A 39 -12.067 -15.463 14.514 1.00 62.22 H new ATOM 0 HA ILE A 39 -11.332 -17.581 16.338 1.00 73.31 H new ATOM 0 HB ILE A 39 -12.159 -19.409 15.188 1.00 11.41 H new ATOM 0 HG12 ILE A 39 -11.152 -18.856 13.034 1.00 24.04 H new ATOM 0 HG13 ILE A 39 -12.797 -19.421 12.819 1.00 24.04 H new ATOM 0 HG21 ILE A 39 -14.512 -19.008 14.574 1.00 22.15 H new ATOM 0 HG22 ILE A 39 -14.069 -18.157 16.073 1.00 22.15 H new ATOM 0 HG23 ILE A 39 -14.202 -17.256 14.544 1.00 22.15 H new ATOM 0 HD11 ILE A 39 -12.332 -17.506 11.372 1.00 42.55 H new ATOM 0 HD12 ILE A 39 -13.579 -17.094 12.573 1.00 42.55 H new ATOM 0 HD13 ILE A 39 -11.909 -16.520 12.792 1.00 42.55 H new ATOM 612 N PRO A 40 -9.338 -18.168 14.771 1.00 4.35 N ATOM 613 CA PRO A 40 -8.044 -18.210 14.085 1.00 43.32 C ATOM 614 C PRO A 40 -8.174 -18.631 12.626 1.00 62.23 C ATOM 615 O PRO A 40 -9.253 -18.988 12.152 1.00 44.35 O ATOM 616 CB PRO A 40 -7.256 -19.257 14.876 1.00 22.11 C ATOM 617 CG PRO A 40 -8.296 -20.133 15.484 1.00 42.42 C ATOM 618 CD PRO A 40 -9.473 -19.242 15.770 1.00 73.20 C ATOM 0 HA PRO A 40 -7.567 -17.230 14.056 1.00 43.32 H new ATOM 0 HB2 PRO A 40 -6.590 -19.825 14.227 1.00 22.11 H new ATOM 0 HB3 PRO A 40 -6.635 -18.791 15.641 1.00 22.11 H new ATOM 0 HG2 PRO A 40 -8.573 -20.939 14.805 1.00 42.42 H new ATOM 0 HG3 PRO A 40 -7.928 -20.599 16.398 1.00 42.42 H new ATOM 0 HD2 PRO A 40 -10.417 -19.776 15.661 1.00 73.20 H new ATOM 0 HD3 PRO A 40 -9.443 -18.851 16.787 1.00 73.20 H new ATOM 626 N PRO A 41 -7.050 -18.590 11.894 1.00 55.22 N ATOM 627 CA PRO A 41 -7.013 -18.966 10.478 1.00 72.01 C ATOM 628 C PRO A 41 -7.212 -20.464 10.270 1.00 25.12 C ATOM 629 O PRO A 41 -8.221 -21.031 10.686 1.00 13.44 O ATOM 630 CB PRO A 41 -5.610 -18.546 10.036 1.00 44.44 C ATOM 631 CG PRO A 41 -4.796 -18.571 11.283 1.00 13.32 C ATOM 632 CD PRO A 41 -5.729 -18.175 12.394 1.00 13.12 C ATOM 0 HA PRO A 41 -7.813 -18.492 9.910 1.00 72.01 H new ATOM 0 HB2 PRO A 41 -5.209 -19.230 9.288 1.00 44.44 H new ATOM 0 HB3 PRO A 41 -5.617 -17.552 9.588 1.00 44.44 H new ATOM 0 HG2 PRO A 41 -4.380 -19.563 11.458 1.00 13.32 H new ATOM 0 HG3 PRO A 41 -3.955 -17.880 11.214 1.00 13.32 H new ATOM 0 HD2 PRO A 41 -5.477 -18.677 13.328 1.00 13.12 H new ATOM 0 HD3 PRO A 41 -5.691 -17.103 12.588 1.00 13.12 H new ATOM 640 N LYS A 42 -6.240 -21.100 9.624 1.00 5.32 N ATOM 641 CA LYS A 42 -6.305 -22.533 9.362 1.00 21.13 C ATOM 642 C LYS A 42 -7.753 -22.999 9.245 1.00 3.45 C ATOM 643 O LYS A 42 -8.100 -24.093 9.691 1.00 31.10 O ATOM 644 CB LYS A 42 -5.596 -23.309 10.475 1.00 52.30 C ATOM 645 CG LYS A 42 -4.102 -23.044 10.543 1.00 61.22 C ATOM 646 CD LYS A 42 -3.390 -24.088 11.388 1.00 14.35 C ATOM 647 CE LYS A 42 -1.950 -23.687 11.671 1.00 54.52 C ATOM 648 NZ LYS A 42 -1.129 -24.847 12.117 1.00 63.24 N ATOM 0 H LYS A 42 -5.398 -20.645 9.272 1.00 5.32 H new ATOM 0 HA LYS A 42 -5.801 -22.727 8.415 1.00 21.13 H new ATOM 0 HB2 LYS A 42 -6.047 -23.048 11.433 1.00 52.30 H new ATOM 0 HB3 LYS A 42 -5.761 -24.376 10.325 1.00 52.30 H new ATOM 0 HG2 LYS A 42 -3.685 -23.043 9.536 1.00 61.22 H new ATOM 0 HG3 LYS A 42 -3.926 -22.053 10.962 1.00 61.22 H new ATOM 0 HD2 LYS A 42 -3.923 -24.222 12.329 1.00 14.35 H new ATOM 0 HD3 LYS A 42 -3.407 -25.048 10.873 1.00 14.35 H new ATOM 0 HE2 LYS A 42 -1.510 -23.255 10.772 1.00 54.52 H new ATOM 0 HE3 LYS A 42 -1.933 -22.913 12.438 1.00 54.52 H new ATOM 0 HZ1 LYS A 42 -0.155 -24.533 12.300 1.00 63.24 H new ATOM 0 HZ2 LYS A 42 -1.534 -25.244 12.989 1.00 63.24 H new ATOM 0 HZ3 LYS A 42 -1.124 -25.575 11.374 1.00 63.24 H new ATOM 662 N ASP A 43 -8.592 -22.163 8.643 1.00 72.30 N ATOM 663 CA ASP A 43 -10.001 -22.492 8.465 1.00 15.45 C ATOM 664 C ASP A 43 -10.487 -22.076 7.080 1.00 2.11 C ATOM 665 O ASP A 43 -9.772 -21.404 6.339 1.00 45.41 O ATOM 666 CB ASP A 43 -10.846 -21.807 9.542 1.00 41.14 C ATOM 667 CG ASP A 43 -12.198 -22.469 9.727 1.00 64.53 C ATOM 668 OD1 ASP A 43 -12.275 -23.707 9.585 1.00 22.41 O ATOM 669 OD2 ASP A 43 -13.178 -21.750 10.011 1.00 1.44 O ATOM 0 H ASP A 43 -8.321 -21.253 8.270 1.00 72.30 H new ATOM 0 HA ASP A 43 -10.111 -23.572 8.559 1.00 15.45 H new ATOM 0 HB2 ASP A 43 -10.305 -21.822 10.488 1.00 41.14 H new ATOM 0 HB3 ASP A 43 -10.991 -20.760 9.275 1.00 41.14 H new ATOM 674 N GLN A 44 -11.705 -22.483 6.738 1.00 12.44 N ATOM 675 CA GLN A 44 -12.284 -22.154 5.441 1.00 4.54 C ATOM 676 C GLN A 44 -13.712 -21.641 5.596 1.00 3.45 C ATOM 677 O GLN A 44 -14.515 -22.224 6.325 1.00 14.12 O ATOM 678 CB GLN A 44 -12.266 -23.378 4.526 1.00 61.35 C ATOM 679 CG GLN A 44 -12.224 -23.032 3.047 1.00 45.44 C ATOM 680 CD GLN A 44 -11.038 -22.160 2.685 1.00 65.32 C ATOM 681 OE1 GLN A 44 -11.169 -21.190 1.939 1.00 52.00 O ATOM 682 NE2 GLN A 44 -9.868 -22.504 3.213 1.00 71.31 N ATOM 0 H GLN A 44 -12.310 -23.041 7.341 1.00 12.44 H new ATOM 0 HA GLN A 44 -11.681 -21.365 4.992 1.00 4.54 H new ATOM 0 HB2 GLN A 44 -11.399 -23.992 4.772 1.00 61.35 H new ATOM 0 HB3 GLN A 44 -13.151 -23.982 4.724 1.00 61.35 H new ATOM 0 HG2 GLN A 44 -12.185 -23.952 2.464 1.00 45.44 H new ATOM 0 HG3 GLN A 44 -13.145 -22.518 2.772 1.00 45.44 H new ATOM 0 HE21 GLN A 44 -9.805 -23.316 3.827 1.00 71.31 H new ATOM 0 HE22 GLN A 44 -9.033 -21.956 3.004 1.00 71.31 H new ATOM 691 N ILE A 45 -14.020 -20.547 4.908 1.00 15.03 N ATOM 692 CA ILE A 45 -15.351 -19.956 4.970 1.00 52.33 C ATOM 693 C ILE A 45 -16.432 -21.032 4.951 1.00 64.20 C ATOM 694 O ILE A 45 -17.424 -20.943 5.673 1.00 14.41 O ATOM 695 CB ILE A 45 -15.590 -18.984 3.799 1.00 35.33 C ATOM 696 CG1 ILE A 45 -14.478 -17.935 3.744 1.00 13.31 C ATOM 697 CG2 ILE A 45 -16.951 -18.315 3.936 1.00 23.42 C ATOM 698 CD1 ILE A 45 -14.284 -17.190 5.047 1.00 75.31 C ATOM 0 H ILE A 45 -13.366 -20.052 4.301 1.00 15.03 H new ATOM 0 HA ILE A 45 -15.408 -19.404 5.908 1.00 52.33 H new ATOM 0 HB ILE A 45 -15.577 -19.550 2.867 1.00 35.33 H new ATOM 0 HG12 ILE A 45 -13.542 -18.423 3.471 1.00 13.31 H new ATOM 0 HG13 ILE A 45 -14.705 -17.218 2.955 1.00 13.31 H new ATOM 0 HG21 ILE A 45 -17.106 -17.631 3.102 1.00 23.42 H new ATOM 0 HG22 ILE A 45 -17.732 -19.075 3.932 1.00 23.42 H new ATOM 0 HG23 ILE A 45 -16.991 -17.759 4.873 1.00 23.42 H new ATOM 0 HD11 ILE A 45 -13.480 -16.463 4.934 1.00 75.31 H new ATOM 0 HD12 ILE A 45 -15.206 -16.673 5.311 1.00 75.31 H new ATOM 0 HD13 ILE A 45 -14.026 -17.897 5.835 1.00 75.31 H new ATOM 710 N SER A 46 -16.230 -22.051 4.121 1.00 31.11 N ATOM 711 CA SER A 46 -17.188 -23.144 4.006 1.00 61.14 C ATOM 712 C SER A 46 -17.854 -23.427 5.349 1.00 3.22 C ATOM 713 O SER A 46 -19.079 -23.458 5.453 1.00 53.13 O ATOM 714 CB SER A 46 -16.493 -24.407 3.493 1.00 62.22 C ATOM 715 OG SER A 46 -17.374 -25.517 3.508 1.00 13.23 O ATOM 0 H SER A 46 -15.412 -22.142 3.519 1.00 31.11 H new ATOM 0 HA SER A 46 -17.958 -22.846 3.294 1.00 61.14 H new ATOM 0 HB2 SER A 46 -16.131 -24.240 2.478 1.00 62.22 H new ATOM 0 HB3 SER A 46 -15.621 -24.622 4.111 1.00 62.22 H new ATOM 0 HG SER A 46 -16.906 -26.311 3.174 1.00 13.23 H new ATOM 721 N ARG A 47 -17.035 -23.632 6.376 1.00 2.13 N ATOM 722 CA ARG A 47 -17.543 -23.913 7.713 1.00 31.44 C ATOM 723 C ARG A 47 -18.372 -22.745 8.237 1.00 12.54 C ATOM 724 O ARG A 47 -19.320 -22.934 9.001 1.00 41.20 O ATOM 725 CB ARG A 47 -16.386 -24.201 8.672 1.00 60.34 C ATOM 726 CG ARG A 47 -15.584 -25.439 8.304 1.00 11.32 C ATOM 727 CD ARG A 47 -16.424 -26.701 8.417 1.00 10.00 C ATOM 728 NE ARG A 47 -15.600 -27.895 8.577 1.00 64.12 N ATOM 729 CZ ARG A 47 -14.978 -28.213 9.707 1.00 31.01 C ATOM 730 NH1 ARG A 47 -15.089 -27.431 10.772 1.00 42.31 N ATOM 731 NH2 ARG A 47 -14.245 -29.317 9.775 1.00 14.02 N ATOM 0 H ARG A 47 -16.018 -23.609 6.307 1.00 2.13 H new ATOM 0 HA ARG A 47 -18.184 -24.793 7.652 1.00 31.44 H new ATOM 0 HB2 ARG A 47 -15.719 -23.339 8.692 1.00 60.34 H new ATOM 0 HB3 ARG A 47 -16.782 -24.321 9.680 1.00 60.34 H new ATOM 0 HG2 ARG A 47 -15.208 -25.341 7.286 1.00 11.32 H new ATOM 0 HG3 ARG A 47 -14.716 -25.519 8.958 1.00 11.32 H new ATOM 0 HD2 ARG A 47 -17.100 -26.611 9.267 1.00 10.00 H new ATOM 0 HD3 ARG A 47 -17.043 -26.805 7.526 1.00 10.00 H new ATOM 0 HE ARG A 47 -15.496 -28.520 7.777 1.00 64.12 H new ATOM 0 HH11 ARG A 47 -15.653 -26.583 10.725 1.00 42.31 H new ATOM 0 HH12 ARG A 47 -14.610 -27.678 11.638 1.00 42.31 H new ATOM 0 HH21 ARG A 47 -14.158 -29.923 8.959 1.00 14.02 H new ATOM 0 HH22 ARG A 47 -13.768 -29.560 10.643 1.00 14.02 H new ATOM 745 N VAL A 48 -18.009 -21.535 7.822 1.00 53.02 N ATOM 746 CA VAL A 48 -18.720 -20.334 8.248 1.00 74.43 C ATOM 747 C VAL A 48 -20.201 -20.418 7.895 1.00 63.34 C ATOM 748 O VAL A 48 -21.061 -20.409 8.774 1.00 12.13 O ATOM 749 CB VAL A 48 -18.121 -19.070 7.605 1.00 50.33 C ATOM 750 CG1 VAL A 48 -19.128 -17.931 7.628 1.00 13.30 C ATOM 751 CG2 VAL A 48 -16.836 -18.671 8.313 1.00 4.43 C ATOM 0 H VAL A 48 -17.227 -21.360 7.191 1.00 53.02 H new ATOM 0 HA VAL A 48 -18.611 -20.268 9.331 1.00 74.43 H new ATOM 0 HB VAL A 48 -17.882 -19.291 6.565 1.00 50.33 H new ATOM 0 HG11 VAL A 48 -18.687 -17.046 7.169 1.00 13.30 H new ATOM 0 HG12 VAL A 48 -20.019 -18.222 7.072 1.00 13.30 H new ATOM 0 HG13 VAL A 48 -19.401 -17.707 8.659 1.00 13.30 H new ATOM 0 HG21 VAL A 48 -16.426 -17.776 7.846 1.00 4.43 H new ATOM 0 HG22 VAL A 48 -17.047 -18.468 9.363 1.00 4.43 H new ATOM 0 HG23 VAL A 48 -16.112 -19.483 8.239 1.00 4.43 H new ATOM 761 N ALA A 49 -20.491 -20.500 6.600 1.00 33.41 N ATOM 762 CA ALA A 49 -21.868 -20.588 6.131 1.00 50.15 C ATOM 763 C ALA A 49 -22.657 -21.617 6.932 1.00 61.13 C ATOM 764 O ALA A 49 -23.790 -21.363 7.344 1.00 22.42 O ATOM 765 CB ALA A 49 -21.900 -20.934 4.649 1.00 64.11 C ATOM 0 H ALA A 49 -19.791 -20.507 5.858 1.00 33.41 H new ATOM 0 HA ALA A 49 -22.337 -19.615 6.277 1.00 50.15 H new ATOM 0 HB1 ALA A 49 -22.935 -20.996 4.312 1.00 64.11 H new ATOM 0 HB2 ALA A 49 -21.380 -20.160 4.083 1.00 64.11 H new ATOM 0 HB3 ALA A 49 -21.408 -21.893 4.489 1.00 64.11 H new ATOM 771 N LYS A 50 -22.053 -22.781 7.150 1.00 3.30 N ATOM 772 CA LYS A 50 -22.699 -23.849 7.904 1.00 62.43 C ATOM 773 C LYS A 50 -23.314 -23.311 9.192 1.00 75.24 C ATOM 774 O LYS A 50 -24.486 -23.555 9.479 1.00 70.11 O ATOM 775 CB LYS A 50 -21.689 -24.952 8.230 1.00 22.12 C ATOM 776 CG LYS A 50 -21.160 -25.675 7.003 1.00 12.43 C ATOM 777 CD LYS A 50 -22.173 -26.669 6.461 1.00 15.30 C ATOM 778 CE LYS A 50 -21.602 -27.473 5.303 1.00 1.31 C ATOM 779 NZ LYS A 50 -22.440 -28.661 4.986 1.00 52.03 N ATOM 0 H LYS A 50 -21.117 -23.008 6.815 1.00 3.30 H new ATOM 0 HA LYS A 50 -23.497 -24.265 7.288 1.00 62.43 H new ATOM 0 HB2 LYS A 50 -20.851 -24.516 8.774 1.00 22.12 H new ATOM 0 HB3 LYS A 50 -22.158 -25.677 8.895 1.00 22.12 H new ATOM 0 HG2 LYS A 50 -20.913 -24.948 6.230 1.00 12.43 H new ATOM 0 HG3 LYS A 50 -20.237 -26.197 7.257 1.00 12.43 H new ATOM 0 HD2 LYS A 50 -22.482 -27.346 7.258 1.00 15.30 H new ATOM 0 HD3 LYS A 50 -23.065 -26.137 6.131 1.00 15.30 H new ATOM 0 HE2 LYS A 50 -21.526 -26.836 4.421 1.00 1.31 H new ATOM 0 HE3 LYS A 50 -20.591 -27.797 5.550 1.00 1.31 H new ATOM 0 HZ1 LYS A 50 -22.017 -29.182 4.192 1.00 52.03 H new ATOM 0 HZ2 LYS A 50 -22.492 -29.282 5.819 1.00 52.03 H new ATOM 0 HZ3 LYS A 50 -23.398 -28.351 4.726 1.00 52.03 H new ATOM 793 N MET A 51 -22.517 -22.579 9.962 1.00 11.31 N ATOM 794 CA MET A 51 -22.986 -22.005 11.218 1.00 12.35 C ATOM 795 C MET A 51 -24.127 -21.022 10.975 1.00 42.05 C ATOM 796 O MET A 51 -25.170 -21.093 11.625 1.00 1.21 O ATOM 797 CB MET A 51 -21.836 -21.301 11.943 1.00 74.14 C ATOM 798 CG MET A 51 -20.771 -22.253 12.459 1.00 5.13 C ATOM 799 SD MET A 51 -19.379 -21.392 13.219 1.00 72.35 S ATOM 800 CE MET A 51 -18.045 -21.877 12.127 1.00 43.31 C ATOM 0 H MET A 51 -21.544 -22.369 9.739 1.00 11.31 H new ATOM 0 HA MET A 51 -23.357 -22.817 11.843 1.00 12.35 H new ATOM 0 HB2 MET A 51 -21.373 -20.585 11.264 1.00 74.14 H new ATOM 0 HB3 MET A 51 -22.239 -20.732 12.780 1.00 74.14 H new ATOM 0 HG2 MET A 51 -21.217 -22.930 13.188 1.00 5.13 H new ATOM 0 HG3 MET A 51 -20.408 -22.867 11.635 1.00 5.13 H new ATOM 0 HE1 MET A 51 -17.184 -21.229 12.294 1.00 43.31 H new ATOM 0 HE2 MET A 51 -17.766 -22.911 12.330 1.00 43.31 H new ATOM 0 HE3 MET A 51 -18.372 -21.786 11.091 1.00 43.31 H new ATOM 810 N LEU A 52 -23.921 -20.105 10.035 1.00 40.20 N ATOM 811 CA LEU A 52 -24.932 -19.107 9.706 1.00 13.03 C ATOM 812 C LEU A 52 -26.273 -19.769 9.404 1.00 25.12 C ATOM 813 O LEU A 52 -27.328 -19.154 9.554 1.00 74.40 O ATOM 814 CB LEU A 52 -24.482 -18.271 8.506 1.00 3.14 C ATOM 815 CG LEU A 52 -23.030 -17.791 8.531 1.00 3.30 C ATOM 816 CD1 LEU A 52 -22.792 -16.756 7.442 1.00 24.13 C ATOM 817 CD2 LEU A 52 -22.680 -17.220 9.898 1.00 20.32 C ATOM 0 H LEU A 52 -23.063 -20.033 9.488 1.00 40.20 H new ATOM 0 HA LEU A 52 -25.056 -18.454 10.570 1.00 13.03 H new ATOM 0 HB2 LEU A 52 -24.634 -18.859 7.601 1.00 3.14 H new ATOM 0 HB3 LEU A 52 -25.131 -17.399 8.432 1.00 3.14 H new ATOM 0 HG LEU A 52 -22.381 -18.646 8.340 1.00 3.30 H new ATOM 0 HD11 LEU A 52 -21.754 -16.426 7.475 1.00 24.13 H new ATOM 0 HD12 LEU A 52 -23.002 -17.198 6.468 1.00 24.13 H new ATOM 0 HD13 LEU A 52 -23.450 -15.902 7.602 1.00 24.13 H new ATOM 0 HD21 LEU A 52 -21.643 -16.884 9.897 1.00 20.32 H new ATOM 0 HD22 LEU A 52 -23.335 -16.377 10.119 1.00 20.32 H new ATOM 0 HD23 LEU A 52 -22.811 -17.990 10.658 1.00 20.32 H new ATOM 829 N ALA A 53 -26.222 -21.027 8.979 1.00 75.50 N ATOM 830 CA ALA A 53 -27.433 -21.774 8.660 1.00 44.13 C ATOM 831 C ALA A 53 -28.190 -22.160 9.926 1.00 23.21 C ATOM 832 O ALA A 53 -29.348 -21.784 10.107 1.00 23.02 O ATOM 833 CB ALA A 53 -27.089 -23.016 7.849 1.00 13.54 C ATOM 0 H ALA A 53 -25.356 -21.550 8.848 1.00 75.50 H new ATOM 0 HA ALA A 53 -28.080 -21.131 8.063 1.00 44.13 H new ATOM 0 HB1 ALA A 53 -28.002 -23.564 7.618 1.00 13.54 H new ATOM 0 HB2 ALA A 53 -26.599 -22.721 6.921 1.00 13.54 H new ATOM 0 HB3 ALA A 53 -26.419 -23.654 8.426 1.00 13.54 H new ATOM 839 N ASP A 54 -27.529 -22.912 10.799 1.00 44.04 N ATOM 840 CA ASP A 54 -28.139 -23.349 12.048 1.00 34.04 C ATOM 841 C ASP A 54 -28.865 -22.194 12.731 1.00 14.10 C ATOM 842 O ASP A 54 -29.905 -22.388 13.362 1.00 62.44 O ATOM 843 CB ASP A 54 -27.077 -23.925 12.987 1.00 54.04 C ATOM 844 CG ASP A 54 -27.616 -24.191 14.378 1.00 35.33 C ATOM 845 OD1 ASP A 54 -28.788 -24.608 14.491 1.00 53.12 O ATOM 846 OD2 ASP A 54 -26.865 -23.984 15.354 1.00 14.22 O ATOM 0 H ASP A 54 -26.570 -23.232 10.664 1.00 44.04 H new ATOM 0 HA ASP A 54 -28.867 -24.126 11.815 1.00 34.04 H new ATOM 0 HB2 ASP A 54 -26.690 -24.853 12.567 1.00 54.04 H new ATOM 0 HB3 ASP A 54 -26.239 -23.231 13.052 1.00 54.04 H new ATOM 851 N GLU A 55 -28.311 -20.993 12.601 1.00 25.23 N ATOM 852 CA GLU A 55 -28.905 -19.807 13.207 1.00 33.51 C ATOM 853 C GLU A 55 -30.333 -19.599 12.709 1.00 23.53 C ATOM 854 O GLU A 55 -31.262 -19.445 13.501 1.00 42.44 O ATOM 855 CB GLU A 55 -28.059 -18.570 12.898 1.00 20.21 C ATOM 856 CG GLU A 55 -28.141 -17.494 13.967 1.00 0.14 C ATOM 857 CD GLU A 55 -26.949 -16.558 13.945 1.00 13.52 C ATOM 858 OE1 GLU A 55 -25.813 -17.040 14.134 1.00 63.42 O ATOM 859 OE2 GLU A 55 -27.151 -15.343 13.739 1.00 55.25 O ATOM 0 H GLU A 55 -27.451 -20.815 12.081 1.00 25.23 H new ATOM 0 HA GLU A 55 -28.933 -19.957 14.286 1.00 33.51 H new ATOM 0 HB2 GLU A 55 -27.019 -18.872 12.778 1.00 20.21 H new ATOM 0 HB3 GLU A 55 -28.381 -18.149 11.945 1.00 20.21 H new ATOM 0 HG2 GLU A 55 -29.055 -16.916 13.826 1.00 0.14 H new ATOM 0 HG3 GLU A 55 -28.210 -17.966 14.947 1.00 0.14 H new ATOM 866 N PHE A 56 -30.498 -19.596 11.390 1.00 41.13 N ATOM 867 CA PHE A 56 -31.811 -19.405 10.785 1.00 43.30 C ATOM 868 C PHE A 56 -32.864 -20.252 11.492 1.00 51.11 C ATOM 869 O PHE A 56 -33.907 -19.748 11.904 1.00 31.12 O ATOM 870 CB PHE A 56 -31.767 -19.763 9.298 1.00 43.41 C ATOM 871 CG PHE A 56 -31.432 -18.597 8.411 1.00 65.24 C ATOM 872 CD1 PHE A 56 -30.118 -18.188 8.249 1.00 50.14 C ATOM 873 CD2 PHE A 56 -32.431 -17.912 7.739 1.00 12.43 C ATOM 874 CE1 PHE A 56 -29.807 -17.116 7.433 1.00 71.34 C ATOM 875 CE2 PHE A 56 -32.126 -16.840 6.922 1.00 53.53 C ATOM 876 CZ PHE A 56 -30.813 -16.441 6.770 1.00 53.44 C ATOM 0 H PHE A 56 -29.739 -19.724 10.720 1.00 41.13 H new ATOM 0 HA PHE A 56 -32.083 -18.355 10.892 1.00 43.30 H new ATOM 0 HB2 PHE A 56 -31.029 -20.551 9.144 1.00 43.41 H new ATOM 0 HB3 PHE A 56 -32.734 -20.169 9.001 1.00 43.41 H new ATOM 0 HD1 PHE A 56 -29.328 -18.712 8.766 1.00 50.14 H new ATOM 0 HD2 PHE A 56 -33.460 -18.219 7.855 1.00 12.43 H new ATOM 0 HE1 PHE A 56 -28.779 -16.807 7.314 1.00 71.34 H new ATOM 0 HE2 PHE A 56 -32.914 -16.315 6.403 1.00 53.53 H new ATOM 0 HZ PHE A 56 -30.573 -15.602 6.133 1.00 53.44 H new ATOM 886 N GLY A 57 -32.582 -21.545 11.629 1.00 41.33 N ATOM 887 CA GLY A 57 -33.515 -22.441 12.285 1.00 25.43 C ATOM 888 C GLY A 57 -33.689 -22.122 13.757 1.00 44.24 C ATOM 889 O GLY A 57 -34.659 -22.548 14.382 1.00 22.24 O ATOM 0 H GLY A 57 -31.724 -21.987 11.297 1.00 41.33 H new ATOM 0 HA2 GLY A 57 -34.483 -22.381 11.787 1.00 25.43 H new ATOM 0 HA3 GLY A 57 -33.164 -23.467 12.178 1.00 25.43 H new ATOM 893 N THR A 58 -32.744 -21.369 14.313 1.00 72.14 N ATOM 894 CA THR A 58 -32.795 -20.995 15.720 1.00 11.05 C ATOM 895 C THR A 58 -33.767 -19.842 15.948 1.00 64.25 C ATOM 896 O THR A 58 -34.782 -19.998 16.625 1.00 40.35 O ATOM 897 CB THR A 58 -31.405 -20.591 16.245 1.00 25.03 C ATOM 898 OG1 THR A 58 -30.384 -21.184 15.435 1.00 2.22 O ATOM 899 CG2 THR A 58 -31.226 -21.023 17.693 1.00 70.13 C ATOM 0 H THR A 58 -31.934 -21.007 13.809 1.00 72.14 H new ATOM 0 HA THR A 58 -33.141 -21.872 16.267 1.00 11.05 H new ATOM 0 HB THR A 58 -31.324 -19.505 16.194 1.00 25.03 H new ATOM 0 HG1 THR A 58 -30.753 -21.955 14.956 1.00 2.22 H new ATOM 0 HG21 THR A 58 -30.237 -20.727 18.041 1.00 70.13 H new ATOM 0 HG22 THR A 58 -31.986 -20.546 18.312 1.00 70.13 H new ATOM 0 HG23 THR A 58 -31.327 -22.106 17.765 1.00 70.13 H new ATOM 907 N ALA A 59 -33.447 -18.685 15.376 1.00 33.05 N ATOM 908 CA ALA A 59 -34.294 -17.505 15.515 1.00 33.52 C ATOM 909 C ALA A 59 -35.672 -17.745 14.907 1.00 31.21 C ATOM 910 O ALA A 59 -36.648 -17.097 15.284 1.00 32.11 O ATOM 911 CB ALA A 59 -33.630 -16.301 14.866 1.00 43.22 C ATOM 0 H ALA A 59 -32.609 -18.539 14.813 1.00 33.05 H new ATOM 0 HA ALA A 59 -34.425 -17.304 16.578 1.00 33.52 H new ATOM 0 HB1 ALA A 59 -34.272 -15.427 14.977 1.00 43.22 H new ATOM 0 HB2 ALA A 59 -32.671 -16.110 15.349 1.00 43.22 H new ATOM 0 HB3 ALA A 59 -33.469 -16.501 13.807 1.00 43.22 H new ATOM 917 N SER A 60 -35.743 -18.678 13.963 1.00 32.33 N ATOM 918 CA SER A 60 -37.001 -19.000 13.299 1.00 2.50 C ATOM 919 C SER A 60 -37.925 -19.777 14.232 1.00 44.11 C ATOM 920 O SER A 60 -39.128 -19.526 14.283 1.00 10.21 O ATOM 921 CB SER A 60 -36.739 -19.811 12.029 1.00 12.31 C ATOM 922 OG SER A 60 -37.953 -20.257 11.449 1.00 51.41 O ATOM 0 H SER A 60 -34.944 -19.224 13.641 1.00 32.33 H new ATOM 0 HA SER A 60 -37.490 -18.064 13.029 1.00 2.50 H new ATOM 0 HB2 SER A 60 -36.192 -19.201 11.311 1.00 12.31 H new ATOM 0 HB3 SER A 60 -36.108 -20.668 12.265 1.00 12.31 H new ATOM 0 HG SER A 60 -37.758 -20.772 10.638 1.00 51.41 H new ATOM 928 N ASN A 61 -37.351 -20.723 14.969 1.00 41.13 N ATOM 929 CA ASN A 61 -38.121 -21.539 15.900 1.00 34.12 C ATOM 930 C ASN A 61 -38.696 -20.685 17.025 1.00 4.35 C ATOM 931 O ASN A 61 -39.675 -21.065 17.669 1.00 3.33 O ATOM 932 CB ASN A 61 -37.245 -22.649 16.484 1.00 43.30 C ATOM 933 CG ASN A 61 -36.503 -22.205 17.729 1.00 20.45 C ATOM 934 OD1 ASN A 61 -37.114 -21.794 18.716 1.00 41.32 O ATOM 935 ND2 ASN A 61 -35.178 -22.286 17.689 1.00 3.23 N ATOM 0 H ASN A 61 -36.355 -20.943 14.939 1.00 41.13 H new ATOM 0 HA ASN A 61 -38.948 -21.989 15.351 1.00 34.12 H new ATOM 0 HB2 ASN A 61 -37.867 -23.511 16.723 1.00 43.30 H new ATOM 0 HB3 ASN A 61 -36.526 -22.974 15.732 1.00 43.30 H new ATOM 0 HD21 ASN A 61 -34.625 -22.001 18.497 1.00 3.23 H new ATOM 0 HD22 ASN A 61 -34.713 -22.633 16.850 1.00 3.23 H new ATOM 942 N ILE A 62 -38.082 -19.529 17.256 1.00 0.23 N ATOM 943 CA ILE A 62 -38.533 -18.620 18.302 1.00 52.34 C ATOM 944 C ILE A 62 -39.976 -18.184 18.067 1.00 43.31 C ATOM 945 O ILE A 62 -40.430 -18.093 16.926 1.00 54.32 O ATOM 946 CB ILE A 62 -37.638 -17.370 18.386 1.00 64.20 C ATOM 947 CG1 ILE A 62 -36.163 -17.774 18.420 1.00 3.21 C ATOM 948 CG2 ILE A 62 -37.995 -16.544 19.613 1.00 33.44 C ATOM 949 CD1 ILE A 62 -35.830 -18.757 19.520 1.00 20.04 C ATOM 0 H ILE A 62 -37.271 -19.200 16.732 1.00 0.23 H new ATOM 0 HA ILE A 62 -38.470 -19.166 19.243 1.00 52.34 H new ATOM 0 HB ILE A 62 -37.808 -16.759 17.499 1.00 64.20 H new ATOM 0 HG12 ILE A 62 -35.892 -18.211 17.459 1.00 3.21 H new ATOM 0 HG13 ILE A 62 -35.553 -16.880 18.546 1.00 3.21 H new ATOM 0 HG21 ILE A 62 -37.354 -15.664 19.658 1.00 33.44 H new ATOM 0 HG22 ILE A 62 -39.037 -16.231 19.550 1.00 33.44 H new ATOM 0 HG23 ILE A 62 -37.850 -17.145 20.511 1.00 33.44 H new ATOM 0 HD11 ILE A 62 -34.768 -18.998 19.483 1.00 20.04 H new ATOM 0 HD12 ILE A 62 -36.069 -18.315 20.487 1.00 20.04 H new ATOM 0 HD13 ILE A 62 -36.414 -19.667 19.383 1.00 20.04 H new ATOM 961 N LYS A 63 -40.691 -17.913 19.153 1.00 70.34 N ATOM 962 CA LYS A 63 -42.082 -17.483 19.067 1.00 65.43 C ATOM 963 C LYS A 63 -42.172 -15.988 18.780 1.00 2.44 C ATOM 964 O LYS A 63 -43.113 -15.525 18.136 1.00 31.12 O ATOM 965 CB LYS A 63 -42.820 -17.810 20.367 1.00 2.31 C ATOM 966 CG LYS A 63 -42.218 -17.141 21.591 1.00 34.13 C ATOM 967 CD LYS A 63 -42.965 -17.523 22.858 1.00 34.01 C ATOM 968 CE LYS A 63 -44.300 -16.800 22.957 1.00 32.55 C ATOM 969 NZ LYS A 63 -44.948 -17.013 24.281 1.00 15.42 N ATOM 0 H LYS A 63 -40.330 -17.984 20.104 1.00 70.34 H new ATOM 0 HA LYS A 63 -42.553 -18.022 18.245 1.00 65.43 H new ATOM 0 HB2 LYS A 63 -43.862 -17.504 20.271 1.00 2.31 H new ATOM 0 HB3 LYS A 63 -42.818 -18.890 20.515 1.00 2.31 H new ATOM 0 HG2 LYS A 63 -41.170 -17.427 21.685 1.00 34.13 H new ATOM 0 HG3 LYS A 63 -42.243 -16.059 21.465 1.00 34.13 H new ATOM 0 HD2 LYS A 63 -43.131 -18.600 22.873 1.00 34.01 H new ATOM 0 HD3 LYS A 63 -42.354 -17.283 23.728 1.00 34.01 H new ATOM 0 HE2 LYS A 63 -44.148 -15.733 22.794 1.00 32.55 H new ATOM 0 HE3 LYS A 63 -44.963 -17.152 22.167 1.00 32.55 H new ATOM 0 HZ1 LYS A 63 -45.855 -16.505 24.309 1.00 15.42 H new ATOM 0 HZ2 LYS A 63 -45.116 -18.029 24.426 1.00 15.42 H new ATOM 0 HZ3 LYS A 63 -44.326 -16.654 25.034 1.00 15.42 H new ATOM 983 N SER A 64 -41.185 -15.237 19.261 1.00 72.41 N ATOM 984 CA SER A 64 -41.155 -13.793 19.059 1.00 62.54 C ATOM 985 C SER A 64 -40.496 -13.446 17.728 1.00 43.11 C ATOM 986 O SER A 64 -39.276 -13.535 17.585 1.00 10.40 O ATOM 987 CB SER A 64 -40.406 -13.112 20.205 1.00 32.03 C ATOM 988 OG SER A 64 -41.239 -12.966 21.342 1.00 2.31 O ATOM 0 H SER A 64 -40.396 -15.605 19.793 1.00 72.41 H new ATOM 0 HA SER A 64 -42.183 -13.431 19.042 1.00 62.54 H new ATOM 0 HB2 SER A 64 -39.526 -13.699 20.468 1.00 32.03 H new ATOM 0 HB3 SER A 64 -40.052 -12.133 19.881 1.00 32.03 H new ATOM 0 HG SER A 64 -40.737 -12.530 22.062 1.00 2.31 H new ATOM 994 N ARG A 65 -41.310 -13.049 16.756 1.00 32.22 N ATOM 995 CA ARG A 65 -40.807 -12.689 15.436 1.00 14.02 C ATOM 996 C ARG A 65 -39.581 -11.789 15.549 1.00 44.42 C ATOM 997 O ARG A 65 -38.734 -11.760 14.655 1.00 54.01 O ATOM 998 CB ARG A 65 -41.897 -11.983 14.626 1.00 73.21 C ATOM 999 CG ARG A 65 -41.853 -10.468 14.735 1.00 31.52 C ATOM 1000 CD ARG A 65 -42.278 -9.996 16.116 1.00 11.02 C ATOM 1001 NE ARG A 65 -43.716 -9.750 16.191 1.00 11.33 N ATOM 1002 CZ ARG A 65 -44.322 -9.258 17.266 1.00 4.24 C ATOM 1003 NH1 ARG A 65 -43.618 -8.962 18.351 1.00 13.15 N ATOM 1004 NH2 ARG A 65 -45.634 -9.061 17.258 1.00 35.33 N ATOM 0 H ARG A 65 -42.322 -12.968 16.858 1.00 32.22 H new ATOM 0 HA ARG A 65 -40.518 -13.606 14.923 1.00 14.02 H new ATOM 0 HB2 ARG A 65 -41.800 -12.266 13.578 1.00 73.21 H new ATOM 0 HB3 ARG A 65 -42.873 -12.335 14.962 1.00 73.21 H new ATOM 0 HG2 ARG A 65 -40.843 -10.116 14.524 1.00 31.52 H new ATOM 0 HG3 ARG A 65 -42.507 -10.029 13.982 1.00 31.52 H new ATOM 0 HD2 ARG A 65 -41.999 -10.745 16.857 1.00 11.02 H new ATOM 0 HD3 ARG A 65 -41.740 -9.082 16.368 1.00 11.02 H new ATOM 0 HE ARG A 65 -44.286 -9.968 15.374 1.00 11.33 H new ATOM 0 HH11 ARG A 65 -42.609 -9.112 18.361 1.00 13.15 H new ATOM 0 HH12 ARG A 65 -44.086 -8.584 19.175 1.00 13.15 H new ATOM 0 HH21 ARG A 65 -46.179 -9.287 16.426 1.00 35.33 H new ATOM 0 HH22 ARG A 65 -46.098 -8.683 18.084 1.00 35.33 H new ATOM 1018 N VAL A 66 -39.491 -11.055 16.653 1.00 51.00 N ATOM 1019 CA VAL A 66 -38.367 -10.155 16.884 1.00 51.32 C ATOM 1020 C VAL A 66 -37.046 -10.914 16.884 1.00 23.14 C ATOM 1021 O VAL A 66 -35.973 -10.314 16.837 1.00 70.02 O ATOM 1022 CB VAL A 66 -38.515 -9.402 18.219 1.00 73.33 C ATOM 1023 CG1 VAL A 66 -37.314 -8.502 18.462 1.00 24.30 C ATOM 1024 CG2 VAL A 66 -39.806 -8.597 18.236 1.00 10.11 C ATOM 0 H VAL A 66 -40.183 -11.066 17.402 1.00 51.00 H new ATOM 0 HA VAL A 66 -38.367 -9.433 16.067 1.00 51.32 H new ATOM 0 HB VAL A 66 -38.559 -10.134 19.025 1.00 73.33 H new ATOM 0 HG11 VAL A 66 -37.437 -7.979 19.410 1.00 24.30 H new ATOM 0 HG12 VAL A 66 -36.408 -9.106 18.496 1.00 24.30 H new ATOM 0 HG13 VAL A 66 -37.235 -7.775 17.654 1.00 24.30 H new ATOM 0 HG21 VAL A 66 -39.894 -8.071 19.187 1.00 10.11 H new ATOM 0 HG22 VAL A 66 -39.794 -7.873 17.421 1.00 10.11 H new ATOM 0 HG23 VAL A 66 -40.655 -9.269 18.113 1.00 10.11 H new ATOM 1034 N ASN A 67 -37.131 -12.239 16.940 1.00 32.21 N ATOM 1035 CA ASN A 67 -35.941 -13.082 16.948 1.00 44.24 C ATOM 1036 C ASN A 67 -35.517 -13.438 15.526 1.00 44.51 C ATOM 1037 O ASN A 67 -34.375 -13.201 15.130 1.00 34.20 O ATOM 1038 CB ASN A 67 -36.200 -14.359 17.749 1.00 35.34 C ATOM 1039 CG ASN A 67 -36.146 -14.123 19.246 1.00 35.01 C ATOM 1040 OD1 ASN A 67 -35.383 -14.773 19.961 1.00 33.04 O ATOM 1041 ND2 ASN A 67 -36.959 -13.190 19.727 1.00 53.51 N ATOM 0 H ASN A 67 -38.012 -12.752 16.981 1.00 32.21 H new ATOM 0 HA ASN A 67 -35.133 -12.523 17.420 1.00 44.24 H new ATOM 0 HB2 ASN A 67 -37.178 -14.760 17.482 1.00 35.34 H new ATOM 0 HB3 ASN A 67 -35.461 -15.112 17.476 1.00 35.34 H new ATOM 0 HD21 ASN A 67 -36.968 -12.987 20.727 1.00 53.51 H new ATOM 0 HD22 ASN A 67 -37.575 -12.676 19.097 1.00 53.51 H new ATOM 1048 N ARG A 68 -36.444 -14.008 14.762 1.00 11.35 N ATOM 1049 CA ARG A 68 -36.167 -14.397 13.386 1.00 52.52 C ATOM 1050 C ARG A 68 -35.991 -13.167 12.498 1.00 25.33 C ATOM 1051 O ARG A 68 -35.306 -13.219 11.476 1.00 33.41 O ATOM 1052 CB ARG A 68 -37.298 -15.272 12.843 1.00 43.21 C ATOM 1053 CG ARG A 68 -37.020 -15.838 11.460 1.00 51.43 C ATOM 1054 CD ARG A 68 -38.301 -15.997 10.655 1.00 13.22 C ATOM 1055 NE ARG A 68 -38.908 -17.311 10.847 1.00 13.03 N ATOM 1056 CZ ARG A 68 -40.132 -17.623 10.435 1.00 0.42 C ATOM 1057 NH1 ARG A 68 -40.875 -16.719 9.812 1.00 33.54 N ATOM 1058 NH2 ARG A 68 -40.614 -18.841 10.647 1.00 73.25 N ATOM 0 H ARG A 68 -37.394 -14.210 15.074 1.00 11.35 H new ATOM 0 HA ARG A 68 -35.238 -14.968 13.377 1.00 52.52 H new ATOM 0 HB2 ARG A 68 -37.473 -16.096 13.535 1.00 43.21 H new ATOM 0 HB3 ARG A 68 -38.216 -14.685 12.808 1.00 43.21 H new ATOM 0 HG2 ARG A 68 -36.334 -15.180 10.927 1.00 51.43 H new ATOM 0 HG3 ARG A 68 -36.526 -16.805 11.554 1.00 51.43 H new ATOM 0 HD2 ARG A 68 -39.011 -15.223 10.947 1.00 13.22 H new ATOM 0 HD3 ARG A 68 -38.085 -15.848 9.597 1.00 13.22 H new ATOM 0 HE ARG A 68 -38.362 -18.029 11.324 1.00 13.03 H new ATOM 0 HH11 ARG A 68 -40.507 -15.782 9.648 1.00 33.54 H new ATOM 0 HH12 ARG A 68 -41.814 -16.961 9.497 1.00 33.54 H new ATOM 0 HH21 ARG A 68 -40.045 -19.538 11.127 1.00 73.25 H new ATOM 0 HH22 ARG A 68 -41.554 -19.080 10.330 1.00 73.25 H new ATOM 1072 N LEU A 69 -36.613 -12.064 12.896 1.00 1.44 N ATOM 1073 CA LEU A 69 -36.526 -10.820 12.138 1.00 61.43 C ATOM 1074 C LEU A 69 -35.150 -10.181 12.295 1.00 3.14 C ATOM 1075 O LEU A 69 -34.425 -9.993 11.319 1.00 54.22 O ATOM 1076 CB LEU A 69 -37.611 -9.843 12.595 1.00 64.40 C ATOM 1077 CG LEU A 69 -37.523 -8.428 12.023 1.00 43.41 C ATOM 1078 CD1 LEU A 69 -37.730 -8.447 10.517 1.00 52.30 C ATOM 1079 CD2 LEU A 69 -38.542 -7.518 12.692 1.00 34.45 C ATOM 0 H LEU A 69 -37.184 -12.005 13.739 1.00 1.44 H new ATOM 0 HA LEU A 69 -36.679 -11.055 11.085 1.00 61.43 H new ATOM 0 HB2 LEU A 69 -38.583 -10.261 12.331 1.00 64.40 H new ATOM 0 HB3 LEU A 69 -37.578 -9.777 13.682 1.00 64.40 H new ATOM 0 HG LEU A 69 -36.527 -8.036 12.227 1.00 43.41 H new ATOM 0 HD11 LEU A 69 -37.664 -7.431 10.128 1.00 52.30 H new ATOM 0 HD12 LEU A 69 -36.962 -9.064 10.052 1.00 52.30 H new ATOM 0 HD13 LEU A 69 -38.713 -8.859 10.290 1.00 52.30 H new ATOM 0 HD21 LEU A 69 -38.465 -6.515 12.272 1.00 34.45 H new ATOM 0 HD22 LEU A 69 -39.546 -7.907 12.520 1.00 34.45 H new ATOM 0 HD23 LEU A 69 -38.347 -7.479 13.764 1.00 34.45 H new ATOM 1091 N SER A 70 -34.795 -9.851 13.534 1.00 51.22 N ATOM 1092 CA SER A 70 -33.507 -9.232 13.820 1.00 11.03 C ATOM 1093 C SER A 70 -32.364 -10.072 13.260 1.00 25.15 C ATOM 1094 O SER A 70 -31.635 -9.636 12.369 1.00 21.32 O ATOM 1095 CB SER A 70 -33.330 -9.048 15.329 1.00 63.42 C ATOM 1096 OG SER A 70 -32.484 -7.947 15.613 1.00 74.42 O ATOM 0 H SER A 70 -35.382 -10.002 14.354 1.00 51.22 H new ATOM 0 HA SER A 70 -33.486 -8.255 13.337 1.00 11.03 H new ATOM 0 HB2 SER A 70 -34.303 -8.893 15.796 1.00 63.42 H new ATOM 0 HB3 SER A 70 -32.909 -9.955 15.762 1.00 63.42 H new ATOM 0 HG SER A 70 -31.799 -8.219 16.259 1.00 74.42 H new ATOM 1102 N VAL A 71 -32.211 -11.282 13.792 1.00 73.22 N ATOM 1103 CA VAL A 71 -31.158 -12.186 13.346 1.00 40.31 C ATOM 1104 C VAL A 71 -31.151 -12.314 11.827 1.00 44.21 C ATOM 1105 O VAL A 71 -30.090 -12.350 11.200 1.00 13.54 O ATOM 1106 CB VAL A 71 -31.319 -13.585 13.968 1.00 74.11 C ATOM 1107 CG1 VAL A 71 -30.212 -14.513 13.489 1.00 34.34 C ATOM 1108 CG2 VAL A 71 -31.332 -13.495 15.486 1.00 75.03 C ATOM 0 H VAL A 71 -32.804 -11.658 14.532 1.00 73.22 H new ATOM 0 HA VAL A 71 -30.212 -11.757 13.676 1.00 40.31 H new ATOM 0 HB VAL A 71 -32.273 -14.000 13.644 1.00 74.11 H new ATOM 0 HG11 VAL A 71 -30.342 -15.497 13.939 1.00 34.34 H new ATOM 0 HG12 VAL A 71 -30.256 -14.602 12.403 1.00 34.34 H new ATOM 0 HG13 VAL A 71 -29.244 -14.106 13.781 1.00 34.34 H new ATOM 0 HG21 VAL A 71 -31.447 -14.493 15.909 1.00 75.03 H new ATOM 0 HG22 VAL A 71 -30.395 -13.059 15.833 1.00 75.03 H new ATOM 0 HG23 VAL A 71 -32.164 -12.868 15.806 1.00 75.03 H new ATOM 1118 N LEU A 72 -32.340 -12.384 11.239 1.00 42.43 N ATOM 1119 CA LEU A 72 -32.472 -12.507 9.791 1.00 21.45 C ATOM 1120 C LEU A 72 -31.672 -11.422 9.077 1.00 71.22 C ATOM 1121 O LEU A 72 -31.055 -11.672 8.042 1.00 14.41 O ATOM 1122 CB LEU A 72 -33.944 -12.425 9.384 1.00 0.54 C ATOM 1123 CG LEU A 72 -34.221 -11.921 7.968 1.00 45.33 C ATOM 1124 CD1 LEU A 72 -35.486 -12.558 7.412 1.00 65.01 C ATOM 1125 CD2 LEU A 72 -34.335 -10.404 7.954 1.00 13.20 C ATOM 0 H LEU A 72 -33.227 -12.358 11.742 1.00 42.43 H new ATOM 0 HA LEU A 72 -32.075 -13.478 9.496 1.00 21.45 H new ATOM 0 HB2 LEU A 72 -34.385 -13.416 9.488 1.00 0.54 H new ATOM 0 HB3 LEU A 72 -34.459 -11.772 10.088 1.00 0.54 H new ATOM 0 HG LEU A 72 -33.384 -12.208 7.331 1.00 45.33 H new ATOM 0 HD11 LEU A 72 -35.667 -12.187 6.403 1.00 65.01 H new ATOM 0 HD12 LEU A 72 -35.366 -13.641 7.384 1.00 65.01 H new ATOM 0 HD13 LEU A 72 -36.332 -12.303 8.050 1.00 65.01 H new ATOM 0 HD21 LEU A 72 -34.532 -10.063 6.938 1.00 13.20 H new ATOM 0 HD22 LEU A 72 -35.152 -10.095 8.605 1.00 13.20 H new ATOM 0 HD23 LEU A 72 -33.402 -9.966 8.309 1.00 13.20 H new ATOM 1137 N GLY A 73 -31.688 -10.218 9.638 1.00 3.32 N ATOM 1138 CA GLY A 73 -30.960 -9.113 9.042 1.00 41.14 C ATOM 1139 C GLY A 73 -29.457 -9.281 9.153 1.00 71.44 C ATOM 1140 O GLY A 73 -28.724 -9.009 8.202 1.00 20.13 O ATOM 0 H GLY A 73 -32.192 -9.987 10.494 1.00 3.32 H new ATOM 0 HA2 GLY A 73 -31.236 -9.025 7.991 1.00 41.14 H new ATOM 0 HA3 GLY A 73 -31.255 -8.183 9.528 1.00 41.14 H new ATOM 1144 N ALA A 74 -28.998 -9.732 10.315 1.00 40.34 N ATOM 1145 CA ALA A 74 -27.573 -9.937 10.546 1.00 55.25 C ATOM 1146 C ALA A 74 -27.092 -11.231 9.896 1.00 15.42 C ATOM 1147 O ALA A 74 -26.103 -11.237 9.163 1.00 3.04 O ATOM 1148 CB ALA A 74 -27.276 -9.952 12.038 1.00 74.15 C ATOM 0 H ALA A 74 -29.592 -9.963 11.112 1.00 40.34 H new ATOM 0 HA ALA A 74 -27.033 -9.108 10.088 1.00 55.25 H new ATOM 0 HB1 ALA A 74 -26.208 -10.106 12.195 1.00 74.15 H new ATOM 0 HB2 ALA A 74 -27.574 -9.000 12.478 1.00 74.15 H new ATOM 0 HB3 ALA A 74 -27.833 -10.761 12.512 1.00 74.15 H new ATOM 1154 N ILE A 75 -27.798 -12.322 10.170 1.00 75.43 N ATOM 1155 CA ILE A 75 -27.444 -13.620 9.611 1.00 22.50 C ATOM 1156 C ILE A 75 -27.339 -13.556 8.091 1.00 55.30 C ATOM 1157 O ILE A 75 -26.403 -14.092 7.497 1.00 12.45 O ATOM 1158 CB ILE A 75 -28.472 -14.700 9.998 1.00 54.34 C ATOM 1159 CG1 ILE A 75 -27.898 -16.096 9.745 1.00 24.33 C ATOM 1160 CG2 ILE A 75 -29.764 -14.505 9.219 1.00 43.33 C ATOM 1161 CD1 ILE A 75 -26.701 -16.423 10.611 1.00 44.41 C ATOM 0 H ILE A 75 -28.619 -12.333 10.776 1.00 75.43 H new ATOM 0 HA ILE A 75 -26.473 -13.887 10.028 1.00 22.50 H new ATOM 0 HB ILE A 75 -28.693 -14.605 11.061 1.00 54.34 H new ATOM 0 HG12 ILE A 75 -28.677 -16.838 9.921 1.00 24.33 H new ATOM 0 HG13 ILE A 75 -27.611 -16.178 8.697 1.00 24.33 H new ATOM 0 HG21 ILE A 75 -30.480 -15.276 9.504 1.00 43.33 H new ATOM 0 HG22 ILE A 75 -30.180 -13.523 9.444 1.00 43.33 H new ATOM 0 HG23 ILE A 75 -29.559 -14.577 8.151 1.00 43.33 H new ATOM 0 HD11 ILE A 75 -26.347 -17.427 10.378 1.00 44.41 H new ATOM 0 HD12 ILE A 75 -25.905 -15.704 10.418 1.00 44.41 H new ATOM 0 HD13 ILE A 75 -26.988 -16.374 11.661 1.00 44.41 H new ATOM 1173 N THR A 76 -28.307 -12.892 7.465 1.00 71.44 N ATOM 1174 CA THR A 76 -28.324 -12.756 6.014 1.00 53.04 C ATOM 1175 C THR A 76 -27.284 -11.745 5.544 1.00 3.12 C ATOM 1176 O THR A 76 -26.747 -11.859 4.442 1.00 2.04 O ATOM 1177 CB THR A 76 -29.712 -12.320 5.508 1.00 40.24 C ATOM 1178 OG1 THR A 76 -30.707 -13.255 5.939 1.00 33.15 O ATOM 1179 CG2 THR A 76 -29.727 -12.221 3.989 1.00 41.30 C ATOM 0 H THR A 76 -29.088 -12.441 7.940 1.00 71.44 H new ATOM 0 HA THR A 76 -28.086 -13.736 5.602 1.00 53.04 H new ATOM 0 HB THR A 76 -29.934 -11.337 5.924 1.00 40.24 H new ATOM 0 HG1 THR A 76 -31.082 -12.962 6.796 1.00 33.15 H new ATOM 0 HG21 THR A 76 -30.717 -11.912 3.654 1.00 41.30 H new ATOM 0 HG22 THR A 76 -28.989 -11.487 3.665 1.00 41.30 H new ATOM 0 HG23 THR A 76 -29.486 -13.193 3.559 1.00 41.30 H new ATOM 1187 N SER A 77 -27.004 -10.756 6.388 1.00 64.22 N ATOM 1188 CA SER A 77 -26.029 -9.723 6.058 1.00 51.14 C ATOM 1189 C SER A 77 -24.622 -10.307 5.983 1.00 21.31 C ATOM 1190 O SER A 77 -23.907 -10.113 5.000 1.00 73.12 O ATOM 1191 CB SER A 77 -26.073 -8.599 7.095 1.00 34.41 C ATOM 1192 OG SER A 77 -27.018 -7.607 6.732 1.00 24.34 O ATOM 0 H SER A 77 -27.438 -10.649 7.305 1.00 64.22 H new ATOM 0 HA SER A 77 -26.286 -9.315 5.080 1.00 51.14 H new ATOM 0 HB2 SER A 77 -26.330 -9.010 8.071 1.00 34.41 H new ATOM 0 HB3 SER A 77 -25.085 -8.148 7.189 1.00 34.41 H new ATOM 0 HG SER A 77 -27.884 -7.815 7.141 1.00 24.34 H new ATOM 1198 N VAL A 78 -24.230 -11.024 7.032 1.00 60.22 N ATOM 1199 CA VAL A 78 -22.908 -11.638 7.086 1.00 33.44 C ATOM 1200 C VAL A 78 -22.783 -12.765 6.066 1.00 12.05 C ATOM 1201 O VAL A 78 -21.748 -12.916 5.419 1.00 44.30 O ATOM 1202 CB VAL A 78 -22.606 -12.197 8.490 1.00 14.31 C ATOM 1203 CG1 VAL A 78 -22.530 -11.069 9.508 1.00 53.11 C ATOM 1204 CG2 VAL A 78 -23.658 -13.220 8.894 1.00 50.10 C ATOM 0 H VAL A 78 -24.808 -11.194 7.855 1.00 60.22 H new ATOM 0 HA VAL A 78 -22.186 -10.856 6.850 1.00 33.44 H new ATOM 0 HB VAL A 78 -21.638 -12.697 8.463 1.00 14.31 H new ATOM 0 HG11 VAL A 78 -22.316 -11.482 10.494 1.00 53.11 H new ATOM 0 HG12 VAL A 78 -21.737 -10.376 9.225 1.00 53.11 H new ATOM 0 HG13 VAL A 78 -23.482 -10.539 9.536 1.00 53.11 H new ATOM 0 HG21 VAL A 78 -23.429 -13.604 9.888 1.00 50.10 H new ATOM 0 HG22 VAL A 78 -24.640 -12.747 8.905 1.00 50.10 H new ATOM 0 HG23 VAL A 78 -23.659 -14.042 8.179 1.00 50.10 H new ATOM 1214 N GLN A 79 -23.845 -13.552 5.928 1.00 4.22 N ATOM 1215 CA GLN A 79 -23.853 -14.664 4.986 1.00 33.54 C ATOM 1216 C GLN A 79 -23.232 -14.255 3.655 1.00 64.41 C ATOM 1217 O GLN A 79 -22.141 -14.706 3.305 1.00 61.43 O ATOM 1218 CB GLN A 79 -25.283 -15.161 4.764 1.00 71.04 C ATOM 1219 CG GLN A 79 -25.389 -16.672 4.636 1.00 54.15 C ATOM 1220 CD GLN A 79 -26.757 -17.196 5.025 1.00 2.24 C ATOM 1221 OE1 GLN A 79 -26.857 -17.757 6.225 1.00 11.31 O flip ATOM 1222 NE2 GLN A 79 -27.714 -17.099 4.257 1.00 52.22 N flip ATOM 0 H GLN A 79 -24.710 -13.440 6.456 1.00 4.22 H new ATOM 0 HA GLN A 79 -23.257 -15.471 5.411 1.00 33.54 H new ATOM 0 HB2 GLN A 79 -25.907 -14.830 5.595 1.00 71.04 H new ATOM 0 HB3 GLN A 79 -25.683 -14.699 3.861 1.00 71.04 H new ATOM 0 HG2 GLN A 79 -25.172 -16.962 3.608 1.00 54.15 H new ATOM 0 HG3 GLN A 79 -24.632 -17.140 5.266 1.00 54.15 H new ATOM 0 HE21 GLN A 79 -27.593 -16.661 3.344 1.00 52.22 H new ATOM 0 HE22 GLN A 79 -28.628 -17.457 4.534 1.00 52.22 H new ATOM 1231 N GLN A 80 -23.932 -13.399 2.918 1.00 64.41 N ATOM 1232 CA GLN A 80 -23.448 -12.930 1.624 1.00 30.55 C ATOM 1233 C GLN A 80 -22.158 -12.133 1.783 1.00 63.22 C ATOM 1234 O GLN A 80 -21.347 -12.058 0.860 1.00 22.02 O ATOM 1235 CB GLN A 80 -24.513 -12.073 0.939 1.00 4.21 C ATOM 1236 CG GLN A 80 -24.610 -10.662 1.498 1.00 2.13 C ATOM 1237 CD GLN A 80 -25.985 -10.052 1.307 1.00 22.33 C ATOM 1238 OE1 GLN A 80 -26.646 -10.290 0.297 1.00 52.54 O ATOM 1239 NE2 GLN A 80 -26.422 -9.262 2.280 1.00 1.21 N ATOM 0 H GLN A 80 -24.836 -13.016 3.194 1.00 64.41 H new ATOM 0 HA GLN A 80 -23.240 -13.801 1.003 1.00 30.55 H new ATOM 0 HB2 GLN A 80 -24.293 -12.018 -0.127 1.00 4.21 H new ATOM 0 HB3 GLN A 80 -25.482 -12.562 1.040 1.00 4.21 H new ATOM 0 HG2 GLN A 80 -24.369 -10.679 2.561 1.00 2.13 H new ATOM 0 HG3 GLN A 80 -23.866 -10.031 1.012 1.00 2.13 H new ATOM 0 HE21 GLN A 80 -25.839 -9.093 3.100 1.00 1.21 H new ATOM 0 HE22 GLN A 80 -27.340 -8.824 2.208 1.00 1.21 H new ATOM 1248 N ARG A 81 -21.976 -11.538 2.957 1.00 10.32 N ATOM 1249 CA ARG A 81 -20.785 -10.744 3.236 1.00 72.35 C ATOM 1250 C ARG A 81 -19.519 -11.564 3.007 1.00 35.12 C ATOM 1251 O ARG A 81 -18.641 -11.170 2.239 1.00 72.35 O ATOM 1252 CB ARG A 81 -20.817 -10.225 4.674 1.00 34.43 C ATOM 1253 CG ARG A 81 -21.404 -8.829 4.806 1.00 55.15 C ATOM 1254 CD ARG A 81 -20.327 -7.760 4.708 1.00 14.21 C ATOM 1255 NE ARG A 81 -20.070 -7.367 3.326 1.00 61.15 N ATOM 1256 CZ ARG A 81 -20.910 -6.638 2.600 1.00 35.11 C ATOM 1257 NH1 ARG A 81 -22.056 -6.224 3.123 1.00 2.40 N ATOM 1258 NH2 ARG A 81 -20.606 -6.321 1.348 1.00 45.12 N ATOM 0 H ARG A 81 -22.638 -11.591 3.731 1.00 10.32 H new ATOM 0 HA ARG A 81 -20.776 -9.896 2.552 1.00 72.35 H new ATOM 0 HB2 ARG A 81 -21.399 -10.914 5.287 1.00 34.43 H new ATOM 0 HB3 ARG A 81 -19.803 -10.222 5.073 1.00 34.43 H new ATOM 0 HG2 ARG A 81 -22.148 -8.670 4.025 1.00 55.15 H new ATOM 0 HG3 ARG A 81 -21.921 -8.739 5.761 1.00 55.15 H new ATOM 0 HD2 ARG A 81 -20.631 -6.885 5.283 1.00 14.21 H new ATOM 0 HD3 ARG A 81 -19.406 -8.132 5.156 1.00 14.21 H new ATOM 0 HE ARG A 81 -19.197 -7.669 2.894 1.00 61.15 H new ATOM 0 HH11 ARG A 81 -22.294 -6.465 4.085 1.00 2.40 H new ATOM 0 HH12 ARG A 81 -22.699 -5.664 2.563 1.00 2.40 H new ATOM 0 HH21 ARG A 81 -19.726 -6.637 0.941 1.00 45.12 H new ATOM 0 HH22 ARG A 81 -21.253 -5.761 0.792 1.00 45.12 H new ATOM 1272 N LEU A 82 -19.432 -12.706 3.681 1.00 63.14 N ATOM 1273 CA LEU A 82 -18.272 -13.583 3.552 1.00 71.23 C ATOM 1274 C LEU A 82 -18.175 -14.154 2.141 1.00 4.00 C ATOM 1275 O LEU A 82 -17.090 -14.229 1.563 1.00 60.24 O ATOM 1276 CB LEU A 82 -18.354 -14.722 4.570 1.00 40.31 C ATOM 1277 CG LEU A 82 -17.793 -14.420 5.960 1.00 44.00 C ATOM 1278 CD1 LEU A 82 -16.274 -14.342 5.918 1.00 72.44 C ATOM 1279 CD2 LEU A 82 -18.380 -13.126 6.503 1.00 1.25 C ATOM 0 H LEU A 82 -20.149 -13.046 4.321 1.00 63.14 H new ATOM 0 HA LEU A 82 -17.377 -12.992 3.747 1.00 71.23 H new ATOM 0 HB2 LEU A 82 -19.399 -15.013 4.677 1.00 40.31 H new ATOM 0 HB3 LEU A 82 -17.823 -15.584 4.165 1.00 40.31 H new ATOM 0 HG LEU A 82 -18.076 -15.233 6.629 1.00 44.00 H new ATOM 0 HD11 LEU A 82 -15.893 -14.126 6.916 1.00 72.44 H new ATOM 0 HD12 LEU A 82 -15.870 -15.294 5.573 1.00 72.44 H new ATOM 0 HD13 LEU A 82 -15.969 -13.550 5.234 1.00 72.44 H new ATOM 0 HD21 LEU A 82 -17.969 -12.927 7.493 1.00 1.25 H new ATOM 0 HD22 LEU A 82 -18.128 -12.303 5.834 1.00 1.25 H new ATOM 0 HD23 LEU A 82 -19.464 -13.219 6.572 1.00 1.25 H new ATOM 1291 N LYS A 83 -19.317 -14.553 1.590 1.00 65.14 N ATOM 1292 CA LYS A 83 -19.362 -15.113 0.244 1.00 71.21 C ATOM 1293 C LYS A 83 -18.621 -14.218 -0.744 1.00 4.03 C ATOM 1294 O LYS A 83 -18.196 -14.669 -1.808 1.00 74.41 O ATOM 1295 CB LYS A 83 -20.813 -15.295 -0.206 1.00 22.41 C ATOM 1296 CG LYS A 83 -21.583 -16.310 0.621 1.00 73.44 C ATOM 1297 CD LYS A 83 -21.200 -17.734 0.254 1.00 32.33 C ATOM 1298 CE LYS A 83 -21.943 -18.209 -0.985 1.00 73.25 C ATOM 1299 NZ LYS A 83 -21.600 -19.617 -1.333 1.00 2.03 N ATOM 0 H LYS A 83 -20.223 -14.499 2.055 1.00 65.14 H new ATOM 0 HA LYS A 83 -18.869 -16.085 0.266 1.00 71.21 H new ATOM 0 HB2 LYS A 83 -21.324 -14.334 -0.154 1.00 22.41 H new ATOM 0 HB3 LYS A 83 -20.824 -15.606 -1.251 1.00 22.41 H new ATOM 0 HG2 LYS A 83 -21.388 -16.141 1.680 1.00 73.44 H new ATOM 0 HG3 LYS A 83 -22.653 -16.169 0.468 1.00 73.44 H new ATOM 0 HD2 LYS A 83 -20.126 -17.789 0.079 1.00 32.33 H new ATOM 0 HD3 LYS A 83 -21.421 -18.398 1.089 1.00 32.33 H new ATOM 0 HE2 LYS A 83 -23.017 -18.128 -0.818 1.00 73.25 H new ATOM 0 HE3 LYS A 83 -21.701 -17.558 -1.825 1.00 73.25 H new ATOM 0 HZ1 LYS A 83 -22.127 -19.903 -2.183 1.00 2.03 H new ATOM 0 HZ2 LYS A 83 -20.579 -19.690 -1.518 1.00 2.03 H new ATOM 0 HZ3 LYS A 83 -21.854 -20.242 -0.542 1.00 2.03 H new ATOM 1313 N LEU A 84 -18.467 -12.948 -0.384 1.00 61.32 N ATOM 1314 CA LEU A 84 -17.776 -11.990 -1.238 1.00 45.24 C ATOM 1315 C LEU A 84 -16.269 -12.227 -1.216 1.00 33.13 C ATOM 1316 O LEU A 84 -15.500 -11.464 -1.801 1.00 74.51 O ATOM 1317 CB LEU A 84 -18.084 -10.560 -0.790 1.00 34.15 C ATOM 1318 CG LEU A 84 -17.901 -9.470 -1.846 1.00 74.41 C ATOM 1319 CD1 LEU A 84 -19.098 -9.430 -2.784 1.00 5.42 C ATOM 1320 CD2 LEU A 84 -17.693 -8.116 -1.184 1.00 72.54 C ATOM 0 H LEU A 84 -18.812 -12.559 0.494 1.00 61.32 H new ATOM 0 HA LEU A 84 -18.133 -12.130 -2.258 1.00 45.24 H new ATOM 0 HB2 LEU A 84 -19.115 -10.526 -0.437 1.00 34.15 H new ATOM 0 HB3 LEU A 84 -17.447 -10.323 0.062 1.00 34.15 H new ATOM 0 HG LEU A 84 -17.013 -9.704 -2.433 1.00 74.41 H new ATOM 0 HD11 LEU A 84 -18.950 -8.648 -3.529 1.00 5.42 H new ATOM 0 HD12 LEU A 84 -19.201 -10.393 -3.284 1.00 5.42 H new ATOM 0 HD13 LEU A 84 -20.002 -9.220 -2.212 1.00 5.42 H new ATOM 0 HD21 LEU A 84 -17.564 -7.352 -1.951 1.00 72.54 H new ATOM 0 HD22 LEU A 84 -18.561 -7.873 -0.572 1.00 72.54 H new ATOM 0 HD23 LEU A 84 -16.804 -8.152 -0.555 1.00 72.54 H new ATOM 1332 N TYR A 85 -15.854 -13.291 -0.537 1.00 63.25 N ATOM 1333 CA TYR A 85 -14.439 -13.630 -0.438 1.00 3.14 C ATOM 1334 C TYR A 85 -14.237 -15.142 -0.468 1.00 34.44 C ATOM 1335 O TYR A 85 -15.061 -15.900 0.043 1.00 2.23 O ATOM 1336 CB TYR A 85 -13.843 -13.050 0.846 1.00 32.32 C ATOM 1337 CG TYR A 85 -14.382 -11.682 1.200 1.00 73.35 C ATOM 1338 CD1 TYR A 85 -13.831 -10.532 0.649 1.00 22.21 C ATOM 1339 CD2 TYR A 85 -15.445 -11.541 2.085 1.00 42.25 C ATOM 1340 CE1 TYR A 85 -14.320 -9.281 0.970 1.00 62.33 C ATOM 1341 CE2 TYR A 85 -15.940 -10.293 2.411 1.00 74.52 C ATOM 1342 CZ TYR A 85 -15.375 -9.167 1.851 1.00 54.41 C ATOM 1343 OH TYR A 85 -15.866 -7.922 2.172 1.00 64.31 O ATOM 0 H TYR A 85 -16.477 -13.933 -0.047 1.00 63.25 H new ATOM 0 HA TYR A 85 -13.927 -13.196 -1.297 1.00 3.14 H new ATOM 0 HB2 TYR A 85 -14.042 -13.734 1.671 1.00 32.32 H new ATOM 0 HB3 TYR A 85 -12.760 -12.988 0.738 1.00 32.32 H new ATOM 0 HD1 TYR A 85 -13.006 -10.618 -0.042 1.00 22.21 H new ATOM 0 HD2 TYR A 85 -15.891 -12.421 2.525 1.00 42.25 H new ATOM 0 HE1 TYR A 85 -13.879 -8.397 0.534 1.00 62.33 H new ATOM 0 HE2 TYR A 85 -16.766 -10.200 3.101 1.00 74.52 H new ATOM 0 HH TYR A 85 -16.609 -8.016 2.804 1.00 64.31 H new ATOM 1353 N ASN A 86 -13.134 -15.574 -1.070 1.00 51.23 N ATOM 1354 CA ASN A 86 -12.822 -16.994 -1.168 1.00 22.41 C ATOM 1355 C ASN A 86 -12.304 -17.530 0.164 1.00 4.01 C ATOM 1356 O ASN A 86 -12.939 -18.374 0.796 1.00 55.21 O ATOM 1357 CB ASN A 86 -11.785 -17.237 -2.266 1.00 42.20 C ATOM 1358 CG ASN A 86 -12.383 -17.139 -3.657 1.00 24.42 C ATOM 1359 OD1 ASN A 86 -13.266 -17.915 -4.020 1.00 33.43 O ATOM 1360 ND2 ASN A 86 -11.901 -16.183 -4.442 1.00 2.11 N ATOM 0 H ASN A 86 -12.441 -14.960 -1.498 1.00 51.23 H new ATOM 0 HA ASN A 86 -13.740 -17.525 -1.422 1.00 22.41 H new ATOM 0 HB2 ASN A 86 -10.979 -16.510 -2.168 1.00 42.20 H new ATOM 0 HB3 ASN A 86 -11.342 -18.224 -2.132 1.00 42.20 H new ATOM 0 HD21 ASN A 86 -12.263 -16.069 -5.389 1.00 2.11 H new ATOM 0 HD22 ASN A 86 -11.168 -15.562 -4.098 1.00 2.11 H new ATOM 1367 N LYS A 87 -11.145 -17.035 0.584 1.00 12.50 N ATOM 1368 CA LYS A 87 -10.540 -17.460 1.840 1.00 10.43 C ATOM 1369 C LYS A 87 -9.865 -16.287 2.544 1.00 13.22 C ATOM 1370 O LYS A 87 -9.284 -15.414 1.900 1.00 42.05 O ATOM 1371 CB LYS A 87 -9.520 -18.573 1.588 1.00 31.02 C ATOM 1372 CG LYS A 87 -8.291 -18.110 0.825 1.00 31.03 C ATOM 1373 CD LYS A 87 -7.371 -19.272 0.492 1.00 22.43 C ATOM 1374 CE LYS A 87 -7.867 -20.046 -0.719 1.00 70.45 C ATOM 1375 NZ LYS A 87 -6.921 -21.127 -1.113 1.00 2.11 N ATOM 0 H LYS A 87 -10.605 -16.338 0.072 1.00 12.50 H new ATOM 0 HA LYS A 87 -11.332 -17.841 2.485 1.00 10.43 H new ATOM 0 HB2 LYS A 87 -9.207 -18.991 2.545 1.00 31.02 H new ATOM 0 HB3 LYS A 87 -10.002 -19.377 1.031 1.00 31.02 H new ATOM 0 HG2 LYS A 87 -8.599 -17.613 -0.095 1.00 31.03 H new ATOM 0 HG3 LYS A 87 -7.749 -17.374 1.419 1.00 31.03 H new ATOM 0 HD2 LYS A 87 -6.366 -18.898 0.299 1.00 22.43 H new ATOM 0 HD3 LYS A 87 -7.303 -19.941 1.350 1.00 22.43 H new ATOM 0 HE2 LYS A 87 -8.842 -20.480 -0.498 1.00 70.45 H new ATOM 0 HE3 LYS A 87 -8.005 -19.361 -1.556 1.00 70.45 H new ATOM 0 HZ1 LYS A 87 -7.295 -21.631 -1.942 1.00 2.11 H new ATOM 0 HZ2 LYS A 87 -5.997 -20.711 -1.349 1.00 2.11 H new ATOM 0 HZ3 LYS A 87 -6.809 -21.795 -0.324 1.00 2.11 H new ATOM 1389 N VAL A 88 -9.944 -16.274 3.871 1.00 70.43 N ATOM 1390 CA VAL A 88 -9.339 -15.210 4.662 1.00 23.24 C ATOM 1391 C VAL A 88 -7.826 -15.379 4.744 1.00 41.40 C ATOM 1392 O VAL A 88 -7.280 -16.448 4.473 1.00 61.25 O ATOM 1393 CB VAL A 88 -9.918 -15.173 6.089 1.00 4.53 C ATOM 1394 CG1 VAL A 88 -11.230 -14.404 6.113 1.00 44.31 C ATOM 1395 CG2 VAL A 88 -10.107 -16.584 6.624 1.00 4.25 C ATOM 0 H VAL A 88 -10.421 -16.989 4.420 1.00 70.43 H new ATOM 0 HA VAL A 88 -9.570 -14.271 4.159 1.00 23.24 H new ATOM 0 HB VAL A 88 -9.210 -14.656 6.737 1.00 4.53 H new ATOM 0 HG11 VAL A 88 -11.624 -14.388 7.129 1.00 44.31 H new ATOM 0 HG12 VAL A 88 -11.059 -13.382 5.774 1.00 44.31 H new ATOM 0 HG13 VAL A 88 -11.948 -14.890 5.453 1.00 44.31 H new ATOM 0 HG21 VAL A 88 -10.517 -16.539 7.633 1.00 4.25 H new ATOM 0 HG22 VAL A 88 -10.794 -17.129 5.977 1.00 4.25 H new ATOM 0 HG23 VAL A 88 -9.145 -17.097 6.646 1.00 4.25 H new ATOM 1405 N PRO A 89 -7.130 -14.298 5.128 1.00 43.13 N ATOM 1406 CA PRO A 89 -5.669 -14.301 5.255 1.00 22.54 C ATOM 1407 C PRO A 89 -5.192 -15.148 6.431 1.00 41.42 C ATOM 1408 O PRO A 89 -5.986 -15.667 7.216 1.00 60.21 O ATOM 1409 CB PRO A 89 -5.330 -12.827 5.485 1.00 42.40 C ATOM 1410 CG PRO A 89 -6.564 -12.243 6.081 1.00 23.25 C ATOM 1411 CD PRO A 89 -7.715 -12.990 5.468 1.00 62.35 C ATOM 0 HA PRO A 89 -5.184 -14.732 4.379 1.00 22.54 H new ATOM 0 HB2 PRO A 89 -4.477 -12.717 6.154 1.00 42.40 H new ATOM 0 HB3 PRO A 89 -5.068 -12.330 4.551 1.00 42.40 H new ATOM 0 HG2 PRO A 89 -6.562 -12.351 7.166 1.00 23.25 H new ATOM 0 HG3 PRO A 89 -6.633 -11.176 5.867 1.00 23.25 H new ATOM 0 HD2 PRO A 89 -8.546 -13.091 6.166 1.00 62.35 H new ATOM 0 HD3 PRO A 89 -8.100 -12.480 4.585 1.00 62.35 H new ATOM 1419 N PRO A 90 -3.864 -15.291 6.557 1.00 2.14 N ATOM 1420 CA PRO A 90 -3.251 -16.073 7.635 1.00 53.43 C ATOM 1421 C PRO A 90 -3.408 -15.405 8.997 1.00 62.23 C ATOM 1422 O PRO A 90 -3.054 -15.980 10.025 1.00 51.04 O ATOM 1423 CB PRO A 90 -1.775 -16.133 7.235 1.00 54.13 C ATOM 1424 CG PRO A 90 -1.564 -14.926 6.387 1.00 25.14 C ATOM 1425 CD PRO A 90 -2.859 -14.700 5.658 1.00 55.01 C ATOM 0 HA PRO A 90 -3.717 -17.052 7.744 1.00 53.43 H new ATOM 0 HB2 PRO A 90 -1.126 -16.120 8.111 1.00 54.13 H new ATOM 0 HB3 PRO A 90 -1.550 -17.047 6.686 1.00 54.13 H new ATOM 0 HG2 PRO A 90 -1.304 -14.061 6.997 1.00 25.14 H new ATOM 0 HG3 PRO A 90 -0.744 -15.080 5.686 1.00 25.14 H new ATOM 0 HD2 PRO A 90 -3.045 -13.639 5.489 1.00 55.01 H new ATOM 0 HD3 PRO A 90 -2.860 -15.183 4.681 1.00 55.01 H new ATOM 1433 N ASN A 91 -3.940 -14.187 8.996 1.00 32.41 N ATOM 1434 CA ASN A 91 -4.143 -13.441 10.232 1.00 13.32 C ATOM 1435 C ASN A 91 -5.477 -13.807 10.876 1.00 64.41 C ATOM 1436 O ASN A 91 -5.892 -13.197 11.861 1.00 23.41 O ATOM 1437 CB ASN A 91 -4.094 -11.937 9.958 1.00 44.54 C ATOM 1438 CG ASN A 91 -2.697 -11.366 10.113 1.00 71.12 C ATOM 1439 OD1 ASN A 91 -2.087 -10.916 9.144 1.00 72.15 O ATOM 1440 ND2 ASN A 91 -2.184 -11.383 11.338 1.00 51.40 N ATOM 0 H ASN A 91 -4.238 -13.696 8.153 1.00 32.41 H new ATOM 0 HA ASN A 91 -3.341 -13.705 10.922 1.00 13.32 H new ATOM 0 HB2 ASN A 91 -4.453 -11.743 8.947 1.00 44.54 H new ATOM 0 HB3 ASN A 91 -4.771 -11.424 10.641 1.00 44.54 H new ATOM 0 HD21 ASN A 91 -1.248 -11.013 11.504 1.00 51.40 H new ATOM 0 HD22 ASN A 91 -2.726 -11.766 12.113 1.00 51.40 H new ATOM 1447 N GLY A 92 -6.144 -14.810 10.313 1.00 34.53 N ATOM 1448 CA GLY A 92 -7.423 -15.242 10.845 1.00 22.15 C ATOM 1449 C GLY A 92 -8.587 -14.470 10.256 1.00 73.52 C ATOM 1450 O GLY A 92 -8.444 -13.806 9.228 1.00 3.11 O ATOM 0 H GLY A 92 -5.821 -15.331 9.498 1.00 34.53 H new ATOM 0 HA2 GLY A 92 -7.557 -16.305 10.643 1.00 22.15 H new ATOM 0 HA3 GLY A 92 -7.422 -15.121 11.928 1.00 22.15 H new ATOM 1454 N LEU A 93 -9.743 -14.560 10.904 1.00 11.12 N ATOM 1455 CA LEU A 93 -10.938 -13.866 10.435 1.00 3.45 C ATOM 1456 C LEU A 93 -11.741 -13.314 11.609 1.00 34.31 C ATOM 1457 O LEU A 93 -12.150 -14.059 12.500 1.00 53.00 O ATOM 1458 CB LEU A 93 -11.809 -14.812 9.606 1.00 0.23 C ATOM 1459 CG LEU A 93 -13.239 -14.343 9.335 1.00 21.13 C ATOM 1460 CD1 LEU A 93 -13.728 -14.868 7.995 1.00 72.32 C ATOM 1461 CD2 LEU A 93 -14.167 -14.789 10.456 1.00 11.52 C ATOM 0 H LEU A 93 -9.879 -15.106 11.755 1.00 11.12 H new ATOM 0 HA LEU A 93 -10.622 -13.031 9.809 1.00 3.45 H new ATOM 0 HB2 LEU A 93 -11.316 -14.982 8.649 1.00 0.23 H new ATOM 0 HB3 LEU A 93 -11.854 -15.774 10.117 1.00 0.23 H new ATOM 0 HG LEU A 93 -13.243 -13.254 9.298 1.00 21.13 H new ATOM 0 HD11 LEU A 93 -14.747 -14.524 7.819 1.00 72.32 H new ATOM 0 HD12 LEU A 93 -13.079 -14.499 7.201 1.00 72.32 H new ATOM 0 HD13 LEU A 93 -13.709 -15.958 8.002 1.00 72.32 H new ATOM 0 HD21 LEU A 93 -15.181 -14.447 10.247 1.00 11.52 H new ATOM 0 HD22 LEU A 93 -14.158 -15.877 10.525 1.00 11.52 H new ATOM 0 HD23 LEU A 93 -13.828 -14.363 11.400 1.00 11.52 H new ATOM 1473 N VAL A 94 -11.966 -12.004 11.601 1.00 72.00 N ATOM 1474 CA VAL A 94 -12.724 -11.352 12.663 1.00 74.02 C ATOM 1475 C VAL A 94 -13.946 -10.631 12.103 1.00 25.41 C ATOM 1476 O VAL A 94 -13.828 -9.567 11.495 1.00 31.31 O ATOM 1477 CB VAL A 94 -11.855 -10.342 13.435 1.00 71.24 C ATOM 1478 CG1 VAL A 94 -10.947 -11.062 14.420 1.00 62.41 C ATOM 1479 CG2 VAL A 94 -11.041 -9.493 12.469 1.00 34.01 C ATOM 0 H VAL A 94 -11.634 -11.373 10.871 1.00 72.00 H new ATOM 0 HA VAL A 94 -13.050 -12.136 13.346 1.00 74.02 H new ATOM 0 HB VAL A 94 -12.512 -9.681 14.000 1.00 71.24 H new ATOM 0 HG11 VAL A 94 -10.341 -10.332 14.956 1.00 62.41 H new ATOM 0 HG12 VAL A 94 -11.554 -11.622 15.131 1.00 62.41 H new ATOM 0 HG13 VAL A 94 -10.295 -11.748 13.879 1.00 62.41 H new ATOM 0 HG21 VAL A 94 -10.433 -8.785 13.031 1.00 34.01 H new ATOM 0 HG22 VAL A 94 -10.392 -10.138 11.876 1.00 34.01 H new ATOM 0 HG23 VAL A 94 -11.714 -8.948 11.807 1.00 34.01 H new ATOM 1489 N VAL A 95 -15.120 -11.218 12.313 1.00 42.04 N ATOM 1490 CA VAL A 95 -16.365 -10.631 11.831 1.00 30.42 C ATOM 1491 C VAL A 95 -17.088 -9.884 12.946 1.00 53.20 C ATOM 1492 O VAL A 95 -17.211 -10.384 14.064 1.00 3.21 O ATOM 1493 CB VAL A 95 -17.306 -11.707 11.255 1.00 4.40 C ATOM 1494 CG1 VAL A 95 -16.763 -12.240 9.938 1.00 72.23 C ATOM 1495 CG2 VAL A 95 -17.501 -12.835 12.256 1.00 75.24 C ATOM 0 H VAL A 95 -15.235 -12.099 12.814 1.00 42.04 H new ATOM 0 HA VAL A 95 -16.099 -9.929 11.040 1.00 30.42 H new ATOM 0 HB VAL A 95 -18.277 -11.251 11.063 1.00 4.40 H new ATOM 0 HG11 VAL A 95 -17.440 -12.999 9.546 1.00 72.23 H new ATOM 0 HG12 VAL A 95 -16.679 -11.423 9.222 1.00 72.23 H new ATOM 0 HG13 VAL A 95 -15.780 -12.681 10.102 1.00 72.23 H new ATOM 0 HG21 VAL A 95 -18.168 -13.586 11.833 1.00 75.24 H new ATOM 0 HG22 VAL A 95 -16.537 -13.292 12.482 1.00 75.24 H new ATOM 0 HG23 VAL A 95 -17.937 -12.437 13.172 1.00 75.24 H new ATOM 1505 N TYR A 96 -17.565 -8.684 12.633 1.00 31.13 N ATOM 1506 CA TYR A 96 -18.274 -7.866 13.609 1.00 53.41 C ATOM 1507 C TYR A 96 -19.590 -7.351 13.033 1.00 32.13 C ATOM 1508 O TYR A 96 -19.603 -6.444 12.200 1.00 35.01 O ATOM 1509 CB TYR A 96 -17.402 -6.689 14.050 1.00 21.30 C ATOM 1510 CG TYR A 96 -16.214 -7.099 14.891 1.00 13.43 C ATOM 1511 CD1 TYR A 96 -16.370 -7.945 15.983 1.00 45.54 C ATOM 1512 CD2 TYR A 96 -14.937 -6.638 14.596 1.00 31.11 C ATOM 1513 CE1 TYR A 96 -15.288 -8.321 16.754 1.00 4.52 C ATOM 1514 CE2 TYR A 96 -13.849 -7.010 15.361 1.00 11.51 C ATOM 1515 CZ TYR A 96 -14.029 -7.850 16.440 1.00 1.11 C ATOM 1516 OH TYR A 96 -12.948 -8.222 17.205 1.00 2.24 O ATOM 0 H TYR A 96 -17.473 -8.257 11.711 1.00 31.13 H new ATOM 0 HA TYR A 96 -18.496 -8.489 14.475 1.00 53.41 H new ATOM 0 HB2 TYR A 96 -17.046 -6.160 13.166 1.00 21.30 H new ATOM 0 HB3 TYR A 96 -18.013 -5.987 14.617 1.00 21.30 H new ATOM 0 HD1 TYR A 96 -17.354 -8.314 16.232 1.00 45.54 H new ATOM 0 HD2 TYR A 96 -14.793 -5.977 13.754 1.00 31.11 H new ATOM 0 HE1 TYR A 96 -15.426 -8.980 17.598 1.00 4.52 H new ATOM 0 HE2 TYR A 96 -12.863 -6.645 15.116 1.00 11.51 H new ATOM 0 HH TYR A 96 -12.136 -7.804 16.849 1.00 2.24 H new ATOM 1526 N CYS A 97 -20.695 -7.934 13.485 1.00 22.34 N ATOM 1527 CA CYS A 97 -22.017 -7.536 13.016 1.00 2.23 C ATOM 1528 C CYS A 97 -22.859 -6.991 14.165 1.00 14.23 C ATOM 1529 O CYS A 97 -22.952 -7.605 15.227 1.00 1.23 O ATOM 1530 CB CYS A 97 -22.729 -8.721 12.364 1.00 71.51 C ATOM 1531 SG CYS A 97 -22.195 -10.334 12.983 1.00 61.43 S ATOM 0 H CYS A 97 -20.701 -8.684 14.176 1.00 22.34 H new ATOM 0 HA CYS A 97 -21.890 -6.747 12.275 1.00 2.23 H new ATOM 0 HB2 CYS A 97 -23.802 -8.619 12.524 1.00 71.51 H new ATOM 0 HB3 CYS A 97 -22.563 -8.684 11.287 1.00 71.51 H new ATOM 0 HG CYS A 97 -21.922 -10.244 14.251 1.00 61.43 H new ATOM 1537 N GLY A 98 -23.472 -5.830 13.945 1.00 23.51 N ATOM 1538 CA GLY A 98 -24.298 -5.221 14.972 1.00 64.35 C ATOM 1539 C GLY A 98 -25.269 -4.204 14.406 1.00 71.55 C ATOM 1540 O GLY A 98 -24.959 -3.508 13.438 1.00 25.15 O ATOM 0 H GLY A 98 -23.411 -5.302 13.075 1.00 23.51 H new ATOM 0 HA2 GLY A 98 -24.855 -5.999 15.495 1.00 64.35 H new ATOM 0 HA3 GLY A 98 -23.658 -4.737 15.709 1.00 64.35 H new ATOM 1544 N THR A 99 -26.451 -4.118 15.008 1.00 23.15 N ATOM 1545 CA THR A 99 -27.472 -3.182 14.557 1.00 31.15 C ATOM 1546 C THR A 99 -27.456 -1.907 15.392 1.00 51.50 C ATOM 1547 O THR A 99 -27.828 -1.917 16.566 1.00 53.31 O ATOM 1548 CB THR A 99 -28.878 -3.808 14.625 1.00 2.02 C ATOM 1549 OG1 THR A 99 -28.790 -5.228 14.464 1.00 32.51 O ATOM 1550 CG2 THR A 99 -29.782 -3.226 13.550 1.00 54.54 C ATOM 0 H THR A 99 -26.725 -4.686 15.810 1.00 23.15 H new ATOM 0 HA THR A 99 -27.241 -2.938 13.520 1.00 31.15 H new ATOM 0 HB THR A 99 -29.307 -3.579 15.601 1.00 2.02 H new ATOM 0 HG1 THR A 99 -29.688 -5.619 14.510 1.00 32.51 H new ATOM 0 HG21 THR A 99 -30.769 -3.683 13.618 1.00 54.54 H new ATOM 0 HG22 THR A 99 -29.870 -2.149 13.693 1.00 54.54 H new ATOM 0 HG23 THR A 99 -29.355 -3.428 12.567 1.00 54.54 H new ATOM 1558 N ILE A 100 -27.022 -0.810 14.780 1.00 51.41 N ATOM 1559 CA ILE A 100 -26.960 0.474 15.467 1.00 11.22 C ATOM 1560 C ILE A 100 -28.312 1.177 15.443 1.00 55.52 C ATOM 1561 O ILE A 100 -29.282 0.662 14.885 1.00 10.42 O ATOM 1562 CB ILE A 100 -25.901 1.399 14.837 1.00 73.25 C ATOM 1563 CG1 ILE A 100 -26.302 1.769 13.408 1.00 54.02 C ATOM 1564 CG2 ILE A 100 -24.535 0.729 14.853 1.00 54.31 C ATOM 1565 CD1 ILE A 100 -27.120 3.039 13.318 1.00 23.15 C ATOM 0 H ILE A 100 -26.708 -0.785 13.810 1.00 51.41 H new ATOM 0 HA ILE A 100 -26.681 0.266 16.500 1.00 11.22 H new ATOM 0 HB ILE A 100 -25.842 2.314 15.427 1.00 73.25 H new ATOM 0 HG12 ILE A 100 -25.401 1.883 12.805 1.00 54.02 H new ATOM 0 HG13 ILE A 100 -26.873 0.947 12.976 1.00 54.02 H new ATOM 0 HG21 ILE A 100 -23.798 1.395 14.405 1.00 54.31 H new ATOM 0 HG22 ILE A 100 -24.249 0.511 15.882 1.00 54.31 H new ATOM 0 HG23 ILE A 100 -24.579 -0.200 14.284 1.00 54.31 H new ATOM 0 HD11 ILE A 100 -27.368 3.239 12.276 1.00 23.15 H new ATOM 0 HD12 ILE A 100 -28.038 2.922 13.893 1.00 23.15 H new ATOM 0 HD13 ILE A 100 -26.544 3.872 13.720 1.00 23.15 H new ATOM 1577 N VAL A 101 -28.370 2.358 16.051 1.00 71.11 N ATOM 1578 CA VAL A 101 -29.604 3.135 16.096 1.00 21.52 C ATOM 1579 C VAL A 101 -29.310 4.628 16.175 1.00 54.51 C ATOM 1580 O VAL A 101 -28.378 5.055 16.858 1.00 62.33 O ATOM 1581 CB VAL A 101 -30.477 2.731 17.299 1.00 32.44 C ATOM 1582 CG1 VAL A 101 -31.394 3.875 17.702 1.00 62.30 C ATOM 1583 CG2 VAL A 101 -31.281 1.479 16.977 1.00 14.52 C ATOM 0 H VAL A 101 -27.577 2.798 16.519 1.00 71.11 H new ATOM 0 HA VAL A 101 -30.146 2.922 15.175 1.00 21.52 H new ATOM 0 HB VAL A 101 -29.823 2.508 18.142 1.00 32.44 H new ATOM 0 HG11 VAL A 101 -32.003 3.571 18.553 1.00 62.30 H new ATOM 0 HG12 VAL A 101 -30.794 4.743 17.977 1.00 62.30 H new ATOM 0 HG13 VAL A 101 -32.043 4.133 16.865 1.00 62.30 H new ATOM 0 HG21 VAL A 101 -31.892 1.208 17.838 1.00 14.52 H new ATOM 0 HG22 VAL A 101 -31.926 1.671 16.120 1.00 14.52 H new ATOM 0 HG23 VAL A 101 -30.601 0.660 16.742 1.00 14.52 H new ATOM 1593 N THR A 102 -30.112 5.421 15.471 1.00 14.52 N ATOM 1594 CA THR A 102 -29.939 6.869 15.461 1.00 62.41 C ATOM 1595 C THR A 102 -30.985 7.554 16.331 1.00 53.24 C ATOM 1596 O THR A 102 -32.117 7.084 16.442 1.00 23.24 O ATOM 1597 CB THR A 102 -30.027 7.433 14.031 1.00 44.43 C ATOM 1598 OG1 THR A 102 -30.630 8.732 14.053 1.00 3.42 O ATOM 1599 CG2 THR A 102 -30.835 6.510 13.131 1.00 22.45 C ATOM 0 H THR A 102 -30.888 5.085 14.900 1.00 14.52 H new ATOM 0 HA THR A 102 -28.947 7.072 15.864 1.00 62.41 H new ATOM 0 HB THR A 102 -29.015 7.508 13.632 1.00 44.43 H new ATOM 0 HG1 THR A 102 -29.930 9.417 14.080 1.00 3.42 H new ATOM 0 HG21 THR A 102 -30.882 6.931 12.127 1.00 22.45 H new ATOM 0 HG22 THR A 102 -30.358 5.531 13.092 1.00 22.45 H new ATOM 0 HG23 THR A 102 -31.845 6.406 13.529 1.00 22.45 H new ATOM 1607 N GLU A 103 -30.599 8.669 16.945 1.00 72.13 N ATOM 1608 CA GLU A 103 -31.507 9.419 17.806 1.00 63.01 C ATOM 1609 C GLU A 103 -32.802 9.753 17.073 1.00 64.44 C ATOM 1610 O GLU A 103 -33.847 9.944 17.693 1.00 4.13 O ATOM 1611 CB GLU A 103 -30.837 10.706 18.292 1.00 63.33 C ATOM 1612 CG GLU A 103 -29.712 10.468 19.286 1.00 24.14 C ATOM 1613 CD GLU A 103 -30.212 9.947 20.619 1.00 22.33 C ATOM 1614 OE1 GLU A 103 -31.001 10.657 21.277 1.00 71.20 O ATOM 1615 OE2 GLU A 103 -29.814 8.827 21.005 1.00 64.24 O ATOM 0 H GLU A 103 -29.666 9.072 16.862 1.00 72.13 H new ATOM 0 HA GLU A 103 -31.748 8.795 18.667 1.00 63.01 H new ATOM 0 HB2 GLU A 103 -30.442 11.247 17.432 1.00 63.33 H new ATOM 0 HB3 GLU A 103 -31.589 11.346 18.754 1.00 63.33 H new ATOM 0 HG2 GLU A 103 -29.004 9.755 18.864 1.00 24.14 H new ATOM 0 HG3 GLU A 103 -29.169 11.400 19.445 1.00 24.14 H new ATOM 1622 N GLU A 104 -32.724 9.821 15.747 1.00 70.24 N ATOM 1623 CA GLU A 104 -33.889 10.133 14.928 1.00 34.23 C ATOM 1624 C GLU A 104 -34.980 9.082 15.111 1.00 70.40 C ATOM 1625 O GLU A 104 -36.122 9.277 14.698 1.00 20.13 O ATOM 1626 CB GLU A 104 -33.495 10.224 13.453 1.00 45.02 C ATOM 1627 CG GLU A 104 -32.386 11.226 13.180 1.00 62.11 C ATOM 1628 CD GLU A 104 -32.198 11.500 11.700 1.00 12.13 C ATOM 1629 OE1 GLU A 104 -33.185 11.381 10.945 1.00 54.22 O ATOM 1630 OE2 GLU A 104 -31.064 11.835 11.299 1.00 73.32 O ATOM 0 H GLU A 104 -31.866 9.664 15.218 1.00 70.24 H new ATOM 0 HA GLU A 104 -34.280 11.098 15.251 1.00 34.23 H new ATOM 0 HB2 GLU A 104 -33.177 9.240 13.109 1.00 45.02 H new ATOM 0 HB3 GLU A 104 -34.373 10.498 12.867 1.00 45.02 H new ATOM 0 HG2 GLU A 104 -32.612 12.161 13.693 1.00 62.11 H new ATOM 0 HG3 GLU A 104 -31.452 10.851 13.598 1.00 62.11 H new ATOM 1637 N GLY A 105 -34.618 7.963 15.733 1.00 3.23 N ATOM 1638 CA GLY A 105 -35.575 6.897 15.958 1.00 25.24 C ATOM 1639 C GLY A 105 -35.526 5.835 14.877 1.00 12.42 C ATOM 1640 O GLY A 105 -36.553 5.259 14.516 1.00 44.10 O ATOM 0 H GLY A 105 -33.679 7.777 16.085 1.00 3.23 H new ATOM 0 HA2 GLY A 105 -35.379 6.435 16.926 1.00 25.24 H new ATOM 0 HA3 GLY A 105 -36.579 7.318 16.004 1.00 25.24 H new ATOM 1644 N LYS A 106 -34.332 5.576 14.358 1.00 44.21 N ATOM 1645 CA LYS A 106 -34.151 4.578 13.311 1.00 72.21 C ATOM 1646 C LYS A 106 -33.115 3.537 13.723 1.00 1.52 C ATOM 1647 O LYS A 106 -32.505 3.645 14.787 1.00 71.44 O ATOM 1648 CB LYS A 106 -33.724 5.250 12.004 1.00 22.00 C ATOM 1649 CG LYS A 106 -34.889 5.635 11.109 1.00 45.55 C ATOM 1650 CD LYS A 106 -34.445 5.820 9.667 1.00 51.51 C ATOM 1651 CE LYS A 106 -35.539 6.460 8.825 1.00 1.33 C ATOM 1652 NZ LYS A 106 -35.431 6.078 7.391 1.00 43.02 N ATOM 0 H LYS A 106 -33.473 6.044 14.646 1.00 44.21 H new ATOM 0 HA LYS A 106 -35.105 4.073 13.157 1.00 72.21 H new ATOM 0 HB2 LYS A 106 -33.145 6.144 12.237 1.00 22.00 H new ATOM 0 HB3 LYS A 106 -33.064 4.576 11.458 1.00 22.00 H new ATOM 0 HG2 LYS A 106 -35.658 4.864 11.158 1.00 45.55 H new ATOM 0 HG3 LYS A 106 -35.340 6.558 11.473 1.00 45.55 H new ATOM 0 HD2 LYS A 106 -33.551 6.442 9.637 1.00 51.51 H new ATOM 0 HD3 LYS A 106 -34.175 4.854 9.241 1.00 51.51 H new ATOM 0 HE2 LYS A 106 -36.514 6.160 9.208 1.00 1.33 H new ATOM 0 HE3 LYS A 106 -35.480 7.545 8.917 1.00 1.33 H new ATOM 0 HZ1 LYS A 106 -36.194 6.535 6.852 1.00 43.02 H new ATOM 0 HZ2 LYS A 106 -34.511 6.387 7.018 1.00 43.02 H new ATOM 0 HZ3 LYS A 106 -35.513 5.045 7.300 1.00 43.02 H new ATOM 1666 N GLU A 107 -32.919 2.534 12.873 1.00 73.20 N ATOM 1667 CA GLU A 107 -31.955 1.476 13.150 1.00 30.03 C ATOM 1668 C GLU A 107 -31.359 0.931 11.856 1.00 65.40 C ATOM 1669 O GLU A 107 -31.954 1.050 10.785 1.00 51.41 O ATOM 1670 CB GLU A 107 -32.620 0.343 13.936 1.00 61.23 C ATOM 1671 CG GLU A 107 -33.683 -0.402 13.146 1.00 2.34 C ATOM 1672 CD GLU A 107 -34.600 -1.223 14.033 1.00 41.41 C ATOM 1673 OE1 GLU A 107 -34.143 -1.666 15.107 1.00 1.14 O ATOM 1674 OE2 GLU A 107 -35.772 -1.421 13.652 1.00 33.13 O ATOM 0 H GLU A 107 -33.415 2.432 11.987 1.00 73.20 H new ATOM 0 HA GLU A 107 -31.150 1.901 13.750 1.00 30.03 H new ATOM 0 HB2 GLU A 107 -31.855 -0.364 14.256 1.00 61.23 H new ATOM 0 HB3 GLU A 107 -33.072 0.754 14.839 1.00 61.23 H new ATOM 0 HG2 GLU A 107 -34.278 0.314 12.579 1.00 2.34 H new ATOM 0 HG3 GLU A 107 -33.200 -1.059 12.423 1.00 2.34 H new ATOM 1681 N LYS A 108 -30.177 0.332 11.963 1.00 54.12 N ATOM 1682 CA LYS A 108 -29.497 -0.233 10.802 1.00 15.14 C ATOM 1683 C LYS A 108 -28.491 -1.297 11.226 1.00 34.21 C ATOM 1684 O LYS A 108 -28.041 -1.320 12.372 1.00 64.12 O ATOM 1685 CB LYS A 108 -28.788 0.871 10.014 1.00 34.42 C ATOM 1686 CG LYS A 108 -28.418 0.464 8.599 1.00 45.42 C ATOM 1687 CD LYS A 108 -27.686 1.580 7.871 1.00 14.44 C ATOM 1688 CE LYS A 108 -27.319 1.174 6.452 1.00 41.42 C ATOM 1689 NZ LYS A 108 -26.714 2.302 5.691 1.00 72.23 N ATOM 0 H LYS A 108 -29.670 0.225 12.842 1.00 54.12 H new ATOM 0 HA LYS A 108 -30.247 -0.701 10.164 1.00 15.14 H new ATOM 0 HB2 LYS A 108 -29.433 1.749 9.974 1.00 34.42 H new ATOM 0 HB3 LYS A 108 -27.884 1.164 10.548 1.00 34.42 H new ATOM 0 HG2 LYS A 108 -27.790 -0.426 8.628 1.00 45.42 H new ATOM 0 HG3 LYS A 108 -29.320 0.199 8.048 1.00 45.42 H new ATOM 0 HD2 LYS A 108 -28.313 2.471 7.845 1.00 14.44 H new ATOM 0 HD3 LYS A 108 -26.782 1.843 8.421 1.00 14.44 H new ATOM 0 HE2 LYS A 108 -26.618 0.340 6.483 1.00 41.42 H new ATOM 0 HE3 LYS A 108 -28.211 0.823 5.933 1.00 41.42 H new ATOM 0 HZ1 LYS A 108 -26.478 1.985 4.729 1.00 72.23 H new ATOM 0 HZ2 LYS A 108 -27.392 3.089 5.639 1.00 72.23 H new ATOM 0 HZ3 LYS A 108 -25.849 2.621 6.172 1.00 72.23 H new ATOM 1703 N LYS A 109 -28.140 -2.178 10.295 1.00 3.53 N ATOM 1704 CA LYS A 109 -27.184 -3.243 10.571 1.00 11.00 C ATOM 1705 C LYS A 109 -25.958 -3.120 9.672 1.00 11.14 C ATOM 1706 O LYS A 109 -26.042 -3.313 8.460 1.00 63.51 O ATOM 1707 CB LYS A 109 -27.842 -4.611 10.368 1.00 11.43 C ATOM 1708 CG LYS A 109 -28.817 -4.651 9.205 1.00 1.42 C ATOM 1709 CD LYS A 109 -30.231 -4.321 9.651 1.00 34.02 C ATOM 1710 CE LYS A 109 -30.818 -5.431 10.511 1.00 50.20 C ATOM 1711 NZ LYS A 109 -32.296 -5.310 10.639 1.00 14.04 N ATOM 0 H LYS A 109 -28.504 -2.175 9.342 1.00 3.53 H new ATOM 0 HA LYS A 109 -26.863 -3.150 11.609 1.00 11.00 H new ATOM 0 HB2 LYS A 109 -27.065 -5.358 10.205 1.00 11.43 H new ATOM 0 HB3 LYS A 109 -28.367 -4.891 11.281 1.00 11.43 H new ATOM 0 HG2 LYS A 109 -28.501 -3.942 8.440 1.00 1.42 H new ATOM 0 HG3 LYS A 109 -28.800 -5.641 8.749 1.00 1.42 H new ATOM 0 HD2 LYS A 109 -30.228 -3.387 10.213 1.00 34.02 H new ATOM 0 HD3 LYS A 109 -30.862 -4.164 8.776 1.00 34.02 H new ATOM 0 HE2 LYS A 109 -30.569 -6.398 10.075 1.00 50.20 H new ATOM 0 HE3 LYS A 109 -30.364 -5.402 11.502 1.00 50.20 H new ATOM 0 HZ1 LYS A 109 -32.658 -6.084 11.232 1.00 14.04 H new ATOM 0 HZ2 LYS A 109 -32.533 -4.398 11.078 1.00 14.04 H new ATOM 0 HZ3 LYS A 109 -32.732 -5.364 9.696 1.00 14.04 H new ATOM 1725 N VAL A 110 -24.818 -2.797 10.276 1.00 60.12 N ATOM 1726 CA VAL A 110 -23.574 -2.651 9.531 1.00 44.24 C ATOM 1727 C VAL A 110 -22.508 -3.612 10.045 1.00 50.22 C ATOM 1728 O VAL A 110 -21.972 -3.432 11.138 1.00 70.33 O ATOM 1729 CB VAL A 110 -23.034 -1.210 9.616 1.00 22.34 C ATOM 1730 CG1 VAL A 110 -21.723 -1.085 8.856 1.00 42.04 C ATOM 1731 CG2 VAL A 110 -24.064 -0.224 9.087 1.00 31.14 C ATOM 0 H VAL A 110 -24.731 -2.632 11.279 1.00 60.12 H new ATOM 0 HA VAL A 110 -23.800 -2.886 8.491 1.00 44.24 H new ATOM 0 HB VAL A 110 -22.842 -0.973 10.663 1.00 22.34 H new ATOM 0 HG11 VAL A 110 -21.357 -0.061 8.927 1.00 42.04 H new ATOM 0 HG12 VAL A 110 -20.987 -1.764 9.286 1.00 42.04 H new ATOM 0 HG13 VAL A 110 -21.884 -1.341 7.809 1.00 42.04 H new ATOM 0 HG21 VAL A 110 -23.666 0.789 9.154 1.00 31.14 H new ATOM 0 HG22 VAL A 110 -24.290 -0.457 8.046 1.00 31.14 H new ATOM 0 HG23 VAL A 110 -24.975 -0.296 9.681 1.00 31.14 H new ATOM 1741 N ASN A 111 -22.206 -4.633 9.250 1.00 43.45 N ATOM 1742 CA ASN A 111 -21.204 -5.624 9.625 1.00 70.12 C ATOM 1743 C ASN A 111 -20.020 -5.592 8.664 1.00 54.12 C ATOM 1744 O ASN A 111 -20.192 -5.685 7.448 1.00 53.54 O ATOM 1745 CB ASN A 111 -21.822 -7.023 9.644 1.00 54.13 C ATOM 1746 CG ASN A 111 -21.970 -7.609 8.252 1.00 40.41 C ATOM 1747 OD1 ASN A 111 -21.240 -8.524 7.872 1.00 74.32 O ATOM 1748 ND2 ASN A 111 -22.917 -7.081 7.486 1.00 54.43 N ATOM 0 H ASN A 111 -22.641 -4.796 8.342 1.00 43.45 H new ATOM 0 HA ASN A 111 -20.844 -5.379 10.624 1.00 70.12 H new ATOM 0 HB2 ASN A 111 -21.201 -7.683 10.249 1.00 54.13 H new ATOM 0 HB3 ASN A 111 -22.800 -6.979 10.122 1.00 54.13 H new ATOM 0 HD21 ASN A 111 -23.063 -7.433 6.540 1.00 54.43 H new ATOM 0 HD22 ASN A 111 -23.499 -6.323 7.844 1.00 54.43 H new ATOM 1755 N ILE A 112 -18.819 -5.460 9.217 1.00 42.42 N ATOM 1756 CA ILE A 112 -17.607 -5.416 8.408 1.00 31.30 C ATOM 1757 C ILE A 112 -16.523 -6.315 8.995 1.00 52.21 C ATOM 1758 O ILE A 112 -16.207 -6.230 10.182 1.00 11.33 O ATOM 1759 CB ILE A 112 -17.060 -3.982 8.289 1.00 20.21 C ATOM 1760 CG1 ILE A 112 -18.104 -3.067 7.646 1.00 12.15 C ATOM 1761 CG2 ILE A 112 -15.770 -3.971 7.481 1.00 34.41 C ATOM 1762 CD1 ILE A 112 -18.563 -3.537 6.285 1.00 54.25 C ATOM 0 H ILE A 112 -18.659 -5.382 10.221 1.00 42.42 H new ATOM 0 HA ILE A 112 -17.877 -5.775 7.415 1.00 31.30 H new ATOM 0 HB ILE A 112 -16.842 -3.608 9.290 1.00 20.21 H new ATOM 0 HG12 ILE A 112 -18.968 -2.995 8.307 1.00 12.15 H new ATOM 0 HG13 ILE A 112 -17.688 -2.064 7.554 1.00 12.15 H new ATOM 0 HG21 ILE A 112 -15.396 -2.950 7.406 1.00 34.41 H new ATOM 0 HG22 ILE A 112 -15.025 -4.595 7.976 1.00 34.41 H new ATOM 0 HG23 ILE A 112 -15.963 -4.361 6.482 1.00 34.41 H new ATOM 0 HD11 ILE A 112 -19.302 -2.840 5.890 1.00 54.25 H new ATOM 0 HD12 ILE A 112 -17.709 -3.582 5.609 1.00 54.25 H new ATOM 0 HD13 ILE A 112 -19.009 -4.528 6.373 1.00 54.25 H new ATOM 1774 N ASP A 113 -15.955 -7.173 8.155 1.00 31.13 N ATOM 1775 CA ASP A 113 -14.904 -8.086 8.589 1.00 3.30 C ATOM 1776 C ASP A 113 -13.538 -7.612 8.104 1.00 53.12 C ATOM 1777 O ASP A 113 -13.436 -6.905 7.100 1.00 4.12 O ATOM 1778 CB ASP A 113 -15.180 -9.499 8.073 1.00 35.12 C ATOM 1779 CG ASP A 113 -14.737 -9.687 6.635 1.00 15.44 C ATOM 1780 OD1 ASP A 113 -15.533 -9.376 5.724 1.00 22.02 O ATOM 1781 OD2 ASP A 113 -13.595 -10.145 6.422 1.00 54.25 O ATOM 0 H ASP A 113 -16.205 -7.255 7.169 1.00 31.13 H new ATOM 0 HA ASP A 113 -14.898 -8.101 9.679 1.00 3.30 H new ATOM 0 HB2 ASP A 113 -14.665 -10.221 8.706 1.00 35.12 H new ATOM 0 HB3 ASP A 113 -16.247 -9.710 8.152 1.00 35.12 H new ATOM 1786 N PHE A 114 -12.491 -8.004 8.822 1.00 63.22 N ATOM 1787 CA PHE A 114 -11.131 -7.617 8.465 1.00 2.30 C ATOM 1788 C PHE A 114 -10.116 -8.598 9.046 1.00 75.23 C ATOM 1789 O PHE A 114 -10.483 -9.556 9.726 1.00 54.42 O ATOM 1790 CB PHE A 114 -10.833 -6.202 8.965 1.00 24.05 C ATOM 1791 CG PHE A 114 -11.823 -5.703 9.979 1.00 33.13 C ATOM 1792 CD1 PHE A 114 -12.988 -5.071 9.576 1.00 73.53 C ATOM 1793 CD2 PHE A 114 -11.588 -5.866 11.335 1.00 42.42 C ATOM 1794 CE1 PHE A 114 -13.902 -4.612 10.505 1.00 30.45 C ATOM 1795 CE2 PHE A 114 -12.498 -5.409 12.269 1.00 31.01 C ATOM 1796 CZ PHE A 114 -13.655 -4.780 11.854 1.00 34.00 C ATOM 0 H PHE A 114 -12.558 -8.589 9.655 1.00 63.22 H new ATOM 0 HA PHE A 114 -11.048 -7.636 7.378 1.00 2.30 H new ATOM 0 HB2 PHE A 114 -9.835 -6.183 9.403 1.00 24.05 H new ATOM 0 HB3 PHE A 114 -10.821 -5.520 8.115 1.00 24.05 H new ATOM 0 HD1 PHE A 114 -13.184 -4.935 8.523 1.00 73.53 H new ATOM 0 HD2 PHE A 114 -10.684 -6.356 11.665 1.00 42.42 H new ATOM 0 HE1 PHE A 114 -14.808 -4.123 10.177 1.00 30.45 H new ATOM 0 HE2 PHE A 114 -12.304 -5.544 13.323 1.00 31.01 H new ATOM 0 HZ PHE A 114 -14.366 -4.420 12.583 1.00 34.00 H new ATOM 1806 N GLU A 115 -8.840 -8.352 8.769 1.00 64.52 N ATOM 1807 CA GLU A 115 -7.772 -9.215 9.263 1.00 52.33 C ATOM 1808 C GLU A 115 -6.816 -8.437 10.162 1.00 72.40 C ATOM 1809 O GLU A 115 -6.157 -7.489 9.737 1.00 45.35 O ATOM 1810 CB GLU A 115 -7.002 -9.830 8.092 1.00 35.41 C ATOM 1811 CG GLU A 115 -6.573 -8.817 7.046 1.00 61.30 C ATOM 1812 CD GLU A 115 -5.264 -9.189 6.376 1.00 41.32 C ATOM 1813 OE1 GLU A 115 -4.369 -9.711 7.073 1.00 63.12 O ATOM 1814 OE2 GLU A 115 -5.135 -8.958 5.155 1.00 15.13 O ATOM 0 H GLU A 115 -8.520 -7.564 8.206 1.00 64.52 H new ATOM 0 HA GLU A 115 -8.226 -10.013 9.850 1.00 52.33 H new ATOM 0 HB2 GLU A 115 -6.118 -10.339 8.477 1.00 35.41 H new ATOM 0 HB3 GLU A 115 -7.625 -10.588 7.617 1.00 35.41 H new ATOM 0 HG2 GLU A 115 -7.352 -8.730 6.289 1.00 61.30 H new ATOM 0 HG3 GLU A 115 -6.472 -7.838 7.514 1.00 61.30 H new ATOM 1821 N PRO A 116 -6.738 -8.847 11.437 1.00 34.21 N ATOM 1822 CA PRO A 116 -5.866 -8.203 12.424 1.00 73.14 C ATOM 1823 C PRO A 116 -4.389 -8.462 12.147 1.00 12.42 C ATOM 1824 O PRO A 116 -4.037 -9.137 11.180 1.00 0.04 O ATOM 1825 CB PRO A 116 -6.285 -8.852 13.744 1.00 33.15 C ATOM 1826 CG PRO A 116 -6.849 -10.175 13.355 1.00 23.11 C ATOM 1827 CD PRO A 116 -7.496 -9.970 12.013 1.00 62.45 C ATOM 0 HA PRO A 116 -5.971 -7.118 12.415 1.00 73.14 H new ATOM 0 HB2 PRO A 116 -5.434 -8.967 14.416 1.00 33.15 H new ATOM 0 HB3 PRO A 116 -7.024 -8.245 14.266 1.00 33.15 H new ATOM 0 HG2 PRO A 116 -6.067 -10.932 13.300 1.00 23.11 H new ATOM 0 HG3 PRO A 116 -7.576 -10.521 14.090 1.00 23.11 H new ATOM 0 HD2 PRO A 116 -7.425 -10.863 11.392 1.00 62.45 H new ATOM 0 HD3 PRO A 116 -8.555 -9.732 12.110 1.00 62.45 H new ATOM 1835 N PHE A 117 -3.528 -7.922 13.005 1.00 55.24 N ATOM 1836 CA PHE A 117 -2.088 -8.094 12.852 1.00 15.03 C ATOM 1837 C PHE A 117 -1.543 -9.056 13.903 1.00 24.14 C ATOM 1838 O PHE A 117 -0.334 -9.127 14.129 1.00 60.03 O ATOM 1839 CB PHE A 117 -1.378 -6.744 12.962 1.00 5.41 C ATOM 1840 CG PHE A 117 -2.122 -5.740 13.796 1.00 70.40 C ATOM 1841 CD1 PHE A 117 -3.117 -4.956 13.235 1.00 70.21 C ATOM 1842 CD2 PHE A 117 -1.827 -5.582 15.140 1.00 52.43 C ATOM 1843 CE1 PHE A 117 -3.804 -4.032 13.998 1.00 3.12 C ATOM 1844 CE2 PHE A 117 -2.511 -4.659 15.909 1.00 22.31 C ATOM 1845 CZ PHE A 117 -3.500 -3.883 15.338 1.00 53.31 C ATOM 0 H PHE A 117 -3.803 -7.362 13.812 1.00 55.24 H new ATOM 0 HA PHE A 117 -1.899 -8.516 11.865 1.00 15.03 H new ATOM 0 HB2 PHE A 117 -0.388 -6.898 13.391 1.00 5.41 H new ATOM 0 HB3 PHE A 117 -1.233 -6.337 11.961 1.00 5.41 H new ATOM 0 HD1 PHE A 117 -3.358 -5.069 12.188 1.00 70.21 H new ATOM 0 HD2 PHE A 117 -1.054 -6.186 15.592 1.00 52.43 H new ATOM 0 HE1 PHE A 117 -4.577 -3.427 13.548 1.00 3.12 H new ATOM 0 HE2 PHE A 117 -2.272 -4.545 16.956 1.00 22.31 H new ATOM 0 HZ PHE A 117 -4.035 -3.161 15.937 1.00 53.31 H new ATOM 1855 N LYS A 118 -2.441 -9.796 14.545 1.00 43.42 N ATOM 1856 CA LYS A 118 -2.051 -10.755 15.571 1.00 14.23 C ATOM 1857 C LYS A 118 -2.951 -11.986 15.535 1.00 42.40 C ATOM 1858 O LYS A 118 -4.135 -11.930 15.867 1.00 55.43 O ATOM 1859 CB LYS A 118 -2.115 -10.105 16.955 1.00 24.02 C ATOM 1860 CG LYS A 118 -0.876 -9.300 17.307 1.00 44.24 C ATOM 1861 CD LYS A 118 -1.197 -8.176 18.277 1.00 12.11 C ATOM 1862 CE LYS A 118 -1.796 -8.710 19.569 1.00 35.24 C ATOM 1863 NZ LYS A 118 -1.615 -7.757 20.700 1.00 21.24 N ATOM 0 H LYS A 118 -3.445 -9.749 14.372 1.00 43.42 H new ATOM 0 HA LYS A 118 -1.027 -11.069 15.370 1.00 14.23 H new ATOM 0 HB2 LYS A 118 -2.987 -9.453 17.001 1.00 24.02 H new ATOM 0 HB3 LYS A 118 -2.259 -10.882 17.706 1.00 24.02 H new ATOM 0 HG2 LYS A 118 -0.127 -9.958 17.747 1.00 44.24 H new ATOM 0 HG3 LYS A 118 -0.441 -8.884 16.398 1.00 44.24 H new ATOM 0 HD2 LYS A 118 -0.289 -7.616 18.500 1.00 12.11 H new ATOM 0 HD3 LYS A 118 -1.895 -7.480 17.811 1.00 12.11 H new ATOM 0 HE2 LYS A 118 -2.859 -8.904 19.424 1.00 35.24 H new ATOM 0 HE3 LYS A 118 -1.330 -9.663 19.819 1.00 35.24 H new ATOM 0 HZ1 LYS A 118 -1.865 -8.227 21.593 1.00 21.24 H new ATOM 0 HZ2 LYS A 118 -0.623 -7.447 20.737 1.00 21.24 H new ATOM 0 HZ3 LYS A 118 -2.231 -6.931 20.560 1.00 21.24 H new ATOM 1877 N PRO A 119 -2.377 -13.127 15.125 1.00 54.41 N ATOM 1878 CA PRO A 119 -3.109 -14.394 15.037 1.00 31.31 C ATOM 1879 C PRO A 119 -3.466 -14.953 16.410 1.00 32.21 C ATOM 1880 O PRO A 119 -2.682 -15.682 17.018 1.00 44.12 O ATOM 1881 CB PRO A 119 -2.126 -15.323 14.321 1.00 32.42 C ATOM 1882 CG PRO A 119 -0.782 -14.756 14.624 1.00 65.23 C ATOM 1883 CD PRO A 119 -0.970 -13.268 14.715 1.00 55.10 C ATOM 0 HA PRO A 119 -4.062 -14.279 14.520 1.00 31.31 H new ATOM 0 HB2 PRO A 119 -2.214 -16.348 14.682 1.00 32.42 H new ATOM 0 HB3 PRO A 119 -2.313 -15.346 13.247 1.00 32.42 H new ATOM 0 HG2 PRO A 119 -0.391 -15.158 15.559 1.00 65.23 H new ATOM 0 HG3 PRO A 119 -0.066 -15.012 13.843 1.00 65.23 H new ATOM 0 HD2 PRO A 119 -0.293 -12.821 15.443 1.00 55.10 H new ATOM 0 HD3 PRO A 119 -0.779 -12.780 13.760 1.00 55.10 H new ATOM 1891 N ILE A 120 -4.655 -14.607 16.894 1.00 24.00 N ATOM 1892 CA ILE A 120 -5.116 -15.076 18.194 1.00 31.24 C ATOM 1893 C ILE A 120 -5.899 -16.378 18.064 1.00 54.04 C ATOM 1894 O ILE A 120 -6.946 -16.422 17.420 1.00 61.53 O ATOM 1895 CB ILE A 120 -6.001 -14.026 18.891 1.00 43.20 C ATOM 1896 CG1 ILE A 120 -7.030 -13.463 17.909 1.00 12.25 C ATOM 1897 CG2 ILE A 120 -5.143 -12.908 19.466 1.00 4.12 C ATOM 1898 CD1 ILE A 120 -8.326 -13.041 18.568 1.00 21.11 C ATOM 0 H ILE A 120 -5.316 -14.003 16.405 1.00 24.00 H new ATOM 0 HA ILE A 120 -4.226 -15.249 18.799 1.00 31.24 H new ATOM 0 HB ILE A 120 -6.534 -14.507 19.711 1.00 43.20 H new ATOM 0 HG12 ILE A 120 -6.597 -12.605 17.394 1.00 12.25 H new ATOM 0 HG13 ILE A 120 -7.246 -14.215 17.150 1.00 12.25 H new ATOM 0 HG21 ILE A 120 -5.783 -12.174 19.955 1.00 4.12 H new ATOM 0 HG22 ILE A 120 -4.444 -13.323 20.193 1.00 4.12 H new ATOM 0 HG23 ILE A 120 -4.587 -12.426 18.662 1.00 4.12 H new ATOM 0 HD11 ILE A 120 -9.008 -12.652 17.812 1.00 21.11 H new ATOM 0 HD12 ILE A 120 -8.781 -13.901 19.060 1.00 21.11 H new ATOM 0 HD13 ILE A 120 -8.123 -12.266 19.307 1.00 21.11 H new ATOM 1910 N ASN A 121 -5.385 -17.437 18.681 1.00 10.43 N ATOM 1911 CA ASN A 121 -6.037 -18.740 18.636 1.00 71.03 C ATOM 1912 C ASN A 121 -7.198 -18.803 19.623 1.00 34.20 C ATOM 1913 O ASN A 121 -7.677 -19.884 19.969 1.00 11.42 O ATOM 1914 CB ASN A 121 -5.030 -19.849 18.945 1.00 44.03 C ATOM 1915 CG ASN A 121 -4.195 -20.225 17.736 1.00 25.33 C ATOM 1916 OD1 ASN A 121 -3.524 -19.240 17.150 1.00 60.40 O flip ATOM 1917 ND2 ASN A 121 -4.152 -21.388 17.335 1.00 35.13 N flip ATOM 0 H ASN A 121 -4.518 -17.418 19.218 1.00 10.43 H new ATOM 0 HA ASN A 121 -6.431 -18.886 17.630 1.00 71.03 H new ATOM 0 HB2 ASN A 121 -4.372 -19.524 19.751 1.00 44.03 H new ATOM 0 HB3 ASN A 121 -5.562 -20.730 19.304 1.00 44.03 H new ATOM 0 HD21 ASN A 121 -4.684 -22.113 17.816 1.00 35.13 H new ATOM 0 HD22 ASN A 121 -3.584 -21.626 16.522 1.00 35.13 H new ATOM 1924 N THR A 122 -7.649 -17.636 20.073 1.00 30.15 N ATOM 1925 CA THR A 122 -8.753 -17.557 21.021 1.00 2.33 C ATOM 1926 C THR A 122 -10.041 -17.125 20.330 1.00 0.41 C ATOM 1927 O THR A 122 -10.165 -15.983 19.886 1.00 72.45 O ATOM 1928 CB THR A 122 -8.443 -16.573 22.165 1.00 61.41 C ATOM 1929 OG1 THR A 122 -8.425 -15.231 21.666 1.00 41.02 O ATOM 1930 CG2 THR A 122 -7.103 -16.898 22.810 1.00 51.31 C ATOM 0 H THR A 122 -7.266 -16.732 19.796 1.00 30.15 H new ATOM 0 HA THR A 122 -8.884 -18.556 21.437 1.00 2.33 H new ATOM 0 HB THR A 122 -9.224 -16.669 22.919 1.00 61.41 H new ATOM 0 HG1 THR A 122 -8.949 -15.182 20.840 1.00 41.02 H new ATOM 0 HG21 THR A 122 -6.905 -16.190 23.615 1.00 51.31 H new ATOM 0 HG22 THR A 122 -7.130 -17.910 23.215 1.00 51.31 H new ATOM 0 HG23 THR A 122 -6.313 -16.827 22.063 1.00 51.31 H new ATOM 1938 N SER A 123 -10.998 -18.044 20.244 1.00 44.24 N ATOM 1939 CA SER A 123 -12.276 -17.757 19.604 1.00 73.32 C ATOM 1940 C SER A 123 -13.315 -17.325 20.633 1.00 12.05 C ATOM 1941 O SER A 123 -13.099 -17.447 21.840 1.00 42.40 O ATOM 1942 CB SER A 123 -12.777 -18.988 18.843 1.00 4.10 C ATOM 1943 OG SER A 123 -13.119 -20.034 19.736 1.00 14.01 O ATOM 0 H SER A 123 -10.912 -18.993 20.609 1.00 44.24 H new ATOM 0 HA SER A 123 -12.126 -16.939 18.900 1.00 73.32 H new ATOM 0 HB2 SER A 123 -13.646 -18.720 18.242 1.00 4.10 H new ATOM 0 HB3 SER A 123 -12.006 -19.332 18.153 1.00 4.10 H new ATOM 0 HG SER A 123 -13.438 -20.808 19.226 1.00 14.01 H new ATOM 1949 N LEU A 124 -14.445 -16.820 20.149 1.00 2.22 N ATOM 1950 CA LEU A 124 -15.519 -16.368 21.027 1.00 31.11 C ATOM 1951 C LEU A 124 -16.789 -16.085 20.231 1.00 2.23 C ATOM 1952 O LEU A 124 -16.790 -15.261 19.316 1.00 62.23 O ATOM 1953 CB LEU A 124 -15.089 -15.113 21.787 1.00 0.53 C ATOM 1954 CG LEU A 124 -14.990 -13.829 20.963 1.00 20.43 C ATOM 1955 CD1 LEU A 124 -16.286 -13.040 21.047 1.00 12.52 C ATOM 1956 CD2 LEU A 124 -13.816 -12.982 21.434 1.00 71.45 C ATOM 0 H LEU A 124 -14.641 -16.713 19.154 1.00 2.22 H new ATOM 0 HA LEU A 124 -15.730 -17.163 21.742 1.00 31.11 H new ATOM 0 HB2 LEU A 124 -15.795 -14.945 22.600 1.00 0.53 H new ATOM 0 HB3 LEU A 124 -14.118 -15.304 22.243 1.00 0.53 H new ATOM 0 HG LEU A 124 -14.821 -14.101 19.921 1.00 20.43 H new ATOM 0 HD11 LEU A 124 -16.197 -12.130 20.454 1.00 12.52 H new ATOM 0 HD12 LEU A 124 -17.106 -13.645 20.661 1.00 12.52 H new ATOM 0 HD13 LEU A 124 -16.486 -12.778 22.086 1.00 12.52 H new ATOM 0 HD21 LEU A 124 -13.761 -12.072 20.836 1.00 71.45 H new ATOM 0 HD22 LEU A 124 -13.954 -12.719 22.483 1.00 71.45 H new ATOM 0 HD23 LEU A 124 -12.891 -13.547 21.321 1.00 71.45 H new ATOM 1968 N PHE A 125 -17.870 -16.770 20.587 1.00 31.12 N ATOM 1969 CA PHE A 125 -19.147 -16.591 19.908 1.00 54.21 C ATOM 1970 C PHE A 125 -20.253 -16.260 20.906 1.00 62.42 C ATOM 1971 O PHE A 125 -20.595 -17.076 21.764 1.00 64.41 O ATOM 1972 CB PHE A 125 -19.513 -17.853 19.123 1.00 14.12 C ATOM 1973 CG PHE A 125 -20.762 -17.707 18.302 1.00 64.15 C ATOM 1974 CD1 PHE A 125 -21.020 -16.533 17.611 1.00 4.11 C ATOM 1975 CD2 PHE A 125 -21.678 -18.743 18.219 1.00 31.11 C ATOM 1976 CE1 PHE A 125 -22.167 -16.396 16.853 1.00 12.22 C ATOM 1977 CE2 PHE A 125 -22.827 -18.612 17.463 1.00 52.13 C ATOM 1978 CZ PHE A 125 -23.073 -17.436 16.780 1.00 51.12 C ATOM 0 H PHE A 125 -17.887 -17.455 21.343 1.00 31.12 H new ATOM 0 HA PHE A 125 -19.047 -15.756 19.214 1.00 54.21 H new ATOM 0 HB2 PHE A 125 -18.684 -18.115 18.465 1.00 14.12 H new ATOM 0 HB3 PHE A 125 -19.641 -18.681 19.820 1.00 14.12 H new ATOM 0 HD1 PHE A 125 -20.316 -15.716 17.666 1.00 4.11 H new ATOM 0 HD2 PHE A 125 -21.492 -19.664 18.752 1.00 31.11 H new ATOM 0 HE1 PHE A 125 -22.355 -15.477 16.318 1.00 12.22 H new ATOM 0 HE2 PHE A 125 -23.532 -19.428 17.406 1.00 52.13 H new ATOM 0 HZ PHE A 125 -23.972 -17.330 16.190 1.00 51.12 H new ATOM 1988 N LEU A 126 -20.809 -15.060 20.788 1.00 71.21 N ATOM 1989 CA LEU A 126 -21.876 -14.620 21.680 1.00 41.33 C ATOM 1990 C LEU A 126 -22.366 -13.227 21.297 1.00 1.34 C ATOM 1991 O LEU A 126 -21.588 -12.273 21.264 1.00 44.21 O ATOM 1992 CB LEU A 126 -21.390 -14.622 23.130 1.00 25.02 C ATOM 1993 CG LEU A 126 -22.451 -14.902 24.194 1.00 33.02 C ATOM 1994 CD1 LEU A 126 -22.734 -16.393 24.287 1.00 60.50 C ATOM 1995 CD2 LEU A 126 -22.011 -14.355 25.544 1.00 65.54 C ATOM 0 H LEU A 126 -20.539 -14.374 20.083 1.00 71.21 H new ATOM 0 HA LEU A 126 -22.708 -15.317 21.582 1.00 41.33 H new ATOM 0 HB2 LEU A 126 -20.602 -15.369 23.227 1.00 25.02 H new ATOM 0 HB3 LEU A 126 -20.939 -13.653 23.342 1.00 25.02 H new ATOM 0 HG LEU A 126 -23.372 -14.396 23.903 1.00 33.02 H new ATOM 0 HD11 LEU A 126 -23.492 -16.573 25.050 1.00 60.50 H new ATOM 0 HD12 LEU A 126 -23.095 -16.756 23.324 1.00 60.50 H new ATOM 0 HD13 LEU A 126 -21.819 -16.921 24.554 1.00 60.50 H new ATOM 0 HD21 LEU A 126 -22.779 -14.564 26.289 1.00 65.54 H new ATOM 0 HD22 LEU A 126 -21.077 -14.831 25.843 1.00 65.54 H new ATOM 0 HD23 LEU A 126 -21.862 -13.278 25.469 1.00 65.54 H new ATOM 2007 N CYS A 127 -23.658 -13.117 21.013 1.00 63.00 N ATOM 2008 CA CYS A 127 -24.252 -11.840 20.635 1.00 44.44 C ATOM 2009 C CYS A 127 -24.469 -10.957 21.859 1.00 51.21 C ATOM 2010 O CYS A 127 -25.317 -11.246 22.703 1.00 61.54 O ATOM 2011 CB CYS A 127 -25.581 -12.065 19.911 1.00 22.21 C ATOM 2012 SG CYS A 127 -26.748 -10.692 20.065 1.00 25.14 S ATOM 0 H CYS A 127 -24.315 -13.897 21.037 1.00 63.00 H new ATOM 0 HA CYS A 127 -23.561 -11.332 19.961 1.00 44.44 H new ATOM 0 HB2 CYS A 127 -25.381 -12.241 18.854 1.00 22.21 H new ATOM 0 HB3 CYS A 127 -26.047 -12.969 20.302 1.00 22.21 H new ATOM 0 HG CYS A 127 -27.964 -11.149 20.016 1.00 25.14 H new ATOM 2018 N ASP A 128 -23.695 -9.880 21.950 1.00 21.34 N ATOM 2019 CA ASP A 128 -23.802 -8.955 23.073 1.00 42.11 C ATOM 2020 C ASP A 128 -24.059 -7.533 22.582 1.00 63.41 C ATOM 2021 O ASP A 128 -24.608 -7.329 21.500 1.00 34.33 O ATOM 2022 CB ASP A 128 -22.527 -8.994 23.917 1.00 73.23 C ATOM 2023 CG ASP A 128 -21.979 -10.400 24.073 1.00 13.53 C ATOM 2024 OD1 ASP A 128 -22.512 -11.153 24.915 1.00 64.14 O ATOM 2025 OD2 ASP A 128 -21.017 -10.746 23.355 1.00 15.03 O ATOM 0 H ASP A 128 -22.988 -9.626 21.260 1.00 21.34 H new ATOM 0 HA ASP A 128 -24.646 -9.266 23.689 1.00 42.11 H new ATOM 0 HB2 ASP A 128 -21.769 -8.361 23.455 1.00 73.23 H new ATOM 0 HB3 ASP A 128 -22.734 -8.576 24.902 1.00 73.23 H new ATOM 2030 N ASN A 129 -23.659 -6.555 23.386 1.00 3.24 N ATOM 2031 CA ASN A 129 -23.847 -5.151 23.036 1.00 73.24 C ATOM 2032 C ASN A 129 -22.620 -4.602 22.314 1.00 4.23 C ATOM 2033 O ASN A 129 -22.739 -3.838 21.356 1.00 61.12 O ATOM 2034 CB ASN A 129 -24.129 -4.323 24.291 1.00 60.23 C ATOM 2035 CG ASN A 129 -25.021 -5.052 25.276 1.00 22.55 C ATOM 2036 OD1 ASN A 129 -24.580 -5.973 25.966 1.00 63.43 O ATOM 2037 ND2 ASN A 129 -26.282 -4.644 25.347 1.00 21.31 N ATOM 0 H ASN A 129 -23.202 -6.708 24.285 1.00 3.24 H new ATOM 0 HA ASN A 129 -24.703 -5.081 22.365 1.00 73.24 H new ATOM 0 HB2 ASN A 129 -23.186 -4.071 24.776 1.00 60.23 H new ATOM 0 HB3 ASN A 129 -24.601 -3.383 24.004 1.00 60.23 H new ATOM 0 HD21 ASN A 129 -26.929 -5.097 25.992 1.00 21.31 H new ATOM 0 HD22 ASN A 129 -26.604 -3.877 24.757 1.00 21.31 H new ATOM 2044 N LYS A 130 -21.440 -4.996 22.782 1.00 21.21 N ATOM 2045 CA LYS A 130 -20.190 -4.545 22.182 1.00 61.23 C ATOM 2046 C LYS A 130 -19.261 -5.724 21.911 1.00 44.14 C ATOM 2047 O LYS A 130 -19.292 -6.728 22.622 1.00 22.05 O ATOM 2048 CB LYS A 130 -19.496 -3.535 23.098 1.00 65.20 C ATOM 2049 CG LYS A 130 -19.552 -3.909 24.569 1.00 12.43 C ATOM 2050 CD LYS A 130 -18.464 -3.208 25.364 1.00 30.11 C ATOM 2051 CE LYS A 130 -18.750 -3.250 26.858 1.00 60.33 C ATOM 2052 NZ LYS A 130 -17.968 -2.224 27.602 1.00 21.01 N ATOM 0 H LYS A 130 -21.323 -5.627 23.575 1.00 21.21 H new ATOM 0 HA LYS A 130 -20.424 -4.064 21.233 1.00 61.23 H new ATOM 0 HB2 LYS A 130 -18.453 -3.440 22.796 1.00 65.20 H new ATOM 0 HB3 LYS A 130 -19.958 -2.557 22.963 1.00 65.20 H new ATOM 0 HG2 LYS A 130 -20.528 -3.645 24.976 1.00 12.43 H new ATOM 0 HG3 LYS A 130 -19.444 -4.988 24.675 1.00 12.43 H new ATOM 0 HD2 LYS A 130 -17.503 -3.681 25.163 1.00 30.11 H new ATOM 0 HD3 LYS A 130 -18.383 -2.171 25.037 1.00 30.11 H new ATOM 0 HE2 LYS A 130 -19.815 -3.089 27.029 1.00 60.33 H new ATOM 0 HE3 LYS A 130 -18.511 -4.240 27.246 1.00 60.33 H new ATOM 0 HZ1 LYS A 130 -18.191 -2.285 28.616 1.00 21.01 H new ATOM 0 HZ2 LYS A 130 -16.952 -2.392 27.460 1.00 21.01 H new ATOM 0 HZ3 LYS A 130 -18.215 -1.277 27.250 1.00 21.01 H new ATOM 2066 N PHE A 131 -18.432 -5.594 20.879 1.00 14.14 N ATOM 2067 CA PHE A 131 -17.493 -6.648 20.516 1.00 61.44 C ATOM 2068 C PHE A 131 -16.516 -6.924 21.655 1.00 14.15 C ATOM 2069 O PHE A 131 -15.691 -6.078 22.000 1.00 52.04 O ATOM 2070 CB PHE A 131 -16.724 -6.261 19.252 1.00 44.44 C ATOM 2071 CG PHE A 131 -17.584 -5.628 18.196 1.00 4.43 C ATOM 2072 CD1 PHE A 131 -18.625 -6.335 17.616 1.00 64.11 C ATOM 2073 CD2 PHE A 131 -17.352 -4.326 17.782 1.00 3.44 C ATOM 2074 CE1 PHE A 131 -19.419 -5.756 16.645 1.00 50.35 C ATOM 2075 CE2 PHE A 131 -18.142 -3.741 16.812 1.00 42.03 C ATOM 2076 CZ PHE A 131 -19.176 -4.457 16.242 1.00 74.23 C ATOM 0 H PHE A 131 -18.392 -4.769 20.280 1.00 14.14 H new ATOM 0 HA PHE A 131 -18.063 -7.557 20.323 1.00 61.44 H new ATOM 0 HB2 PHE A 131 -15.925 -5.570 19.520 1.00 44.44 H new ATOM 0 HB3 PHE A 131 -16.250 -7.151 18.838 1.00 44.44 H new ATOM 0 HD1 PHE A 131 -18.818 -7.351 17.927 1.00 64.11 H new ATOM 0 HD2 PHE A 131 -16.544 -3.762 18.223 1.00 3.44 H new ATOM 0 HE1 PHE A 131 -20.228 -6.318 16.202 1.00 50.35 H new ATOM 0 HE2 PHE A 131 -17.951 -2.725 16.500 1.00 42.03 H new ATOM 0 HZ PHE A 131 -19.794 -4.002 15.482 1.00 74.23 H new ATOM 2086 N HIS A 132 -16.617 -8.115 22.238 1.00 14.12 N ATOM 2087 CA HIS A 132 -15.743 -8.504 23.339 1.00 53.41 C ATOM 2088 C HIS A 132 -14.690 -9.502 22.870 1.00 21.43 C ATOM 2089 O HIS A 132 -14.958 -10.699 22.757 1.00 13.44 O ATOM 2090 CB HIS A 132 -16.563 -9.107 24.480 1.00 30.42 C ATOM 2091 CG HIS A 132 -15.948 -8.907 25.830 1.00 14.44 C ATOM 2092 ND1 HIS A 132 -15.396 -9.934 26.566 1.00 1.00 N ATOM 2093 CD2 HIS A 132 -15.800 -7.788 26.578 1.00 3.20 C ATOM 2094 CE1 HIS A 132 -14.936 -9.457 27.709 1.00 42.24 C ATOM 2095 NE2 HIS A 132 -15.167 -8.157 27.740 1.00 11.11 N ATOM 0 H HIS A 132 -17.295 -8.827 21.966 1.00 14.12 H new ATOM 0 HA HIS A 132 -15.235 -7.610 23.700 1.00 53.41 H new ATOM 0 HB2 HIS A 132 -17.559 -8.664 24.474 1.00 30.42 H new ATOM 0 HB3 HIS A 132 -16.688 -10.175 24.301 1.00 30.42 H new ATOM 0 HD2 HIS A 132 -16.120 -6.792 26.311 1.00 3.20 H new ATOM 0 HE1 HIS A 132 -14.453 -10.032 28.485 1.00 42.24 H new ATOM 0 HE2 HIS A 132 -14.916 -7.529 28.503 1.00 11.11 H new ATOM 2103 N THR A 133 -13.488 -9.003 22.597 1.00 50.52 N ATOM 2104 CA THR A 133 -12.395 -9.849 22.138 1.00 25.33 C ATOM 2105 C THR A 133 -11.056 -9.355 22.673 1.00 63.34 C ATOM 2106 O THR A 133 -10.752 -8.165 22.608 1.00 14.42 O ATOM 2107 CB THR A 133 -12.333 -9.903 20.600 1.00 23.30 C ATOM 2108 OG1 THR A 133 -11.183 -10.646 20.182 1.00 63.34 O ATOM 2109 CG2 THR A 133 -12.279 -8.502 20.011 1.00 53.20 C ATOM 0 H THR A 133 -13.248 -8.016 22.686 1.00 50.52 H new ATOM 0 HA THR A 133 -12.589 -10.851 22.521 1.00 25.33 H new ATOM 0 HB THR A 133 -13.235 -10.397 20.239 1.00 23.30 H new ATOM 0 HG1 THR A 133 -11.152 -10.677 19.203 1.00 63.34 H new ATOM 0 HG21 THR A 133 -12.236 -8.566 18.924 1.00 53.20 H new ATOM 0 HG22 THR A 133 -13.170 -7.948 20.307 1.00 53.20 H new ATOM 0 HG23 THR A 133 -11.392 -7.986 20.380 1.00 53.20 H new ATOM 2117 N GLU A 134 -10.256 -10.279 23.199 1.00 51.20 N ATOM 2118 CA GLU A 134 -8.949 -9.935 23.745 1.00 64.34 C ATOM 2119 C GLU A 134 -8.070 -9.283 22.681 1.00 23.31 C ATOM 2120 O GLU A 134 -7.089 -8.610 22.997 1.00 33.04 O ATOM 2121 CB GLU A 134 -8.258 -11.184 24.298 1.00 45.52 C ATOM 2122 CG GLU A 134 -9.047 -11.881 25.393 1.00 62.24 C ATOM 2123 CD GLU A 134 -8.936 -11.176 26.731 1.00 65.53 C ATOM 2124 OE1 GLU A 134 -8.146 -10.213 26.832 1.00 73.43 O ATOM 2125 OE2 GLU A 134 -9.637 -11.589 27.678 1.00 63.32 O ATOM 0 H GLU A 134 -10.491 -11.270 23.258 1.00 51.20 H new ATOM 0 HA GLU A 134 -9.098 -9.222 24.556 1.00 64.34 H new ATOM 0 HB2 GLU A 134 -8.087 -11.886 23.482 1.00 45.52 H new ATOM 0 HB3 GLU A 134 -7.279 -10.905 24.688 1.00 45.52 H new ATOM 0 HG2 GLU A 134 -10.096 -11.936 25.101 1.00 62.24 H new ATOM 0 HG3 GLU A 134 -8.691 -12.906 25.496 1.00 62.24 H new ATOM 2132 N ALA A 135 -8.428 -9.490 21.418 1.00 72.02 N ATOM 2133 CA ALA A 135 -7.674 -8.922 20.307 1.00 3.22 C ATOM 2134 C ALA A 135 -7.779 -7.400 20.293 1.00 61.42 C ATOM 2135 O ALA A 135 -6.768 -6.698 20.322 1.00 4.31 O ATOM 2136 CB ALA A 135 -8.163 -9.499 18.987 1.00 33.13 C ATOM 0 H ALA A 135 -9.236 -10.047 21.139 1.00 72.02 H new ATOM 0 HA ALA A 135 -6.625 -9.186 20.440 1.00 3.22 H new ATOM 0 HB1 ALA A 135 -7.591 -9.066 18.166 1.00 33.13 H new ATOM 0 HB2 ALA A 135 -8.029 -10.581 18.991 1.00 33.13 H new ATOM 0 HB3 ALA A 135 -9.219 -9.264 18.856 1.00 33.13 H new ATOM 2142 N LEU A 136 -9.008 -6.898 20.246 1.00 5.34 N ATOM 2143 CA LEU A 136 -9.246 -5.459 20.228 1.00 20.41 C ATOM 2144 C LEU A 136 -8.604 -4.786 21.437 1.00 15.34 C ATOM 2145 O LEU A 136 -8.019 -3.708 21.325 1.00 44.22 O ATOM 2146 CB LEU A 136 -10.748 -5.171 20.205 1.00 41.52 C ATOM 2147 CG LEU A 136 -11.453 -5.175 21.562 1.00 43.10 C ATOM 2148 CD1 LEU A 136 -11.283 -3.832 22.256 1.00 20.44 C ATOM 2149 CD2 LEU A 136 -12.928 -5.509 21.396 1.00 62.05 C ATOM 0 H LEU A 136 -9.855 -7.466 20.220 1.00 5.34 H new ATOM 0 HA LEU A 136 -8.791 -5.051 19.325 1.00 20.41 H new ATOM 0 HB2 LEU A 136 -10.904 -4.198 19.740 1.00 41.52 H new ATOM 0 HB3 LEU A 136 -11.230 -5.911 19.566 1.00 41.52 H new ATOM 0 HG LEU A 136 -10.995 -5.943 22.185 1.00 43.10 H new ATOM 0 HD11 LEU A 136 -11.791 -3.854 23.220 1.00 20.44 H new ATOM 0 HD12 LEU A 136 -10.222 -3.633 22.409 1.00 20.44 H new ATOM 0 HD13 LEU A 136 -11.713 -3.045 21.636 1.00 20.44 H new ATOM 0 HD21 LEU A 136 -13.414 -5.507 22.372 1.00 62.05 H new ATOM 0 HD22 LEU A 136 -13.400 -4.764 20.755 1.00 62.05 H new ATOM 0 HD23 LEU A 136 -13.029 -6.495 20.942 1.00 62.05 H new ATOM 2161 N THR A 137 -8.718 -5.429 22.596 1.00 52.34 N ATOM 2162 CA THR A 137 -8.150 -4.892 23.826 1.00 30.23 C ATOM 2163 C THR A 137 -6.648 -4.671 23.687 1.00 43.33 C ATOM 2164 O THR A 137 -6.113 -3.669 24.160 1.00 23.54 O ATOM 2165 CB THR A 137 -8.411 -5.831 25.020 1.00 51.44 C ATOM 2166 OG1 THR A 137 -7.546 -6.969 24.946 1.00 2.35 O ATOM 2167 CG2 THR A 137 -9.861 -6.289 25.041 1.00 63.20 C ATOM 0 H THR A 137 -9.198 -6.322 22.708 1.00 52.34 H new ATOM 0 HA THR A 137 -8.639 -3.936 24.010 1.00 30.23 H new ATOM 0 HB THR A 137 -8.208 -5.281 25.939 1.00 51.44 H new ATOM 0 HG1 THR A 137 -7.514 -7.296 24.023 1.00 2.35 H new ATOM 0 HG21 THR A 137 -10.021 -6.951 25.892 1.00 63.20 H new ATOM 0 HG22 THR A 137 -10.515 -5.422 25.127 1.00 63.20 H new ATOM 0 HG23 THR A 137 -10.087 -6.824 24.118 1.00 63.20 H new ATOM 2175 N ALA A 138 -5.974 -5.612 23.034 1.00 42.34 N ATOM 2176 CA ALA A 138 -4.534 -5.517 22.830 1.00 32.35 C ATOM 2177 C ALA A 138 -4.203 -4.587 21.668 1.00 52.32 C ATOM 2178 O ALA A 138 -3.174 -3.911 21.673 1.00 64.31 O ATOM 2179 CB ALA A 138 -3.943 -6.899 22.587 1.00 14.54 C ATOM 0 H ALA A 138 -6.402 -6.449 22.637 1.00 42.34 H new ATOM 0 HA ALA A 138 -4.092 -5.098 23.734 1.00 32.35 H new ATOM 0 HB1 ALA A 138 -2.867 -6.813 22.436 1.00 14.54 H new ATOM 0 HB2 ALA A 138 -4.139 -7.535 23.450 1.00 14.54 H new ATOM 0 HB3 ALA A 138 -4.400 -7.339 21.701 1.00 14.54 H new ATOM 2185 N LEU A 139 -5.083 -4.557 20.672 1.00 11.54 N ATOM 2186 CA LEU A 139 -4.885 -3.709 19.502 1.00 3.20 C ATOM 2187 C LEU A 139 -4.565 -2.276 19.915 1.00 44.03 C ATOM 2188 O LEU A 139 -3.526 -1.728 19.542 1.00 71.11 O ATOM 2189 CB LEU A 139 -6.130 -3.730 18.615 1.00 33.40 C ATOM 2190 CG LEU A 139 -6.112 -4.726 17.455 1.00 64.21 C ATOM 2191 CD1 LEU A 139 -5.258 -5.935 17.802 1.00 24.23 C ATOM 2192 CD2 LEU A 139 -7.528 -5.155 17.098 1.00 64.25 C ATOM 0 H LEU A 139 -5.940 -5.110 20.652 1.00 11.54 H new ATOM 0 HA LEU A 139 -4.039 -4.103 18.939 1.00 3.20 H new ATOM 0 HB2 LEU A 139 -6.994 -3.949 19.242 1.00 33.40 H new ATOM 0 HB3 LEU A 139 -6.277 -2.730 18.207 1.00 33.40 H new ATOM 0 HG LEU A 139 -5.673 -4.235 16.587 1.00 64.21 H new ATOM 0 HD11 LEU A 139 -5.257 -6.633 16.964 1.00 24.23 H new ATOM 0 HD12 LEU A 139 -4.237 -5.613 18.007 1.00 24.23 H new ATOM 0 HD13 LEU A 139 -5.666 -6.428 18.684 1.00 24.23 H new ATOM 0 HD21 LEU A 139 -7.496 -5.864 16.271 1.00 64.25 H new ATOM 0 HD22 LEU A 139 -7.994 -5.628 17.963 1.00 64.25 H new ATOM 0 HD23 LEU A 139 -8.110 -4.281 16.805 1.00 64.25 H new ATOM 2204 N LEU A 140 -5.462 -1.675 20.688 1.00 21.25 N ATOM 2205 CA LEU A 140 -5.274 -0.306 21.156 1.00 51.04 C ATOM 2206 C LEU A 140 -4.245 -0.249 22.279 1.00 64.34 C ATOM 2207 O LEU A 140 -3.359 0.606 22.280 1.00 62.21 O ATOM 2208 CB LEU A 140 -6.604 0.276 21.638 1.00 50.40 C ATOM 2209 CG LEU A 140 -7.776 0.173 20.660 1.00 30.33 C ATOM 2210 CD1 LEU A 140 -8.623 -1.051 20.970 1.00 71.23 C ATOM 2211 CD2 LEU A 140 -8.623 1.436 20.709 1.00 52.12 C ATOM 0 H LEU A 140 -6.327 -2.114 21.004 1.00 21.25 H new ATOM 0 HA LEU A 140 -4.905 0.289 20.321 1.00 51.04 H new ATOM 0 HB2 LEU A 140 -6.884 -0.227 22.563 1.00 50.40 H new ATOM 0 HB3 LEU A 140 -6.451 1.328 21.881 1.00 50.40 H new ATOM 0 HG LEU A 140 -7.376 0.067 19.652 1.00 30.33 H new ATOM 0 HD11 LEU A 140 -9.452 -1.108 20.264 1.00 71.23 H new ATOM 0 HD12 LEU A 140 -8.011 -1.949 20.884 1.00 71.23 H new ATOM 0 HD13 LEU A 140 -9.015 -0.975 21.984 1.00 71.23 H new ATOM 0 HD21 LEU A 140 -9.452 1.346 20.007 1.00 52.12 H new ATOM 0 HD22 LEU A 140 -9.014 1.573 21.717 1.00 52.12 H new ATOM 0 HD23 LEU A 140 -8.010 2.296 20.438 1.00 52.12 H new ATOM 2223 N SER A 141 -4.365 -1.167 23.233 1.00 73.55 N ATOM 2224 CA SER A 141 -3.445 -1.222 24.363 1.00 14.43 C ATOM 2225 C SER A 141 -1.997 -1.227 23.885 1.00 52.41 C ATOM 2226 O SER A 141 -1.095 -0.788 24.598 1.00 12.34 O ATOM 2227 CB SER A 141 -3.720 -2.465 25.211 1.00 25.15 C ATOM 2228 OG SER A 141 -2.675 -2.686 26.142 1.00 11.02 O ATOM 0 H SER A 141 -5.091 -1.883 23.246 1.00 73.55 H new ATOM 0 HA SER A 141 -3.604 -0.333 24.973 1.00 14.43 H new ATOM 0 HB2 SER A 141 -4.665 -2.346 25.741 1.00 25.15 H new ATOM 0 HB3 SER A 141 -3.825 -3.335 24.563 1.00 25.15 H new ATOM 0 HG SER A 141 -2.874 -3.485 26.674 1.00 11.02 H new ATOM 2234 N ASP A 142 -1.783 -1.726 22.673 1.00 61.50 N ATOM 2235 CA ASP A 142 -0.444 -1.789 22.097 1.00 12.01 C ATOM 2236 C ASP A 142 -0.360 -0.948 20.827 1.00 23.30 C ATOM 2237 O ASP A 142 -0.259 -1.512 19.738 1.00 11.23 O ATOM 2238 CB ASP A 142 -0.065 -3.238 21.792 1.00 61.22 C ATOM 2239 CG ASP A 142 -0.009 -4.098 23.039 1.00 2.52 C ATOM 2240 OD1 ASP A 142 0.931 -3.918 23.842 1.00 73.30 O ATOM 2241 OD2 ASP A 142 -0.904 -4.951 23.212 1.00 13.13 O ATOM 0 H ASP A 142 -2.519 -2.093 22.070 1.00 61.50 H new ATOM 0 HA ASP A 142 0.259 -1.385 22.826 1.00 12.01 H new ATOM 0 HB2 ASP A 142 -0.789 -3.661 21.095 1.00 61.22 H new ATOM 0 HB3 ASP A 142 0.905 -3.260 21.296 1.00 61.22 H new