USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1308 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 169 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 174 ASN : amide:sc= 0 X(o=0,f=0.46) USER MOD Set 2.1: A 173 HIS : no HD1:sc= 1.06 K(o=1.2,f=-3.4!) USER MOD Set 2.2: A 175 CYS SG : rot 38:sc= 0.138 USER MOD Set 3.1: A 124 TYR OH : rot -156:sc= 0.893 USER MOD Set 3.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 3.3: A 168 HIS : no HD1:sc= -1.02! C(o=-0.13!,f=-12!) USER MOD Set 4.1: A 12 GLN : amide:sc= 0.93 K(o=2.2,f=-1.1) USER MOD Set 4.2: A 91 SER OG : rot 47:sc= 1.26 USER MOD Set 5.1: A 87 LYS NZ :NH3+ 179:sc= 1.73 (180deg=0.971) USER MOD Set 5.2: A 103 THR OG1 : rot 180:sc= 0.645 USER MOD Set 6.1: A 33 HIS : no HD1:sc= -1.23 K(o=0.042,f=-8.7!) USER MOD Set 6.2: A 77 HIS : no HD1:sc= 1.27 K(o=0.042,f=-14!) USER MOD Set 7.1: A 22 SER OG : rot -46:sc= 1.19 USER MOD Set 7.2: A 25 THR OG1 : rot -150:sc= 1.18 USER MOD Set 8.1: A 15 LYS NZ :NH3+ 156:sc= 2.02 (180deg=1.16) USER MOD Set 8.2: A 61 THR OG1 : rot 174:sc= -0.447 USER MOD Single : A 8 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0863) USER MOD Single : A 26 THR OG1 : rot 133:sc= 1.26 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.746 K(o=0.75,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 150:sc= 0.0123 USER MOD Single : A 43 CYS SG : rot -134:sc= -0.564 USER MOD Single : A 46 MET CE :methyl 144:sc= -0.891 (180deg=-2.91!) USER MOD Single : A 50 ASN : amide:sc= -1.84! K(o=-1.8!,f=-0.033) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -179:sc= 0.253 (180deg=0.231) USER MOD Single : A 54 SER OG : rot -144:sc= 0.589 USER MOD Single : A 62 TYR OH : rot 28:sc= 0.31 USER MOD Single : A 64 THR OG1 : rot 97:sc= 0.876 USER MOD Single : A 72 MET CE :methyl 164:sc= -1.74 (180deg=-2.06) USER MOD Single : A 73 ASN : amide:sc= -0.418 X(o=-0.42,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -108:sc= 0.141 USER MOD Single : A 96 GLN : amide:sc= -0.291 X(o=-0.29,f=-0.11) USER MOD Single : A 101 HIS : no HD1:sc= -0.115 X(o=-0.11,f=-0.23) USER MOD Single : A 105 LYS NZ :NH3+ 156:sc= 0.224 (180deg=0.0643) USER MOD Single : A 106 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.14) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 58:sc= 0.418 USER MOD Single : A 119 HIS : no HD1:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : A 120 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-7.2!) USER MOD Single : A 127 GLN : amide:sc= 0.6 K(o=0.6,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 MET CE :methyl -174:sc= 0 (180deg=-0.0596) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 61:sc= 0.0981 USER MOD Single : A 156 HIS : no HD1:sc= -3.59! K(o=-3.6!,f=-2.9) USER MOD Single : A 158 SER OG : rot 160:sc=-0.00392 USER MOD Single : A 161 LYS NZ :NH3+ -168:sc= 0.942 (180deg=0.821) USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 166 LYS NZ :NH3+ 143:sc= -0.966 (180deg=-1.82!) USER MOD Single : A 167 TYR OH : rot -114:sc= 1.22 USER MOD Single : A 171 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.3) USER MOD Single : A 179 LYS NZ :NH3+ 150:sc= 1.91 (180deg=0.509) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -15.930 7.376 5.556 1.00 51.31 N ATOM 93 CA LYS A 8 -16.108 7.926 4.217 1.00 73.31 C ATOM 94 C LYS A 8 -15.284 7.119 3.236 1.00 75.43 C ATOM 95 O LYS A 8 -15.594 7.042 2.049 1.00 35.34 O ATOM 96 CB LYS A 8 -15.687 9.400 4.154 1.00 44.24 C ATOM 97 CG LYS A 8 -16.355 10.288 5.200 1.00 71.41 C ATOM 98 CD LYS A 8 -15.620 10.271 6.540 1.00 43.32 C ATOM 99 CE LYS A 8 -14.192 10.793 6.435 1.00 1.32 C ATOM 100 NZ LYS A 8 -14.140 12.201 5.964 1.00 11.44 N ATOM 0 HA LYS A 8 -17.166 7.869 3.959 1.00 73.31 H new ATOM 0 HB2 LYS A 8 -14.606 9.463 4.278 1.00 44.24 H new ATOM 0 HB3 LYS A 8 -15.917 9.790 3.163 1.00 44.24 H new ATOM 0 HG2 LYS A 8 -16.400 11.311 4.827 1.00 71.41 H new ATOM 0 HG3 LYS A 8 -17.383 9.957 5.349 1.00 71.41 H new ATOM 0 HD2 LYS A 8 -16.171 10.876 7.260 1.00 43.32 H new ATOM 0 HD3 LYS A 8 -15.602 9.252 6.927 1.00 43.32 H new ATOM 0 HE2 LYS A 8 -13.708 10.720 7.409 1.00 1.32 H new ATOM 0 HE3 LYS A 8 -13.626 10.162 5.750 1.00 1.32 H new ATOM 0 HZ1 LYS A 8 -13.165 12.556 6.037 1.00 11.44 H new ATOM 0 HZ2 LYS A 8 -14.452 12.247 4.973 1.00 11.44 H new ATOM 0 HZ3 LYS A 8 -14.766 12.787 6.552 1.00 11.44 H new ATOM 114 N GLU A 9 -14.226 6.521 3.759 1.00 15.11 N ATOM 115 CA GLU A 9 -13.346 5.688 2.970 1.00 75.14 C ATOM 116 C GLU A 9 -13.976 4.319 2.782 1.00 15.11 C ATOM 117 O GLU A 9 -14.500 3.740 3.736 1.00 22.23 O ATOM 118 CB GLU A 9 -11.971 5.544 3.647 1.00 23.41 C ATOM 119 CG GLU A 9 -11.170 6.836 3.727 1.00 11.54 C ATOM 120 CD GLU A 9 -11.745 7.829 4.717 1.00 53.14 C ATOM 121 OE1 GLU A 9 -11.884 7.479 5.908 1.00 0.14 O ATOM 122 OE2 GLU A 9 -12.073 8.959 4.306 1.00 12.21 O ATOM 0 H GLU A 9 -13.957 6.602 4.740 1.00 15.11 H new ATOM 0 HA GLU A 9 -13.199 6.160 1.999 1.00 75.14 H new ATOM 0 HB2 GLU A 9 -12.115 5.157 4.656 1.00 23.41 H new ATOM 0 HB3 GLU A 9 -11.387 4.802 3.102 1.00 23.41 H new ATOM 0 HG2 GLU A 9 -10.143 6.603 4.009 1.00 11.54 H new ATOM 0 HG3 GLU A 9 -11.133 7.296 2.739 1.00 11.54 H new ATOM 129 N PRO A 10 -13.966 3.799 1.547 1.00 14.22 N ATOM 130 CA PRO A 10 -14.429 2.442 1.261 1.00 41.14 C ATOM 131 C PRO A 10 -13.569 1.409 1.978 1.00 43.33 C ATOM 132 O PRO A 10 -12.455 1.724 2.408 1.00 51.44 O ATOM 133 CB PRO A 10 -14.282 2.317 -0.258 1.00 10.14 C ATOM 134 CG PRO A 10 -13.351 3.402 -0.667 1.00 60.03 C ATOM 135 CD PRO A 10 -13.523 4.505 0.334 1.00 14.11 C ATOM 0 HA PRO A 10 -15.450 2.266 1.601 1.00 41.14 H new ATOM 0 HB2 PRO A 10 -13.887 1.339 -0.533 1.00 10.14 H new ATOM 0 HB3 PRO A 10 -15.247 2.422 -0.754 1.00 10.14 H new ATOM 0 HG2 PRO A 10 -12.321 3.046 -0.680 1.00 60.03 H new ATOM 0 HG3 PRO A 10 -13.580 3.752 -1.674 1.00 60.03 H new ATOM 0 HD2 PRO A 10 -12.591 5.045 0.501 1.00 14.11 H new ATOM 0 HD3 PRO A 10 -14.260 5.237 0.003 1.00 14.11 H new ATOM 143 N GLU A 11 -14.065 0.179 2.090 1.00 61.42 N ATOM 144 CA GLU A 11 -13.395 -0.838 2.897 1.00 35.20 C ATOM 145 C GLU A 11 -12.000 -1.166 2.362 1.00 64.31 C ATOM 146 O GLU A 11 -11.130 -1.549 3.127 1.00 2.12 O ATOM 147 CB GLU A 11 -14.234 -2.118 2.998 1.00 74.13 C ATOM 148 CG GLU A 11 -14.300 -2.931 1.717 1.00 54.32 C ATOM 149 CD GLU A 11 -14.801 -4.336 1.958 1.00 74.11 C ATOM 150 OE1 GLU A 11 -14.040 -5.155 2.515 1.00 65.13 O ATOM 151 OE2 GLU A 11 -15.959 -4.627 1.602 1.00 42.32 O ATOM 0 H GLU A 11 -14.922 -0.136 1.636 1.00 61.42 H new ATOM 0 HA GLU A 11 -13.283 -0.417 3.896 1.00 35.20 H new ATOM 0 HB2 GLU A 11 -13.824 -2.744 3.790 1.00 74.13 H new ATOM 0 HB3 GLU A 11 -15.248 -1.850 3.296 1.00 74.13 H new ATOM 0 HG2 GLU A 11 -14.956 -2.431 1.004 1.00 54.32 H new ATOM 0 HG3 GLU A 11 -13.310 -2.973 1.264 1.00 54.32 H new ATOM 158 N GLN A 12 -11.788 -0.983 1.060 1.00 32.23 N ATOM 159 CA GLN A 12 -10.488 -1.250 0.446 1.00 32.40 C ATOM 160 C GLN A 12 -9.470 -0.176 0.837 1.00 74.22 C ATOM 161 O GLN A 12 -8.291 -0.463 1.013 1.00 65.31 O ATOM 162 CB GLN A 12 -10.625 -1.326 -1.083 1.00 71.23 C ATOM 163 CG GLN A 12 -10.973 0.003 -1.742 1.00 72.51 C ATOM 164 CD GLN A 12 -11.400 -0.148 -3.186 1.00 62.14 C ATOM 165 OE1 GLN A 12 -10.578 -0.102 -4.096 1.00 71.30 O ATOM 166 NE2 GLN A 12 -12.691 -0.327 -3.408 1.00 50.35 N ATOM 0 H GLN A 12 -12.500 -0.651 0.409 1.00 32.23 H new ATOM 0 HA GLN A 12 -10.128 -2.211 0.814 1.00 32.40 H new ATOM 0 HB2 GLN A 12 -9.689 -1.694 -1.503 1.00 71.23 H new ATOM 0 HB3 GLN A 12 -11.395 -2.056 -1.332 1.00 71.23 H new ATOM 0 HG2 GLN A 12 -11.775 0.482 -1.180 1.00 72.51 H new ATOM 0 HG3 GLN A 12 -10.108 0.665 -1.692 1.00 72.51 H new ATOM 0 HE21 GLN A 12 -13.343 -0.360 -2.625 1.00 50.35 H new ATOM 0 HE22 GLN A 12 -13.034 -0.433 -4.363 1.00 50.35 H new ATOM 175 N LEU A 13 -9.950 1.049 1.026 1.00 63.23 N ATOM 176 CA LEU A 13 -9.080 2.186 1.304 1.00 41.13 C ATOM 177 C LEU A 13 -8.689 2.233 2.773 1.00 74.24 C ATOM 178 O LEU A 13 -7.797 2.982 3.159 1.00 53.12 O ATOM 179 CB LEU A 13 -9.769 3.496 0.909 1.00 73.23 C ATOM 180 CG LEU A 13 -9.319 4.108 -0.422 1.00 3.24 C ATOM 181 CD1 LEU A 13 -9.590 3.162 -1.576 1.00 51.51 C ATOM 182 CD2 LEU A 13 -10.017 5.433 -0.660 1.00 54.13 C ATOM 0 H LEU A 13 -10.943 1.280 0.991 1.00 63.23 H new ATOM 0 HA LEU A 13 -8.174 2.064 0.710 1.00 41.13 H new ATOM 0 HB2 LEU A 13 -10.844 3.320 0.862 1.00 73.23 H new ATOM 0 HB3 LEU A 13 -9.600 4.227 1.700 1.00 73.23 H new ATOM 0 HG LEU A 13 -8.244 4.280 -0.365 1.00 3.24 H new ATOM 0 HD11 LEU A 13 -9.261 3.621 -2.508 1.00 51.51 H new ATOM 0 HD12 LEU A 13 -9.046 2.231 -1.419 1.00 51.51 H new ATOM 0 HD13 LEU A 13 -10.658 2.953 -1.632 1.00 51.51 H new ATOM 0 HD21 LEU A 13 -9.686 5.853 -1.609 1.00 54.13 H new ATOM 0 HD22 LEU A 13 -11.095 5.276 -0.689 1.00 54.13 H new ATOM 0 HD23 LEU A 13 -9.773 6.123 0.147 1.00 54.13 H new ATOM 194 N ARG A 14 -9.356 1.431 3.587 1.00 24.00 N ATOM 195 CA ARG A 14 -9.053 1.378 5.010 1.00 3.12 C ATOM 196 C ARG A 14 -8.796 -0.057 5.460 1.00 75.42 C ATOM 197 O ARG A 14 -8.848 -0.370 6.650 1.00 62.43 O ATOM 198 CB ARG A 14 -10.182 2.011 5.833 1.00 5.45 C ATOM 199 CG ARG A 14 -11.562 1.485 5.488 1.00 11.13 C ATOM 200 CD ARG A 14 -12.644 2.186 6.291 1.00 62.43 C ATOM 201 NE ARG A 14 -13.981 1.870 5.793 1.00 63.32 N ATOM 202 CZ ARG A 14 -14.792 0.954 6.328 1.00 70.44 C ATOM 203 NH1 ARG A 14 -14.416 0.248 7.386 1.00 31.31 N ATOM 204 NH2 ARG A 14 -15.982 0.742 5.795 1.00 25.44 N ATOM 0 H ARG A 14 -10.108 0.810 3.289 1.00 24.00 H new ATOM 0 HA ARG A 14 -8.144 1.954 5.181 1.00 3.12 H new ATOM 0 HB2 ARG A 14 -9.990 1.834 6.891 1.00 5.45 H new ATOM 0 HB3 ARG A 14 -10.167 3.090 5.683 1.00 5.45 H new ATOM 0 HG2 ARG A 14 -11.750 1.625 4.423 1.00 11.13 H new ATOM 0 HG3 ARG A 14 -11.602 0.413 5.681 1.00 11.13 H new ATOM 0 HD2 ARG A 14 -12.567 1.892 7.338 1.00 62.43 H new ATOM 0 HD3 ARG A 14 -12.486 3.264 6.250 1.00 62.43 H new ATOM 0 HE ARG A 14 -14.318 2.385 4.980 1.00 63.32 H new ATOM 0 HH11 ARG A 14 -13.497 0.402 7.801 1.00 31.31 H new ATOM 0 HH12 ARG A 14 -15.046 -0.448 7.784 1.00 31.31 H new ATOM 0 HH21 ARG A 14 -16.278 1.277 4.978 1.00 25.44 H new ATOM 0 HH22 ARG A 14 -16.605 0.043 6.200 1.00 25.44 H new ATOM 218 N LYS A 15 -8.565 -0.936 4.502 1.00 72.34 N ATOM 219 CA LYS A 15 -8.142 -2.291 4.807 1.00 60.32 C ATOM 220 C LYS A 15 -6.628 -2.430 4.694 1.00 71.50 C ATOM 221 O LYS A 15 -5.974 -1.719 3.929 1.00 24.40 O ATOM 222 CB LYS A 15 -8.836 -3.273 3.861 1.00 70.53 C ATOM 223 CG LYS A 15 -8.719 -4.739 4.256 1.00 42.14 C ATOM 224 CD LYS A 15 -9.068 -5.663 3.096 1.00 51.15 C ATOM 225 CE LYS A 15 -10.455 -5.386 2.532 1.00 72.23 C ATOM 226 NZ LYS A 15 -11.538 -5.752 3.485 1.00 35.42 N ATOM 0 H LYS A 15 -8.663 -0.736 3.507 1.00 72.34 H new ATOM 0 HA LYS A 15 -8.425 -2.519 5.835 1.00 60.32 H new ATOM 0 HB2 LYS A 15 -9.893 -3.012 3.801 1.00 70.53 H new ATOM 0 HB3 LYS A 15 -8.420 -3.147 2.862 1.00 70.53 H new ATOM 0 HG2 LYS A 15 -7.703 -4.945 4.593 1.00 42.14 H new ATOM 0 HG3 LYS A 15 -9.382 -4.944 5.097 1.00 42.14 H new ATOM 0 HD2 LYS A 15 -8.327 -5.545 2.305 1.00 51.15 H new ATOM 0 HD3 LYS A 15 -9.015 -6.699 3.431 1.00 51.15 H new ATOM 0 HE2 LYS A 15 -10.538 -4.329 2.281 1.00 72.23 H new ATOM 0 HE3 LYS A 15 -10.586 -5.945 1.605 1.00 72.23 H new ATOM 0 HZ1 LYS A 15 -12.393 -5.203 3.266 1.00 35.42 H new ATOM 0 HZ2 LYS A 15 -11.747 -6.767 3.400 1.00 35.42 H new ATOM 0 HZ3 LYS A 15 -11.231 -5.542 4.456 1.00 35.42 H new ATOM 240 N LEU A 16 -6.095 -3.350 5.472 1.00 20.55 N ATOM 241 CA LEU A 16 -4.686 -3.674 5.436 1.00 23.53 C ATOM 242 C LEU A 16 -4.492 -5.113 4.993 1.00 52.05 C ATOM 243 O LEU A 16 -5.271 -5.993 5.348 1.00 41.52 O ATOM 244 CB LEU A 16 -4.033 -3.467 6.807 1.00 21.43 C ATOM 245 CG LEU A 16 -3.905 -2.017 7.270 1.00 32.30 C ATOM 246 CD1 LEU A 16 -3.251 -1.958 8.638 1.00 73.20 C ATOM 247 CD2 LEU A 16 -3.107 -1.200 6.269 1.00 43.24 C ATOM 0 H LEU A 16 -6.630 -3.895 6.149 1.00 20.55 H new ATOM 0 HA LEU A 16 -4.208 -3.004 4.722 1.00 23.53 H new ATOM 0 HB2 LEU A 16 -4.611 -4.016 7.550 1.00 21.43 H new ATOM 0 HB3 LEU A 16 -3.038 -3.911 6.785 1.00 21.43 H new ATOM 0 HG LEU A 16 -4.905 -1.590 7.340 1.00 32.30 H new ATOM 0 HD11 LEU A 16 -3.166 -0.919 8.956 1.00 73.20 H new ATOM 0 HD12 LEU A 16 -3.859 -2.509 9.356 1.00 73.20 H new ATOM 0 HD13 LEU A 16 -2.258 -2.404 8.586 1.00 73.20 H new ATOM 0 HD21 LEU A 16 -3.029 -0.171 6.619 1.00 43.24 H new ATOM 0 HD22 LEU A 16 -2.109 -1.625 6.166 1.00 43.24 H new ATOM 0 HD23 LEU A 16 -3.610 -1.217 5.302 1.00 43.24 H new ATOM 259 N PHE A 17 -3.453 -5.333 4.216 1.00 0.44 N ATOM 260 CA PHE A 17 -3.055 -6.660 3.808 1.00 52.33 C ATOM 261 C PHE A 17 -1.931 -7.118 4.719 1.00 65.24 C ATOM 262 O PHE A 17 -0.896 -6.470 4.810 1.00 23.44 O ATOM 263 CB PHE A 17 -2.593 -6.656 2.343 1.00 60.33 C ATOM 264 CG PHE A 17 -1.752 -7.847 1.964 1.00 73.54 C ATOM 265 CD1 PHE A 17 -2.336 -9.076 1.711 1.00 41.50 C ATOM 266 CD2 PHE A 17 -0.372 -7.731 1.860 1.00 22.13 C ATOM 267 CE1 PHE A 17 -1.563 -10.166 1.367 1.00 51.42 C ATOM 268 CE2 PHE A 17 0.405 -8.818 1.515 1.00 21.34 C ATOM 269 CZ PHE A 17 -0.193 -10.038 1.270 1.00 75.10 C ATOM 0 H PHE A 17 -2.858 -4.590 3.848 1.00 0.44 H new ATOM 0 HA PHE A 17 -3.900 -7.344 3.886 1.00 52.33 H new ATOM 0 HB2 PHE A 17 -3.470 -6.622 1.696 1.00 60.33 H new ATOM 0 HB3 PHE A 17 -2.023 -5.746 2.155 1.00 60.33 H new ATOM 0 HD1 PHE A 17 -3.408 -9.183 1.784 1.00 41.50 H new ATOM 0 HD2 PHE A 17 0.099 -6.778 2.052 1.00 22.13 H new ATOM 0 HE1 PHE A 17 -2.031 -11.120 1.174 1.00 51.42 H new ATOM 0 HE2 PHE A 17 1.477 -8.715 1.437 1.00 21.34 H new ATOM 0 HZ PHE A 17 0.412 -10.892 1.002 1.00 75.10 H new ATOM 279 N ILE A 18 -2.142 -8.211 5.404 1.00 62.14 N ATOM 280 CA ILE A 18 -1.156 -8.703 6.339 1.00 63.13 C ATOM 281 C ILE A 18 -0.366 -9.833 5.708 1.00 42.31 C ATOM 282 O ILE A 18 -0.898 -10.912 5.479 1.00 33.40 O ATOM 283 CB ILE A 18 -1.809 -9.204 7.644 1.00 61.11 C ATOM 284 CG1 ILE A 18 -2.882 -8.219 8.133 1.00 4.21 C ATOM 285 CG2 ILE A 18 -0.746 -9.410 8.711 1.00 32.31 C ATOM 286 CD1 ILE A 18 -2.370 -6.812 8.359 1.00 74.31 C ATOM 0 H ILE A 18 -2.986 -8.779 5.335 1.00 62.14 H new ATOM 0 HA ILE A 18 -0.492 -7.874 6.586 1.00 63.13 H new ATOM 0 HB ILE A 18 -2.296 -10.158 7.444 1.00 61.11 H new ATOM 0 HG12 ILE A 18 -3.691 -8.187 7.403 1.00 4.21 H new ATOM 0 HG13 ILE A 18 -3.307 -8.594 9.064 1.00 4.21 H new ATOM 0 HG21 ILE A 18 -1.216 -9.764 9.629 1.00 32.31 H new ATOM 0 HG22 ILE A 18 -0.022 -10.148 8.366 1.00 32.31 H new ATOM 0 HG23 ILE A 18 -0.237 -8.466 8.904 1.00 32.31 H new ATOM 0 HD11 ILE A 18 -3.187 -6.178 8.703 1.00 74.31 H new ATOM 0 HD12 ILE A 18 -1.582 -6.828 9.112 1.00 74.31 H new ATOM 0 HD13 ILE A 18 -1.972 -6.415 7.425 1.00 74.31 H new ATOM 298 N GLY A 19 0.897 -9.578 5.430 1.00 42.32 N ATOM 299 CA GLY A 19 1.735 -10.576 4.807 1.00 55.34 C ATOM 300 C GLY A 19 2.668 -11.215 5.802 1.00 64.23 C ATOM 301 O GLY A 19 3.020 -10.596 6.804 1.00 40.40 O ATOM 0 H GLY A 19 1.362 -8.691 5.626 1.00 42.32 H new ATOM 0 HA2 GLY A 19 1.110 -11.343 4.349 1.00 55.34 H new ATOM 0 HA3 GLY A 19 2.315 -10.117 4.006 1.00 55.34 H new ATOM 305 N GLY A 20 3.056 -12.454 5.545 1.00 3.40 N ATOM 306 CA GLY A 20 3.993 -13.126 6.419 1.00 71.11 C ATOM 307 C GLY A 20 3.393 -13.491 7.760 1.00 74.41 C ATOM 308 O GLY A 20 3.990 -13.234 8.804 1.00 35.11 O ATOM 0 H GLY A 20 2.739 -13.006 4.748 1.00 3.40 H new ATOM 0 HA2 GLY A 20 4.353 -14.031 5.930 1.00 71.11 H new ATOM 0 HA3 GLY A 20 4.859 -12.483 6.577 1.00 71.11 H new ATOM 312 N LEU A 21 2.203 -14.070 7.738 1.00 64.30 N ATOM 313 CA LEU A 21 1.593 -14.605 8.940 1.00 75.14 C ATOM 314 C LEU A 21 2.151 -15.988 9.223 1.00 51.45 C ATOM 315 O LEU A 21 2.941 -16.522 8.441 1.00 41.20 O ATOM 316 CB LEU A 21 0.072 -14.706 8.773 1.00 21.21 C ATOM 317 CG LEU A 21 -0.685 -13.382 8.762 1.00 51.11 C ATOM 318 CD1 LEU A 21 -2.151 -13.609 8.446 1.00 52.33 C ATOM 319 CD2 LEU A 21 -0.544 -12.683 10.099 1.00 53.03 C ATOM 0 H LEU A 21 1.640 -14.181 6.895 1.00 64.30 H new ATOM 0 HA LEU A 21 1.818 -13.934 9.769 1.00 75.14 H new ATOM 0 HB2 LEU A 21 -0.138 -15.230 7.841 1.00 21.21 H new ATOM 0 HB3 LEU A 21 -0.323 -15.322 9.581 1.00 21.21 H new ATOM 0 HG LEU A 21 -0.255 -12.748 7.986 1.00 51.11 H new ATOM 0 HD11 LEU A 21 -2.675 -12.653 8.443 1.00 52.33 H new ATOM 0 HD12 LEU A 21 -2.244 -14.077 7.466 1.00 52.33 H new ATOM 0 HD13 LEU A 21 -2.590 -14.260 9.202 1.00 52.33 H new ATOM 0 HD21 LEU A 21 -1.090 -11.740 10.076 1.00 53.03 H new ATOM 0 HD22 LEU A 21 -0.951 -13.318 10.886 1.00 53.03 H new ATOM 0 HD23 LEU A 21 0.510 -12.488 10.298 1.00 53.03 H new ATOM 331 N SER A 22 1.734 -16.575 10.326 1.00 53.05 N ATOM 332 CA SER A 22 2.070 -17.952 10.598 1.00 3.22 C ATOM 333 C SER A 22 1.034 -18.836 9.915 1.00 73.14 C ATOM 334 O SER A 22 -0.035 -18.359 9.512 1.00 21.05 O ATOM 335 CB SER A 22 2.108 -18.219 12.109 1.00 52.12 C ATOM 336 OG SER A 22 0.805 -18.231 12.670 1.00 52.32 O ATOM 0 H SER A 22 1.166 -16.122 11.042 1.00 53.05 H new ATOM 0 HA SER A 22 3.063 -18.176 10.209 1.00 3.22 H new ATOM 0 HB2 SER A 22 2.595 -19.176 12.298 1.00 52.12 H new ATOM 0 HB3 SER A 22 2.709 -17.453 12.599 1.00 52.12 H new ATOM 0 HG SER A 22 0.300 -17.458 12.341 1.00 52.32 H new ATOM 342 N PHE A 23 1.332 -20.112 9.780 1.00 62.14 N ATOM 343 CA PHE A 23 0.399 -21.036 9.156 1.00 30.30 C ATOM 344 C PHE A 23 -0.672 -21.469 10.155 1.00 3.42 C ATOM 345 O PHE A 23 -1.547 -22.274 9.838 1.00 21.30 O ATOM 346 CB PHE A 23 1.143 -22.247 8.594 1.00 40.24 C ATOM 347 CG PHE A 23 2.059 -21.902 7.454 1.00 73.10 C ATOM 348 CD1 PHE A 23 3.374 -21.534 7.686 1.00 14.00 C ATOM 349 CD2 PHE A 23 1.600 -21.942 6.151 1.00 12.03 C ATOM 350 CE1 PHE A 23 4.214 -21.216 6.637 1.00 22.10 C ATOM 351 CE2 PHE A 23 2.434 -21.625 5.098 1.00 21.11 C ATOM 352 CZ PHE A 23 3.743 -21.260 5.339 1.00 4.44 C ATOM 0 H PHE A 23 2.207 -20.534 10.091 1.00 62.14 H new ATOM 0 HA PHE A 23 -0.095 -20.527 8.329 1.00 30.30 H new ATOM 0 HB2 PHE A 23 1.724 -22.710 9.391 1.00 40.24 H new ATOM 0 HB3 PHE A 23 0.417 -22.987 8.257 1.00 40.24 H new ATOM 0 HD1 PHE A 23 3.747 -21.495 8.699 1.00 14.00 H new ATOM 0 HD2 PHE A 23 0.576 -22.225 5.954 1.00 12.03 H new ATOM 0 HE1 PHE A 23 5.238 -20.933 6.831 1.00 22.10 H new ATOM 0 HE2 PHE A 23 2.062 -21.663 4.085 1.00 21.11 H new ATOM 0 HZ PHE A 23 4.396 -21.010 4.516 1.00 4.44 H new ATOM 362 N GLU A 24 -0.602 -20.899 11.356 1.00 30.34 N ATOM 363 CA GLU A 24 -1.558 -21.186 12.414 1.00 25.43 C ATOM 364 C GLU A 24 -2.296 -19.917 12.845 1.00 75.13 C ATOM 365 O GLU A 24 -2.993 -19.917 13.856 1.00 14.24 O ATOM 366 CB GLU A 24 -0.842 -21.789 13.623 1.00 30.42 C ATOM 367 CG GLU A 24 -0.059 -23.050 13.307 1.00 30.12 C ATOM 368 CD GLU A 24 0.573 -23.668 14.535 1.00 75.21 C ATOM 369 OE1 GLU A 24 -0.142 -24.350 15.297 1.00 15.22 O ATOM 370 OE2 GLU A 24 1.793 -23.495 14.731 1.00 3.13 O ATOM 0 H GLU A 24 0.119 -20.227 11.619 1.00 30.34 H new ATOM 0 HA GLU A 24 -2.284 -21.900 12.025 1.00 25.43 H new ATOM 0 HB2 GLU A 24 -0.162 -21.045 14.039 1.00 30.42 H new ATOM 0 HB3 GLU A 24 -1.579 -22.014 14.394 1.00 30.42 H new ATOM 0 HG2 GLU A 24 -0.723 -23.777 12.840 1.00 30.12 H new ATOM 0 HG3 GLU A 24 0.720 -22.817 12.581 1.00 30.12 H new ATOM 377 N THR A 25 -2.138 -18.834 12.080 1.00 12.41 N ATOM 378 CA THR A 25 -2.794 -17.572 12.409 1.00 32.24 C ATOM 379 C THR A 25 -4.295 -17.662 12.163 1.00 74.22 C ATOM 380 O THR A 25 -4.735 -17.946 11.050 1.00 22.34 O ATOM 381 CB THR A 25 -2.232 -16.391 11.586 1.00 11.44 C ATOM 382 OG1 THR A 25 -0.832 -16.229 11.840 1.00 55.21 O ATOM 383 CG2 THR A 25 -2.958 -15.092 11.922 1.00 74.53 C ATOM 0 H THR A 25 -1.566 -18.808 11.236 1.00 12.41 H new ATOM 0 HA THR A 25 -2.596 -17.389 13.465 1.00 32.24 H new ATOM 0 HB THR A 25 -2.389 -16.618 10.531 1.00 11.44 H new ATOM 0 HG1 THR A 25 -0.588 -15.285 11.737 1.00 55.21 H new ATOM 0 HG21 THR A 25 -2.542 -14.278 11.328 1.00 74.53 H new ATOM 0 HG22 THR A 25 -4.019 -15.199 11.697 1.00 74.53 H new ATOM 0 HG23 THR A 25 -2.833 -14.869 12.982 1.00 74.53 H new ATOM 391 N THR A 26 -5.069 -17.427 13.209 1.00 22.30 N ATOM 392 CA THR A 26 -6.515 -17.387 13.102 1.00 11.23 C ATOM 393 C THR A 26 -6.984 -15.948 12.905 1.00 50.11 C ATOM 394 O THR A 26 -6.294 -15.008 13.304 1.00 14.53 O ATOM 395 CB THR A 26 -7.163 -17.992 14.356 1.00 63.15 C ATOM 396 OG1 THR A 26 -6.378 -17.664 15.508 1.00 13.14 O ATOM 397 CG2 THR A 26 -7.273 -19.500 14.224 1.00 1.01 C ATOM 0 H THR A 26 -4.714 -17.260 14.150 1.00 22.30 H new ATOM 0 HA THR A 26 -6.819 -17.978 12.238 1.00 11.23 H new ATOM 0 HB THR A 26 -8.165 -17.578 14.467 1.00 63.15 H new ATOM 0 HG1 THR A 26 -6.965 -17.339 16.222 1.00 13.14 H new ATOM 0 HG21 THR A 26 -7.734 -19.911 15.122 1.00 1.01 H new ATOM 0 HG22 THR A 26 -7.885 -19.746 13.356 1.00 1.01 H new ATOM 0 HG23 THR A 26 -6.278 -19.928 14.099 1.00 1.01 H new ATOM 405 N ASP A 27 -8.154 -15.772 12.293 1.00 14.14 N ATOM 406 CA ASP A 27 -8.644 -14.432 11.970 1.00 22.24 C ATOM 407 C ASP A 27 -9.057 -13.686 13.233 1.00 23.04 C ATOM 408 O ASP A 27 -8.993 -12.464 13.276 1.00 30.41 O ATOM 409 CB ASP A 27 -9.813 -14.477 10.969 1.00 55.11 C ATOM 410 CG ASP A 27 -11.171 -14.589 11.633 1.00 23.00 C ATOM 411 OD1 ASP A 27 -11.588 -15.719 11.939 1.00 61.23 O ATOM 412 OD2 ASP A 27 -11.825 -13.550 11.854 1.00 2.15 O ATOM 0 H ASP A 27 -8.775 -16.531 12.013 1.00 14.14 H new ATOM 0 HA ASP A 27 -7.822 -13.893 11.498 1.00 22.24 H new ATOM 0 HB2 ASP A 27 -9.790 -13.577 10.355 1.00 55.11 H new ATOM 0 HB3 ASP A 27 -9.674 -15.324 10.298 1.00 55.11 H new ATOM 417 N GLU A 28 -9.460 -14.419 14.267 1.00 55.04 N ATOM 418 CA GLU A 28 -9.846 -13.793 15.523 1.00 32.41 C ATOM 419 C GLU A 28 -8.612 -13.365 16.316 1.00 21.12 C ATOM 420 O GLU A 28 -8.679 -12.463 17.148 1.00 43.32 O ATOM 421 CB GLU A 28 -10.762 -14.717 16.342 1.00 30.14 C ATOM 422 CG GLU A 28 -10.259 -16.145 16.522 1.00 62.40 C ATOM 423 CD GLU A 28 -9.225 -16.273 17.621 1.00 33.22 C ATOM 424 OE1 GLU A 28 -9.495 -15.830 18.753 1.00 32.14 O ATOM 425 OE2 GLU A 28 -8.130 -16.804 17.353 1.00 31.23 O ATOM 0 H GLU A 28 -9.527 -15.437 14.259 1.00 55.04 H new ATOM 0 HA GLU A 28 -10.418 -12.893 15.297 1.00 32.41 H new ATOM 0 HB2 GLU A 28 -10.908 -14.275 17.327 1.00 30.14 H new ATOM 0 HB3 GLU A 28 -11.739 -14.752 15.860 1.00 30.14 H new ATOM 0 HG2 GLU A 28 -11.103 -16.796 16.747 1.00 62.40 H new ATOM 0 HG3 GLU A 28 -9.829 -16.494 15.583 1.00 62.40 H new ATOM 432 N SER A 29 -7.481 -14.004 16.035 1.00 44.01 N ATOM 433 CA SER A 29 -6.214 -13.626 16.645 1.00 61.14 C ATOM 434 C SER A 29 -5.623 -12.432 15.903 1.00 30.41 C ATOM 435 O SER A 29 -5.110 -11.497 16.516 1.00 54.53 O ATOM 436 CB SER A 29 -5.232 -14.803 16.624 1.00 11.11 C ATOM 437 OG SER A 29 -4.029 -14.483 17.300 1.00 70.33 O ATOM 0 H SER A 29 -7.418 -14.789 15.386 1.00 44.01 H new ATOM 0 HA SER A 29 -6.393 -13.350 17.684 1.00 61.14 H new ATOM 0 HB2 SER A 29 -5.694 -15.673 17.091 1.00 11.11 H new ATOM 0 HB3 SER A 29 -5.010 -15.076 15.592 1.00 11.11 H new ATOM 0 HG SER A 29 -3.423 -15.253 17.272 1.00 70.33 H new ATOM 443 N LEU A 30 -5.725 -12.474 14.577 1.00 13.44 N ATOM 444 CA LEU A 30 -5.283 -11.379 13.724 1.00 13.32 C ATOM 445 C LEU A 30 -6.075 -10.118 14.056 1.00 0.31 C ATOM 446 O LEU A 30 -5.510 -9.035 14.215 1.00 1.31 O ATOM 447 CB LEU A 30 -5.475 -11.763 12.251 1.00 3.12 C ATOM 448 CG LEU A 30 -4.857 -10.806 11.231 1.00 60.22 C ATOM 449 CD1 LEU A 30 -3.356 -10.710 11.432 1.00 62.42 C ATOM 450 CD2 LEU A 30 -5.174 -11.264 9.814 1.00 22.51 C ATOM 0 H LEU A 30 -6.115 -13.266 14.067 1.00 13.44 H new ATOM 0 HA LEU A 30 -4.225 -11.183 13.899 1.00 13.32 H new ATOM 0 HB2 LEU A 30 -5.051 -12.755 12.095 1.00 3.12 H new ATOM 0 HB3 LEU A 30 -6.544 -11.838 12.050 1.00 3.12 H new ATOM 0 HG LEU A 30 -5.289 -9.817 11.381 1.00 60.22 H new ATOM 0 HD11 LEU A 30 -2.934 -10.025 10.697 1.00 62.42 H new ATOM 0 HD12 LEU A 30 -3.146 -10.340 12.436 1.00 62.42 H new ATOM 0 HD13 LEU A 30 -2.908 -11.696 11.308 1.00 62.42 H new ATOM 0 HD21 LEU A 30 -4.727 -10.573 9.100 1.00 22.51 H new ATOM 0 HD22 LEU A 30 -4.768 -12.263 9.655 1.00 22.51 H new ATOM 0 HD23 LEU A 30 -6.254 -11.285 9.672 1.00 22.51 H new ATOM 462 N ARG A 31 -7.391 -10.287 14.151 1.00 35.21 N ATOM 463 CA ARG A 31 -8.298 -9.253 14.628 1.00 73.34 C ATOM 464 C ARG A 31 -7.868 -8.708 15.982 1.00 62.03 C ATOM 465 O ARG A 31 -7.541 -7.541 16.091 1.00 11.53 O ATOM 466 CB ARG A 31 -9.703 -9.838 14.725 1.00 4.13 C ATOM 467 CG ARG A 31 -10.779 -8.851 15.131 1.00 23.51 C ATOM 468 CD ARG A 31 -12.102 -9.569 15.351 1.00 34.34 C ATOM 469 NE ARG A 31 -12.363 -10.581 14.318 1.00 52.20 N ATOM 470 CZ ARG A 31 -13.577 -10.940 13.902 1.00 72.01 C ATOM 471 NH1 ARG A 31 -14.662 -10.376 14.420 1.00 40.41 N ATOM 472 NH2 ARG A 31 -13.703 -11.878 12.972 1.00 70.11 N ATOM 0 H ARG A 31 -7.860 -11.156 13.896 1.00 35.21 H new ATOM 0 HA ARG A 31 -8.280 -8.423 13.922 1.00 73.34 H new ATOM 0 HB2 ARG A 31 -9.970 -10.267 13.759 1.00 4.13 H new ATOM 0 HB3 ARG A 31 -9.691 -10.657 15.445 1.00 4.13 H new ATOM 0 HG2 ARG A 31 -10.482 -8.335 16.044 1.00 23.51 H new ATOM 0 HG3 ARG A 31 -10.895 -8.091 14.358 1.00 23.51 H new ATOM 0 HD2 ARG A 31 -12.096 -10.046 16.331 1.00 34.34 H new ATOM 0 HD3 ARG A 31 -12.912 -8.840 15.356 1.00 34.34 H new ATOM 0 HE ARG A 31 -11.559 -11.040 13.890 1.00 52.20 H new ATOM 0 HH11 ARG A 31 -14.570 -9.662 15.142 1.00 40.41 H new ATOM 0 HH12 ARG A 31 -15.587 -10.657 14.095 1.00 40.41 H new ATOM 0 HH21 ARG A 31 -12.873 -12.321 12.579 1.00 70.11 H new ATOM 0 HH22 ARG A 31 -14.630 -12.156 12.650 1.00 70.11 H new ATOM 486 N SER A 32 -7.859 -9.576 16.995 1.00 43.10 N ATOM 487 CA SER A 32 -7.479 -9.212 18.367 1.00 54.30 C ATOM 488 C SER A 32 -6.170 -8.417 18.423 1.00 13.11 C ATOM 489 O SER A 32 -6.019 -7.516 19.250 1.00 15.24 O ATOM 490 CB SER A 32 -7.344 -10.483 19.210 1.00 74.24 C ATOM 491 OG SER A 32 -7.167 -10.183 20.582 1.00 60.42 O ATOM 0 H SER A 32 -8.116 -10.557 16.889 1.00 43.10 H new ATOM 0 HA SER A 32 -8.265 -8.570 18.765 1.00 54.30 H new ATOM 0 HB2 SER A 32 -8.234 -11.100 19.084 1.00 74.24 H new ATOM 0 HB3 SER A 32 -6.497 -11.069 18.853 1.00 74.24 H new ATOM 0 HG SER A 32 -7.086 -11.016 21.091 1.00 60.42 H new ATOM 497 N HIS A 33 -5.243 -8.746 17.532 1.00 54.14 N ATOM 498 CA HIS A 33 -3.978 -8.037 17.446 1.00 74.15 C ATOM 499 C HIS A 33 -4.192 -6.609 16.939 1.00 43.13 C ATOM 500 O HIS A 33 -3.974 -5.655 17.672 1.00 2.13 O ATOM 501 CB HIS A 33 -3.006 -8.796 16.535 1.00 22.42 C ATOM 502 CG HIS A 33 -1.668 -8.137 16.379 1.00 4.20 C ATOM 503 ND1 HIS A 33 -0.618 -8.429 17.210 1.00 71.15 N ATOM 504 CD2 HIS A 33 -1.264 -7.220 15.470 1.00 53.43 C ATOM 505 CE1 HIS A 33 0.392 -7.691 16.789 1.00 71.21 C ATOM 506 NE2 HIS A 33 0.046 -6.943 15.736 1.00 72.43 N ATOM 0 H HIS A 33 -5.347 -9.503 16.857 1.00 54.14 H new ATOM 0 HA HIS A 33 -3.544 -7.979 18.444 1.00 74.15 H new ATOM 0 HB2 HIS A 33 -2.860 -9.800 16.934 1.00 22.42 H new ATOM 0 HB3 HIS A 33 -3.460 -8.908 15.551 1.00 22.42 H new ATOM 0 HD2 HIS A 33 -1.864 -6.789 14.683 1.00 53.43 H new ATOM 0 HE1 HIS A 33 1.374 -7.691 17.238 1.00 71.21 H new ATOM 0 HE2 HIS A 33 0.645 -6.291 15.229 1.00 72.43 H new ATOM 514 N PHE A 34 -4.647 -6.466 15.702 1.00 65.15 N ATOM 515 CA PHE A 34 -4.742 -5.148 15.074 1.00 13.51 C ATOM 516 C PHE A 34 -5.858 -4.291 15.678 1.00 13.53 C ATOM 517 O PHE A 34 -5.827 -3.065 15.587 1.00 42.44 O ATOM 518 CB PHE A 34 -4.918 -5.294 13.562 1.00 71.45 C ATOM 519 CG PHE A 34 -3.643 -5.692 12.868 1.00 64.30 C ATOM 520 CD1 PHE A 34 -2.720 -4.731 12.480 1.00 61.20 C ATOM 521 CD2 PHE A 34 -3.357 -7.024 12.619 1.00 74.34 C ATOM 522 CE1 PHE A 34 -1.541 -5.094 11.856 1.00 53.13 C ATOM 523 CE2 PHE A 34 -2.179 -7.391 11.997 1.00 4.41 C ATOM 524 CZ PHE A 34 -1.270 -6.426 11.615 1.00 53.20 C ATOM 0 H PHE A 34 -4.956 -7.239 15.113 1.00 65.15 H new ATOM 0 HA PHE A 34 -3.807 -4.624 15.272 1.00 13.51 H new ATOM 0 HB2 PHE A 34 -5.686 -6.040 13.359 1.00 71.45 H new ATOM 0 HB3 PHE A 34 -5.274 -4.350 13.148 1.00 71.45 H new ATOM 0 HD1 PHE A 34 -2.925 -3.687 12.668 1.00 61.20 H new ATOM 0 HD2 PHE A 34 -4.064 -7.785 12.915 1.00 74.34 H new ATOM 0 HE1 PHE A 34 -0.832 -4.336 11.557 1.00 53.13 H new ATOM 0 HE2 PHE A 34 -1.970 -8.434 11.810 1.00 4.41 H new ATOM 0 HZ PHE A 34 -0.349 -6.712 11.129 1.00 53.20 H new ATOM 534 N GLU A 35 -6.827 -4.944 16.308 1.00 22.51 N ATOM 535 CA GLU A 35 -7.930 -4.263 16.981 1.00 11.04 C ATOM 536 C GLU A 35 -7.433 -3.383 18.138 1.00 11.52 C ATOM 537 O GLU A 35 -8.126 -2.463 18.568 1.00 73.24 O ATOM 538 CB GLU A 35 -8.928 -5.299 17.497 1.00 33.14 C ATOM 539 CG GLU A 35 -10.270 -4.724 17.897 1.00 4.33 C ATOM 540 CD GLU A 35 -11.288 -5.803 18.188 1.00 41.42 C ATOM 541 OE1 GLU A 35 -11.136 -6.511 19.202 1.00 54.41 O ATOM 542 OE2 GLU A 35 -12.251 -5.943 17.410 1.00 34.44 O ATOM 0 H GLU A 35 -6.872 -5.961 16.368 1.00 22.51 H new ATOM 0 HA GLU A 35 -8.418 -3.608 16.259 1.00 11.04 H new ATOM 0 HB2 GLU A 35 -9.084 -6.052 16.725 1.00 33.14 H new ATOM 0 HB3 GLU A 35 -8.493 -5.809 18.357 1.00 33.14 H new ATOM 0 HG2 GLU A 35 -10.146 -4.096 18.779 1.00 4.33 H new ATOM 0 HG3 GLU A 35 -10.641 -4.082 17.098 1.00 4.33 H new ATOM 549 N GLN A 36 -6.231 -3.677 18.637 1.00 22.50 N ATOM 550 CA GLN A 36 -5.610 -2.870 19.690 1.00 73.22 C ATOM 551 C GLN A 36 -5.413 -1.419 19.250 1.00 55.34 C ATOM 552 O GLN A 36 -5.464 -0.506 20.071 1.00 65.04 O ATOM 553 CB GLN A 36 -4.253 -3.451 20.098 1.00 32.20 C ATOM 554 CG GLN A 36 -4.325 -4.848 20.686 1.00 22.33 C ATOM 555 CD GLN A 36 -2.953 -5.433 20.962 1.00 2.20 C ATOM 556 OE1 GLN A 36 -2.405 -5.288 22.052 1.00 40.30 O ATOM 557 NE2 GLN A 36 -2.377 -6.076 19.962 1.00 53.12 N ATOM 0 H GLN A 36 -5.667 -4.469 18.329 1.00 22.50 H new ATOM 0 HA GLN A 36 -6.290 -2.892 20.542 1.00 73.22 H new ATOM 0 HB2 GLN A 36 -3.601 -3.470 19.225 1.00 32.20 H new ATOM 0 HB3 GLN A 36 -3.790 -2.786 20.827 1.00 32.20 H new ATOM 0 HG2 GLN A 36 -4.898 -4.820 21.613 1.00 22.33 H new ATOM 0 HG3 GLN A 36 -4.863 -5.501 19.999 1.00 22.33 H new ATOM 0 HE21 GLN A 36 -2.864 -6.176 19.072 1.00 53.12 H new ATOM 0 HE22 GLN A 36 -1.445 -6.473 20.080 1.00 53.12 H new ATOM 566 N TRP A 37 -5.215 -1.212 17.954 1.00 15.35 N ATOM 567 CA TRP A 37 -4.891 0.113 17.439 1.00 13.24 C ATOM 568 C TRP A 37 -6.119 0.823 16.878 1.00 65.23 C ATOM 569 O TRP A 37 -6.105 2.039 16.693 1.00 54.32 O ATOM 570 CB TRP A 37 -3.784 0.021 16.388 1.00 52.42 C ATOM 571 CG TRP A 37 -2.453 -0.312 16.990 1.00 12.54 C ATOM 572 CD1 TRP A 37 -1.548 0.568 17.503 1.00 11.05 C ATOM 573 CD2 TRP A 37 -1.886 -1.616 17.160 1.00 35.54 C ATOM 574 NE1 TRP A 37 -0.455 -0.109 17.988 1.00 5.34 N ATOM 575 CE2 TRP A 37 -0.637 -1.451 17.784 1.00 45.20 C ATOM 576 CE3 TRP A 37 -2.313 -2.904 16.847 1.00 32.42 C ATOM 577 CZ2 TRP A 37 0.187 -2.528 18.101 1.00 23.51 C ATOM 578 CZ3 TRP A 37 -1.495 -3.972 17.158 1.00 4.13 C ATOM 579 CH2 TRP A 37 -0.258 -3.779 17.781 1.00 24.52 C ATOM 0 H TRP A 37 -5.273 -1.941 17.243 1.00 15.35 H new ATOM 0 HA TRP A 37 -4.530 0.712 18.275 1.00 13.24 H new ATOM 0 HB2 TRP A 37 -4.047 -0.739 15.652 1.00 52.42 H new ATOM 0 HB3 TRP A 37 -3.712 0.969 15.856 1.00 52.42 H new ATOM 0 HD1 TRP A 37 -1.672 1.641 17.525 1.00 11.05 H new ATOM 0 HE1 TRP A 37 0.360 0.319 18.428 1.00 5.34 H new ATOM 0 HE3 TRP A 37 -3.268 -3.065 16.369 1.00 32.42 H new ATOM 0 HZ2 TRP A 37 1.142 -2.380 18.582 1.00 23.51 H new ATOM 0 HZ3 TRP A 37 -1.816 -4.974 16.916 1.00 4.13 H new ATOM 0 HH2 TRP A 37 0.357 -4.636 18.014 1.00 24.52 H new ATOM 590 N GLY A 38 -7.175 0.071 16.603 1.00 51.43 N ATOM 591 CA GLY A 38 -8.415 0.681 16.170 1.00 4.41 C ATOM 592 C GLY A 38 -9.520 -0.333 15.983 1.00 52.22 C ATOM 593 O GLY A 38 -9.257 -1.534 15.914 1.00 52.34 O ATOM 0 H GLY A 38 -7.196 -0.946 16.672 1.00 51.43 H new ATOM 0 HA2 GLY A 38 -8.727 1.424 16.904 1.00 4.41 H new ATOM 0 HA3 GLY A 38 -8.248 1.210 15.232 1.00 4.41 H new ATOM 597 N THR A 39 -10.755 0.147 15.909 1.00 0.13 N ATOM 598 CA THR A 39 -11.906 -0.722 15.717 1.00 41.44 C ATOM 599 C THR A 39 -11.866 -1.406 14.355 1.00 13.35 C ATOM 600 O THR A 39 -11.885 -0.749 13.315 1.00 12.44 O ATOM 601 CB THR A 39 -13.232 0.051 15.852 1.00 12.21 C ATOM 602 OG1 THR A 39 -13.327 0.641 17.154 1.00 32.12 O ATOM 603 CG2 THR A 39 -14.417 -0.875 15.620 1.00 22.34 C ATOM 0 H THR A 39 -10.984 1.138 15.980 1.00 0.13 H new ATOM 0 HA THR A 39 -11.856 -1.478 16.500 1.00 41.44 H new ATOM 0 HB THR A 39 -13.250 0.838 15.098 1.00 12.21 H new ATOM 0 HG1 THR A 39 -14.172 1.132 17.230 1.00 32.12 H new ATOM 0 HG21 THR A 39 -15.344 -0.311 15.720 1.00 22.34 H new ATOM 0 HG22 THR A 39 -14.356 -1.300 14.618 1.00 22.34 H new ATOM 0 HG23 THR A 39 -14.400 -1.679 16.356 1.00 22.34 H new ATOM 611 N LEU A 40 -11.765 -2.721 14.377 1.00 65.32 N ATOM 612 CA LEU A 40 -11.830 -3.506 13.160 1.00 43.00 C ATOM 613 C LEU A 40 -13.268 -3.813 12.784 1.00 3.05 C ATOM 614 O LEU A 40 -14.084 -4.189 13.629 1.00 32.05 O ATOM 615 CB LEU A 40 -11.035 -4.804 13.301 1.00 25.12 C ATOM 616 CG LEU A 40 -9.521 -4.635 13.445 1.00 23.01 C ATOM 617 CD1 LEU A 40 -8.846 -5.990 13.481 1.00 20.54 C ATOM 618 CD2 LEU A 40 -8.955 -3.800 12.310 1.00 55.33 C ATOM 0 H LEU A 40 -11.637 -3.269 15.227 1.00 65.32 H new ATOM 0 HA LEU A 40 -11.384 -2.912 12.363 1.00 43.00 H new ATOM 0 HB2 LEU A 40 -11.407 -5.345 14.171 1.00 25.12 H new ATOM 0 HB3 LEU A 40 -11.232 -5.427 12.429 1.00 25.12 H new ATOM 0 HG LEU A 40 -9.325 -4.113 14.382 1.00 23.01 H new ATOM 0 HD11 LEU A 40 -7.769 -5.857 13.584 1.00 20.54 H new ATOM 0 HD12 LEU A 40 -9.224 -6.562 14.328 1.00 20.54 H new ATOM 0 HD13 LEU A 40 -9.059 -6.527 12.557 1.00 20.54 H new ATOM 0 HD21 LEU A 40 -7.877 -3.696 12.437 1.00 55.33 H new ATOM 0 HD22 LEU A 40 -9.162 -4.291 11.359 1.00 55.33 H new ATOM 0 HD23 LEU A 40 -9.418 -2.813 12.318 1.00 55.33 H new ATOM 630 N THR A 41 -13.566 -3.633 11.515 1.00 3.03 N ATOM 631 CA THR A 41 -14.880 -3.918 10.981 1.00 41.53 C ATOM 632 C THR A 41 -14.895 -5.301 10.340 1.00 40.14 C ATOM 633 O THR A 41 -15.924 -5.982 10.315 1.00 10.40 O ATOM 634 CB THR A 41 -15.278 -2.856 9.938 1.00 33.42 C ATOM 635 OG1 THR A 41 -14.210 -2.671 9.002 1.00 10.30 O ATOM 636 CG2 THR A 41 -15.588 -1.528 10.601 1.00 63.55 C ATOM 0 H THR A 41 -12.902 -3.284 10.823 1.00 3.03 H new ATOM 0 HA THR A 41 -15.599 -3.894 11.800 1.00 41.53 H new ATOM 0 HB THR A 41 -16.172 -3.209 9.423 1.00 33.42 H new ATOM 0 HG1 THR A 41 -14.579 -2.412 8.132 1.00 10.30 H new ATOM 0 HG21 THR A 41 -15.866 -0.798 9.841 1.00 63.55 H new ATOM 0 HG22 THR A 41 -16.414 -1.655 11.301 1.00 63.55 H new ATOM 0 HG23 THR A 41 -14.708 -1.175 11.138 1.00 63.55 H new ATOM 644 N ASP A 42 -13.731 -5.716 9.849 1.00 35.15 N ATOM 645 CA ASP A 42 -13.583 -7.004 9.183 1.00 63.10 C ATOM 646 C ASP A 42 -12.182 -7.549 9.392 1.00 62.32 C ATOM 647 O ASP A 42 -11.229 -6.785 9.544 1.00 64.51 O ATOM 648 CB ASP A 42 -13.834 -6.864 7.683 1.00 32.31 C ATOM 649 CG ASP A 42 -14.042 -8.202 6.997 1.00 54.10 C ATOM 650 OD1 ASP A 42 -15.193 -8.671 6.933 1.00 25.15 O ATOM 651 OD2 ASP A 42 -13.052 -8.787 6.513 1.00 62.43 O ATOM 0 H ASP A 42 -12.870 -5.172 9.901 1.00 35.15 H new ATOM 0 HA ASP A 42 -14.313 -7.689 9.614 1.00 63.10 H new ATOM 0 HB2 ASP A 42 -14.711 -6.238 7.522 1.00 32.31 H new ATOM 0 HB3 ASP A 42 -12.989 -6.352 7.223 1.00 32.31 H new ATOM 656 N CYS A 43 -12.061 -8.863 9.404 1.00 73.31 N ATOM 657 CA CYS A 43 -10.773 -9.524 9.455 1.00 40.14 C ATOM 658 C CYS A 43 -10.911 -10.942 8.931 1.00 23.14 C ATOM 659 O CYS A 43 -11.806 -11.678 9.349 1.00 34.54 O ATOM 660 CB CYS A 43 -10.231 -9.549 10.886 1.00 5.33 C ATOM 661 SG CYS A 43 -8.676 -10.452 11.061 1.00 4.30 S ATOM 0 H CYS A 43 -12.855 -9.502 9.379 1.00 73.31 H new ATOM 0 HA CYS A 43 -10.071 -8.969 8.833 1.00 40.14 H new ATOM 0 HB2 CYS A 43 -10.086 -8.524 11.227 1.00 5.33 H new ATOM 0 HB3 CYS A 43 -10.978 -10.000 11.540 1.00 5.33 H new ATOM 0 HG CYS A 43 -8.744 -11.237 12.095 1.00 4.30 H new ATOM 667 N VAL A 44 -10.048 -11.319 8.002 1.00 35.24 N ATOM 668 CA VAL A 44 -10.052 -12.668 7.482 1.00 11.54 C ATOM 669 C VAL A 44 -8.628 -13.111 7.166 1.00 45.52 C ATOM 670 O VAL A 44 -7.865 -12.388 6.521 1.00 54.21 O ATOM 671 CB VAL A 44 -10.969 -12.792 6.231 1.00 34.11 C ATOM 672 CG1 VAL A 44 -10.535 -11.850 5.120 1.00 35.42 C ATOM 673 CG2 VAL A 44 -11.020 -14.227 5.729 1.00 11.12 C ATOM 0 H VAL A 44 -9.339 -10.708 7.596 1.00 35.24 H new ATOM 0 HA VAL A 44 -10.460 -13.329 8.247 1.00 11.54 H new ATOM 0 HB VAL A 44 -11.974 -12.501 6.538 1.00 34.11 H new ATOM 0 HG11 VAL A 44 -11.200 -11.966 4.264 1.00 35.42 H new ATOM 0 HG12 VAL A 44 -10.580 -10.821 5.477 1.00 35.42 H new ATOM 0 HG13 VAL A 44 -9.514 -12.086 4.821 1.00 35.42 H new ATOM 0 HG21 VAL A 44 -11.668 -14.284 4.854 1.00 11.12 H new ATOM 0 HG22 VAL A 44 -10.016 -14.554 5.458 1.00 11.12 H new ATOM 0 HG23 VAL A 44 -11.413 -14.873 6.514 1.00 11.12 H new ATOM 683 N VAL A 45 -8.255 -14.273 7.671 1.00 32.45 N ATOM 684 CA VAL A 45 -6.964 -14.849 7.353 1.00 24.21 C ATOM 685 C VAL A 45 -7.132 -15.800 6.176 1.00 14.53 C ATOM 686 O VAL A 45 -8.045 -16.630 6.158 1.00 40.15 O ATOM 687 CB VAL A 45 -6.326 -15.567 8.578 1.00 61.33 C ATOM 688 CG1 VAL A 45 -7.231 -16.655 9.129 1.00 54.44 C ATOM 689 CG2 VAL A 45 -4.961 -16.141 8.229 1.00 64.53 C ATOM 0 H VAL A 45 -8.827 -14.834 8.302 1.00 32.45 H new ATOM 0 HA VAL A 45 -6.276 -14.048 7.082 1.00 24.21 H new ATOM 0 HB VAL A 45 -6.197 -14.814 9.356 1.00 61.33 H new ATOM 0 HG11 VAL A 45 -6.749 -17.131 9.983 1.00 54.44 H new ATOM 0 HG12 VAL A 45 -8.177 -16.216 9.445 1.00 54.44 H new ATOM 0 HG13 VAL A 45 -7.417 -17.400 8.355 1.00 54.44 H new ATOM 0 HG21 VAL A 45 -4.540 -16.636 9.104 1.00 64.53 H new ATOM 0 HG22 VAL A 45 -5.066 -16.863 7.419 1.00 64.53 H new ATOM 0 HG23 VAL A 45 -4.297 -15.336 7.914 1.00 64.53 H new ATOM 699 N MET A 46 -6.285 -15.646 5.172 1.00 75.43 N ATOM 700 CA MET A 46 -6.373 -16.467 3.982 1.00 43.02 C ATOM 701 C MET A 46 -5.983 -17.890 4.307 1.00 1.34 C ATOM 702 O MET A 46 -4.995 -18.133 4.997 1.00 70.34 O ATOM 703 CB MET A 46 -5.483 -15.923 2.867 1.00 30.12 C ATOM 704 CG MET A 46 -5.972 -14.613 2.273 1.00 33.05 C ATOM 705 SD MET A 46 -7.135 -14.836 0.911 1.00 73.42 S ATOM 706 CE MET A 46 -8.659 -15.166 1.791 1.00 34.22 C ATOM 0 H MET A 46 -5.530 -14.960 5.160 1.00 75.43 H new ATOM 0 HA MET A 46 -7.405 -16.446 3.631 1.00 43.02 H new ATOM 0 HB2 MET A 46 -4.475 -15.780 3.257 1.00 30.12 H new ATOM 0 HB3 MET A 46 -5.415 -16.667 2.074 1.00 30.12 H new ATOM 0 HG2 MET A 46 -6.449 -14.023 3.056 1.00 33.05 H new ATOM 0 HG3 MET A 46 -5.115 -14.040 1.919 1.00 33.05 H new ATOM 0 HE1 MET A 46 -9.494 -14.715 1.254 1.00 34.22 H new ATOM 0 HE2 MET A 46 -8.812 -16.243 1.862 1.00 34.22 H new ATOM 0 HE3 MET A 46 -8.600 -14.741 2.793 1.00 34.22 H new ATOM 716 N ARG A 47 -6.761 -18.823 3.796 1.00 60.23 N ATOM 717 CA ARG A 47 -6.539 -20.226 4.070 1.00 61.34 C ATOM 718 C ARG A 47 -6.708 -21.031 2.801 1.00 41.33 C ATOM 719 O ARG A 47 -7.385 -20.607 1.864 1.00 31.42 O ATOM 720 CB ARG A 47 -7.504 -20.771 5.129 1.00 53.24 C ATOM 721 CG ARG A 47 -7.419 -20.084 6.479 1.00 72.32 C ATOM 722 CD ARG A 47 -8.682 -20.321 7.282 1.00 14.52 C ATOM 723 NE ARG A 47 -8.470 -20.141 8.716 1.00 32.42 N ATOM 724 CZ ARG A 47 -9.452 -20.038 9.611 1.00 73.10 C ATOM 725 NH1 ARG A 47 -10.721 -20.095 9.223 1.00 52.23 N ATOM 726 NH2 ARG A 47 -9.159 -19.895 10.899 1.00 24.44 N ATOM 0 H ARG A 47 -7.556 -18.632 3.186 1.00 60.23 H new ATOM 0 HA ARG A 47 -5.523 -20.319 4.453 1.00 61.34 H new ATOM 0 HB2 ARG A 47 -8.523 -20.679 4.754 1.00 53.24 H new ATOM 0 HB3 ARG A 47 -7.309 -21.835 5.265 1.00 53.24 H new ATOM 0 HG2 ARG A 47 -6.556 -20.459 7.030 1.00 72.32 H new ATOM 0 HG3 ARG A 47 -7.267 -19.014 6.339 1.00 72.32 H new ATOM 0 HD2 ARG A 47 -9.459 -19.636 6.943 1.00 14.52 H new ATOM 0 HD3 ARG A 47 -9.044 -21.332 7.095 1.00 14.52 H new ATOM 0 HE ARG A 47 -7.509 -20.091 9.054 1.00 32.42 H new ATOM 0 HH11 ARG A 47 -10.948 -20.218 8.236 1.00 52.23 H new ATOM 0 HH12 ARG A 47 -11.469 -20.016 9.912 1.00 52.23 H new ATOM 0 HH21 ARG A 47 -8.185 -19.864 11.200 1.00 24.44 H new ATOM 0 HH22 ARG A 47 -9.908 -19.816 11.587 1.00 24.44 H new ATOM 740 N ASP A 48 -6.071 -22.177 2.787 1.00 44.15 N ATOM 741 CA ASP A 48 -6.181 -23.123 1.698 1.00 33.42 C ATOM 742 C ASP A 48 -7.558 -23.780 1.709 1.00 45.14 C ATOM 743 O ASP A 48 -8.015 -24.215 2.755 1.00 54.14 O ATOM 744 CB ASP A 48 -5.112 -24.191 1.879 1.00 24.13 C ATOM 745 CG ASP A 48 -4.991 -25.107 0.693 1.00 51.23 C ATOM 746 OD1 ASP A 48 -4.508 -24.669 -0.365 1.00 55.52 O ATOM 747 OD2 ASP A 48 -5.365 -26.280 0.828 1.00 31.10 O ATOM 0 H ASP A 48 -5.454 -22.484 3.539 1.00 44.15 H new ATOM 0 HA ASP A 48 -6.047 -22.606 0.748 1.00 33.42 H new ATOM 0 HB2 ASP A 48 -4.151 -23.709 2.058 1.00 24.13 H new ATOM 0 HB3 ASP A 48 -5.343 -24.782 2.766 1.00 24.13 H new ATOM 752 N PRO A 49 -8.250 -23.861 0.566 1.00 13.11 N ATOM 753 CA PRO A 49 -9.565 -24.514 0.497 1.00 12.33 C ATOM 754 C PRO A 49 -9.488 -26.037 0.670 1.00 24.52 C ATOM 755 O PRO A 49 -10.483 -26.681 1.000 1.00 14.43 O ATOM 756 CB PRO A 49 -10.066 -24.157 -0.905 1.00 31.54 C ATOM 757 CG PRO A 49 -8.842 -23.857 -1.696 1.00 73.41 C ATOM 758 CD PRO A 49 -7.837 -23.295 -0.730 1.00 54.44 C ATOM 0 HA PRO A 49 -10.221 -24.179 1.300 1.00 12.33 H new ATOM 0 HB2 PRO A 49 -10.626 -24.983 -1.345 1.00 31.54 H new ATOM 0 HB3 PRO A 49 -10.736 -23.298 -0.876 1.00 31.54 H new ATOM 0 HG2 PRO A 49 -8.459 -24.758 -2.174 1.00 73.41 H new ATOM 0 HG3 PRO A 49 -9.059 -23.142 -2.490 1.00 73.41 H new ATOM 0 HD2 PRO A 49 -6.821 -23.590 -0.991 1.00 54.44 H new ATOM 0 HD3 PRO A 49 -7.859 -22.205 -0.717 1.00 54.44 H new ATOM 766 N ASN A 50 -8.307 -26.607 0.447 1.00 11.10 N ATOM 767 CA ASN A 50 -8.132 -28.059 0.510 1.00 61.05 C ATOM 768 C ASN A 50 -7.882 -28.532 1.943 1.00 42.51 C ATOM 769 O ASN A 50 -8.607 -29.375 2.459 1.00 54.31 O ATOM 770 CB ASN A 50 -6.969 -28.516 -0.387 1.00 53.34 C ATOM 771 CG ASN A 50 -7.259 -28.439 -1.881 1.00 63.14 C ATOM 772 OD1 ASN A 50 -6.743 -29.240 -2.659 1.00 41.44 O ATOM 773 ND2 ASN A 50 -8.068 -27.478 -2.298 1.00 74.41 N ATOM 0 H ASN A 50 -7.458 -26.089 0.221 1.00 11.10 H new ATOM 0 HA ASN A 50 -9.059 -28.506 0.150 1.00 61.05 H new ATOM 0 HB2 ASN A 50 -6.094 -27.904 -0.167 1.00 53.34 H new ATOM 0 HB3 ASN A 50 -6.711 -29.544 -0.132 1.00 53.34 H new ATOM 0 HD21 ASN A 50 -8.280 -27.385 -3.291 1.00 74.41 H new ATOM 0 HD22 ASN A 50 -8.479 -26.830 -1.626 1.00 74.41 H new ATOM 780 N THR A 51 -6.863 -27.970 2.586 1.00 30.04 N ATOM 781 CA THR A 51 -6.464 -28.412 3.923 1.00 3.03 C ATOM 782 C THR A 51 -6.947 -27.441 5.011 1.00 22.43 C ATOM 783 O THR A 51 -6.856 -27.731 6.205 1.00 54.20 O ATOM 784 CB THR A 51 -4.930 -28.576 3.989 1.00 73.13 C ATOM 785 OG1 THR A 51 -4.475 -29.256 2.816 1.00 73.52 O ATOM 786 CG2 THR A 51 -4.498 -29.366 5.216 1.00 55.25 C ATOM 0 H THR A 51 -6.299 -27.210 2.207 1.00 30.04 H new ATOM 0 HA THR A 51 -6.937 -29.376 4.112 1.00 3.03 H new ATOM 0 HB THR A 51 -4.491 -27.580 4.053 1.00 73.13 H new ATOM 0 HG1 THR A 51 -3.501 -29.360 2.855 1.00 73.52 H new ATOM 0 HG21 THR A 51 -3.412 -29.459 5.225 1.00 55.25 H new ATOM 0 HG22 THR A 51 -4.825 -28.847 6.117 1.00 55.25 H new ATOM 0 HG23 THR A 51 -4.947 -30.359 5.186 1.00 55.25 H new ATOM 794 N LYS A 52 -7.464 -26.292 4.577 1.00 53.54 N ATOM 795 CA LYS A 52 -8.062 -25.280 5.466 1.00 62.32 C ATOM 796 C LYS A 52 -7.029 -24.629 6.389 1.00 42.42 C ATOM 797 O LYS A 52 -7.381 -24.099 7.440 1.00 2.52 O ATOM 798 CB LYS A 52 -9.214 -25.871 6.298 1.00 31.00 C ATOM 799 CG LYS A 52 -10.305 -26.553 5.479 1.00 34.21 C ATOM 800 CD LYS A 52 -10.733 -25.713 4.285 1.00 55.53 C ATOM 801 CE LYS A 52 -12.092 -26.146 3.756 1.00 70.34 C ATOM 802 NZ LYS A 52 -12.099 -27.575 3.341 1.00 31.23 N ATOM 0 H LYS A 52 -7.483 -26.029 3.592 1.00 53.54 H new ATOM 0 HA LYS A 52 -8.462 -24.503 4.815 1.00 62.32 H new ATOM 0 HB2 LYS A 52 -8.802 -26.593 7.003 1.00 31.00 H new ATOM 0 HB3 LYS A 52 -9.666 -25.073 6.887 1.00 31.00 H new ATOM 0 HG2 LYS A 52 -9.945 -27.521 5.130 1.00 34.21 H new ATOM 0 HG3 LYS A 52 -11.169 -26.745 6.115 1.00 34.21 H new ATOM 0 HD2 LYS A 52 -10.772 -24.663 4.573 1.00 55.53 H new ATOM 0 HD3 LYS A 52 -9.989 -25.799 3.493 1.00 55.53 H new ATOM 0 HE2 LYS A 52 -12.848 -25.988 4.526 1.00 70.34 H new ATOM 0 HE3 LYS A 52 -12.367 -25.520 2.907 1.00 70.34 H new ATOM 0 HZ1 LYS A 52 -13.038 -27.824 2.971 1.00 31.23 H new ATOM 0 HZ2 LYS A 52 -11.384 -27.725 2.601 1.00 31.23 H new ATOM 0 HZ3 LYS A 52 -11.879 -28.176 4.161 1.00 31.23 H new ATOM 816 N ARG A 53 -5.763 -24.628 5.981 1.00 61.31 N ATOM 817 CA ARG A 53 -4.714 -24.026 6.793 1.00 61.42 C ATOM 818 C ARG A 53 -4.371 -22.654 6.258 1.00 12.00 C ATOM 819 O ARG A 53 -4.686 -22.350 5.114 1.00 51.13 O ATOM 820 CB ARG A 53 -3.451 -24.892 6.851 1.00 51.43 C ATOM 821 CG ARG A 53 -3.281 -25.914 5.732 1.00 44.21 C ATOM 822 CD ARG A 53 -3.004 -25.271 4.379 1.00 61.24 C ATOM 823 NE ARG A 53 -1.843 -24.379 4.396 1.00 24.40 N ATOM 824 CZ ARG A 53 -1.066 -24.140 3.335 1.00 65.32 C ATOM 825 NH1 ARG A 53 -1.312 -24.735 2.169 1.00 64.04 N ATOM 826 NH2 ARG A 53 -0.057 -23.282 3.432 1.00 65.12 N ATOM 0 H ARG A 53 -5.442 -25.033 5.102 1.00 61.31 H new ATOM 0 HA ARG A 53 -5.099 -23.943 7.809 1.00 61.42 H new ATOM 0 HB2 ARG A 53 -2.583 -24.232 6.847 1.00 51.43 H new ATOM 0 HB3 ARG A 53 -3.443 -25.423 7.803 1.00 51.43 H new ATOM 0 HG2 ARG A 53 -2.461 -26.587 5.983 1.00 44.21 H new ATOM 0 HG3 ARG A 53 -4.183 -26.522 5.662 1.00 44.21 H new ATOM 0 HD2 ARG A 53 -2.843 -26.053 3.637 1.00 61.24 H new ATOM 0 HD3 ARG A 53 -3.883 -24.708 4.064 1.00 61.24 H new ATOM 0 HE ARG A 53 -1.613 -23.911 5.272 1.00 24.40 H new ATOM 0 HH11 ARG A 53 -2.098 -25.379 2.081 1.00 64.04 H new ATOM 0 HH12 ARG A 53 -0.714 -24.547 1.364 1.00 64.04 H new ATOM 0 HH21 ARG A 53 0.125 -22.806 4.316 1.00 65.12 H new ATOM 0 HH22 ARG A 53 0.536 -23.099 2.623 1.00 65.12 H new ATOM 840 N SER A 54 -3.688 -21.846 7.054 1.00 22.32 N ATOM 841 CA SER A 54 -3.403 -20.477 6.669 1.00 74.32 C ATOM 842 C SER A 54 -2.397 -20.448 5.523 1.00 32.00 C ATOM 843 O SER A 54 -1.481 -21.270 5.459 1.00 41.24 O ATOM 844 CB SER A 54 -2.875 -19.696 7.879 1.00 12.12 C ATOM 845 OG SER A 54 -2.353 -18.431 7.502 1.00 52.33 O ATOM 0 H SER A 54 -3.323 -22.116 7.967 1.00 22.32 H new ATOM 0 HA SER A 54 -4.322 -20.004 6.324 1.00 74.32 H new ATOM 0 HB2 SER A 54 -3.679 -19.557 8.601 1.00 12.12 H new ATOM 0 HB3 SER A 54 -2.098 -20.277 8.376 1.00 12.12 H new ATOM 0 HG SER A 54 -1.573 -18.220 8.057 1.00 52.33 H new ATOM 851 N ARG A 55 -2.594 -19.502 4.616 1.00 24.33 N ATOM 852 CA ARG A 55 -1.717 -19.321 3.470 1.00 15.44 C ATOM 853 C ARG A 55 -0.568 -18.389 3.820 1.00 42.44 C ATOM 854 O ARG A 55 0.273 -18.079 2.979 1.00 41.14 O ATOM 855 CB ARG A 55 -2.498 -18.743 2.295 1.00 34.32 C ATOM 856 CG ARG A 55 -3.406 -19.737 1.599 1.00 25.23 C ATOM 857 CD ARG A 55 -4.360 -19.019 0.663 1.00 4.12 C ATOM 858 NE ARG A 55 -4.978 -19.919 -0.303 1.00 21.40 N ATOM 859 CZ ARG A 55 -6.060 -19.615 -1.018 1.00 30.52 C ATOM 860 NH1 ARG A 55 -6.658 -18.436 -0.876 1.00 30.11 N ATOM 861 NH2 ARG A 55 -6.521 -20.482 -1.904 1.00 53.20 N ATOM 0 H ARG A 55 -3.367 -18.838 4.655 1.00 24.33 H new ATOM 0 HA ARG A 55 -1.314 -20.295 3.192 1.00 15.44 H new ATOM 0 HB2 ARG A 55 -3.100 -17.906 2.650 1.00 34.32 H new ATOM 0 HB3 ARG A 55 -1.793 -18.342 1.567 1.00 34.32 H new ATOM 0 HG2 ARG A 55 -2.807 -20.454 1.038 1.00 25.23 H new ATOM 0 HG3 ARG A 55 -3.971 -20.303 2.340 1.00 25.23 H new ATOM 0 HD2 ARG A 55 -5.138 -18.530 1.248 1.00 4.12 H new ATOM 0 HD3 ARG A 55 -3.821 -18.235 0.131 1.00 4.12 H new ATOM 0 HE ARG A 55 -4.556 -20.838 -0.440 1.00 21.40 H new ATOM 0 HH11 ARG A 55 -6.289 -17.753 -0.214 1.00 30.11 H new ATOM 0 HH12 ARG A 55 -7.486 -18.214 -1.429 1.00 30.11 H new ATOM 0 HH21 ARG A 55 -6.049 -21.376 -2.036 1.00 53.20 H new ATOM 0 HH22 ARG A 55 -7.349 -20.256 -2.455 1.00 53.20 H new ATOM 875 N GLY A 56 -0.540 -17.945 5.068 1.00 33.13 N ATOM 876 CA GLY A 56 0.524 -17.068 5.517 1.00 62.21 C ATOM 877 C GLY A 56 0.270 -15.600 5.230 1.00 10.43 C ATOM 878 O GLY A 56 1.201 -14.800 5.246 1.00 30.11 O ATOM 0 H GLY A 56 -1.235 -18.176 5.778 1.00 33.13 H new ATOM 0 HA2 GLY A 56 0.662 -17.200 6.590 1.00 62.21 H new ATOM 0 HA3 GLY A 56 1.456 -17.367 5.036 1.00 62.21 H new ATOM 882 N PHE A 57 -0.978 -15.239 4.960 1.00 2.10 N ATOM 883 CA PHE A 57 -1.348 -13.839 4.778 1.00 1.12 C ATOM 884 C PHE A 57 -2.846 -13.652 5.013 1.00 43.55 C ATOM 885 O PHE A 57 -3.611 -14.613 4.956 1.00 21.30 O ATOM 886 CB PHE A 57 -0.931 -13.318 3.386 1.00 63.22 C ATOM 887 CG PHE A 57 -1.530 -14.039 2.203 1.00 15.35 C ATOM 888 CD1 PHE A 57 -0.974 -15.219 1.734 1.00 75.31 C ATOM 889 CD2 PHE A 57 -2.630 -13.517 1.541 1.00 20.42 C ATOM 890 CE1 PHE A 57 -1.506 -15.864 0.634 1.00 11.20 C ATOM 891 CE2 PHE A 57 -3.162 -14.155 0.436 1.00 1.23 C ATOM 892 CZ PHE A 57 -2.601 -15.331 -0.016 1.00 20.41 C ATOM 0 H PHE A 57 -1.752 -15.896 4.862 1.00 2.10 H new ATOM 0 HA PHE A 57 -0.807 -13.247 5.516 1.00 1.12 H new ATOM 0 HB2 PHE A 57 -1.201 -12.264 3.319 1.00 63.22 H new ATOM 0 HB3 PHE A 57 0.155 -13.375 3.309 1.00 63.22 H new ATOM 0 HD1 PHE A 57 -0.114 -15.639 2.235 1.00 75.31 H new ATOM 0 HD2 PHE A 57 -3.078 -12.599 1.893 1.00 20.42 H new ATOM 0 HE1 PHE A 57 -1.065 -16.785 0.283 1.00 11.20 H new ATOM 0 HE2 PHE A 57 -4.016 -13.733 -0.073 1.00 1.23 H new ATOM 0 HZ PHE A 57 -3.017 -15.834 -0.876 1.00 20.41 H new ATOM 902 N GLY A 58 -3.249 -12.423 5.305 1.00 10.53 N ATOM 903 CA GLY A 58 -4.645 -12.124 5.574 1.00 21.02 C ATOM 904 C GLY A 58 -4.941 -10.652 5.392 1.00 45.34 C ATOM 905 O GLY A 58 -4.131 -9.932 4.816 1.00 53.41 O ATOM 0 H GLY A 58 -2.626 -11.617 5.361 1.00 10.53 H new ATOM 0 HA2 GLY A 58 -5.279 -12.709 4.907 1.00 21.02 H new ATOM 0 HA3 GLY A 58 -4.893 -12.423 6.593 1.00 21.02 H new ATOM 909 N PHE A 59 -6.102 -10.199 5.859 1.00 73.32 N ATOM 910 CA PHE A 59 -6.475 -8.789 5.752 1.00 2.31 C ATOM 911 C PHE A 59 -7.264 -8.346 6.981 1.00 72.51 C ATOM 912 O PHE A 59 -7.999 -9.136 7.577 1.00 15.44 O ATOM 913 CB PHE A 59 -7.343 -8.510 4.511 1.00 23.11 C ATOM 914 CG PHE A 59 -7.052 -9.368 3.314 1.00 75.34 C ATOM 915 CD1 PHE A 59 -7.671 -10.595 3.178 1.00 44.32 C ATOM 916 CD2 PHE A 59 -6.177 -8.950 2.325 1.00 64.12 C ATOM 917 CE1 PHE A 59 -7.427 -11.395 2.090 1.00 55.22 C ATOM 918 CE2 PHE A 59 -5.925 -9.749 1.224 1.00 52.41 C ATOM 919 CZ PHE A 59 -6.551 -10.975 1.107 1.00 64.45 C ATOM 0 H PHE A 59 -6.801 -10.786 6.315 1.00 73.32 H new ATOM 0 HA PHE A 59 -5.542 -8.232 5.670 1.00 2.31 H new ATOM 0 HB2 PHE A 59 -8.390 -8.641 4.784 1.00 23.11 H new ATOM 0 HB3 PHE A 59 -7.216 -7.465 4.227 1.00 23.11 H new ATOM 0 HD1 PHE A 59 -8.358 -10.930 3.940 1.00 44.32 H new ATOM 0 HD2 PHE A 59 -5.687 -7.992 2.414 1.00 64.12 H new ATOM 0 HE1 PHE A 59 -7.919 -12.352 2.002 1.00 55.22 H new ATOM 0 HE2 PHE A 59 -5.241 -9.415 0.458 1.00 52.41 H new ATOM 0 HZ PHE A 59 -6.356 -11.603 0.250 1.00 64.45 H new ATOM 929 N VAL A 60 -7.127 -7.073 7.326 1.00 12.33 N ATOM 930 CA VAL A 60 -7.878 -6.473 8.425 1.00 24.01 C ATOM 931 C VAL A 60 -8.454 -5.131 7.982 1.00 23.12 C ATOM 932 O VAL A 60 -7.750 -4.305 7.410 1.00 11.21 O ATOM 933 CB VAL A 60 -7.016 -6.269 9.702 1.00 42.12 C ATOM 934 CG1 VAL A 60 -6.720 -7.598 10.375 1.00 1.22 C ATOM 935 CG2 VAL A 60 -5.717 -5.544 9.381 1.00 41.42 C ATOM 0 H VAL A 60 -6.494 -6.427 6.854 1.00 12.33 H new ATOM 0 HA VAL A 60 -8.678 -7.167 8.681 1.00 24.01 H new ATOM 0 HB VAL A 60 -7.592 -5.651 10.390 1.00 42.12 H new ATOM 0 HG11 VAL A 60 -6.116 -7.428 11.266 1.00 1.22 H new ATOM 0 HG12 VAL A 60 -7.656 -8.079 10.658 1.00 1.22 H new ATOM 0 HG13 VAL A 60 -6.175 -8.242 9.685 1.00 1.22 H new ATOM 0 HG21 VAL A 60 -5.136 -5.416 10.295 1.00 41.42 H new ATOM 0 HG22 VAL A 60 -5.141 -6.129 8.664 1.00 41.42 H new ATOM 0 HG23 VAL A 60 -5.942 -4.566 8.954 1.00 41.42 H new ATOM 945 N THR A 61 -9.734 -4.919 8.217 1.00 31.14 N ATOM 946 CA THR A 61 -10.380 -3.680 7.819 1.00 21.12 C ATOM 947 C THR A 61 -10.653 -2.809 9.033 1.00 33.11 C ATOM 948 O THR A 61 -11.308 -3.244 9.975 1.00 74.13 O ATOM 949 CB THR A 61 -11.698 -3.948 7.073 1.00 75.23 C ATOM 950 OG1 THR A 61 -11.508 -5.017 6.139 1.00 22.24 O ATOM 951 CG2 THR A 61 -12.169 -2.706 6.329 1.00 33.22 C ATOM 0 H THR A 61 -10.349 -5.587 8.681 1.00 31.14 H new ATOM 0 HA THR A 61 -9.701 -3.159 7.144 1.00 21.12 H new ATOM 0 HB THR A 61 -12.458 -4.220 7.806 1.00 75.23 H new ATOM 0 HG1 THR A 61 -12.368 -5.254 5.734 1.00 22.24 H new ATOM 0 HG21 THR A 61 -13.103 -2.925 5.811 1.00 33.22 H new ATOM 0 HG22 THR A 61 -12.330 -1.895 7.040 1.00 33.22 H new ATOM 0 HG23 THR A 61 -11.412 -2.408 5.603 1.00 33.22 H new ATOM 959 N TYR A 62 -10.138 -1.591 9.014 1.00 61.32 N ATOM 960 CA TYR A 62 -10.349 -0.661 10.111 1.00 73.31 C ATOM 961 C TYR A 62 -11.594 0.175 9.876 1.00 22.33 C ATOM 962 O TYR A 62 -12.039 0.326 8.742 1.00 33.20 O ATOM 963 CB TYR A 62 -9.143 0.256 10.277 1.00 32.11 C ATOM 964 CG TYR A 62 -8.013 -0.350 11.077 1.00 4.01 C ATOM 965 CD1 TYR A 62 -8.021 -0.301 12.464 1.00 43.13 C ATOM 966 CD2 TYR A 62 -6.932 -0.955 10.449 1.00 31.31 C ATOM 967 CE1 TYR A 62 -6.983 -0.834 13.201 1.00 11.31 C ATOM 968 CE2 TYR A 62 -5.894 -1.493 11.181 1.00 61.02 C ATOM 969 CZ TYR A 62 -5.923 -1.427 12.555 1.00 41.44 C ATOM 970 OH TYR A 62 -4.886 -1.956 13.282 1.00 31.30 O ATOM 0 H TYR A 62 -9.570 -1.223 8.251 1.00 61.32 H new ATOM 0 HA TYR A 62 -10.481 -1.244 11.022 1.00 73.31 H new ATOM 0 HB2 TYR A 62 -8.769 0.530 9.290 1.00 32.11 H new ATOM 0 HB3 TYR A 62 -9.465 1.177 10.763 1.00 32.11 H new ATOM 0 HD1 TYR A 62 -8.853 0.162 12.975 1.00 43.13 H new ATOM 0 HD2 TYR A 62 -6.904 -1.005 9.371 1.00 31.31 H new ATOM 0 HE1 TYR A 62 -7.003 -0.786 14.280 1.00 11.31 H new ATOM 0 HE2 TYR A 62 -5.062 -1.964 10.678 1.00 61.02 H new ATOM 0 HH TYR A 62 -5.213 -2.236 14.162 1.00 31.30 H new ATOM 980 N ALA A 63 -12.144 0.708 10.958 1.00 0.04 N ATOM 981 CA ALA A 63 -13.323 1.564 10.902 1.00 74.21 C ATOM 982 C ALA A 63 -13.026 2.865 10.158 1.00 32.03 C ATOM 983 O ALA A 63 -13.793 3.288 9.294 1.00 60.52 O ATOM 984 CB ALA A 63 -13.806 1.859 12.315 1.00 32.05 C ATOM 0 H ALA A 63 -11.786 0.559 11.901 1.00 0.04 H new ATOM 0 HA ALA A 63 -14.106 1.040 10.354 1.00 74.21 H new ATOM 0 HB1 ALA A 63 -14.687 2.499 12.272 1.00 32.05 H new ATOM 0 HB2 ALA A 63 -14.060 0.924 12.815 1.00 32.05 H new ATOM 0 HB3 ALA A 63 -13.017 2.365 12.871 1.00 32.05 H new ATOM 990 N THR A 64 -11.906 3.486 10.498 1.00 42.32 N ATOM 991 CA THR A 64 -11.486 4.721 9.847 1.00 61.33 C ATOM 992 C THR A 64 -10.088 4.548 9.258 1.00 34.13 C ATOM 993 O THR A 64 -9.301 3.725 9.738 1.00 23.45 O ATOM 994 CB THR A 64 -11.488 5.913 10.835 1.00 3.22 C ATOM 995 OG1 THR A 64 -12.632 5.832 11.695 1.00 21.23 O ATOM 996 CG2 THR A 64 -11.508 7.250 10.103 1.00 2.44 C ATOM 0 H THR A 64 -11.269 3.155 11.223 1.00 42.32 H new ATOM 0 HA THR A 64 -12.199 4.938 9.051 1.00 61.33 H new ATOM 0 HB THR A 64 -10.571 5.856 11.422 1.00 3.22 H new ATOM 0 HG1 THR A 64 -12.377 5.405 12.539 1.00 21.23 H new ATOM 0 HG21 THR A 64 -11.509 8.063 10.830 1.00 2.44 H new ATOM 0 HG22 THR A 64 -10.625 7.331 9.469 1.00 2.44 H new ATOM 0 HG23 THR A 64 -12.404 7.314 9.486 1.00 2.44 H new ATOM 1004 N VAL A 65 -9.784 5.321 8.224 1.00 74.34 N ATOM 1005 CA VAL A 65 -8.491 5.252 7.562 1.00 4.22 C ATOM 1006 C VAL A 65 -7.356 5.681 8.505 1.00 4.05 C ATOM 1007 O VAL A 65 -6.233 5.207 8.389 1.00 62.20 O ATOM 1008 CB VAL A 65 -8.499 6.111 6.275 1.00 32.53 C ATOM 1009 CG1 VAL A 65 -8.520 7.599 6.591 1.00 34.02 C ATOM 1010 CG2 VAL A 65 -7.326 5.762 5.379 1.00 62.45 C ATOM 0 H VAL A 65 -10.423 6.008 7.824 1.00 74.34 H new ATOM 0 HA VAL A 65 -8.308 4.214 7.283 1.00 4.22 H new ATOM 0 HB VAL A 65 -9.418 5.879 5.736 1.00 32.53 H new ATOM 0 HG11 VAL A 65 -8.525 8.168 5.662 1.00 34.02 H new ATOM 0 HG12 VAL A 65 -9.415 7.836 7.167 1.00 34.02 H new ATOM 0 HG13 VAL A 65 -7.635 7.860 7.172 1.00 34.02 H new ATOM 0 HG21 VAL A 65 -7.357 6.381 4.482 1.00 62.45 H new ATOM 0 HG22 VAL A 65 -6.393 5.943 5.913 1.00 62.45 H new ATOM 0 HG23 VAL A 65 -7.384 4.711 5.097 1.00 62.45 H new ATOM 1020 N GLU A 66 -7.654 6.590 9.432 1.00 53.22 N ATOM 1021 CA GLU A 66 -6.693 7.007 10.451 1.00 65.53 C ATOM 1022 C GLU A 66 -6.284 5.870 11.380 1.00 22.40 C ATOM 1023 O GLU A 66 -5.133 5.796 11.804 1.00 5.24 O ATOM 1024 CB GLU A 66 -7.295 8.133 11.263 1.00 51.33 C ATOM 1025 CG GLU A 66 -7.686 9.327 10.423 1.00 44.30 C ATOM 1026 CD GLU A 66 -6.487 10.014 9.809 1.00 52.12 C ATOM 1027 OE1 GLU A 66 -5.812 10.788 10.518 1.00 12.31 O ATOM 1028 OE2 GLU A 66 -6.214 9.784 8.615 1.00 32.44 O ATOM 0 H GLU A 66 -8.560 7.054 9.498 1.00 53.22 H new ATOM 0 HA GLU A 66 -5.790 7.336 9.936 1.00 65.53 H new ATOM 0 HB2 GLU A 66 -8.175 7.763 11.790 1.00 51.33 H new ATOM 0 HB3 GLU A 66 -6.579 8.449 12.022 1.00 51.33 H new ATOM 0 HG2 GLU A 66 -8.363 9.005 9.631 1.00 44.30 H new ATOM 0 HG3 GLU A 66 -8.233 10.039 11.040 1.00 44.30 H new ATOM 1035 N GLU A 67 -7.229 5.005 11.718 1.00 71.12 N ATOM 1036 CA GLU A 67 -6.924 3.816 12.506 1.00 72.32 C ATOM 1037 C GLU A 67 -5.982 2.887 11.741 1.00 11.30 C ATOM 1038 O GLU A 67 -5.195 2.154 12.336 1.00 0.01 O ATOM 1039 CB GLU A 67 -8.206 3.079 12.882 1.00 35.53 C ATOM 1040 CG GLU A 67 -8.931 3.672 14.078 1.00 71.21 C ATOM 1041 CD GLU A 67 -9.841 4.828 13.720 1.00 64.21 C ATOM 1042 OE1 GLU A 67 -9.340 5.956 13.540 1.00 35.53 O ATOM 1043 OE2 GLU A 67 -11.066 4.611 13.632 1.00 74.44 O ATOM 0 H GLU A 67 -8.211 5.102 11.461 1.00 71.12 H new ATOM 0 HA GLU A 67 -6.425 4.134 13.421 1.00 72.32 H new ATOM 0 HB2 GLU A 67 -8.879 3.081 12.025 1.00 35.53 H new ATOM 0 HB3 GLU A 67 -7.965 2.038 13.096 1.00 35.53 H new ATOM 0 HG2 GLU A 67 -9.520 2.892 14.559 1.00 71.21 H new ATOM 0 HG3 GLU A 67 -8.195 4.011 14.807 1.00 71.21 H new ATOM 1050 N VAL A 68 -6.068 2.938 10.415 1.00 62.12 N ATOM 1051 CA VAL A 68 -5.114 2.250 9.554 1.00 10.33 C ATOM 1052 C VAL A 68 -3.722 2.833 9.755 1.00 20.01 C ATOM 1053 O VAL A 68 -2.759 2.102 9.980 1.00 33.10 O ATOM 1054 CB VAL A 68 -5.513 2.378 8.070 1.00 2.35 C ATOM 1055 CG1 VAL A 68 -4.386 1.951 7.145 1.00 13.51 C ATOM 1056 CG2 VAL A 68 -6.757 1.570 7.788 1.00 13.05 C ATOM 0 H VAL A 68 -6.792 3.451 9.913 1.00 62.12 H new ATOM 0 HA VAL A 68 -5.115 1.194 9.824 1.00 10.33 H new ATOM 0 HB VAL A 68 -5.720 3.430 7.875 1.00 2.35 H new ATOM 0 HG11 VAL A 68 -4.707 2.056 6.108 1.00 13.51 H new ATOM 0 HG12 VAL A 68 -3.513 2.580 7.320 1.00 13.51 H new ATOM 0 HG13 VAL A 68 -4.128 0.910 7.342 1.00 13.51 H new ATOM 0 HG21 VAL A 68 -7.026 1.671 6.736 1.00 13.05 H new ATOM 0 HG22 VAL A 68 -6.569 0.521 8.016 1.00 13.05 H new ATOM 0 HG23 VAL A 68 -7.576 1.934 8.408 1.00 13.05 H new ATOM 1066 N ASP A 69 -3.645 4.161 9.686 1.00 44.30 N ATOM 1067 CA ASP A 69 -2.398 4.895 9.887 1.00 50.34 C ATOM 1068 C ASP A 69 -1.728 4.500 11.200 1.00 41.13 C ATOM 1069 O ASP A 69 -0.546 4.173 11.215 1.00 44.24 O ATOM 1070 CB ASP A 69 -2.664 6.401 9.876 1.00 65.13 C ATOM 1071 CG ASP A 69 -1.391 7.213 9.960 1.00 72.11 C ATOM 1072 OD1 ASP A 69 -0.762 7.446 8.911 1.00 72.14 O ATOM 1073 OD2 ASP A 69 -1.012 7.619 11.077 1.00 24.55 O ATOM 0 H ASP A 69 -4.447 4.759 9.489 1.00 44.30 H new ATOM 0 HA ASP A 69 -1.725 4.639 9.069 1.00 50.34 H new ATOM 0 HB2 ASP A 69 -3.201 6.666 8.965 1.00 65.13 H new ATOM 0 HB3 ASP A 69 -3.312 6.659 10.714 1.00 65.13 H new ATOM 1078 N ALA A 70 -2.497 4.546 12.287 1.00 70.23 N ATOM 1079 CA ALA A 70 -2.045 4.086 13.608 1.00 71.25 C ATOM 1080 C ALA A 70 -1.352 2.720 13.558 1.00 55.32 C ATOM 1081 O ALA A 70 -0.317 2.520 14.192 1.00 0.34 O ATOM 1082 CB ALA A 70 -3.222 4.033 14.570 1.00 32.44 C ATOM 0 H ALA A 70 -3.453 4.903 12.281 1.00 70.23 H new ATOM 0 HA ALA A 70 -1.306 4.806 13.959 1.00 71.25 H new ATOM 0 HB1 ALA A 70 -2.879 3.691 15.546 1.00 32.44 H new ATOM 0 HB2 ALA A 70 -3.658 5.027 14.666 1.00 32.44 H new ATOM 0 HB3 ALA A 70 -3.974 3.342 14.188 1.00 32.44 H new ATOM 1088 N ALA A 71 -1.896 1.803 12.765 1.00 10.51 N ATOM 1089 CA ALA A 71 -1.323 0.466 12.646 1.00 40.10 C ATOM 1090 C ALA A 71 -0.041 0.495 11.814 1.00 44.34 C ATOM 1091 O ALA A 71 0.868 -0.303 12.023 1.00 52.43 O ATOM 1092 CB ALA A 71 -2.323 -0.494 12.029 1.00 4.23 C ATOM 0 H ALA A 71 -2.729 1.959 12.197 1.00 10.51 H new ATOM 0 HA ALA A 71 -1.077 0.117 13.649 1.00 40.10 H new ATOM 0 HB1 ALA A 71 -1.875 -1.485 11.950 1.00 4.23 H new ATOM 0 HB2 ALA A 71 -3.212 -0.547 12.658 1.00 4.23 H new ATOM 0 HB3 ALA A 71 -2.601 -0.141 11.036 1.00 4.23 H new ATOM 1098 N MET A 72 0.031 1.434 10.878 1.00 62.10 N ATOM 1099 CA MET A 72 1.195 1.571 10.011 1.00 34.13 C ATOM 1100 C MET A 72 2.390 2.118 10.788 1.00 72.03 C ATOM 1101 O MET A 72 3.529 1.725 10.534 1.00 74.13 O ATOM 1102 CB MET A 72 0.879 2.483 8.822 1.00 14.04 C ATOM 1103 CG MET A 72 -0.387 2.102 8.064 1.00 32.32 C ATOM 1104 SD MET A 72 -0.088 1.108 6.591 1.00 34.13 S ATOM 1105 CE MET A 72 0.464 -0.446 7.264 1.00 20.04 C ATOM 0 H MET A 72 -0.707 2.115 10.700 1.00 62.10 H new ATOM 0 HA MET A 72 1.451 0.581 9.634 1.00 34.13 H new ATOM 0 HB2 MET A 72 0.780 3.508 9.180 1.00 14.04 H new ATOM 0 HB3 MET A 72 1.722 2.466 8.131 1.00 14.04 H new ATOM 0 HG2 MET A 72 -1.047 1.551 8.734 1.00 32.32 H new ATOM 0 HG3 MET A 72 -0.913 3.012 7.775 1.00 32.32 H new ATOM 0 HE1 MET A 72 0.407 -1.216 6.495 1.00 20.04 H new ATOM 0 HE2 MET A 72 1.495 -0.349 7.605 1.00 20.04 H new ATOM 0 HE3 MET A 72 -0.171 -0.725 8.105 1.00 20.04 H new ATOM 1115 N ASN A 73 2.130 3.013 11.740 1.00 54.10 N ATOM 1116 CA ASN A 73 3.190 3.545 12.603 1.00 23.45 C ATOM 1117 C ASN A 73 3.676 2.469 13.563 1.00 73.12 C ATOM 1118 O ASN A 73 4.861 2.385 13.880 1.00 31.23 O ATOM 1119 CB ASN A 73 2.701 4.742 13.427 1.00 3.12 C ATOM 1120 CG ASN A 73 2.137 5.861 12.586 1.00 51.34 C ATOM 1121 OD1 ASN A 73 2.857 6.540 11.858 1.00 10.14 O ATOM 1122 ND2 ASN A 73 0.846 6.083 12.713 1.00 11.20 N ATOM 0 H ASN A 73 1.200 3.385 11.935 1.00 54.10 H new ATOM 0 HA ASN A 73 4.001 3.870 11.952 1.00 23.45 H new ATOM 0 HB2 ASN A 73 1.937 4.403 14.127 1.00 3.12 H new ATOM 0 HB3 ASN A 73 3.530 5.127 14.021 1.00 3.12 H new ATOM 0 HD21 ASN A 73 0.406 6.844 12.195 1.00 11.20 H new ATOM 0 HD22 ASN A 73 0.285 5.494 13.329 1.00 11.20 H new ATOM 1129 N ALA A 74 2.737 1.648 14.017 1.00 42.13 N ATOM 1130 CA ALA A 74 3.025 0.586 14.979 1.00 42.50 C ATOM 1131 C ALA A 74 3.897 -0.533 14.399 1.00 53.24 C ATOM 1132 O ALA A 74 4.370 -1.393 15.144 1.00 60.43 O ATOM 1133 CB ALA A 74 1.728 0.009 15.508 1.00 21.32 C ATOM 0 H ALA A 74 1.759 1.697 13.732 1.00 42.13 H new ATOM 0 HA ALA A 74 3.596 1.039 15.789 1.00 42.50 H new ATOM 0 HB1 ALA A 74 1.947 -0.782 16.225 1.00 21.32 H new ATOM 0 HB2 ALA A 74 1.154 0.795 15.999 1.00 21.32 H new ATOM 0 HB3 ALA A 74 1.148 -0.401 14.681 1.00 21.32 H new ATOM 1139 N ARG A 75 4.078 -0.542 13.078 1.00 15.25 N ATOM 1140 CA ARG A 75 4.966 -1.507 12.420 1.00 71.21 C ATOM 1141 C ARG A 75 6.391 -1.432 12.974 1.00 33.04 C ATOM 1142 O ARG A 75 6.876 -0.349 13.313 1.00 53.50 O ATOM 1143 CB ARG A 75 4.988 -1.275 10.909 1.00 33.31 C ATOM 1144 CG ARG A 75 3.752 -1.792 10.194 1.00 25.14 C ATOM 1145 CD ARG A 75 3.823 -1.538 8.698 1.00 1.14 C ATOM 1146 NE ARG A 75 3.944 -0.113 8.395 1.00 2.52 N ATOM 1147 CZ ARG A 75 3.889 0.410 7.167 1.00 33.03 C ATOM 1148 NH1 ARG A 75 3.720 -0.374 6.109 1.00 44.33 N ATOM 1149 NH2 ARG A 75 3.988 1.721 7.009 1.00 70.35 N ATOM 0 H ARG A 75 3.621 0.109 12.439 1.00 15.25 H new ATOM 0 HA ARG A 75 4.572 -2.502 12.626 1.00 71.21 H new ATOM 0 HB2 ARG A 75 5.089 -0.207 10.716 1.00 33.31 H new ATOM 0 HB3 ARG A 75 5.869 -1.759 10.489 1.00 33.31 H new ATOM 0 HG2 ARG A 75 3.646 -2.861 10.377 1.00 25.14 H new ATOM 0 HG3 ARG A 75 2.865 -1.309 10.604 1.00 25.14 H new ATOM 0 HD2 ARG A 75 4.675 -2.073 8.279 1.00 1.14 H new ATOM 0 HD3 ARG A 75 2.929 -1.937 8.219 1.00 1.14 H new ATOM 0 HE ARG A 75 4.080 0.528 9.177 1.00 2.52 H new ATOM 0 HH11 ARG A 75 3.631 -1.383 6.231 1.00 44.33 H new ATOM 0 HH12 ARG A 75 3.679 0.032 5.174 1.00 44.33 H new ATOM 0 HH21 ARG A 75 4.106 2.325 7.822 1.00 70.35 H new ATOM 0 HH22 ARG A 75 3.947 2.127 6.074 1.00 70.35 H new ATOM 1163 N PRO A 76 7.092 -2.582 13.067 1.00 20.51 N ATOM 1164 CA PRO A 76 6.578 -3.884 12.620 1.00 40.44 C ATOM 1165 C PRO A 76 5.619 -4.532 13.623 1.00 23.04 C ATOM 1166 O PRO A 76 5.571 -4.156 14.793 1.00 33.34 O ATOM 1167 CB PRO A 76 7.849 -4.721 12.483 1.00 51.44 C ATOM 1168 CG PRO A 76 8.791 -4.159 13.488 1.00 14.22 C ATOM 1169 CD PRO A 76 8.458 -2.694 13.618 1.00 61.11 C ATOM 0 HA PRO A 76 5.993 -3.795 11.705 1.00 40.44 H new ATOM 0 HB2 PRO A 76 7.650 -5.775 12.675 1.00 51.44 H new ATOM 0 HB3 PRO A 76 8.260 -4.653 11.476 1.00 51.44 H new ATOM 0 HG2 PRO A 76 8.684 -4.667 14.446 1.00 14.22 H new ATOM 0 HG3 PRO A 76 9.824 -4.295 13.169 1.00 14.22 H new ATOM 0 HD2 PRO A 76 8.496 -2.368 14.657 1.00 61.11 H new ATOM 0 HD3 PRO A 76 9.163 -2.075 13.063 1.00 61.11 H new ATOM 1177 N HIS A 77 4.862 -5.509 13.147 1.00 20.33 N ATOM 1178 CA HIS A 77 3.890 -6.203 13.983 1.00 0.34 C ATOM 1179 C HIS A 77 4.256 -7.669 14.116 1.00 73.55 C ATOM 1180 O HIS A 77 4.961 -8.218 13.271 1.00 1.31 O ATOM 1181 CB HIS A 77 2.479 -6.088 13.401 1.00 32.34 C ATOM 1182 CG HIS A 77 1.854 -4.737 13.538 1.00 10.22 C ATOM 1183 ND1 HIS A 77 0.877 -4.488 14.466 1.00 42.14 N ATOM 1184 CD2 HIS A 77 2.073 -3.617 12.821 1.00 23.24 C ATOM 1185 CE1 HIS A 77 0.521 -3.231 14.288 1.00 63.55 C ATOM 1186 NE2 HIS A 77 1.222 -2.665 13.303 1.00 51.42 N ATOM 0 H HIS A 77 4.901 -5.841 12.183 1.00 20.33 H new ATOM 0 HA HIS A 77 3.906 -5.732 14.966 1.00 0.34 H new ATOM 0 HB2 HIS A 77 2.514 -6.351 12.344 1.00 32.34 H new ATOM 0 HB3 HIS A 77 1.838 -6.821 13.891 1.00 32.34 H new ATOM 0 HD2 HIS A 77 2.786 -3.496 12.019 1.00 23.24 H new ATOM 0 HE1 HIS A 77 -0.239 -2.725 14.864 1.00 63.55 H new ATOM 0 HE2 HIS A 77 1.138 -1.703 12.973 1.00 51.42 H new ATOM 1194 N LYS A 78 3.789 -8.298 15.180 1.00 12.13 N ATOM 1195 CA LYS A 78 4.006 -9.719 15.372 1.00 73.03 C ATOM 1196 C LYS A 78 2.733 -10.402 15.864 1.00 15.23 C ATOM 1197 O LYS A 78 2.297 -10.178 16.995 1.00 53.42 O ATOM 1198 CB LYS A 78 5.161 -9.958 16.348 1.00 44.42 C ATOM 1199 CG LYS A 78 5.308 -11.411 16.764 1.00 3.44 C ATOM 1200 CD LYS A 78 6.717 -11.730 17.224 1.00 51.00 C ATOM 1201 CE LYS A 78 7.639 -12.004 16.050 1.00 3.25 C ATOM 1202 NZ LYS A 78 9.011 -12.356 16.497 1.00 60.32 N ATOM 0 H LYS A 78 3.257 -7.846 15.924 1.00 12.13 H new ATOM 0 HA LYS A 78 4.273 -10.156 14.410 1.00 73.03 H new ATOM 0 HB2 LYS A 78 6.091 -9.624 15.888 1.00 44.42 H new ATOM 0 HB3 LYS A 78 5.008 -9.347 17.237 1.00 44.42 H new ATOM 0 HG2 LYS A 78 4.606 -11.631 17.568 1.00 3.44 H new ATOM 0 HG3 LYS A 78 5.045 -12.056 15.926 1.00 3.44 H new ATOM 0 HD2 LYS A 78 7.108 -10.896 17.807 1.00 51.00 H new ATOM 0 HD3 LYS A 78 6.698 -12.598 17.883 1.00 51.00 H new ATOM 0 HE2 LYS A 78 7.232 -12.818 15.450 1.00 3.25 H new ATOM 0 HE3 LYS A 78 7.680 -11.125 15.407 1.00 3.25 H new ATOM 0 HZ1 LYS A 78 9.611 -12.536 15.667 1.00 60.32 H new ATOM 0 HZ2 LYS A 78 9.409 -11.569 17.048 1.00 60.32 H new ATOM 0 HZ3 LYS A 78 8.975 -13.210 17.090 1.00 60.32 H new ATOM 1216 N VAL A 79 2.141 -11.222 15.003 1.00 55.33 N ATOM 1217 CA VAL A 79 0.934 -11.968 15.341 1.00 14.51 C ATOM 1218 C VAL A 79 1.264 -13.451 15.458 1.00 51.53 C ATOM 1219 O VAL A 79 1.878 -14.020 14.554 1.00 43.15 O ATOM 1220 CB VAL A 79 -0.173 -11.786 14.273 1.00 22.33 C ATOM 1221 CG1 VAL A 79 -1.495 -12.366 14.752 1.00 24.24 C ATOM 1222 CG2 VAL A 79 -0.341 -10.320 13.900 1.00 60.40 C ATOM 0 H VAL A 79 2.482 -11.388 14.056 1.00 55.33 H new ATOM 0 HA VAL A 79 0.564 -11.581 16.290 1.00 14.51 H new ATOM 0 HB VAL A 79 0.138 -12.331 13.382 1.00 22.33 H new ATOM 0 HG11 VAL A 79 -2.254 -12.225 13.983 1.00 24.24 H new ATOM 0 HG12 VAL A 79 -1.374 -13.431 14.951 1.00 24.24 H new ATOM 0 HG13 VAL A 79 -1.805 -11.859 15.666 1.00 24.24 H new ATOM 0 HG21 VAL A 79 -1.125 -10.223 13.149 1.00 60.40 H new ATOM 0 HG22 VAL A 79 -0.616 -9.748 14.786 1.00 60.40 H new ATOM 0 HG23 VAL A 79 0.597 -9.937 13.497 1.00 60.40 H new ATOM 1232 N ASP A 80 0.885 -14.054 16.589 1.00 62.43 N ATOM 1233 CA ASP A 80 1.070 -15.495 16.834 1.00 31.21 C ATOM 1234 C ASP A 80 2.561 -15.863 16.875 1.00 70.24 C ATOM 1235 O ASP A 80 2.954 -16.985 16.559 1.00 30.44 O ATOM 1236 CB ASP A 80 0.325 -16.327 15.769 1.00 55.31 C ATOM 1237 CG ASP A 80 0.160 -17.786 16.164 1.00 24.43 C ATOM 1238 OD1 ASP A 80 -0.346 -18.052 17.273 1.00 12.21 O ATOM 1239 OD2 ASP A 80 0.541 -18.671 15.366 1.00 44.32 O ATOM 0 H ASP A 80 0.441 -13.560 17.363 1.00 62.43 H new ATOM 0 HA ASP A 80 0.644 -15.729 17.810 1.00 31.21 H new ATOM 0 HB2 ASP A 80 -0.658 -15.890 15.596 1.00 55.31 H new ATOM 0 HB3 ASP A 80 0.869 -16.271 14.826 1.00 55.31 H new ATOM 1244 N GLY A 81 3.388 -14.909 17.283 1.00 45.23 N ATOM 1245 CA GLY A 81 4.820 -15.146 17.350 1.00 15.05 C ATOM 1246 C GLY A 81 5.472 -15.143 15.981 1.00 2.44 C ATOM 1247 O GLY A 81 6.496 -15.791 15.770 1.00 20.52 O ATOM 0 H GLY A 81 3.094 -13.975 17.569 1.00 45.23 H new ATOM 0 HA2 GLY A 81 5.283 -14.380 17.972 1.00 15.05 H new ATOM 0 HA3 GLY A 81 5.004 -16.105 17.835 1.00 15.05 H new ATOM 1251 N ARG A 82 4.879 -14.408 15.051 1.00 64.21 N ATOM 1252 CA ARG A 82 5.404 -14.307 13.701 1.00 70.31 C ATOM 1253 C ARG A 82 5.463 -12.840 13.284 1.00 0.20 C ATOM 1254 O ARG A 82 4.556 -12.075 13.599 1.00 2.01 O ATOM 1255 CB ARG A 82 4.518 -15.097 12.734 1.00 71.41 C ATOM 1256 CG ARG A 82 5.155 -15.329 11.378 1.00 30.12 C ATOM 1257 CD ARG A 82 5.980 -16.604 11.371 1.00 51.22 C ATOM 1258 NE ARG A 82 6.577 -16.878 10.065 1.00 14.32 N ATOM 1259 CZ ARG A 82 7.080 -18.063 9.714 1.00 65.21 C ATOM 1260 NH1 ARG A 82 7.056 -19.077 10.569 1.00 51.34 N ATOM 1261 NH2 ARG A 82 7.611 -18.235 8.509 1.00 53.03 N ATOM 0 H ARG A 82 4.027 -13.870 15.211 1.00 64.21 H new ATOM 0 HA ARG A 82 6.410 -14.726 13.673 1.00 70.31 H new ATOM 0 HB2 ARG A 82 4.275 -16.061 13.182 1.00 71.41 H new ATOM 0 HB3 ARG A 82 3.578 -14.563 12.598 1.00 71.41 H new ATOM 0 HG2 ARG A 82 4.380 -15.390 10.614 1.00 30.12 H new ATOM 0 HG3 ARG A 82 5.789 -14.481 11.121 1.00 30.12 H new ATOM 0 HD2 ARG A 82 6.769 -16.526 12.118 1.00 51.22 H new ATOM 0 HD3 ARG A 82 5.348 -17.443 11.661 1.00 51.22 H new ATOM 0 HE ARG A 82 6.611 -16.120 9.383 1.00 14.32 H new ATOM 0 HH11 ARG A 82 6.652 -18.952 11.497 1.00 51.34 H new ATOM 0 HH12 ARG A 82 7.441 -19.982 10.298 1.00 51.34 H new ATOM 0 HH21 ARG A 82 7.636 -17.459 7.847 1.00 53.03 H new ATOM 0 HH22 ARG A 82 7.994 -19.143 8.245 1.00 53.03 H new ATOM 1275 N VAL A 83 6.523 -12.451 12.584 1.00 13.23 N ATOM 1276 CA VAL A 83 6.682 -11.063 12.154 1.00 0.20 C ATOM 1277 C VAL A 83 5.814 -10.810 10.930 1.00 21.42 C ATOM 1278 O VAL A 83 6.067 -11.363 9.862 1.00 44.44 O ATOM 1279 CB VAL A 83 8.146 -10.712 11.805 1.00 20.43 C ATOM 1280 CG1 VAL A 83 8.255 -9.266 11.336 1.00 20.30 C ATOM 1281 CG2 VAL A 83 9.064 -10.953 12.991 1.00 42.04 C ATOM 0 H VAL A 83 7.282 -13.072 12.303 1.00 13.23 H new ATOM 0 HA VAL A 83 6.378 -10.432 12.989 1.00 0.20 H new ATOM 0 HB VAL A 83 8.462 -11.367 10.993 1.00 20.43 H new ATOM 0 HG11 VAL A 83 9.294 -9.039 11.095 1.00 20.30 H new ATOM 0 HG12 VAL A 83 7.637 -9.124 10.449 1.00 20.30 H new ATOM 0 HG13 VAL A 83 7.912 -8.600 12.128 1.00 20.30 H new ATOM 0 HG21 VAL A 83 10.088 -10.698 12.717 1.00 42.04 H new ATOM 0 HG22 VAL A 83 8.747 -10.332 13.829 1.00 42.04 H new ATOM 0 HG23 VAL A 83 9.017 -12.003 13.280 1.00 42.04 H new ATOM 1291 N VAL A 84 4.791 -9.990 11.088 1.00 72.24 N ATOM 1292 CA VAL A 84 3.848 -9.752 10.012 1.00 61.44 C ATOM 1293 C VAL A 84 4.063 -8.381 9.384 1.00 4.45 C ATOM 1294 O VAL A 84 4.496 -7.429 10.044 1.00 13.42 O ATOM 1295 CB VAL A 84 2.382 -9.900 10.488 1.00 33.01 C ATOM 1296 CG1 VAL A 84 2.246 -11.125 11.373 1.00 40.24 C ATOM 1297 CG2 VAL A 84 1.893 -8.659 11.218 1.00 73.33 C ATOM 0 H VAL A 84 4.593 -9.479 11.948 1.00 72.24 H new ATOM 0 HA VAL A 84 4.033 -10.514 9.254 1.00 61.44 H new ATOM 0 HB VAL A 84 1.756 -10.022 9.604 1.00 33.01 H new ATOM 0 HG11 VAL A 84 1.212 -11.222 11.704 1.00 40.24 H new ATOM 0 HG12 VAL A 84 2.532 -12.014 10.811 1.00 40.24 H new ATOM 0 HG13 VAL A 84 2.896 -11.020 12.241 1.00 40.24 H new ATOM 0 HG21 VAL A 84 0.860 -8.806 11.534 1.00 73.33 H new ATOM 0 HG22 VAL A 84 2.519 -8.481 12.093 1.00 73.33 H new ATOM 0 HG23 VAL A 84 1.949 -7.799 10.551 1.00 73.33 H new ATOM 1307 N GLU A 85 3.781 -8.312 8.099 1.00 23.14 N ATOM 1308 CA GLU A 85 3.938 -7.094 7.332 1.00 32.13 C ATOM 1309 C GLU A 85 2.583 -6.563 6.878 1.00 51.20 C ATOM 1310 O GLU A 85 2.024 -7.029 5.887 1.00 75.42 O ATOM 1311 CB GLU A 85 4.827 -7.361 6.117 1.00 13.45 C ATOM 1312 CG GLU A 85 5.523 -6.121 5.580 1.00 43.24 C ATOM 1313 CD GLU A 85 6.538 -6.440 4.498 1.00 3.04 C ATOM 1314 OE1 GLU A 85 6.294 -7.360 3.695 1.00 3.32 O ATOM 1315 OE2 GLU A 85 7.584 -5.766 4.443 1.00 60.41 O ATOM 0 H GLU A 85 3.435 -9.103 7.555 1.00 23.14 H new ATOM 0 HA GLU A 85 4.407 -6.342 7.966 1.00 32.13 H new ATOM 0 HB2 GLU A 85 5.581 -8.101 6.386 1.00 13.45 H new ATOM 0 HB3 GLU A 85 4.220 -7.798 5.324 1.00 13.45 H new ATOM 0 HG2 GLU A 85 4.776 -5.435 5.181 1.00 43.24 H new ATOM 0 HG3 GLU A 85 6.023 -5.606 6.400 1.00 43.24 H new ATOM 1322 N PRO A 86 2.024 -5.594 7.614 1.00 2.24 N ATOM 1323 CA PRO A 86 0.784 -4.938 7.236 1.00 70.03 C ATOM 1324 C PRO A 86 1.015 -3.913 6.132 1.00 65.53 C ATOM 1325 O PRO A 86 1.909 -3.066 6.221 1.00 65.41 O ATOM 1326 CB PRO A 86 0.301 -4.263 8.525 1.00 11.10 C ATOM 1327 CG PRO A 86 1.333 -4.556 9.570 1.00 22.30 C ATOM 1328 CD PRO A 86 2.556 -5.065 8.867 1.00 20.43 C ATOM 0 HA PRO A 86 0.052 -5.640 6.836 1.00 70.03 H new ATOM 0 HB2 PRO A 86 0.188 -3.188 8.382 1.00 11.10 H new ATOM 0 HB3 PRO A 86 -0.674 -4.649 8.823 1.00 11.10 H new ATOM 0 HG2 PRO A 86 1.566 -3.657 10.141 1.00 22.30 H new ATOM 0 HG3 PRO A 86 0.962 -5.297 10.278 1.00 22.30 H new ATOM 0 HD2 PRO A 86 3.281 -4.270 8.693 1.00 20.43 H new ATOM 0 HD3 PRO A 86 3.062 -5.836 9.447 1.00 20.43 H new ATOM 1336 N LYS A 87 0.220 -4.023 5.084 1.00 15.32 N ATOM 1337 CA LYS A 87 0.342 -3.172 3.913 1.00 61.30 C ATOM 1338 C LYS A 87 -1.032 -2.661 3.532 1.00 61.12 C ATOM 1339 O LYS A 87 -2.019 -3.102 4.095 1.00 51.04 O ATOM 1340 CB LYS A 87 0.958 -3.957 2.743 1.00 41.20 C ATOM 1341 CG LYS A 87 2.165 -4.797 3.143 1.00 12.10 C ATOM 1342 CD LYS A 87 3.125 -5.026 1.990 1.00 75.32 C ATOM 1343 CE LYS A 87 3.795 -6.383 2.115 1.00 14.23 C ATOM 1344 NZ LYS A 87 4.850 -6.588 1.094 1.00 31.30 N ATOM 0 H LYS A 87 -0.533 -4.708 5.020 1.00 15.32 H new ATOM 0 HA LYS A 87 0.996 -2.331 4.142 1.00 61.30 H new ATOM 0 HB2 LYS A 87 0.198 -4.609 2.313 1.00 41.20 H new ATOM 0 HB3 LYS A 87 1.255 -3.257 1.962 1.00 41.20 H new ATOM 0 HG2 LYS A 87 2.693 -4.302 3.958 1.00 12.10 H new ATOM 0 HG3 LYS A 87 1.823 -5.760 3.523 1.00 12.10 H new ATOM 0 HD2 LYS A 87 2.587 -4.966 1.044 1.00 75.32 H new ATOM 0 HD3 LYS A 87 3.881 -4.241 1.977 1.00 75.32 H new ATOM 0 HE2 LYS A 87 4.231 -6.480 3.109 1.00 14.23 H new ATOM 0 HE3 LYS A 87 3.043 -7.167 2.019 1.00 14.23 H new ATOM 0 HZ1 LYS A 87 5.289 -7.521 1.231 1.00 31.30 H new ATOM 0 HZ2 LYS A 87 4.428 -6.540 0.145 1.00 31.30 H new ATOM 0 HZ3 LYS A 87 5.574 -5.847 1.189 1.00 31.30 H new ATOM 1358 N ARG A 88 -1.108 -1.745 2.589 1.00 50.32 N ATOM 1359 CA ARG A 88 -2.399 -1.218 2.168 1.00 43.11 C ATOM 1360 C ARG A 88 -3.101 -2.210 1.241 1.00 32.42 C ATOM 1361 O ARG A 88 -2.461 -2.845 0.398 1.00 11.52 O ATOM 1362 CB ARG A 88 -2.216 0.126 1.462 1.00 73.03 C ATOM 1363 CG ARG A 88 -3.518 0.829 1.088 1.00 64.33 C ATOM 1364 CD ARG A 88 -4.274 1.317 2.314 1.00 74.12 C ATOM 1365 NE ARG A 88 -3.454 2.209 3.136 1.00 71.53 N ATOM 1366 CZ ARG A 88 -3.885 3.320 3.732 1.00 14.34 C ATOM 1367 NH1 ARG A 88 -5.146 3.713 3.619 1.00 0.43 N ATOM 1368 NH2 ARG A 88 -3.035 4.042 4.452 1.00 71.13 N ATOM 0 H ARG A 88 -0.304 -1.351 2.101 1.00 50.32 H new ATOM 0 HA ARG A 88 -3.019 -1.068 3.052 1.00 43.11 H new ATOM 0 HB2 ARG A 88 -1.635 0.785 2.108 1.00 73.03 H new ATOM 0 HB3 ARG A 88 -1.630 -0.031 0.556 1.00 73.03 H new ATOM 0 HG2 ARG A 88 -3.299 1.675 0.436 1.00 64.33 H new ATOM 0 HG3 ARG A 88 -4.150 0.145 0.521 1.00 64.33 H new ATOM 0 HD2 ARG A 88 -5.178 1.839 2.000 1.00 74.12 H new ATOM 0 HD3 ARG A 88 -4.591 0.462 2.910 1.00 74.12 H new ATOM 0 HE ARG A 88 -2.473 1.960 3.263 1.00 71.53 H new ATOM 0 HH11 ARG A 88 -5.805 3.162 3.069 1.00 0.43 H new ATOM 0 HH12 ARG A 88 -5.458 4.566 4.083 1.00 0.43 H new ATOM 0 HH21 ARG A 88 -2.064 3.744 4.544 1.00 71.13 H new ATOM 0 HH22 ARG A 88 -3.353 4.894 4.913 1.00 71.13 H new ATOM 1382 N ALA A 89 -4.401 -2.390 1.446 1.00 62.21 N ATOM 1383 CA ALA A 89 -5.207 -3.178 0.532 1.00 32.43 C ATOM 1384 C ALA A 89 -5.431 -2.426 -0.771 1.00 62.31 C ATOM 1385 O ALA A 89 -6.269 -1.527 -0.852 1.00 53.32 O ATOM 1386 CB ALA A 89 -6.534 -3.553 1.165 1.00 61.31 C ATOM 0 H ALA A 89 -4.915 -2.000 2.236 1.00 62.21 H new ATOM 0 HA ALA A 89 -4.665 -4.097 0.311 1.00 32.43 H new ATOM 0 HB1 ALA A 89 -7.120 -4.143 0.460 1.00 61.31 H new ATOM 0 HB2 ALA A 89 -6.354 -4.138 2.067 1.00 61.31 H new ATOM 0 HB3 ALA A 89 -7.083 -2.647 1.424 1.00 61.31 H new ATOM 1392 N VAL A 90 -4.638 -2.787 -1.765 1.00 53.43 N ATOM 1393 CA VAL A 90 -4.735 -2.214 -3.102 1.00 12.15 C ATOM 1394 C VAL A 90 -6.124 -2.449 -3.702 1.00 62.34 C ATOM 1395 O VAL A 90 -6.794 -3.439 -3.380 1.00 74.54 O ATOM 1396 CB VAL A 90 -3.683 -2.817 -4.069 1.00 70.21 C ATOM 1397 CG1 VAL A 90 -3.275 -1.801 -5.125 1.00 12.34 C ATOM 1398 CG2 VAL A 90 -2.456 -3.334 -3.324 1.00 24.11 C ATOM 0 H VAL A 90 -3.904 -3.489 -1.670 1.00 53.43 H new ATOM 0 HA VAL A 90 -4.550 -1.146 -2.990 1.00 12.15 H new ATOM 0 HB VAL A 90 -4.150 -3.668 -4.564 1.00 70.21 H new ATOM 0 HG11 VAL A 90 -2.537 -2.246 -5.792 1.00 12.34 H new ATOM 0 HG12 VAL A 90 -4.151 -1.503 -5.701 1.00 12.34 H new ATOM 0 HG13 VAL A 90 -2.845 -0.925 -4.640 1.00 12.34 H new ATOM 0 HG21 VAL A 90 -1.744 -3.748 -4.038 1.00 24.11 H new ATOM 0 HG22 VAL A 90 -1.988 -2.514 -2.780 1.00 24.11 H new ATOM 0 HG23 VAL A 90 -2.758 -4.110 -2.621 1.00 24.11 H new ATOM 1408 N SER A 91 -6.533 -1.536 -4.584 1.00 21.51 N ATOM 1409 CA SER A 91 -7.817 -1.616 -5.272 1.00 4.11 C ATOM 1410 C SER A 91 -7.954 -2.960 -5.997 1.00 34.44 C ATOM 1411 O SER A 91 -6.961 -3.516 -6.456 1.00 74.14 O ATOM 1412 CB SER A 91 -7.925 -0.455 -6.264 1.00 2.03 C ATOM 1413 OG SER A 91 -9.276 -0.094 -6.493 1.00 45.14 O ATOM 0 H SER A 91 -5.979 -0.719 -4.840 1.00 21.51 H new ATOM 0 HA SER A 91 -8.625 -1.545 -4.544 1.00 4.11 H new ATOM 0 HB2 SER A 91 -7.377 0.406 -5.880 1.00 2.03 H new ATOM 0 HB3 SER A 91 -7.457 -0.736 -7.207 1.00 2.03 H new ATOM 0 HG SER A 91 -9.747 -0.030 -5.636 1.00 45.14 H new ATOM 1419 N ARG A 92 -9.190 -3.457 -6.094 1.00 35.40 N ATOM 1420 CA ARG A 92 -9.476 -4.835 -6.530 1.00 65.32 C ATOM 1421 C ARG A 92 -8.794 -5.237 -7.840 1.00 43.04 C ATOM 1422 O ARG A 92 -8.256 -6.340 -7.942 1.00 25.12 O ATOM 1423 CB ARG A 92 -10.985 -5.043 -6.659 1.00 24.12 C ATOM 1424 CG ARG A 92 -11.709 -5.126 -5.323 1.00 54.44 C ATOM 1425 CD ARG A 92 -11.326 -6.381 -4.551 1.00 64.22 C ATOM 1426 NE ARG A 92 -12.058 -6.495 -3.291 1.00 71.21 N ATOM 1427 CZ ARG A 92 -11.968 -7.538 -2.464 1.00 73.30 C ATOM 1428 NH1 ARG A 92 -11.172 -8.565 -2.757 1.00 15.21 N ATOM 1429 NH2 ARG A 92 -12.686 -7.557 -1.346 1.00 33.22 N ATOM 0 H ARG A 92 -10.026 -2.917 -5.873 1.00 35.40 H new ATOM 0 HA ARG A 92 -9.059 -5.479 -5.756 1.00 65.32 H new ATOM 0 HB2 ARG A 92 -11.407 -4.223 -7.240 1.00 24.12 H new ATOM 0 HB3 ARG A 92 -11.170 -5.959 -7.220 1.00 24.12 H new ATOM 0 HG2 ARG A 92 -11.473 -4.245 -4.726 1.00 54.44 H new ATOM 0 HG3 ARG A 92 -12.786 -5.117 -5.492 1.00 54.44 H new ATOM 0 HD2 ARG A 92 -11.524 -7.259 -5.166 1.00 64.22 H new ATOM 0 HD3 ARG A 92 -10.255 -6.369 -4.348 1.00 64.22 H new ATOM 0 HE ARG A 92 -12.677 -5.728 -3.027 1.00 71.21 H new ATOM 0 HH11 ARG A 92 -10.626 -8.557 -3.619 1.00 15.21 H new ATOM 0 HH12 ARG A 92 -11.108 -9.359 -2.120 1.00 15.21 H new ATOM 0 HH21 ARG A 92 -13.303 -6.776 -1.123 1.00 33.22 H new ATOM 0 HH22 ARG A 92 -12.620 -8.353 -0.711 1.00 33.22 H new ATOM 1443 N GLU A 93 -8.812 -4.362 -8.836 1.00 60.14 N ATOM 1444 CA GLU A 93 -8.197 -4.677 -10.123 1.00 62.44 C ATOM 1445 C GLU A 93 -6.676 -4.676 -10.017 1.00 12.33 C ATOM 1446 O GLU A 93 -5.994 -5.458 -10.680 1.00 42.00 O ATOM 1447 CB GLU A 93 -8.619 -3.668 -11.187 1.00 74.21 C ATOM 1448 CG GLU A 93 -10.117 -3.591 -11.412 1.00 24.41 C ATOM 1449 CD GLU A 93 -10.493 -2.447 -12.326 1.00 52.13 C ATOM 1450 OE1 GLU A 93 -10.344 -1.281 -11.910 1.00 44.53 O ATOM 1451 OE2 GLU A 93 -10.912 -2.705 -13.472 1.00 0.23 O ATOM 0 H GLU A 93 -9.240 -3.438 -8.782 1.00 60.14 H new ATOM 0 HA GLU A 93 -8.537 -5.672 -10.410 1.00 62.44 H new ATOM 0 HB2 GLU A 93 -8.255 -2.681 -10.901 1.00 74.21 H new ATOM 0 HB3 GLU A 93 -8.134 -3.926 -12.129 1.00 74.21 H new ATOM 0 HG2 GLU A 93 -10.468 -4.529 -11.842 1.00 24.41 H new ATOM 0 HG3 GLU A 93 -10.622 -3.471 -10.454 1.00 24.41 H new ATOM 1458 N ASP A 94 -6.162 -3.800 -9.168 1.00 10.23 N ATOM 1459 CA ASP A 94 -4.732 -3.569 -9.059 1.00 41.42 C ATOM 1460 C ASP A 94 -4.061 -4.576 -8.134 1.00 54.42 C ATOM 1461 O ASP A 94 -2.882 -4.864 -8.295 1.00 51.34 O ATOM 1462 CB ASP A 94 -4.464 -2.147 -8.574 1.00 42.10 C ATOM 1463 CG ASP A 94 -4.936 -1.103 -9.565 1.00 60.41 C ATOM 1464 OD1 ASP A 94 -4.240 -0.881 -10.579 1.00 21.42 O ATOM 1465 OD2 ASP A 94 -6.004 -0.501 -9.343 1.00 3.51 O ATOM 0 H ASP A 94 -6.725 -3.230 -8.536 1.00 10.23 H new ATOM 0 HA ASP A 94 -4.302 -3.699 -10.052 1.00 41.42 H new ATOM 0 HB2 ASP A 94 -4.965 -1.991 -7.619 1.00 42.10 H new ATOM 0 HB3 ASP A 94 -3.396 -2.021 -8.398 1.00 42.10 H new ATOM 1470 N SER A 95 -4.812 -5.119 -7.178 1.00 72.44 N ATOM 1471 CA SER A 95 -4.268 -6.114 -6.252 1.00 20.04 C ATOM 1472 C SER A 95 -4.090 -7.467 -6.938 1.00 5.04 C ATOM 1473 O SER A 95 -3.394 -8.348 -6.430 1.00 24.31 O ATOM 1474 CB SER A 95 -5.167 -6.256 -5.022 1.00 13.40 C ATOM 1475 OG SER A 95 -6.530 -6.058 -5.355 1.00 12.41 O ATOM 0 H SER A 95 -5.794 -4.889 -7.023 1.00 72.44 H new ATOM 0 HA SER A 95 -3.287 -5.766 -5.929 1.00 20.04 H new ATOM 0 HB2 SER A 95 -5.037 -7.247 -4.586 1.00 13.40 H new ATOM 0 HB3 SER A 95 -4.867 -5.533 -4.264 1.00 13.40 H new ATOM 0 HG SER A 95 -6.833 -5.198 -4.995 1.00 12.41 H new ATOM 1481 N GLN A 96 -4.717 -7.616 -8.097 1.00 45.20 N ATOM 1482 CA GLN A 96 -4.588 -8.825 -8.894 1.00 72.33 C ATOM 1483 C GLN A 96 -3.352 -8.746 -9.792 1.00 5.21 C ATOM 1484 O GLN A 96 -2.946 -9.735 -10.402 1.00 14.45 O ATOM 1485 CB GLN A 96 -5.847 -9.024 -9.740 1.00 60.50 C ATOM 1486 CG GLN A 96 -5.946 -10.400 -10.381 1.00 44.32 C ATOM 1487 CD GLN A 96 -6.094 -11.512 -9.360 1.00 15.35 C ATOM 1488 OE1 GLN A 96 -7.204 -11.874 -8.976 1.00 51.25 O ATOM 1489 NE2 GLN A 96 -4.974 -12.065 -8.920 1.00 60.04 N ATOM 0 H GLN A 96 -5.325 -6.907 -8.508 1.00 45.20 H new ATOM 0 HA GLN A 96 -4.471 -9.677 -8.224 1.00 72.33 H new ATOM 0 HB2 GLN A 96 -6.724 -8.862 -9.113 1.00 60.50 H new ATOM 0 HB3 GLN A 96 -5.870 -8.266 -10.523 1.00 60.50 H new ATOM 0 HG2 GLN A 96 -6.799 -10.420 -11.060 1.00 44.32 H new ATOM 0 HG3 GLN A 96 -5.055 -10.581 -10.983 1.00 44.32 H new ATOM 0 HE21 GLN A 96 -4.073 -11.735 -9.265 1.00 60.04 H new ATOM 0 HE22 GLN A 96 -5.013 -12.821 -8.237 1.00 60.04 H new ATOM 1498 N ARG A 97 -2.748 -7.567 -9.860 1.00 72.32 N ATOM 1499 CA ARG A 97 -1.591 -7.350 -10.719 1.00 1.12 C ATOM 1500 C ARG A 97 -0.306 -7.712 -9.980 1.00 3.14 C ATOM 1501 O ARG A 97 -0.227 -7.574 -8.759 1.00 73.11 O ATOM 1502 CB ARG A 97 -1.526 -5.889 -11.185 1.00 52.30 C ATOM 1503 CG ARG A 97 -2.843 -5.347 -11.722 1.00 21.41 C ATOM 1504 CD ARG A 97 -3.336 -6.127 -12.929 1.00 44.20 C ATOM 1505 NE ARG A 97 -4.583 -5.580 -13.461 1.00 50.12 N ATOM 1506 CZ ARG A 97 -5.130 -5.953 -14.621 1.00 24.24 C ATOM 1507 NH1 ARG A 97 -4.541 -6.875 -15.377 1.00 15.12 N ATOM 1508 NH2 ARG A 97 -6.272 -5.405 -15.020 1.00 23.22 N ATOM 0 H ARG A 97 -3.040 -6.746 -9.330 1.00 72.32 H new ATOM 0 HA ARG A 97 -1.694 -7.992 -11.594 1.00 1.12 H new ATOM 0 HB2 ARG A 97 -1.203 -5.267 -10.350 1.00 52.30 H new ATOM 0 HB3 ARG A 97 -0.766 -5.800 -11.961 1.00 52.30 H new ATOM 0 HG2 ARG A 97 -3.597 -5.384 -10.935 1.00 21.41 H new ATOM 0 HG3 ARG A 97 -2.718 -4.299 -11.995 1.00 21.41 H new ATOM 0 HD2 ARG A 97 -2.573 -6.113 -13.707 1.00 44.20 H new ATOM 0 HD3 ARG A 97 -3.487 -7.170 -12.650 1.00 44.20 H new ATOM 0 HE ARG A 97 -5.066 -4.869 -12.912 1.00 50.12 H new ATOM 0 HH11 ARG A 97 -3.666 -7.302 -15.072 1.00 15.12 H new ATOM 0 HH12 ARG A 97 -4.964 -7.155 -16.262 1.00 15.12 H new ATOM 0 HH21 ARG A 97 -6.729 -4.701 -14.441 1.00 23.22 H new ATOM 0 HH22 ARG A 97 -6.692 -5.688 -15.905 1.00 23.22 H new ATOM 1522 N PRO A 98 0.711 -8.198 -10.709 1.00 43.53 N ATOM 1523 CA PRO A 98 2.018 -8.511 -10.126 1.00 52.12 C ATOM 1524 C PRO A 98 2.746 -7.253 -9.654 1.00 52.14 C ATOM 1525 O PRO A 98 2.954 -6.313 -10.427 1.00 72.42 O ATOM 1526 CB PRO A 98 2.780 -9.179 -11.275 1.00 72.24 C ATOM 1527 CG PRO A 98 2.098 -8.730 -12.520 1.00 55.34 C ATOM 1528 CD PRO A 98 0.661 -8.491 -12.153 1.00 64.12 C ATOM 0 HA PRO A 98 1.932 -9.144 -9.243 1.00 52.12 H new ATOM 0 HB2 PRO A 98 3.829 -8.883 -11.274 1.00 72.24 H new ATOM 0 HB3 PRO A 98 2.755 -10.265 -11.184 1.00 72.24 H new ATOM 0 HG2 PRO A 98 2.556 -7.820 -12.908 1.00 55.34 H new ATOM 0 HG3 PRO A 98 2.179 -9.486 -13.301 1.00 55.34 H new ATOM 0 HD2 PRO A 98 0.237 -7.659 -12.716 1.00 64.12 H new ATOM 0 HD3 PRO A 98 0.044 -9.365 -12.363 1.00 64.12 H new ATOM 1536 N GLY A 99 3.114 -7.236 -8.382 1.00 72.21 N ATOM 1537 CA GLY A 99 3.786 -6.083 -7.814 1.00 11.02 C ATOM 1538 C GLY A 99 2.853 -5.223 -6.990 1.00 21.53 C ATOM 1539 O GLY A 99 3.193 -4.099 -6.617 1.00 14.12 O ATOM 0 H GLY A 99 2.959 -8.004 -7.729 1.00 72.21 H new ATOM 0 HA2 GLY A 99 4.614 -6.419 -7.189 1.00 11.02 H new ATOM 0 HA3 GLY A 99 4.215 -5.483 -8.617 1.00 11.02 H new ATOM 1543 N ALA A 100 1.676 -5.758 -6.697 1.00 4.23 N ATOM 1544 CA ALA A 100 0.674 -5.033 -5.935 1.00 54.12 C ATOM 1545 C ALA A 100 0.944 -5.117 -4.446 1.00 33.25 C ATOM 1546 O ALA A 100 1.008 -4.101 -3.761 1.00 73.33 O ATOM 1547 CB ALA A 100 -0.706 -5.572 -6.237 1.00 3.34 C ATOM 0 H ALA A 100 1.392 -6.697 -6.978 1.00 4.23 H new ATOM 0 HA ALA A 100 0.726 -3.985 -6.232 1.00 54.12 H new ATOM 0 HB1 ALA A 100 -1.447 -5.020 -5.659 1.00 3.34 H new ATOM 0 HB2 ALA A 100 -0.916 -5.458 -7.300 1.00 3.34 H new ATOM 0 HB3 ALA A 100 -0.751 -6.628 -5.969 1.00 3.34 H new ATOM 1553 N HIS A 101 1.109 -6.328 -3.946 1.00 23.42 N ATOM 1554 CA HIS A 101 1.313 -6.526 -2.523 1.00 72.24 C ATOM 1555 C HIS A 101 2.790 -6.668 -2.190 1.00 22.30 C ATOM 1556 O HIS A 101 3.155 -7.068 -1.085 1.00 1.44 O ATOM 1557 CB HIS A 101 0.507 -7.727 -2.031 1.00 51.43 C ATOM 1558 CG HIS A 101 -0.954 -7.418 -1.883 1.00 72.21 C ATOM 1559 ND1 HIS A 101 -1.923 -8.229 -2.419 1.00 21.55 N ATOM 1560 CD2 HIS A 101 -1.550 -6.371 -1.260 1.00 31.05 C ATOM 1561 CE1 HIS A 101 -3.079 -7.667 -2.111 1.00 51.44 C ATOM 1562 NE2 HIS A 101 -2.902 -6.541 -1.409 1.00 21.22 N ATOM 0 H HIS A 101 1.106 -7.184 -4.500 1.00 23.42 H new ATOM 0 HA HIS A 101 0.952 -5.641 -1.999 1.00 72.24 H new ATOM 0 HB2 HIS A 101 0.631 -8.554 -2.730 1.00 51.43 H new ATOM 0 HB3 HIS A 101 0.904 -8.058 -1.071 1.00 51.43 H new ATOM 0 HD2 HIS A 101 -1.055 -5.560 -0.746 1.00 31.05 H new ATOM 0 HE1 HIS A 101 -4.043 -8.065 -2.390 1.00 51.44 H new ATOM 0 HE2 HIS A 101 -3.634 -5.926 -1.053 1.00 21.22 H new ATOM 1570 N LEU A 102 3.638 -6.314 -3.147 1.00 40.24 N ATOM 1571 CA LEU A 102 5.066 -6.198 -2.895 1.00 50.52 C ATOM 1572 C LEU A 102 5.332 -4.898 -2.149 1.00 52.42 C ATOM 1573 O LEU A 102 4.537 -3.961 -2.230 1.00 21.00 O ATOM 1574 CB LEU A 102 5.870 -6.207 -4.204 1.00 41.23 C ATOM 1575 CG LEU A 102 5.874 -7.525 -4.985 1.00 33.34 C ATOM 1576 CD1 LEU A 102 6.742 -7.400 -6.229 1.00 43.30 C ATOM 1577 CD2 LEU A 102 6.376 -8.665 -4.115 1.00 53.52 C ATOM 0 H LEU A 102 3.360 -6.102 -4.105 1.00 40.24 H new ATOM 0 HA LEU A 102 5.382 -7.054 -2.299 1.00 50.52 H new ATOM 0 HB2 LEU A 102 5.477 -5.425 -4.853 1.00 41.23 H new ATOM 0 HB3 LEU A 102 6.902 -5.941 -3.974 1.00 41.23 H new ATOM 0 HG LEU A 102 4.850 -7.744 -5.287 1.00 33.34 H new ATOM 0 HD11 LEU A 102 6.735 -8.344 -6.774 1.00 43.30 H new ATOM 0 HD12 LEU A 102 6.350 -6.609 -6.868 1.00 43.30 H new ATOM 0 HD13 LEU A 102 7.764 -7.157 -5.937 1.00 43.30 H new ATOM 0 HD21 LEU A 102 6.370 -9.591 -4.690 1.00 53.52 H new ATOM 0 HD22 LEU A 102 7.392 -8.450 -3.784 1.00 53.52 H new ATOM 0 HD23 LEU A 102 5.726 -8.773 -3.246 1.00 53.52 H new ATOM 1589 N THR A 103 6.429 -4.843 -1.416 1.00 11.32 N ATOM 1590 CA THR A 103 6.802 -3.633 -0.704 1.00 61.21 C ATOM 1591 C THR A 103 7.397 -2.616 -1.676 1.00 53.03 C ATOM 1592 O THR A 103 8.600 -2.610 -1.942 1.00 64.44 O ATOM 1593 CB THR A 103 7.802 -3.948 0.418 1.00 11.14 C ATOM 1594 OG1 THR A 103 7.356 -5.108 1.138 1.00 20.02 O ATOM 1595 CG2 THR A 103 7.933 -2.779 1.380 1.00 30.14 C ATOM 0 H THR A 103 7.077 -5.621 -1.298 1.00 11.32 H new ATOM 0 HA THR A 103 5.906 -3.208 -0.252 1.00 61.21 H new ATOM 0 HB THR A 103 8.777 -4.134 -0.032 1.00 11.14 H new ATOM 0 HG1 THR A 103 7.993 -5.313 1.854 1.00 20.02 H new ATOM 0 HG21 THR A 103 8.648 -3.031 2.164 1.00 30.14 H new ATOM 0 HG22 THR A 103 8.283 -1.900 0.839 1.00 30.14 H new ATOM 0 HG23 THR A 103 6.963 -2.566 1.829 1.00 30.14 H new ATOM 1603 N VAL A 104 6.530 -1.781 -2.226 1.00 14.34 N ATOM 1604 CA VAL A 104 6.912 -0.828 -3.256 1.00 34.42 C ATOM 1605 C VAL A 104 6.743 0.597 -2.756 1.00 1.24 C ATOM 1606 O VAL A 104 5.619 1.029 -2.508 1.00 62.24 O ATOM 1607 CB VAL A 104 6.032 -1.003 -4.511 1.00 33.02 C ATOM 1608 CG1 VAL A 104 6.437 -0.023 -5.596 1.00 42.41 C ATOM 1609 CG2 VAL A 104 6.088 -2.428 -5.023 1.00 24.02 C ATOM 0 H VAL A 104 5.543 -1.745 -1.972 1.00 14.34 H new ATOM 0 HA VAL A 104 7.957 -1.015 -3.504 1.00 34.42 H new ATOM 0 HB VAL A 104 5.001 -0.790 -4.229 1.00 33.02 H new ATOM 0 HG11 VAL A 104 5.802 -0.166 -6.471 1.00 42.41 H new ATOM 0 HG12 VAL A 104 6.322 0.996 -5.227 1.00 42.41 H new ATOM 0 HG13 VAL A 104 7.478 -0.194 -5.871 1.00 42.41 H new ATOM 0 HG21 VAL A 104 5.458 -2.522 -5.908 1.00 24.02 H new ATOM 0 HG22 VAL A 104 7.116 -2.682 -5.281 1.00 24.02 H new ATOM 0 HG23 VAL A 104 5.730 -3.107 -4.249 1.00 24.02 H new ATOM 1619 N LYS A 105 7.838 1.330 -2.586 1.00 63.25 N ATOM 1620 CA LYS A 105 7.753 2.732 -2.199 1.00 74.24 C ATOM 1621 C LYS A 105 8.050 3.639 -3.388 1.00 4.44 C ATOM 1622 O LYS A 105 8.344 4.817 -3.225 1.00 51.23 O ATOM 1623 CB LYS A 105 8.744 3.027 -1.073 1.00 11.31 C ATOM 1624 CG LYS A 105 8.775 1.959 0.003 1.00 22.04 C ATOM 1625 CD LYS A 105 9.702 2.337 1.140 1.00 13.33 C ATOM 1626 CE LYS A 105 9.760 1.242 2.188 1.00 73.43 C ATOM 1627 NZ LYS A 105 10.533 1.661 3.385 1.00 42.50 N ATOM 0 H LYS A 105 8.788 0.979 -2.709 1.00 63.25 H new ATOM 0 HA LYS A 105 6.739 2.928 -1.851 1.00 74.24 H new ATOM 0 HB2 LYS A 105 9.742 3.133 -1.497 1.00 11.31 H new ATOM 0 HB3 LYS A 105 8.489 3.983 -0.617 1.00 11.31 H new ATOM 0 HG2 LYS A 105 7.768 1.803 0.391 1.00 22.04 H new ATOM 0 HG3 LYS A 105 9.099 1.013 -0.432 1.00 22.04 H new ATOM 0 HD2 LYS A 105 10.703 2.524 0.750 1.00 13.33 H new ATOM 0 HD3 LYS A 105 9.360 3.265 1.598 1.00 13.33 H new ATOM 0 HE2 LYS A 105 8.747 0.971 2.486 1.00 73.43 H new ATOM 0 HE3 LYS A 105 10.214 0.350 1.756 1.00 73.43 H new ATOM 0 HZ1 LYS A 105 10.229 1.102 4.208 1.00 42.50 H new ATOM 0 HZ2 LYS A 105 11.547 1.505 3.215 1.00 42.50 H new ATOM 0 HZ3 LYS A 105 10.365 2.670 3.571 1.00 42.50 H new ATOM 1641 N LYS A 106 7.977 3.083 -4.584 1.00 44.42 N ATOM 1642 CA LYS A 106 8.213 3.850 -5.796 1.00 61.44 C ATOM 1643 C LYS A 106 6.980 3.849 -6.691 1.00 71.45 C ATOM 1644 O LYS A 106 6.319 2.823 -6.839 1.00 43.43 O ATOM 1645 CB LYS A 106 9.416 3.272 -6.546 1.00 12.01 C ATOM 1646 CG LYS A 106 10.699 4.042 -6.298 1.00 25.02 C ATOM 1647 CD LYS A 106 10.738 5.307 -7.135 1.00 53.02 C ATOM 1648 CE LYS A 106 11.374 5.058 -8.490 1.00 75.12 C ATOM 1649 NZ LYS A 106 12.824 5.386 -8.477 1.00 33.10 N ATOM 0 H LYS A 106 7.756 2.100 -4.743 1.00 44.42 H new ATOM 0 HA LYS A 106 8.425 4.883 -5.518 1.00 61.44 H new ATOM 0 HB2 LYS A 106 9.559 2.234 -6.246 1.00 12.01 H new ATOM 0 HB3 LYS A 106 9.202 3.268 -7.615 1.00 12.01 H new ATOM 0 HG2 LYS A 106 10.777 4.297 -5.241 1.00 25.02 H new ATOM 0 HG3 LYS A 106 11.557 3.415 -6.539 1.00 25.02 H new ATOM 0 HD2 LYS A 106 9.725 5.686 -7.271 1.00 53.02 H new ATOM 0 HD3 LYS A 106 11.298 6.078 -6.605 1.00 53.02 H new ATOM 0 HE2 LYS A 106 11.238 4.014 -8.771 1.00 75.12 H new ATOM 0 HE3 LYS A 106 10.870 5.660 -9.246 1.00 75.12 H new ATOM 0 HZ1 LYS A 106 13.204 5.319 -9.443 1.00 33.10 H new ATOM 0 HZ2 LYS A 106 12.958 6.353 -8.118 1.00 33.10 H new ATOM 0 HZ3 LYS A 106 13.326 4.715 -7.861 1.00 33.10 H new ATOM 1663 N ILE A 107 6.664 4.994 -7.288 1.00 21.05 N ATOM 1664 CA ILE A 107 5.539 5.076 -8.214 1.00 65.11 C ATOM 1665 C ILE A 107 5.944 5.703 -9.537 1.00 71.52 C ATOM 1666 O ILE A 107 6.881 6.504 -9.608 1.00 4.41 O ATOM 1667 CB ILE A 107 4.345 5.866 -7.641 1.00 41.33 C ATOM 1668 CG1 ILE A 107 4.830 7.072 -6.842 1.00 4.42 C ATOM 1669 CG2 ILE A 107 3.474 4.964 -6.792 1.00 3.22 C ATOM 1670 CD1 ILE A 107 3.712 7.932 -6.305 1.00 40.00 C ATOM 0 H ILE A 107 7.166 5.871 -7.149 1.00 21.05 H new ATOM 0 HA ILE A 107 5.226 4.044 -8.374 1.00 65.11 H new ATOM 0 HB ILE A 107 3.743 6.236 -8.471 1.00 41.33 H new ATOM 0 HG12 ILE A 107 5.441 6.723 -6.009 1.00 4.42 H new ATOM 0 HG13 ILE A 107 5.474 7.682 -7.476 1.00 4.42 H new ATOM 0 HG21 ILE A 107 2.636 5.536 -6.395 1.00 3.22 H new ATOM 0 HG22 ILE A 107 3.096 4.143 -7.402 1.00 3.22 H new ATOM 0 HG23 ILE A 107 4.062 4.562 -5.967 1.00 3.22 H new ATOM 0 HD11 ILE A 107 4.132 8.769 -5.748 1.00 40.00 H new ATOM 0 HD12 ILE A 107 3.114 8.311 -7.134 1.00 40.00 H new ATOM 0 HD13 ILE A 107 3.081 7.338 -5.644 1.00 40.00 H new ATOM 1682 N PHE A 108 5.230 5.307 -10.575 1.00 65.23 N ATOM 1683 CA PHE A 108 5.459 5.783 -11.923 1.00 4.33 C ATOM 1684 C PHE A 108 4.442 6.860 -12.265 1.00 41.14 C ATOM 1685 O PHE A 108 3.254 6.701 -12.001 1.00 74.15 O ATOM 1686 CB PHE A 108 5.357 4.592 -12.893 1.00 53.30 C ATOM 1687 CG PHE A 108 4.964 4.943 -14.303 1.00 22.41 C ATOM 1688 CD1 PHE A 108 5.914 5.334 -15.230 1.00 30.53 C ATOM 1689 CD2 PHE A 108 3.636 4.868 -14.700 1.00 75.13 C ATOM 1690 CE1 PHE A 108 5.546 5.647 -16.524 1.00 72.14 C ATOM 1691 CE2 PHE A 108 3.263 5.176 -15.987 1.00 5.41 C ATOM 1692 CZ PHE A 108 4.220 5.568 -16.903 1.00 63.22 C ATOM 0 H PHE A 108 4.465 4.637 -10.502 1.00 65.23 H new ATOM 0 HA PHE A 108 6.453 6.222 -12.008 1.00 4.33 H new ATOM 0 HB2 PHE A 108 6.320 4.081 -12.918 1.00 53.30 H new ATOM 0 HB3 PHE A 108 4.630 3.883 -12.497 1.00 53.30 H new ATOM 0 HD1 PHE A 108 6.952 5.395 -14.939 1.00 30.53 H new ATOM 0 HD2 PHE A 108 2.884 4.563 -13.987 1.00 75.13 H new ATOM 0 HE1 PHE A 108 6.295 5.953 -17.239 1.00 72.14 H new ATOM 0 HE2 PHE A 108 2.226 5.112 -16.281 1.00 5.41 H new ATOM 0 HZ PHE A 108 3.932 5.813 -17.915 1.00 63.22 H new ATOM 1702 N VAL A 109 4.922 7.955 -12.827 1.00 21.43 N ATOM 1703 CA VAL A 109 4.056 9.029 -13.288 1.00 60.33 C ATOM 1704 C VAL A 109 4.248 9.208 -14.786 1.00 74.12 C ATOM 1705 O VAL A 109 5.300 9.654 -15.225 1.00 63.13 O ATOM 1706 CB VAL A 109 4.373 10.365 -12.576 1.00 34.34 C ATOM 1707 CG1 VAL A 109 3.288 11.398 -12.847 1.00 34.43 C ATOM 1708 CG2 VAL A 109 4.553 10.154 -11.083 1.00 11.40 C ATOM 0 H VAL A 109 5.916 8.126 -12.977 1.00 21.43 H new ATOM 0 HA VAL A 109 3.026 8.759 -13.057 1.00 60.33 H new ATOM 0 HB VAL A 109 5.311 10.745 -12.981 1.00 34.34 H new ATOM 0 HG11 VAL A 109 3.535 12.328 -12.335 1.00 34.43 H new ATOM 0 HG12 VAL A 109 3.220 11.581 -13.919 1.00 34.43 H new ATOM 0 HG13 VAL A 109 2.331 11.025 -12.481 1.00 34.43 H new ATOM 0 HG21 VAL A 109 4.775 11.108 -10.605 1.00 11.40 H new ATOM 0 HG22 VAL A 109 3.637 9.741 -10.661 1.00 11.40 H new ATOM 0 HG23 VAL A 109 5.377 9.461 -10.910 1.00 11.40 H new ATOM 1718 N GLY A 110 3.249 8.861 -15.570 1.00 41.33 N ATOM 1719 CA GLY A 110 3.412 8.907 -17.004 1.00 3.51 C ATOM 1720 C GLY A 110 2.329 9.698 -17.690 1.00 20.40 C ATOM 1721 O GLY A 110 1.222 9.836 -17.169 1.00 41.33 O ATOM 0 H GLY A 110 2.333 8.550 -15.245 1.00 41.33 H new ATOM 0 HA2 GLY A 110 4.381 9.346 -17.241 1.00 3.51 H new ATOM 0 HA3 GLY A 110 3.417 7.890 -17.397 1.00 3.51 H new ATOM 1725 N GLY A 111 2.656 10.231 -18.857 1.00 72.55 N ATOM 1726 CA GLY A 111 1.686 10.979 -19.622 1.00 13.42 C ATOM 1727 C GLY A 111 1.796 12.466 -19.383 1.00 32.33 C ATOM 1728 O GLY A 111 0.944 13.229 -19.829 1.00 43.54 O ATOM 0 H GLY A 111 3.578 10.158 -19.287 1.00 72.55 H new ATOM 0 HA2 GLY A 111 1.825 10.772 -20.683 1.00 13.42 H new ATOM 0 HA3 GLY A 111 0.682 10.644 -19.360 1.00 13.42 H new ATOM 1732 N ILE A 112 2.841 12.879 -18.671 1.00 11.33 N ATOM 1733 CA ILE A 112 3.078 14.295 -18.415 1.00 4.43 C ATOM 1734 C ILE A 112 3.551 14.997 -19.687 1.00 63.22 C ATOM 1735 O ILE A 112 4.735 15.008 -20.006 1.00 61.51 O ATOM 1736 CB ILE A 112 4.096 14.527 -17.268 1.00 51.03 C ATOM 1737 CG1 ILE A 112 5.299 13.590 -17.384 1.00 3.53 C ATOM 1738 CG2 ILE A 112 3.427 14.335 -15.919 1.00 41.23 C ATOM 1739 CD1 ILE A 112 6.435 13.945 -16.451 1.00 50.01 C ATOM 0 H ILE A 112 3.536 12.254 -18.262 1.00 11.33 H new ATOM 0 HA ILE A 112 2.127 14.723 -18.097 1.00 4.43 H new ATOM 0 HB ILE A 112 4.454 15.553 -17.353 1.00 51.03 H new ATOM 0 HG12 ILE A 112 4.976 12.570 -17.177 1.00 3.53 H new ATOM 0 HG13 ILE A 112 5.664 13.607 -18.411 1.00 3.53 H new ATOM 0 HG21 ILE A 112 4.155 14.501 -15.125 1.00 41.23 H new ATOM 0 HG22 ILE A 112 2.607 15.046 -15.815 1.00 41.23 H new ATOM 0 HG23 ILE A 112 3.038 13.319 -15.847 1.00 41.23 H new ATOM 0 HD11 ILE A 112 7.253 13.238 -16.588 1.00 50.01 H new ATOM 0 HD12 ILE A 112 6.786 14.953 -16.672 1.00 50.01 H new ATOM 0 HD13 ILE A 112 6.086 13.900 -15.419 1.00 50.01 H new ATOM 1751 N LYS A 113 2.605 15.562 -20.419 1.00 4.13 N ATOM 1752 CA LYS A 113 2.896 16.210 -21.689 1.00 63.12 C ATOM 1753 C LYS A 113 3.441 17.615 -21.467 1.00 73.54 C ATOM 1754 O LYS A 113 4.169 18.154 -22.300 1.00 3.23 O ATOM 1755 CB LYS A 113 1.629 16.261 -22.541 1.00 63.02 C ATOM 1756 CG LYS A 113 1.056 14.886 -22.859 1.00 0.32 C ATOM 1757 CD LYS A 113 -0.369 14.973 -23.386 1.00 14.33 C ATOM 1758 CE LYS A 113 -0.441 15.725 -24.703 1.00 73.14 C ATOM 1759 NZ LYS A 113 -1.846 15.946 -25.137 1.00 1.22 N ATOM 0 H LYS A 113 1.621 15.585 -20.153 1.00 4.13 H new ATOM 0 HA LYS A 113 3.658 15.631 -22.212 1.00 63.12 H new ATOM 0 HB2 LYS A 113 0.874 16.849 -22.020 1.00 63.02 H new ATOM 0 HB3 LYS A 113 1.849 16.779 -23.474 1.00 63.02 H new ATOM 0 HG2 LYS A 113 1.687 14.392 -23.598 1.00 0.32 H new ATOM 0 HG3 LYS A 113 1.074 14.269 -21.961 1.00 0.32 H new ATOM 0 HD2 LYS A 113 -0.769 13.968 -23.520 1.00 14.33 H new ATOM 0 HD3 LYS A 113 -0.999 15.471 -22.649 1.00 14.33 H new ATOM 0 HE2 LYS A 113 0.063 16.686 -24.601 1.00 73.14 H new ATOM 0 HE3 LYS A 113 0.093 15.165 -25.471 1.00 73.14 H new ATOM 0 HZ1 LYS A 113 -1.853 16.462 -26.040 1.00 1.22 H new ATOM 0 HZ2 LYS A 113 -2.320 15.028 -25.259 1.00 1.22 H new ATOM 0 HZ3 LYS A 113 -2.349 16.502 -24.416 1.00 1.22 H new ATOM 1773 N GLU A 114 3.087 18.195 -20.329 1.00 43.30 N ATOM 1774 CA GLU A 114 3.536 19.528 -19.972 1.00 53.44 C ATOM 1775 C GLU A 114 4.861 19.463 -19.225 1.00 51.14 C ATOM 1776 O GLU A 114 5.231 18.406 -18.708 1.00 23.44 O ATOM 1777 CB GLU A 114 2.480 20.222 -19.116 1.00 42.41 C ATOM 1778 CG GLU A 114 1.206 20.545 -19.878 1.00 61.21 C ATOM 1779 CD GLU A 114 1.469 21.368 -21.122 1.00 14.31 C ATOM 1780 OE1 GLU A 114 1.721 22.582 -20.995 1.00 14.53 O ATOM 1781 OE2 GLU A 114 1.443 20.802 -22.233 1.00 33.33 O ATOM 0 H GLU A 114 2.484 17.756 -19.633 1.00 43.30 H new ATOM 0 HA GLU A 114 3.685 20.103 -20.886 1.00 53.44 H new ATOM 0 HB2 GLU A 114 2.235 19.585 -18.266 1.00 42.41 H new ATOM 0 HB3 GLU A 114 2.898 21.145 -18.713 1.00 42.41 H new ATOM 0 HG2 GLU A 114 0.709 19.617 -20.159 1.00 61.21 H new ATOM 0 HG3 GLU A 114 0.523 21.088 -19.225 1.00 61.21 H new ATOM 1788 N ASP A 115 5.569 20.588 -19.182 1.00 11.14 N ATOM 1789 CA ASP A 115 6.846 20.675 -18.479 1.00 33.41 C ATOM 1790 C ASP A 115 6.630 20.490 -16.981 1.00 4.53 C ATOM 1791 O ASP A 115 6.134 21.387 -16.295 1.00 52.30 O ATOM 1792 CB ASP A 115 7.513 22.024 -18.763 1.00 2.43 C ATOM 1793 CG ASP A 115 8.899 22.134 -18.163 1.00 11.35 C ATOM 1794 OD1 ASP A 115 9.853 21.617 -18.772 1.00 12.14 O ATOM 1795 OD2 ASP A 115 9.042 22.759 -17.089 1.00 72.20 O ATOM 0 H ASP A 115 5.278 21.458 -19.629 1.00 11.14 H new ATOM 0 HA ASP A 115 7.503 19.882 -18.836 1.00 33.41 H new ATOM 0 HB2 ASP A 115 7.576 22.172 -19.841 1.00 2.43 H new ATOM 0 HB3 ASP A 115 6.887 22.824 -18.367 1.00 2.43 H new ATOM 1800 N THR A 116 6.978 19.312 -16.489 1.00 25.14 N ATOM 1801 CA THR A 116 6.701 18.953 -15.113 1.00 50.13 C ATOM 1802 C THR A 116 7.984 18.904 -14.299 1.00 34.33 C ATOM 1803 O THR A 116 8.965 18.273 -14.688 1.00 63.30 O ATOM 1804 CB THR A 116 5.966 17.600 -15.033 1.00 71.33 C ATOM 1805 OG1 THR A 116 4.879 17.591 -15.973 1.00 30.50 O ATOM 1806 CG2 THR A 116 5.427 17.347 -13.629 1.00 61.42 C ATOM 0 H THR A 116 7.454 18.588 -17.027 1.00 25.14 H new ATOM 0 HA THR A 116 6.053 19.722 -14.692 1.00 50.13 H new ATOM 0 HB THR A 116 6.676 16.809 -15.274 1.00 71.33 H new ATOM 0 HG1 THR A 116 5.226 17.747 -16.876 1.00 30.50 H new ATOM 0 HG21 THR A 116 4.914 16.386 -13.604 1.00 61.42 H new ATOM 0 HG22 THR A 116 6.254 17.336 -12.918 1.00 61.42 H new ATOM 0 HG23 THR A 116 4.728 18.139 -13.360 1.00 61.42 H new ATOM 1814 N GLU A 117 7.948 19.570 -13.161 1.00 71.13 N ATOM 1815 CA GLU A 117 9.114 19.683 -12.308 1.00 11.50 C ATOM 1816 C GLU A 117 8.912 18.932 -11.001 1.00 23.14 C ATOM 1817 O GLU A 117 7.826 18.395 -10.727 1.00 40.14 O ATOM 1818 CB GLU A 117 9.464 21.151 -12.046 1.00 3.40 C ATOM 1819 CG GLU A 117 8.402 21.912 -11.284 1.00 5.15 C ATOM 1820 CD GLU A 117 8.813 23.339 -10.995 1.00 11.31 C ATOM 1821 OE1 GLU A 117 8.575 24.212 -11.849 1.00 51.40 O ATOM 1822 OE2 GLU A 117 9.388 23.591 -9.918 1.00 64.04 O ATOM 0 H GLU A 117 7.118 20.044 -12.805 1.00 71.13 H new ATOM 0 HA GLU A 117 9.954 19.225 -12.831 1.00 11.50 H new ATOM 0 HB2 GLU A 117 10.399 21.196 -11.488 1.00 3.40 H new ATOM 0 HB3 GLU A 117 9.638 21.648 -13.000 1.00 3.40 H new ATOM 0 HG2 GLU A 117 7.476 21.912 -11.859 1.00 5.15 H new ATOM 0 HG3 GLU A 117 8.194 21.399 -10.345 1.00 5.15 H new ATOM 1829 N GLU A 118 9.972 18.904 -10.206 1.00 61.32 N ATOM 1830 CA GLU A 118 9.976 18.205 -8.933 1.00 61.13 C ATOM 1831 C GLU A 118 8.897 18.759 -8.006 1.00 65.40 C ATOM 1832 O GLU A 118 8.099 18.001 -7.473 1.00 63.45 O ATOM 1833 CB GLU A 118 11.367 18.314 -8.299 1.00 32.54 C ATOM 1834 CG GLU A 118 11.492 17.662 -6.933 1.00 32.10 C ATOM 1835 CD GLU A 118 11.722 18.672 -5.830 1.00 31.34 C ATOM 1836 OE1 GLU A 118 12.733 19.399 -5.888 1.00 65.32 O ATOM 1837 OE2 GLU A 118 10.888 18.755 -4.910 1.00 45.22 O ATOM 0 H GLU A 118 10.854 19.367 -10.428 1.00 61.32 H new ATOM 0 HA GLU A 118 9.748 17.152 -9.099 1.00 61.13 H new ATOM 0 HB2 GLU A 118 12.095 17.860 -8.972 1.00 32.54 H new ATOM 0 HB3 GLU A 118 11.629 19.368 -8.209 1.00 32.54 H new ATOM 0 HG2 GLU A 118 10.586 17.095 -6.720 1.00 32.10 H new ATOM 0 HG3 GLU A 118 12.317 16.950 -6.948 1.00 32.10 H new ATOM 1844 N HIS A 119 8.849 20.085 -7.871 1.00 74.32 N ATOM 1845 CA HIS A 119 7.884 20.755 -6.993 1.00 71.30 C ATOM 1846 C HIS A 119 6.443 20.374 -7.343 1.00 24.13 C ATOM 1847 O HIS A 119 5.616 20.207 -6.449 1.00 55.10 O ATOM 1848 CB HIS A 119 8.059 22.279 -7.078 1.00 62.43 C ATOM 1849 CG HIS A 119 7.128 23.062 -6.192 1.00 70.13 C ATOM 1850 ND1 HIS A 119 6.038 23.724 -6.705 1.00 51.32 N ATOM 1851 CD2 HIS A 119 7.164 23.252 -4.850 1.00 0.22 C ATOM 1852 CE1 HIS A 119 5.443 24.300 -5.674 1.00 33.35 C ATOM 1853 NE2 HIS A 119 6.089 24.040 -4.531 1.00 25.35 N ATOM 0 H HIS A 119 9.474 20.723 -8.364 1.00 74.32 H new ATOM 0 HA HIS A 119 8.080 20.424 -5.973 1.00 71.30 H new ATOM 0 HB2 HIS A 119 9.087 22.530 -6.816 1.00 62.43 H new ATOM 0 HB3 HIS A 119 7.908 22.593 -8.111 1.00 62.43 H new ATOM 0 HD2 HIS A 119 7.899 22.858 -4.164 1.00 0.22 H new ATOM 0 HE1 HIS A 119 4.550 24.903 -5.745 1.00 33.35 H new ATOM 0 HE2 HIS A 119 5.830 24.366 -3.600 1.00 25.35 H new ATOM 1861 N HIS A 120 6.165 20.220 -8.640 1.00 41.34 N ATOM 1862 CA HIS A 120 4.824 19.871 -9.114 1.00 10.20 C ATOM 1863 C HIS A 120 4.338 18.578 -8.477 1.00 33.32 C ATOM 1864 O HIS A 120 3.351 18.568 -7.728 1.00 50.04 O ATOM 1865 CB HIS A 120 4.809 19.718 -10.640 1.00 12.41 C ATOM 1866 CG HIS A 120 4.966 21.005 -11.395 1.00 65.31 C ATOM 1867 ND1 HIS A 120 5.259 21.011 -12.737 1.00 72.31 N ATOM 1868 CD2 HIS A 120 4.864 22.286 -10.962 1.00 72.30 C ATOM 1869 CE1 HIS A 120 5.322 22.283 -13.089 1.00 43.11 C ATOM 1870 NE2 HIS A 120 5.090 23.094 -12.046 1.00 31.53 N ATOM 0 H HIS A 120 6.854 20.332 -9.383 1.00 41.34 H new ATOM 0 HA HIS A 120 4.155 20.682 -8.826 1.00 10.20 H new ATOM 0 HB2 HIS A 120 5.610 19.040 -10.933 1.00 12.41 H new ATOM 0 HB3 HIS A 120 3.871 19.249 -10.936 1.00 12.41 H new ATOM 0 HD2 HIS A 120 4.646 22.608 -9.955 1.00 72.30 H new ATOM 0 HE1 HIS A 120 5.534 22.627 -14.091 1.00 43.11 H new ATOM 0 HE2 HIS A 120 5.083 24.114 -12.057 1.00 31.53 H new ATOM 1878 N LEU A 121 5.064 17.496 -8.715 1.00 73.43 N ATOM 1879 CA LEU A 121 4.595 16.198 -8.269 1.00 15.13 C ATOM 1880 C LEU A 121 4.958 15.941 -6.810 1.00 73.01 C ATOM 1881 O LEU A 121 4.257 15.213 -6.125 1.00 12.13 O ATOM 1882 CB LEU A 121 5.099 15.075 -9.185 1.00 20.31 C ATOM 1883 CG LEU A 121 6.612 14.952 -9.366 1.00 75.14 C ATOM 1884 CD1 LEU A 121 7.223 14.078 -8.280 1.00 61.23 C ATOM 1885 CD2 LEU A 121 6.912 14.375 -10.734 1.00 63.11 C ATOM 0 H LEU A 121 5.960 17.491 -9.203 1.00 73.43 H new ATOM 0 HA LEU A 121 3.507 16.205 -8.333 1.00 15.13 H new ATOM 0 HB2 LEU A 121 4.727 14.128 -8.795 1.00 20.31 H new ATOM 0 HB3 LEU A 121 4.651 15.214 -10.169 1.00 20.31 H new ATOM 0 HG LEU A 121 7.055 15.945 -9.285 1.00 75.14 H new ATOM 0 HD11 LEU A 121 8.300 14.007 -8.433 1.00 61.23 H new ATOM 0 HD12 LEU A 121 7.023 14.518 -7.303 1.00 61.23 H new ATOM 0 HD13 LEU A 121 6.784 13.081 -8.325 1.00 61.23 H new ATOM 0 HD21 LEU A 121 7.991 14.287 -10.863 1.00 63.11 H new ATOM 0 HD22 LEU A 121 6.455 13.389 -10.821 1.00 63.11 H new ATOM 0 HD23 LEU A 121 6.507 15.033 -11.503 1.00 63.11 H new ATOM 1897 N ARG A 122 6.031 16.560 -6.331 1.00 41.25 N ATOM 1898 CA ARG A 122 6.451 16.389 -4.944 1.00 74.52 C ATOM 1899 C ARG A 122 5.422 16.981 -3.997 1.00 44.13 C ATOM 1900 O ARG A 122 4.976 16.312 -3.075 1.00 73.35 O ATOM 1901 CB ARG A 122 7.824 17.023 -4.702 1.00 4.42 C ATOM 1902 CG ARG A 122 8.276 17.002 -3.248 1.00 11.24 C ATOM 1903 CD ARG A 122 8.049 18.343 -2.575 1.00 43.11 C ATOM 1904 NE ARG A 122 8.924 19.373 -3.127 1.00 40.52 N ATOM 1905 CZ ARG A 122 8.838 20.671 -2.847 1.00 24.41 C ATOM 1906 NH1 ARG A 122 7.905 21.121 -2.015 1.00 33.35 N ATOM 1907 NH2 ARG A 122 9.693 21.518 -3.406 1.00 50.43 N ATOM 0 H ARG A 122 6.624 17.183 -6.880 1.00 41.25 H new ATOM 0 HA ARG A 122 6.531 15.320 -4.748 1.00 74.52 H new ATOM 0 HB2 ARG A 122 8.564 16.501 -5.308 1.00 4.42 H new ATOM 0 HB3 ARG A 122 7.800 18.056 -5.048 1.00 4.42 H new ATOM 0 HG2 ARG A 122 7.733 16.226 -2.708 1.00 11.24 H new ATOM 0 HG3 ARG A 122 9.334 16.743 -3.199 1.00 11.24 H new ATOM 0 HD2 ARG A 122 7.008 18.643 -2.700 1.00 43.11 H new ATOM 0 HD3 ARG A 122 8.227 18.249 -1.504 1.00 43.11 H new ATOM 0 HE ARG A 122 9.654 19.076 -3.774 1.00 40.52 H new ATOM 0 HH11 ARG A 122 7.248 20.470 -1.585 1.00 33.35 H new ATOM 0 HH12 ARG A 122 7.846 22.118 -1.806 1.00 33.35 H new ATOM 0 HH21 ARG A 122 10.409 21.172 -4.045 1.00 50.43 H new ATOM 0 HH22 ARG A 122 9.634 22.515 -3.197 1.00 50.43 H new ATOM 1921 N ASP A 123 5.029 18.224 -4.243 1.00 23.33 N ATOM 1922 CA ASP A 123 4.065 18.897 -3.379 1.00 1.21 C ATOM 1923 C ASP A 123 2.700 18.225 -3.481 1.00 52.51 C ATOM 1924 O ASP A 123 1.892 18.287 -2.556 1.00 2.24 O ATOM 1925 CB ASP A 123 3.958 20.377 -3.741 1.00 41.45 C ATOM 1926 CG ASP A 123 3.257 21.185 -2.668 1.00 2.31 C ATOM 1927 OD1 ASP A 123 3.840 21.362 -1.582 1.00 23.21 O ATOM 1928 OD2 ASP A 123 2.127 21.651 -2.903 1.00 53.53 O ATOM 0 H ASP A 123 5.360 18.785 -5.028 1.00 23.33 H new ATOM 0 HA ASP A 123 4.415 18.820 -2.350 1.00 1.21 H new ATOM 0 HB2 ASP A 123 4.957 20.782 -3.902 1.00 41.45 H new ATOM 0 HB3 ASP A 123 3.417 20.480 -4.681 1.00 41.45 H new ATOM 1933 N TYR A 124 2.464 17.558 -4.606 1.00 33.10 N ATOM 1934 CA TYR A 124 1.247 16.809 -4.803 1.00 42.35 C ATOM 1935 C TYR A 124 1.273 15.466 -4.054 1.00 64.11 C ATOM 1936 O TYR A 124 0.396 15.184 -3.245 1.00 13.43 O ATOM 1937 CB TYR A 124 1.033 16.578 -6.291 1.00 71.11 C ATOM 1938 CG TYR A 124 -0.192 15.772 -6.571 1.00 53.23 C ATOM 1939 CD1 TYR A 124 -1.442 16.344 -6.441 1.00 64.01 C ATOM 1940 CD2 TYR A 124 -0.102 14.440 -6.929 1.00 21.34 C ATOM 1941 CE1 TYR A 124 -2.581 15.612 -6.665 1.00 5.42 C ATOM 1942 CE2 TYR A 124 -1.238 13.693 -7.152 1.00 1.32 C ATOM 1943 CZ TYR A 124 -2.480 14.290 -7.019 1.00 32.22 C ATOM 1944 OH TYR A 124 -3.625 13.567 -7.233 1.00 51.21 O ATOM 0 H TYR A 124 3.110 17.527 -5.395 1.00 33.10 H new ATOM 0 HA TYR A 124 0.420 17.390 -4.395 1.00 42.35 H new ATOM 0 HB2 TYR A 124 0.956 17.540 -6.798 1.00 71.11 H new ATOM 0 HB3 TYR A 124 1.903 16.068 -6.706 1.00 71.11 H new ATOM 0 HD1 TYR A 124 -1.525 17.383 -6.159 1.00 64.01 H new ATOM 0 HD2 TYR A 124 0.869 13.980 -7.035 1.00 21.34 H new ATOM 0 HE1 TYR A 124 -3.552 16.074 -6.563 1.00 5.42 H new ATOM 0 HE2 TYR A 124 -1.160 12.652 -7.428 1.00 1.32 H new ATOM 0 HH TYR A 124 -3.441 12.615 -7.093 1.00 51.21 H new ATOM 1954 N PHE A 125 2.269 14.639 -4.345 1.00 53.51 N ATOM 1955 CA PHE A 125 2.371 13.300 -3.760 1.00 33.55 C ATOM 1956 C PHE A 125 2.677 13.332 -2.255 1.00 62.13 C ATOM 1957 O PHE A 125 2.357 12.386 -1.539 1.00 51.35 O ATOM 1958 CB PHE A 125 3.444 12.481 -4.487 1.00 4.34 C ATOM 1959 CG PHE A 125 3.052 12.005 -5.861 1.00 14.30 C ATOM 1960 CD1 PHE A 125 1.941 11.195 -6.050 1.00 5.45 C ATOM 1961 CD2 PHE A 125 3.809 12.357 -6.962 1.00 2.21 C ATOM 1962 CE1 PHE A 125 1.597 10.750 -7.317 1.00 2.35 C ATOM 1963 CE2 PHE A 125 3.470 11.916 -8.226 1.00 75.54 C ATOM 1964 CZ PHE A 125 2.365 11.111 -8.402 1.00 12.14 C ATOM 0 H PHE A 125 3.026 14.871 -4.988 1.00 53.51 H new ATOM 0 HA PHE A 125 1.396 12.829 -3.885 1.00 33.55 H new ATOM 0 HB2 PHE A 125 4.347 13.085 -4.571 1.00 4.34 H new ATOM 0 HB3 PHE A 125 3.696 11.614 -3.876 1.00 4.34 H new ATOM 0 HD1 PHE A 125 1.338 10.908 -5.201 1.00 5.45 H new ATOM 0 HD2 PHE A 125 4.678 12.986 -6.832 1.00 2.21 H new ATOM 0 HE1 PHE A 125 0.729 10.122 -7.453 1.00 2.35 H new ATOM 0 HE2 PHE A 125 4.071 12.202 -9.077 1.00 75.54 H new ATOM 0 HZ PHE A 125 2.102 10.764 -9.390 1.00 12.14 H new ATOM 1974 N GLU A 126 3.263 14.428 -1.778 1.00 71.31 N ATOM 1975 CA GLU A 126 3.636 14.546 -0.365 1.00 11.21 C ATOM 1976 C GLU A 126 2.407 14.656 0.530 1.00 44.30 C ATOM 1977 O GLU A 126 2.477 14.417 1.735 1.00 24.20 O ATOM 1978 CB GLU A 126 4.552 15.741 -0.128 1.00 25.11 C ATOM 1979 CG GLU A 126 5.980 15.337 0.179 1.00 60.10 C ATOM 1980 CD GLU A 126 6.809 16.475 0.729 1.00 14.25 C ATOM 1981 OE1 GLU A 126 6.340 17.165 1.652 1.00 40.33 O ATOM 1982 OE2 GLU A 126 7.949 16.667 0.260 1.00 60.45 O ATOM 0 H GLU A 126 3.490 15.245 -2.344 1.00 71.31 H new ATOM 0 HA GLU A 126 4.176 13.635 -0.105 1.00 11.21 H new ATOM 0 HB2 GLU A 126 4.542 16.381 -1.011 1.00 25.11 H new ATOM 0 HB3 GLU A 126 4.161 16.334 0.699 1.00 25.11 H new ATOM 0 HG2 GLU A 126 5.974 14.518 0.898 1.00 60.10 H new ATOM 0 HG3 GLU A 126 6.449 14.959 -0.730 1.00 60.10 H new ATOM 1989 N GLN A 127 1.288 15.044 -0.068 1.00 15.31 N ATOM 1990 CA GLN A 127 -0.001 15.028 0.616 1.00 64.52 C ATOM 1991 C GLN A 127 -0.334 13.621 1.134 1.00 32.44 C ATOM 1992 O GLN A 127 -1.026 13.468 2.141 1.00 51.42 O ATOM 1993 CB GLN A 127 -1.109 15.508 -0.327 1.00 55.25 C ATOM 1994 CG GLN A 127 -0.840 16.867 -0.964 1.00 51.54 C ATOM 1995 CD GLN A 127 -1.982 17.326 -1.850 1.00 30.01 C ATOM 1996 OE1 GLN A 127 -2.897 18.016 -1.400 1.00 51.04 O ATOM 1997 NE2 GLN A 127 -1.947 16.932 -3.111 1.00 41.42 N ATOM 0 H GLN A 127 1.246 15.376 -1.032 1.00 15.31 H new ATOM 0 HA GLN A 127 0.064 15.704 1.469 1.00 64.52 H new ATOM 0 HB2 GLN A 127 -1.244 14.769 -1.117 1.00 55.25 H new ATOM 0 HB3 GLN A 127 -2.046 15.558 0.227 1.00 55.25 H new ATOM 0 HG2 GLN A 127 -0.672 17.606 -0.180 1.00 51.54 H new ATOM 0 HG3 GLN A 127 0.075 16.814 -1.554 1.00 51.54 H new ATOM 0 HE21 GLN A 127 -1.171 16.361 -3.445 1.00 41.42 H new ATOM 0 HE22 GLN A 127 -2.696 17.199 -3.750 1.00 41.42 H new ATOM 2006 N TYR A 128 0.175 12.602 0.447 1.00 40.23 N ATOM 2007 CA TYR A 128 -0.081 11.210 0.812 1.00 40.11 C ATOM 2008 C TYR A 128 0.947 10.680 1.819 1.00 0.20 C ATOM 2009 O TYR A 128 0.630 9.806 2.630 1.00 41.13 O ATOM 2010 CB TYR A 128 -0.077 10.327 -0.437 1.00 40.54 C ATOM 2011 CG TYR A 128 -1.132 10.704 -1.456 1.00 22.24 C ATOM 2012 CD1 TYR A 128 -0.895 11.691 -2.408 1.00 12.34 C ATOM 2013 CD2 TYR A 128 -2.365 10.066 -1.469 1.00 71.43 C ATOM 2014 CE1 TYR A 128 -1.855 12.031 -3.339 1.00 11.33 C ATOM 2015 CE2 TYR A 128 -3.331 10.400 -2.399 1.00 72.44 C ATOM 2016 CZ TYR A 128 -3.071 11.385 -3.330 1.00 4.23 C ATOM 2017 OH TYR A 128 -4.026 11.723 -4.258 1.00 64.42 O ATOM 0 H TYR A 128 0.772 12.715 -0.372 1.00 40.23 H new ATOM 0 HA TYR A 128 -1.062 11.176 1.286 1.00 40.11 H new ATOM 0 HB2 TYR A 128 0.905 10.383 -0.907 1.00 40.54 H new ATOM 0 HB3 TYR A 128 -0.229 9.290 -0.138 1.00 40.54 H new ATOM 0 HD1 TYR A 128 0.057 12.200 -2.418 1.00 12.34 H new ATOM 0 HD2 TYR A 128 -2.573 9.296 -0.740 1.00 71.43 H new ATOM 0 HE1 TYR A 128 -1.654 12.799 -4.071 1.00 11.33 H new ATOM 0 HE2 TYR A 128 -4.285 9.893 -2.397 1.00 72.44 H new ATOM 0 HH TYR A 128 -4.826 11.175 -4.118 1.00 64.42 H new ATOM 2027 N GLY A 129 2.171 11.200 1.756 1.00 12.20 N ATOM 2028 CA GLY A 129 3.215 10.750 2.666 1.00 21.31 C ATOM 2029 C GLY A 129 4.556 11.420 2.422 1.00 73.44 C ATOM 2030 O GLY A 129 4.666 12.302 1.572 1.00 4.33 O ATOM 0 H GLY A 129 2.459 11.921 1.095 1.00 12.20 H new ATOM 0 HA2 GLY A 129 2.901 10.944 3.692 1.00 21.31 H new ATOM 0 HA3 GLY A 129 3.333 9.671 2.567 1.00 21.31 H new ATOM 2034 N LYS A 130 5.576 10.995 3.168 1.00 40.14 N ATOM 2035 CA LYS A 130 6.917 11.559 3.046 1.00 25.13 C ATOM 2036 C LYS A 130 7.619 11.044 1.796 1.00 14.12 C ATOM 2037 O LYS A 130 7.639 9.840 1.525 1.00 34.14 O ATOM 2038 CB LYS A 130 7.767 11.219 4.283 1.00 32.44 C ATOM 2039 CG LYS A 130 9.239 11.597 4.132 1.00 0.31 C ATOM 2040 CD LYS A 130 10.081 11.121 5.303 1.00 0.53 C ATOM 2041 CE LYS A 130 11.566 11.274 5.008 1.00 22.32 C ATOM 2042 NZ LYS A 130 12.416 10.811 6.138 1.00 64.22 N ATOM 0 H LYS A 130 5.496 10.257 3.867 1.00 40.14 H new ATOM 0 HA LYS A 130 6.809 12.641 2.970 1.00 25.13 H new ATOM 0 HB2 LYS A 130 7.355 11.734 5.150 1.00 32.44 H new ATOM 0 HB3 LYS A 130 7.693 10.150 4.482 1.00 32.44 H new ATOM 0 HG2 LYS A 130 9.629 11.168 3.209 1.00 0.31 H new ATOM 0 HG3 LYS A 130 9.326 12.680 4.042 1.00 0.31 H new ATOM 0 HD2 LYS A 130 9.824 11.691 6.196 1.00 0.53 H new ATOM 0 HD3 LYS A 130 9.855 10.076 5.516 1.00 0.53 H new ATOM 0 HE2 LYS A 130 11.817 10.707 4.112 1.00 22.32 H new ATOM 0 HE3 LYS A 130 11.786 12.320 4.795 1.00 22.32 H new ATOM 0 HZ1 LYS A 130 13.419 10.934 5.891 1.00 64.22 H new ATOM 0 HZ2 LYS A 130 12.197 11.369 6.988 1.00 64.22 H new ATOM 0 HZ3 LYS A 130 12.227 9.806 6.325 1.00 64.22 H new ATOM 2056 N ILE A 131 8.218 11.963 1.062 1.00 24.12 N ATOM 2057 CA ILE A 131 8.991 11.621 -0.113 1.00 64.31 C ATOM 2058 C ILE A 131 10.479 11.694 0.217 1.00 13.41 C ATOM 2059 O ILE A 131 10.920 12.589 0.933 1.00 13.25 O ATOM 2060 CB ILE A 131 8.657 12.563 -1.293 1.00 4.24 C ATOM 2061 CG1 ILE A 131 7.192 12.389 -1.699 1.00 54.23 C ATOM 2062 CG2 ILE A 131 9.577 12.302 -2.479 1.00 4.41 C ATOM 2063 CD1 ILE A 131 6.747 13.310 -2.815 1.00 41.34 C ATOM 0 H ILE A 131 8.182 12.962 1.264 1.00 24.12 H new ATOM 0 HA ILE A 131 8.735 10.605 -0.414 1.00 64.31 H new ATOM 0 HB ILE A 131 8.815 13.592 -0.970 1.00 4.24 H new ATOM 0 HG12 ILE A 131 7.032 11.356 -2.009 1.00 54.23 H new ATOM 0 HG13 ILE A 131 6.561 12.561 -0.827 1.00 54.23 H new ATOM 0 HG21 ILE A 131 9.320 12.978 -3.294 1.00 4.41 H new ATOM 0 HG22 ILE A 131 10.612 12.470 -2.181 1.00 4.41 H new ATOM 0 HG23 ILE A 131 9.458 11.271 -2.812 1.00 4.41 H new ATOM 0 HD11 ILE A 131 5.698 13.124 -3.043 1.00 41.34 H new ATOM 0 HD12 ILE A 131 6.872 14.347 -2.503 1.00 41.34 H new ATOM 0 HD13 ILE A 131 7.350 13.123 -3.703 1.00 41.34 H new ATOM 2075 N GLU A 132 11.239 10.737 -0.286 1.00 52.31 N ATOM 2076 CA GLU A 132 12.678 10.728 -0.068 1.00 74.20 C ATOM 2077 C GLU A 132 13.378 11.567 -1.122 1.00 13.34 C ATOM 2078 O GLU A 132 14.176 12.449 -0.805 1.00 30.14 O ATOM 2079 CB GLU A 132 13.243 9.311 -0.104 1.00 14.54 C ATOM 2080 CG GLU A 132 12.721 8.405 0.990 1.00 31.04 C ATOM 2081 CD GLU A 132 13.698 7.299 1.327 1.00 11.35 C ATOM 2082 OE1 GLU A 132 13.634 6.224 0.702 1.00 64.52 O ATOM 2083 OE2 GLU A 132 14.546 7.504 2.217 1.00 44.22 O ATOM 0 H GLU A 132 10.888 9.960 -0.845 1.00 52.31 H new ATOM 0 HA GLU A 132 12.857 11.150 0.921 1.00 74.20 H new ATOM 0 HB2 GLU A 132 13.011 8.864 -1.071 1.00 14.54 H new ATOM 0 HB3 GLU A 132 14.329 9.363 -0.029 1.00 14.54 H new ATOM 0 HG2 GLU A 132 12.520 8.995 1.884 1.00 31.04 H new ATOM 0 HG3 GLU A 132 11.773 7.968 0.677 1.00 31.04 H new ATOM 2090 N VAL A 133 13.054 11.298 -2.377 1.00 54.40 N ATOM 2091 CA VAL A 133 13.714 11.949 -3.494 1.00 1.43 C ATOM 2092 C VAL A 133 12.844 11.820 -4.750 1.00 31.30 C ATOM 2093 O VAL A 133 11.962 10.959 -4.814 1.00 22.02 O ATOM 2094 CB VAL A 133 15.134 11.349 -3.714 1.00 12.32 C ATOM 2095 CG1 VAL A 133 15.061 9.940 -4.267 1.00 71.23 C ATOM 2096 CG2 VAL A 133 15.989 12.244 -4.604 1.00 60.22 C ATOM 0 H VAL A 133 12.333 10.629 -2.647 1.00 54.40 H new ATOM 0 HA VAL A 133 13.841 13.009 -3.274 1.00 1.43 H new ATOM 0 HB VAL A 133 15.617 11.298 -2.738 1.00 12.32 H new ATOM 0 HG11 VAL A 133 16.070 9.552 -4.408 1.00 71.23 H new ATOM 0 HG12 VAL A 133 14.521 9.302 -3.567 1.00 71.23 H new ATOM 0 HG13 VAL A 133 14.539 9.951 -5.224 1.00 71.23 H new ATOM 0 HG21 VAL A 133 16.973 11.793 -4.735 1.00 60.22 H new ATOM 0 HG22 VAL A 133 15.509 12.356 -5.576 1.00 60.22 H new ATOM 0 HG23 VAL A 133 16.098 13.223 -4.138 1.00 60.22 H new ATOM 2106 N ILE A 134 13.067 12.685 -5.727 1.00 12.54 N ATOM 2107 CA ILE A 134 12.232 12.718 -6.920 1.00 15.54 C ATOM 2108 C ILE A 134 13.065 12.476 -8.164 1.00 51.12 C ATOM 2109 O ILE A 134 14.127 13.072 -8.350 1.00 74.04 O ATOM 2110 CB ILE A 134 11.455 14.060 -7.058 1.00 23.43 C ATOM 2111 CG1 ILE A 134 10.323 14.153 -6.032 1.00 52.14 C ATOM 2112 CG2 ILE A 134 10.888 14.237 -8.461 1.00 44.54 C ATOM 2113 CD1 ILE A 134 10.735 14.759 -4.709 1.00 4.14 C ATOM 0 H ILE A 134 13.819 13.374 -5.718 1.00 12.54 H new ATOM 0 HA ILE A 134 11.499 11.918 -6.814 1.00 15.54 H new ATOM 0 HB ILE A 134 12.171 14.860 -6.869 1.00 23.43 H new ATOM 0 HG12 ILE A 134 9.513 14.747 -6.454 1.00 52.14 H new ATOM 0 HG13 ILE A 134 9.926 13.154 -5.853 1.00 52.14 H new ATOM 0 HG21 ILE A 134 10.352 15.184 -8.520 1.00 44.54 H new ATOM 0 HG22 ILE A 134 11.702 14.235 -9.185 1.00 44.54 H new ATOM 0 HG23 ILE A 134 10.203 13.419 -8.683 1.00 44.54 H new ATOM 0 HD11 ILE A 134 9.876 14.789 -4.039 1.00 4.14 H new ATOM 0 HD12 ILE A 134 11.523 14.154 -4.261 1.00 4.14 H new ATOM 0 HD13 ILE A 134 11.103 15.772 -4.872 1.00 4.14 H new ATOM 2125 N GLU A 135 12.576 11.582 -8.997 1.00 25.32 N ATOM 2126 CA GLU A 135 13.224 11.251 -10.244 1.00 22.03 C ATOM 2127 C GLU A 135 12.517 11.938 -11.409 1.00 12.41 C ATOM 2128 O GLU A 135 11.454 11.508 -11.847 1.00 11.23 O ATOM 2129 CB GLU A 135 13.176 9.737 -10.442 1.00 32.12 C ATOM 2130 CG GLU A 135 14.128 8.944 -9.562 1.00 11.44 C ATOM 2131 CD GLU A 135 13.669 8.831 -8.123 1.00 62.14 C ATOM 2132 OE1 GLU A 135 12.714 8.077 -7.857 1.00 2.31 O ATOM 2133 OE2 GLU A 135 14.283 9.471 -7.253 1.00 15.32 O ATOM 0 H GLU A 135 11.714 11.064 -8.826 1.00 25.32 H new ATOM 0 HA GLU A 135 14.259 11.593 -10.212 1.00 22.03 H new ATOM 0 HB2 GLU A 135 12.159 9.393 -10.253 1.00 32.12 H new ATOM 0 HB3 GLU A 135 13.399 9.515 -11.485 1.00 32.12 H new ATOM 0 HG2 GLU A 135 14.245 7.943 -9.977 1.00 11.44 H new ATOM 0 HG3 GLU A 135 15.110 9.416 -9.586 1.00 11.44 H new ATOM 2140 N ILE A 136 13.106 12.998 -11.923 1.00 13.21 N ATOM 2141 CA ILE A 136 12.556 13.658 -13.094 1.00 14.05 C ATOM 2142 C ILE A 136 13.217 13.097 -14.334 1.00 2.54 C ATOM 2143 O ILE A 136 14.428 13.233 -14.517 1.00 64.20 O ATOM 2144 CB ILE A 136 12.750 15.195 -13.056 1.00 21.04 C ATOM 2145 CG1 ILE A 136 12.083 15.800 -11.815 1.00 14.43 C ATOM 2146 CG2 ILE A 136 12.191 15.837 -14.323 1.00 15.41 C ATOM 2147 CD1 ILE A 136 10.574 15.648 -11.785 1.00 33.30 C ATOM 0 H ILE A 136 13.958 13.420 -11.554 1.00 13.21 H new ATOM 0 HA ILE A 136 11.483 13.468 -13.107 1.00 14.05 H new ATOM 0 HB ILE A 136 13.819 15.399 -13.004 1.00 21.04 H new ATOM 0 HG12 ILE A 136 12.502 15.330 -10.925 1.00 14.43 H new ATOM 0 HG13 ILE A 136 12.331 16.860 -11.763 1.00 14.43 H new ATOM 0 HG21 ILE A 136 12.336 16.916 -14.278 1.00 15.41 H new ATOM 0 HG22 ILE A 136 12.711 15.437 -15.193 1.00 15.41 H new ATOM 0 HG23 ILE A 136 11.126 15.617 -14.403 1.00 15.41 H new ATOM 0 HD11 ILE A 136 10.181 16.102 -10.875 1.00 33.30 H new ATOM 0 HD12 ILE A 136 10.141 16.143 -12.654 1.00 33.30 H new ATOM 0 HD13 ILE A 136 10.314 14.590 -11.804 1.00 33.30 H new ATOM 2159 N MET A 137 12.438 12.461 -15.188 1.00 21.21 N ATOM 2160 CA MET A 137 12.993 11.846 -16.369 1.00 45.40 C ATOM 2161 C MET A 137 12.901 12.822 -17.523 1.00 53.11 C ATOM 2162 O MET A 137 11.829 13.340 -17.836 1.00 51.51 O ATOM 2163 CB MET A 137 12.267 10.541 -16.699 1.00 50.50 C ATOM 2164 CG MET A 137 12.102 9.614 -15.501 1.00 33.24 C ATOM 2165 SD MET A 137 13.650 9.285 -14.633 1.00 71.13 S ATOM 2166 CE MET A 137 14.546 8.345 -15.865 1.00 24.05 C ATOM 0 H MET A 137 11.428 12.359 -15.084 1.00 21.21 H new ATOM 0 HA MET A 137 14.039 11.599 -16.188 1.00 45.40 H new ATOM 0 HB2 MET A 137 11.283 10.775 -17.105 1.00 50.50 H new ATOM 0 HB3 MET A 137 12.817 10.017 -17.480 1.00 50.50 H new ATOM 0 HG2 MET A 137 11.390 10.056 -14.804 1.00 33.24 H new ATOM 0 HG3 MET A 137 11.675 8.669 -15.838 1.00 33.24 H new ATOM 0 HE1 MET A 137 15.479 7.979 -15.436 1.00 24.05 H new ATOM 0 HE2 MET A 137 13.940 7.499 -16.190 1.00 24.05 H new ATOM 0 HE3 MET A 137 14.766 8.983 -16.721 1.00 24.05 H new ATOM 2176 N THR A 138 14.033 13.087 -18.135 1.00 55.01 N ATOM 2177 CA THR A 138 14.117 14.087 -19.173 1.00 64.44 C ATOM 2178 C THR A 138 14.349 13.425 -20.519 1.00 20.13 C ATOM 2179 O THR A 138 14.958 12.357 -20.600 1.00 3.03 O ATOM 2180 CB THR A 138 15.264 15.071 -18.889 1.00 43.50 C ATOM 2181 OG1 THR A 138 15.499 15.134 -17.474 1.00 63.20 O ATOM 2182 CG2 THR A 138 14.942 16.464 -19.411 1.00 65.51 C ATOM 0 H THR A 138 14.915 12.619 -17.929 1.00 55.01 H new ATOM 0 HA THR A 138 13.175 14.635 -19.192 1.00 64.44 H new ATOM 0 HB THR A 138 16.156 14.712 -19.403 1.00 43.50 H new ATOM 0 HG1 THR A 138 16.231 15.760 -17.291 1.00 63.20 H new ATOM 0 HG21 THR A 138 15.773 17.135 -19.194 1.00 65.51 H new ATOM 0 HG22 THR A 138 14.782 16.421 -20.488 1.00 65.51 H new ATOM 0 HG23 THR A 138 14.040 16.835 -18.925 1.00 65.51 H new ATOM 2319 N GLY A 147 7.238 13.734 -20.261 1.00 11.22 N ATOM 2320 CA GLY A 147 7.004 12.449 -20.882 1.00 64.23 C ATOM 2321 C GLY A 147 6.726 11.371 -19.863 1.00 5.15 C ATOM 2322 O GLY A 147 5.783 10.593 -20.024 1.00 2.33 O ATOM 0 HA2 GLY A 147 6.160 12.526 -21.568 1.00 64.23 H new ATOM 0 HA3 GLY A 147 7.874 12.170 -21.477 1.00 64.23 H new ATOM 2326 N PHE A 148 7.511 11.352 -18.790 1.00 13.24 N ATOM 2327 CA PHE A 148 7.285 10.457 -17.665 1.00 35.45 C ATOM 2328 C PHE A 148 8.220 10.855 -16.529 1.00 61.20 C ATOM 2329 O PHE A 148 9.266 11.459 -16.764 1.00 63.24 O ATOM 2330 CB PHE A 148 7.498 8.978 -18.051 1.00 74.42 C ATOM 2331 CG PHE A 148 8.868 8.633 -18.588 1.00 40.34 C ATOM 2332 CD1 PHE A 148 9.239 8.985 -19.879 1.00 43.25 C ATOM 2333 CD2 PHE A 148 9.778 7.938 -17.805 1.00 71.43 C ATOM 2334 CE1 PHE A 148 10.486 8.655 -20.375 1.00 22.45 C ATOM 2335 CE2 PHE A 148 11.025 7.602 -18.299 1.00 43.25 C ATOM 2336 CZ PHE A 148 11.379 7.963 -19.584 1.00 41.44 C ATOM 0 H PHE A 148 8.323 11.959 -18.678 1.00 13.24 H new ATOM 0 HA PHE A 148 6.247 10.551 -17.347 1.00 35.45 H new ATOM 0 HB2 PHE A 148 7.306 8.361 -17.173 1.00 74.42 H new ATOM 0 HB3 PHE A 148 6.755 8.706 -18.801 1.00 74.42 H new ATOM 0 HD1 PHE A 148 8.543 9.524 -20.504 1.00 43.25 H new ATOM 0 HD2 PHE A 148 9.509 7.656 -16.798 1.00 71.43 H new ATOM 0 HE1 PHE A 148 10.761 8.939 -21.380 1.00 22.45 H new ATOM 0 HE2 PHE A 148 11.722 7.057 -17.680 1.00 43.25 H new ATOM 0 HZ PHE A 148 12.354 7.704 -19.969 1.00 41.44 H new ATOM 2346 N ALA A 149 7.826 10.550 -15.308 1.00 74.25 N ATOM 2347 CA ALA A 149 8.621 10.860 -14.137 1.00 14.22 C ATOM 2348 C ALA A 149 8.448 9.772 -13.089 1.00 12.11 C ATOM 2349 O ALA A 149 7.588 8.899 -13.218 1.00 1.31 O ATOM 2350 CB ALA A 149 8.239 12.224 -13.570 1.00 42.30 C ATOM 0 H ALA A 149 6.945 10.080 -15.100 1.00 74.25 H new ATOM 0 HA ALA A 149 9.671 10.901 -14.428 1.00 14.22 H new ATOM 0 HB1 ALA A 149 8.848 12.436 -12.691 1.00 42.30 H new ATOM 0 HB2 ALA A 149 8.410 12.992 -14.324 1.00 42.30 H new ATOM 0 HB3 ALA A 149 7.186 12.219 -13.289 1.00 42.30 H new ATOM 2356 N PHE A 150 9.275 9.826 -12.064 1.00 53.22 N ATOM 2357 CA PHE A 150 9.236 8.861 -10.983 1.00 30.33 C ATOM 2358 C PHE A 150 9.428 9.580 -9.655 1.00 33.35 C ATOM 2359 O PHE A 150 9.988 10.672 -9.609 1.00 51.04 O ATOM 2360 CB PHE A 150 10.330 7.799 -11.164 1.00 44.13 C ATOM 2361 CG PHE A 150 10.066 6.798 -12.254 1.00 45.43 C ATOM 2362 CD1 PHE A 150 9.299 5.674 -12.007 1.00 32.31 C ATOM 2363 CD2 PHE A 150 10.602 6.974 -13.521 1.00 42.12 C ATOM 2364 CE1 PHE A 150 9.064 4.748 -13.005 1.00 14.31 C ATOM 2365 CE2 PHE A 150 10.371 6.052 -14.520 1.00 15.51 C ATOM 2366 CZ PHE A 150 9.603 4.935 -14.262 1.00 30.31 C ATOM 0 H PHE A 150 9.994 10.541 -11.957 1.00 53.22 H new ATOM 0 HA PHE A 150 8.267 8.361 -10.993 1.00 30.33 H new ATOM 0 HB2 PHE A 150 11.274 8.303 -11.374 1.00 44.13 H new ATOM 0 HB3 PHE A 150 10.456 7.264 -10.223 1.00 44.13 H new ATOM 0 HD1 PHE A 150 8.880 5.519 -11.024 1.00 32.31 H new ATOM 0 HD2 PHE A 150 11.208 7.844 -13.728 1.00 42.12 H new ATOM 0 HE1 PHE A 150 8.458 3.877 -12.802 1.00 14.31 H new ATOM 0 HE2 PHE A 150 10.791 6.204 -15.503 1.00 15.51 H new ATOM 0 HZ PHE A 150 9.424 4.209 -15.041 1.00 30.31 H new ATOM 2376 N VAL A 151 8.930 9.000 -8.584 1.00 51.13 N ATOM 2377 CA VAL A 151 9.125 9.578 -7.264 1.00 5.12 C ATOM 2378 C VAL A 151 9.291 8.495 -6.195 1.00 63.42 C ATOM 2379 O VAL A 151 8.525 7.529 -6.134 1.00 20.23 O ATOM 2380 CB VAL A 151 7.978 10.564 -6.903 1.00 24.32 C ATOM 2381 CG1 VAL A 151 6.619 9.966 -7.197 1.00 62.23 C ATOM 2382 CG2 VAL A 151 8.054 10.998 -5.451 1.00 74.30 C ATOM 0 H VAL A 151 8.390 8.135 -8.596 1.00 51.13 H new ATOM 0 HA VAL A 151 10.052 10.150 -7.292 1.00 5.12 H new ATOM 0 HB VAL A 151 8.109 11.445 -7.532 1.00 24.32 H new ATOM 0 HG11 VAL A 151 5.841 10.682 -6.933 1.00 62.23 H new ATOM 0 HG12 VAL A 151 6.548 9.728 -8.258 1.00 62.23 H new ATOM 0 HG13 VAL A 151 6.488 9.056 -6.612 1.00 62.23 H new ATOM 0 HG21 VAL A 151 7.237 11.687 -5.234 1.00 74.30 H new ATOM 0 HG22 VAL A 151 7.973 10.124 -4.805 1.00 74.30 H new ATOM 0 HG23 VAL A 151 9.006 11.496 -5.269 1.00 74.30 H new ATOM 2392 N THR A 152 10.325 8.666 -5.380 1.00 60.02 N ATOM 2393 CA THR A 152 10.657 7.739 -4.313 1.00 62.34 C ATOM 2394 C THR A 152 10.011 8.168 -2.996 1.00 55.22 C ATOM 2395 O THR A 152 10.228 9.283 -2.522 1.00 61.53 O ATOM 2396 CB THR A 152 12.186 7.674 -4.117 1.00 33.11 C ATOM 2397 OG1 THR A 152 12.815 7.073 -5.257 1.00 42.05 O ATOM 2398 CG2 THR A 152 12.550 6.904 -2.856 1.00 0.33 C ATOM 0 H THR A 152 10.961 9.461 -5.445 1.00 60.02 H new ATOM 0 HA THR A 152 10.277 6.758 -4.597 1.00 62.34 H new ATOM 0 HB THR A 152 12.549 8.696 -4.009 1.00 33.11 H new ATOM 0 HG1 THR A 152 12.632 7.613 -6.054 1.00 42.05 H new ATOM 0 HG21 THR A 152 13.634 6.876 -2.747 1.00 0.33 H new ATOM 0 HG22 THR A 152 12.110 7.397 -1.989 1.00 0.33 H new ATOM 0 HG23 THR A 152 12.167 5.886 -2.928 1.00 0.33 H new ATOM 2406 N PHE A 153 9.245 7.272 -2.398 1.00 40.14 N ATOM 2407 CA PHE A 153 8.608 7.533 -1.120 1.00 53.13 C ATOM 2408 C PHE A 153 9.374 6.866 0.012 1.00 12.34 C ATOM 2409 O PHE A 153 10.101 5.897 -0.206 1.00 2.04 O ATOM 2410 CB PHE A 153 7.171 7.023 -1.129 1.00 60.41 C ATOM 2411 CG PHE A 153 6.164 8.081 -1.438 1.00 34.02 C ATOM 2412 CD1 PHE A 153 5.909 8.460 -2.744 1.00 13.33 C ATOM 2413 CD2 PHE A 153 5.471 8.697 -0.416 1.00 53.21 C ATOM 2414 CE1 PHE A 153 4.977 9.438 -3.020 1.00 33.34 C ATOM 2415 CE2 PHE A 153 4.541 9.673 -0.684 1.00 74.03 C ATOM 2416 CZ PHE A 153 4.291 10.044 -1.985 1.00 12.41 C ATOM 0 H PHE A 153 9.048 6.348 -2.783 1.00 40.14 H new ATOM 0 HA PHE A 153 8.608 8.611 -0.959 1.00 53.13 H new ATOM 0 HB2 PHE A 153 7.083 6.223 -1.864 1.00 60.41 H new ATOM 0 HB3 PHE A 153 6.942 6.588 -0.156 1.00 60.41 H new ATOM 0 HD1 PHE A 153 6.444 7.986 -3.554 1.00 13.33 H new ATOM 0 HD2 PHE A 153 5.662 8.409 0.607 1.00 53.21 H new ATOM 0 HE1 PHE A 153 4.784 9.729 -4.042 1.00 33.34 H new ATOM 0 HE2 PHE A 153 4.007 10.148 0.126 1.00 74.03 H new ATOM 0 HZ PHE A 153 3.559 10.809 -2.197 1.00 12.41 H new ATOM 2426 N ASP A 154 9.202 7.390 1.217 1.00 4.24 N ATOM 2427 CA ASP A 154 9.847 6.836 2.406 1.00 12.45 C ATOM 2428 C ASP A 154 9.106 5.593 2.888 1.00 21.22 C ATOM 2429 O ASP A 154 9.690 4.705 3.513 1.00 64.11 O ATOM 2430 CB ASP A 154 9.891 7.896 3.514 1.00 75.34 C ATOM 2431 CG ASP A 154 10.483 7.385 4.816 1.00 22.41 C ATOM 2432 OD1 ASP A 154 11.670 7.005 4.837 1.00 41.11 O ATOM 2433 OD2 ASP A 154 9.763 7.379 5.833 1.00 30.34 O ATOM 0 H ASP A 154 8.617 8.205 1.401 1.00 4.24 H new ATOM 0 HA ASP A 154 10.866 6.547 2.151 1.00 12.45 H new ATOM 0 HB2 ASP A 154 10.476 8.748 3.168 1.00 75.34 H new ATOM 0 HB3 ASP A 154 8.880 8.258 3.701 1.00 75.34 H new ATOM 2438 N ASP A 155 7.823 5.527 2.565 1.00 63.15 N ATOM 2439 CA ASP A 155 6.994 4.403 2.981 1.00 32.43 C ATOM 2440 C ASP A 155 6.202 3.848 1.802 1.00 34.24 C ATOM 2441 O ASP A 155 5.825 4.593 0.898 1.00 72.40 O ATOM 2442 CB ASP A 155 6.044 4.824 4.101 1.00 61.30 C ATOM 2443 CG ASP A 155 5.589 3.639 4.924 1.00 54.42 C ATOM 2444 OD1 ASP A 155 6.291 3.283 5.893 1.00 23.41 O ATOM 2445 OD2 ASP A 155 4.544 3.045 4.600 1.00 21.54 O ATOM 0 H ASP A 155 7.334 6.235 2.018 1.00 63.15 H new ATOM 0 HA ASP A 155 7.652 3.618 3.355 1.00 32.43 H new ATOM 0 HB2 ASP A 155 6.542 5.547 4.748 1.00 61.30 H new ATOM 0 HB3 ASP A 155 5.176 5.324 3.673 1.00 61.30 H new ATOM 2450 N HIS A 156 5.948 2.540 1.816 1.00 74.14 N ATOM 2451 CA HIS A 156 5.250 1.893 0.707 1.00 53.40 C ATOM 2452 C HIS A 156 3.746 2.153 0.788 1.00 42.14 C ATOM 2453 O HIS A 156 3.057 2.174 -0.234 1.00 0.54 O ATOM 2454 CB HIS A 156 5.544 0.372 0.654 1.00 24.24 C ATOM 2455 CG HIS A 156 4.847 -0.454 1.699 1.00 33.52 C ATOM 2456 ND1 HIS A 156 3.511 -0.741 1.605 1.00 3.33 N ATOM 2457 CD2 HIS A 156 5.337 -1.016 2.826 1.00 33.14 C ATOM 2458 CE1 HIS A 156 3.222 -1.454 2.666 1.00 41.32 C ATOM 2459 NE2 HIS A 156 4.295 -1.652 3.437 1.00 4.11 N ATOM 0 H HIS A 156 6.212 1.913 2.576 1.00 74.14 H new ATOM 0 HA HIS A 156 5.626 2.331 -0.217 1.00 53.40 H new ATOM 0 HB2 HIS A 156 5.260 -0.002 -0.330 1.00 24.24 H new ATOM 0 HB3 HIS A 156 6.619 0.223 0.754 1.00 24.24 H new ATOM 0 HD2 HIS A 156 6.358 -0.971 3.176 1.00 33.14 H new ATOM 0 HE1 HIS A 156 2.237 -1.835 2.890 1.00 41.32 H new ATOM 0 HE2 HIS A 156 4.329 -2.176 4.311 1.00 4.11 H new ATOM 2467 N ASP A 157 3.254 2.373 2.008 1.00 4.35 N ATOM 2468 CA ASP A 157 1.827 2.559 2.243 1.00 50.24 C ATOM 2469 C ASP A 157 1.328 3.825 1.563 1.00 50.01 C ATOM 2470 O ASP A 157 0.225 3.856 1.017 1.00 13.33 O ATOM 2471 CB ASP A 157 1.529 2.614 3.741 1.00 1.42 C ATOM 2472 CG ASP A 157 0.093 2.984 4.023 1.00 62.40 C ATOM 2473 OD1 ASP A 157 -0.802 2.206 3.653 1.00 24.52 O ATOM 2474 OD2 ASP A 157 -0.147 4.062 4.606 1.00 60.50 O ATOM 0 H ASP A 157 3.828 2.426 2.850 1.00 4.35 H new ATOM 0 HA ASP A 157 1.302 1.705 1.814 1.00 50.24 H new ATOM 0 HB2 ASP A 157 1.747 1.645 4.189 1.00 1.42 H new ATOM 0 HB3 ASP A 157 2.189 3.340 4.215 1.00 1.42 H new ATOM 2479 N SER A 158 2.164 4.859 1.564 1.00 44.54 N ATOM 2480 CA SER A 158 1.824 6.118 0.921 1.00 11.02 C ATOM 2481 C SER A 158 1.707 5.934 -0.589 1.00 44.41 C ATOM 2482 O SER A 158 0.869 6.560 -1.237 1.00 21.34 O ATOM 2483 CB SER A 158 2.888 7.161 1.241 1.00 44.11 C ATOM 2484 OG SER A 158 3.240 7.127 2.613 1.00 21.21 O ATOM 0 H SER A 158 3.084 4.847 2.005 1.00 44.54 H new ATOM 0 HA SER A 158 0.861 6.458 1.301 1.00 11.02 H new ATOM 0 HB2 SER A 158 3.773 6.981 0.631 1.00 44.11 H new ATOM 0 HB3 SER A 158 2.519 8.153 0.982 1.00 44.11 H new ATOM 0 HG SER A 158 4.115 7.551 2.737 1.00 21.21 H new ATOM 2490 N VAL A 159 2.515 5.023 -1.129 1.00 62.34 N ATOM 2491 CA VAL A 159 2.525 4.750 -2.551 1.00 25.22 C ATOM 2492 C VAL A 159 1.244 4.031 -2.952 1.00 3.41 C ATOM 2493 O VAL A 159 0.656 4.320 -3.993 1.00 44.44 O ATOM 2494 CB VAL A 159 3.779 3.923 -2.930 1.00 52.01 C ATOM 2495 CG1 VAL A 159 3.507 2.911 -4.039 1.00 1.02 C ATOM 2496 CG2 VAL A 159 4.901 4.861 -3.329 1.00 3.32 C ATOM 0 H VAL A 159 3.174 4.461 -0.591 1.00 62.34 H new ATOM 0 HA VAL A 159 2.570 5.692 -3.097 1.00 25.22 H new ATOM 0 HB VAL A 159 4.071 3.347 -2.052 1.00 52.01 H new ATOM 0 HG11 VAL A 159 4.421 2.361 -4.262 1.00 1.02 H new ATOM 0 HG12 VAL A 159 2.735 2.214 -3.714 1.00 1.02 H new ATOM 0 HG13 VAL A 159 3.170 3.434 -4.934 1.00 1.02 H new ATOM 0 HG21 VAL A 159 5.784 4.280 -3.596 1.00 3.32 H new ATOM 0 HG22 VAL A 159 4.588 5.459 -4.185 1.00 3.32 H new ATOM 0 HG23 VAL A 159 5.139 5.520 -2.494 1.00 3.32 H new ATOM 2506 N ASP A 160 0.807 3.119 -2.097 1.00 45.32 N ATOM 2507 CA ASP A 160 -0.399 2.357 -2.370 1.00 4.53 C ATOM 2508 C ASP A 160 -1.644 3.235 -2.275 1.00 23.43 C ATOM 2509 O ASP A 160 -2.592 3.039 -3.031 1.00 63.40 O ATOM 2510 CB ASP A 160 -0.528 1.154 -1.455 1.00 43.10 C ATOM 2511 CG ASP A 160 -1.308 0.048 -2.133 1.00 53.24 C ATOM 2512 OD1 ASP A 160 -0.752 -0.575 -3.061 1.00 3.15 O ATOM 2513 OD2 ASP A 160 -2.476 -0.175 -1.772 1.00 14.42 O ATOM 0 H ASP A 160 1.266 2.891 -1.215 1.00 45.32 H new ATOM 0 HA ASP A 160 -0.315 1.989 -3.393 1.00 4.53 H new ATOM 0 HB2 ASP A 160 0.463 0.792 -1.180 1.00 43.10 H new ATOM 0 HB3 ASP A 160 -1.028 1.445 -0.531 1.00 43.10 H new ATOM 2518 N LYS A 161 -1.623 4.227 -1.369 1.00 74.31 N ATOM 2519 CA LYS A 161 -2.689 5.243 -1.306 1.00 63.12 C ATOM 2520 C LYS A 161 -2.867 5.895 -2.671 1.00 75.51 C ATOM 2521 O LYS A 161 -3.980 6.180 -3.115 1.00 31.20 O ATOM 2522 CB LYS A 161 -2.354 6.359 -0.309 1.00 34.15 C ATOM 2523 CG LYS A 161 -2.125 5.914 1.123 1.00 3.11 C ATOM 2524 CD LYS A 161 -1.769 7.109 1.999 1.00 3.40 C ATOM 2525 CE LYS A 161 -1.184 6.683 3.332 1.00 2.31 C ATOM 2526 NZ LYS A 161 -0.845 7.852 4.189 1.00 22.01 N ATOM 0 H LYS A 161 -0.886 4.347 -0.675 1.00 74.31 H new ATOM 0 HA LYS A 161 -3.597 4.730 -0.988 1.00 63.12 H new ATOM 0 HB2 LYS A 161 -1.460 6.876 -0.657 1.00 34.15 H new ATOM 0 HB3 LYS A 161 -3.166 7.086 -0.319 1.00 34.15 H new ATOM 0 HG2 LYS A 161 -3.021 5.427 1.507 1.00 3.11 H new ATOM 0 HG3 LYS A 161 -1.322 5.177 1.158 1.00 3.11 H new ATOM 0 HD2 LYS A 161 -1.053 7.742 1.475 1.00 3.40 H new ATOM 0 HD3 LYS A 161 -2.661 7.711 2.171 1.00 3.40 H new ATOM 0 HE2 LYS A 161 -1.897 6.045 3.854 1.00 2.31 H new ATOM 0 HE3 LYS A 161 -0.288 6.086 3.161 1.00 2.31 H new ATOM 0 HZ1 LYS A 161 -0.268 7.536 4.995 1.00 22.01 H new ATOM 0 HZ2 LYS A 161 -0.310 8.548 3.631 1.00 22.01 H new ATOM 0 HZ3 LYS A 161 -1.720 8.290 4.541 1.00 22.01 H new ATOM 2540 N ILE A 162 -1.737 6.109 -3.318 1.00 12.23 N ATOM 2541 CA ILE A 162 -1.681 6.767 -4.604 1.00 54.25 C ATOM 2542 C ILE A 162 -2.104 5.842 -5.753 1.00 43.12 C ATOM 2543 O ILE A 162 -2.900 6.241 -6.594 1.00 62.43 O ATOM 2544 CB ILE A 162 -0.262 7.309 -4.843 1.00 3.13 C ATOM 2545 CG1 ILE A 162 -0.002 8.472 -3.899 1.00 22.11 C ATOM 2546 CG2 ILE A 162 -0.076 7.740 -6.280 1.00 41.34 C ATOM 2547 CD1 ILE A 162 1.450 8.636 -3.535 1.00 33.33 C ATOM 0 H ILE A 162 -0.825 5.827 -2.960 1.00 12.23 H new ATOM 0 HA ILE A 162 -2.393 7.592 -4.587 1.00 54.25 H new ATOM 0 HB ILE A 162 0.456 6.513 -4.644 1.00 3.13 H new ATOM 0 HG12 ILE A 162 -0.359 9.392 -4.362 1.00 22.11 H new ATOM 0 HG13 ILE A 162 -0.583 8.327 -2.988 1.00 22.11 H new ATOM 0 HG21 ILE A 162 0.937 8.119 -6.418 1.00 41.34 H new ATOM 0 HG22 ILE A 162 -0.238 6.887 -6.939 1.00 41.34 H new ATOM 0 HG23 ILE A 162 -0.793 8.525 -6.520 1.00 41.34 H new ATOM 0 HD11 ILE A 162 1.562 9.484 -2.859 1.00 33.33 H new ATOM 0 HD12 ILE A 162 1.806 7.731 -3.043 1.00 33.33 H new ATOM 0 HD13 ILE A 162 2.034 8.812 -4.438 1.00 33.33 H new ATOM 2559 N VAL A 163 -1.642 4.592 -5.758 1.00 31.23 N ATOM 2560 CA VAL A 163 -1.912 3.694 -6.891 1.00 11.12 C ATOM 2561 C VAL A 163 -3.354 3.188 -6.850 1.00 51.51 C ATOM 2562 O VAL A 163 -3.847 2.586 -7.811 1.00 13.24 O ATOM 2563 CB VAL A 163 -0.943 2.488 -6.947 1.00 64.12 C ATOM 2564 CG1 VAL A 163 0.495 2.960 -6.892 1.00 73.30 C ATOM 2565 CG2 VAL A 163 -1.231 1.490 -5.837 1.00 73.23 C ATOM 0 H VAL A 163 -1.088 4.179 -5.007 1.00 31.23 H new ATOM 0 HA VAL A 163 -1.754 4.286 -7.793 1.00 11.12 H new ATOM 0 HB VAL A 163 -1.101 1.975 -7.896 1.00 64.12 H new ATOM 0 HG11 VAL A 163 1.162 2.099 -6.932 1.00 73.30 H new ATOM 0 HG12 VAL A 163 0.696 3.615 -7.740 1.00 73.30 H new ATOM 0 HG13 VAL A 163 0.663 3.506 -5.964 1.00 73.30 H new ATOM 0 HG21 VAL A 163 -0.532 0.656 -5.907 1.00 73.23 H new ATOM 0 HG22 VAL A 163 -1.117 1.979 -4.870 1.00 73.23 H new ATOM 0 HG23 VAL A 163 -2.251 1.118 -5.938 1.00 73.23 H new ATOM 2575 N ILE A 164 -4.012 3.431 -5.717 1.00 61.51 N ATOM 2576 CA ILE A 164 -5.444 3.213 -5.573 1.00 15.43 C ATOM 2577 C ILE A 164 -6.206 4.050 -6.605 1.00 12.04 C ATOM 2578 O ILE A 164 -7.254 3.643 -7.106 1.00 32.24 O ATOM 2579 CB ILE A 164 -5.892 3.559 -4.126 1.00 32.24 C ATOM 2580 CG1 ILE A 164 -5.698 2.339 -3.218 1.00 3.42 C ATOM 2581 CG2 ILE A 164 -7.334 4.046 -4.073 1.00 14.40 C ATOM 2582 CD1 ILE A 164 -5.838 2.642 -1.742 1.00 52.13 C ATOM 0 H ILE A 164 -3.562 3.786 -4.873 1.00 61.51 H new ATOM 0 HA ILE A 164 -5.670 2.162 -5.754 1.00 15.43 H new ATOM 0 HB ILE A 164 -5.268 4.378 -3.769 1.00 32.24 H new ATOM 0 HG12 ILE A 164 -6.426 1.575 -3.492 1.00 3.42 H new ATOM 0 HG13 ILE A 164 -4.709 1.917 -3.400 1.00 3.42 H new ATOM 0 HG21 ILE A 164 -7.603 4.276 -3.042 1.00 14.40 H new ATOM 0 HG22 ILE A 164 -7.438 4.943 -4.684 1.00 14.40 H new ATOM 0 HG23 ILE A 164 -7.995 3.268 -4.456 1.00 14.40 H new ATOM 0 HD11 ILE A 164 -5.687 1.728 -1.167 1.00 52.13 H new ATOM 0 HD12 ILE A 164 -5.093 3.382 -1.450 1.00 52.13 H new ATOM 0 HD13 ILE A 164 -6.835 3.035 -1.544 1.00 52.13 H new ATOM 2594 N GLN A 165 -5.639 5.195 -6.949 1.00 45.12 N ATOM 2595 CA GLN A 165 -6.184 6.043 -7.990 1.00 33.02 C ATOM 2596 C GLN A 165 -5.212 6.049 -9.163 1.00 42.43 C ATOM 2597 O GLN A 165 -4.183 6.713 -9.117 1.00 0.03 O ATOM 2598 CB GLN A 165 -6.404 7.464 -7.465 1.00 12.44 C ATOM 2599 CG GLN A 165 -7.131 7.517 -6.129 1.00 22.24 C ATOM 2600 CD GLN A 165 -7.327 8.932 -5.618 1.00 34.31 C ATOM 2601 OE1 GLN A 165 -7.472 9.876 -6.395 1.00 53.14 O ATOM 2602 NE2 GLN A 165 -7.329 9.089 -4.304 1.00 51.31 N ATOM 0 H GLN A 165 -4.791 5.559 -6.515 1.00 45.12 H new ATOM 0 HA GLN A 165 -7.151 5.658 -8.314 1.00 33.02 H new ATOM 0 HB2 GLN A 165 -5.438 7.958 -7.363 1.00 12.44 H new ATOM 0 HB3 GLN A 165 -6.974 8.030 -8.202 1.00 12.44 H new ATOM 0 HG2 GLN A 165 -8.103 7.035 -6.231 1.00 22.24 H new ATOM 0 HG3 GLN A 165 -6.568 6.945 -5.392 1.00 22.24 H new ATOM 0 HE21 GLN A 165 -7.206 8.281 -3.694 1.00 51.31 H new ATOM 0 HE22 GLN A 165 -7.454 10.018 -3.902 1.00 51.31 H new ATOM 2611 N LYS A 166 -5.529 5.269 -10.188 1.00 4.21 N ATOM 2612 CA LYS A 166 -4.642 5.070 -11.331 1.00 4.32 C ATOM 2613 C LYS A 166 -4.293 6.379 -12.039 1.00 13.42 C ATOM 2614 O LYS A 166 -3.207 6.525 -12.586 1.00 40.41 O ATOM 2615 CB LYS A 166 -5.305 4.113 -12.309 1.00 50.11 C ATOM 2616 CG LYS A 166 -4.395 3.627 -13.414 1.00 73.04 C ATOM 2617 CD LYS A 166 -4.995 2.434 -14.127 1.00 12.41 C ATOM 2618 CE LYS A 166 -4.729 1.129 -13.382 1.00 33.22 C ATOM 2619 NZ LYS A 166 -5.687 0.891 -12.266 1.00 2.21 N ATOM 0 H LYS A 166 -6.408 4.756 -10.252 1.00 4.21 H new ATOM 0 HA LYS A 166 -3.706 4.653 -10.959 1.00 4.32 H new ATOM 0 HB2 LYS A 166 -5.681 3.251 -11.758 1.00 50.11 H new ATOM 0 HB3 LYS A 166 -6.168 4.607 -12.755 1.00 50.11 H new ATOM 0 HG2 LYS A 166 -4.222 4.432 -14.128 1.00 73.04 H new ATOM 0 HG3 LYS A 166 -3.425 3.356 -12.998 1.00 73.04 H new ATOM 0 HD2 LYS A 166 -6.070 2.578 -14.233 1.00 12.41 H new ATOM 0 HD3 LYS A 166 -4.582 2.368 -15.133 1.00 12.41 H new ATOM 0 HE2 LYS A 166 -4.785 0.298 -14.085 1.00 33.22 H new ATOM 0 HE3 LYS A 166 -3.714 1.144 -12.985 1.00 33.22 H new ATOM 0 HZ1 LYS A 166 -5.909 -0.123 -12.210 1.00 2.21 H new ATOM 0 HZ2 LYS A 166 -5.261 1.202 -11.370 1.00 2.21 H new ATOM 0 HZ3 LYS A 166 -6.561 1.428 -12.438 1.00 2.21 H new ATOM 2633 N TYR A 167 -5.222 7.311 -12.056 1.00 21.32 N ATOM 2634 CA TYR A 167 -4.970 8.603 -12.672 1.00 14.11 C ATOM 2635 C TYR A 167 -5.134 9.726 -11.663 1.00 12.31 C ATOM 2636 O TYR A 167 -6.126 9.784 -10.942 1.00 24.31 O ATOM 2637 CB TYR A 167 -5.900 8.823 -13.864 1.00 64.14 C ATOM 2638 CG TYR A 167 -5.645 7.861 -15.001 1.00 30.24 C ATOM 2639 CD1 TYR A 167 -6.212 6.591 -15.010 1.00 63.43 C ATOM 2640 CD2 TYR A 167 -4.815 8.214 -16.055 1.00 25.22 C ATOM 2641 CE1 TYR A 167 -5.957 5.703 -16.035 1.00 34.53 C ATOM 2642 CE2 TYR A 167 -4.561 7.333 -17.086 1.00 14.03 C ATOM 2643 CZ TYR A 167 -5.133 6.080 -17.069 1.00 10.42 C ATOM 2644 OH TYR A 167 -4.868 5.192 -18.089 1.00 45.20 O ATOM 0 H TYR A 167 -6.153 7.203 -11.654 1.00 21.32 H new ATOM 0 HA TYR A 167 -3.940 8.609 -13.029 1.00 14.11 H new ATOM 0 HB2 TYR A 167 -6.934 8.720 -13.534 1.00 64.14 H new ATOM 0 HB3 TYR A 167 -5.781 9.844 -14.226 1.00 64.14 H new ATOM 0 HD1 TYR A 167 -6.863 6.295 -14.201 1.00 63.43 H new ATOM 0 HD2 TYR A 167 -4.361 9.194 -16.069 1.00 25.22 H new ATOM 0 HE1 TYR A 167 -6.402 4.719 -16.025 1.00 34.53 H new ATOM 0 HE2 TYR A 167 -3.917 7.624 -17.902 1.00 14.03 H new ATOM 0 HH TYR A 167 -3.920 4.946 -18.070 1.00 45.20 H new ATOM 2654 N HIS A 168 -4.153 10.609 -11.623 1.00 73.13 N ATOM 2655 CA HIS A 168 -4.160 11.736 -10.698 1.00 72.11 C ATOM 2656 C HIS A 168 -4.026 13.047 -11.450 1.00 63.13 C ATOM 2657 O HIS A 168 -3.419 13.098 -12.517 1.00 71.53 O ATOM 2658 CB HIS A 168 -3.005 11.633 -9.702 1.00 12.03 C ATOM 2659 CG HIS A 168 -3.188 10.601 -8.638 1.00 35.14 C ATOM 2660 ND1 HIS A 168 -3.962 10.834 -7.532 1.00 35.34 N ATOM 2661 CD2 HIS A 168 -2.653 9.372 -8.551 1.00 1.41 C ATOM 2662 CE1 HIS A 168 -3.873 9.742 -6.798 1.00 33.00 C ATOM 2663 NE2 HIS A 168 -3.088 8.831 -7.377 1.00 44.41 N ATOM 0 H HIS A 168 -3.331 10.569 -12.226 1.00 73.13 H new ATOM 0 HA HIS A 168 -5.109 11.710 -10.163 1.00 72.11 H new ATOM 0 HB2 HIS A 168 -2.089 11.412 -10.250 1.00 12.03 H new ATOM 0 HB3 HIS A 168 -2.865 12.604 -9.227 1.00 12.03 H new ATOM 0 HD2 HIS A 168 -2.002 8.902 -9.273 1.00 1.41 H new ATOM 0 HE1 HIS A 168 -4.371 9.603 -5.850 1.00 33.00 H new ATOM 0 HE2 HIS A 168 -2.858 7.907 -7.011 1.00 44.41 H new ATOM 2671 N THR A 169 -4.578 14.106 -10.890 1.00 43.13 N ATOM 2672 CA THR A 169 -4.424 15.426 -11.470 1.00 13.35 C ATOM 2673 C THR A 169 -3.247 16.150 -10.820 1.00 63.24 C ATOM 2674 O THR A 169 -3.332 16.594 -9.677 1.00 44.12 O ATOM 2675 CB THR A 169 -5.705 16.269 -11.308 1.00 61.52 C ATOM 2676 OG1 THR A 169 -6.854 15.491 -11.675 1.00 11.33 O ATOM 2677 CG2 THR A 169 -5.647 17.517 -12.175 1.00 22.42 C ATOM 0 H THR A 169 -5.136 14.079 -10.036 1.00 43.13 H new ATOM 0 HA THR A 169 -4.234 15.300 -12.536 1.00 13.35 H new ATOM 0 HB THR A 169 -5.782 16.570 -10.263 1.00 61.52 H new ATOM 0 HG1 THR A 169 -7.664 16.033 -11.568 1.00 11.33 H new ATOM 0 HG21 THR A 169 -6.562 18.095 -12.043 1.00 22.42 H new ATOM 0 HG22 THR A 169 -4.790 18.123 -11.883 1.00 22.42 H new ATOM 0 HG23 THR A 169 -5.548 17.229 -13.221 1.00 22.42 H new ATOM 2685 N VAL A 170 -2.144 16.244 -11.549 1.00 70.34 N ATOM 2686 CA VAL A 170 -0.955 16.940 -11.068 1.00 32.02 C ATOM 2687 C VAL A 170 -0.666 18.123 -11.984 1.00 33.41 C ATOM 2688 O VAL A 170 -0.626 17.961 -13.201 1.00 24.14 O ATOM 2689 CB VAL A 170 0.289 16.018 -11.032 1.00 31.34 C ATOM 2690 CG1 VAL A 170 1.406 16.643 -10.210 1.00 4.21 C ATOM 2691 CG2 VAL A 170 -0.056 14.636 -10.495 1.00 32.23 C ATOM 0 H VAL A 170 -2.046 15.845 -12.482 1.00 70.34 H new ATOM 0 HA VAL A 170 -1.155 17.272 -10.049 1.00 32.02 H new ATOM 0 HB VAL A 170 0.638 15.902 -12.058 1.00 31.34 H new ATOM 0 HG11 VAL A 170 2.268 15.976 -10.201 1.00 4.21 H new ATOM 0 HG12 VAL A 170 1.691 17.598 -10.651 1.00 4.21 H new ATOM 0 HG13 VAL A 170 1.060 16.804 -9.189 1.00 4.21 H new ATOM 0 HG21 VAL A 170 0.840 14.016 -10.484 1.00 32.23 H new ATOM 0 HG22 VAL A 170 -0.447 14.727 -9.482 1.00 32.23 H new ATOM 0 HG23 VAL A 170 -0.808 14.175 -11.134 1.00 32.23 H new ATOM 2701 N ASN A 171 -0.454 19.303 -11.395 1.00 51.43 N ATOM 2702 CA ASN A 171 -0.307 20.557 -12.152 1.00 34.54 C ATOM 2703 C ASN A 171 -1.489 20.775 -13.116 1.00 15.44 C ATOM 2704 O ASN A 171 -1.345 21.327 -14.205 1.00 73.10 O ATOM 2705 CB ASN A 171 1.048 20.579 -12.889 1.00 33.23 C ATOM 2706 CG ASN A 171 1.434 21.967 -13.385 1.00 5.33 C ATOM 2707 OD1 ASN A 171 1.277 22.298 -14.560 1.00 40.31 O ATOM 2708 ND2 ASN A 171 1.920 22.799 -12.487 1.00 10.51 N ATOM 0 H ASN A 171 -0.379 19.420 -10.384 1.00 51.43 H new ATOM 0 HA ASN A 171 -0.321 21.389 -11.448 1.00 34.54 H new ATOM 0 HB2 ASN A 171 1.825 20.209 -12.220 1.00 33.23 H new ATOM 0 HB3 ASN A 171 1.005 19.895 -13.737 1.00 33.23 H new ATOM 0 HD21 ASN A 171 2.178 23.748 -12.758 1.00 10.51 H new ATOM 0 HD22 ASN A 171 2.038 22.494 -11.521 1.00 10.51 H new ATOM 2715 N GLY A 172 -2.670 20.342 -12.686 1.00 14.12 N ATOM 2716 CA GLY A 172 -3.870 20.484 -13.499 1.00 5.34 C ATOM 2717 C GLY A 172 -3.943 19.493 -14.651 1.00 21.31 C ATOM 2718 O GLY A 172 -4.904 19.502 -15.421 1.00 32.04 O ATOM 0 H GLY A 172 -2.820 19.892 -11.783 1.00 14.12 H new ATOM 0 HA2 GLY A 172 -4.747 20.356 -12.864 1.00 5.34 H new ATOM 0 HA3 GLY A 172 -3.911 21.497 -13.899 1.00 5.34 H new ATOM 2722 N HIS A 173 -2.943 18.632 -14.761 1.00 72.13 N ATOM 2723 CA HIS A 173 -2.873 17.658 -15.841 1.00 45.05 C ATOM 2724 C HIS A 173 -3.065 16.248 -15.291 1.00 54.11 C ATOM 2725 O HIS A 173 -2.403 15.851 -14.331 1.00 43.52 O ATOM 2726 CB HIS A 173 -1.522 17.786 -16.560 1.00 54.54 C ATOM 2727 CG HIS A 173 -1.348 16.872 -17.738 1.00 14.34 C ATOM 2728 ND1 HIS A 173 -2.043 17.061 -18.906 1.00 44.23 N ATOM 2729 CD2 HIS A 173 -0.541 15.795 -17.875 1.00 54.33 C ATOM 2730 CE1 HIS A 173 -1.643 16.100 -19.722 1.00 23.03 C ATOM 2731 NE2 HIS A 173 -0.735 15.310 -19.142 1.00 32.11 N ATOM 0 H HIS A 173 -2.161 18.588 -14.108 1.00 72.13 H new ATOM 0 HA HIS A 173 -3.671 17.852 -16.558 1.00 45.05 H new ATOM 0 HB2 HIS A 173 -1.401 18.816 -16.896 1.00 54.54 H new ATOM 0 HB3 HIS A 173 -0.725 17.589 -15.844 1.00 54.54 H new ATOM 0 HD2 HIS A 173 0.128 15.394 -17.128 1.00 54.33 H new ATOM 0 HE1 HIS A 173 -2.005 15.970 -20.731 1.00 23.03 H new ATOM 0 HE2 HIS A 173 -0.275 14.502 -19.561 1.00 32.11 H new ATOM 2739 N ASN A 174 -3.980 15.497 -15.888 1.00 44.13 N ATOM 2740 CA ASN A 174 -4.235 14.131 -15.453 1.00 33.31 C ATOM 2741 C ASN A 174 -3.156 13.191 -15.971 1.00 41.12 C ATOM 2742 O ASN A 174 -3.068 12.915 -17.168 1.00 74.25 O ATOM 2743 CB ASN A 174 -5.618 13.657 -15.909 1.00 21.23 C ATOM 2744 CG ASN A 174 -6.734 14.260 -15.077 1.00 54.24 C ATOM 2745 OD1 ASN A 174 -7.244 15.336 -15.385 1.00 52.32 O ATOM 2746 ND2 ASN A 174 -7.129 13.569 -14.019 1.00 21.25 N ATOM 0 H ASN A 174 -4.555 15.808 -16.671 1.00 44.13 H new ATOM 0 HA ASN A 174 -4.213 14.118 -14.363 1.00 33.31 H new ATOM 0 HB2 ASN A 174 -5.764 13.922 -16.956 1.00 21.23 H new ATOM 0 HB3 ASN A 174 -5.667 12.570 -15.846 1.00 21.23 H new ATOM 0 HD21 ASN A 174 -7.880 13.926 -13.428 1.00 21.25 H new ATOM 0 HD22 ASN A 174 -6.682 12.680 -13.795 1.00 21.25 H new ATOM 2753 N CYS A 175 -2.330 12.723 -15.053 1.00 61.44 N ATOM 2754 CA CYS A 175 -1.249 11.809 -15.369 1.00 21.10 C ATOM 2755 C CYS A 175 -1.558 10.431 -14.806 1.00 2.44 C ATOM 2756 O CYS A 175 -2.333 10.308 -13.854 1.00 52.25 O ATOM 2757 CB CYS A 175 0.059 12.327 -14.773 1.00 71.24 C ATOM 2758 SG CYS A 175 0.211 14.127 -14.792 1.00 3.03 S ATOM 0 H CYS A 175 -2.391 12.967 -14.065 1.00 61.44 H new ATOM 0 HA CYS A 175 -1.147 11.739 -16.452 1.00 21.10 H new ATOM 0 HB2 CYS A 175 0.142 11.976 -13.744 1.00 71.24 H new ATOM 0 HB3 CYS A 175 0.894 11.896 -15.325 1.00 71.24 H new ATOM 0 HG CYS A 175 -0.943 14.663 -14.526 1.00 3.03 H new ATOM 2764 N GLU A 176 -0.961 9.404 -15.385 1.00 4.44 N ATOM 2765 CA GLU A 176 -1.155 8.053 -14.897 1.00 22.22 C ATOM 2766 C GLU A 176 -0.116 7.728 -13.837 1.00 21.21 C ATOM 2767 O GLU A 176 1.077 7.958 -14.030 1.00 22.21 O ATOM 2768 CB GLU A 176 -1.076 7.034 -16.033 1.00 11.41 C ATOM 2769 CG GLU A 176 -1.626 5.671 -15.649 1.00 74.11 C ATOM 2770 CD GLU A 176 -1.451 4.638 -16.741 1.00 65.42 C ATOM 2771 OE1 GLU A 176 -2.175 4.714 -17.755 1.00 4.52 O ATOM 2772 OE2 GLU A 176 -0.588 3.741 -16.599 1.00 11.42 O ATOM 0 H GLU A 176 -0.340 9.481 -16.191 1.00 4.44 H new ATOM 0 HA GLU A 176 -2.151 7.994 -14.459 1.00 22.22 H new ATOM 0 HB2 GLU A 176 -1.629 7.413 -16.893 1.00 11.41 H new ATOM 0 HB3 GLU A 176 -0.037 6.926 -16.344 1.00 11.41 H new ATOM 0 HG2 GLU A 176 -1.126 5.325 -14.744 1.00 74.11 H new ATOM 0 HG3 GLU A 176 -2.686 5.766 -15.412 1.00 74.11 H new ATOM 2779 N VAL A 177 -0.589 7.200 -12.726 1.00 34.11 N ATOM 2780 CA VAL A 177 0.264 6.852 -11.610 1.00 70.11 C ATOM 2781 C VAL A 177 0.004 5.418 -11.178 1.00 42.24 C ATOM 2782 O VAL A 177 -1.143 4.999 -11.021 1.00 61.34 O ATOM 2783 CB VAL A 177 0.068 7.791 -10.405 1.00 34.21 C ATOM 2784 CG1 VAL A 177 1.142 7.540 -9.363 1.00 73.10 C ATOM 2785 CG2 VAL A 177 0.072 9.252 -10.831 1.00 63.51 C ATOM 0 H VAL A 177 -1.577 7.000 -12.572 1.00 34.11 H new ATOM 0 HA VAL A 177 1.293 6.960 -11.952 1.00 70.11 H new ATOM 0 HB VAL A 177 -0.907 7.576 -9.968 1.00 34.21 H new ATOM 0 HG11 VAL A 177 0.992 8.210 -8.517 1.00 73.10 H new ATOM 0 HG12 VAL A 177 1.084 6.506 -9.022 1.00 73.10 H new ATOM 0 HG13 VAL A 177 2.123 7.723 -9.801 1.00 73.10 H new ATOM 0 HG21 VAL A 177 -0.069 9.887 -9.956 1.00 63.51 H new ATOM 0 HG22 VAL A 177 1.025 9.491 -11.303 1.00 63.51 H new ATOM 0 HG23 VAL A 177 -0.738 9.427 -11.540 1.00 63.51 H new ATOM 2795 N ARG A 178 1.076 4.675 -10.989 1.00 4.24 N ATOM 2796 CA ARG A 178 0.978 3.258 -10.665 1.00 31.22 C ATOM 2797 C ARG A 178 2.254 2.783 -9.977 1.00 42.34 C ATOM 2798 O ARG A 178 3.197 3.557 -9.832 1.00 32.11 O ATOM 2799 CB ARG A 178 0.706 2.446 -11.944 1.00 63.23 C ATOM 2800 CG ARG A 178 1.940 2.170 -12.787 1.00 73.41 C ATOM 2801 CD ARG A 178 1.565 1.865 -14.226 1.00 3.14 C ATOM 2802 NE ARG A 178 2.718 1.435 -15.012 1.00 44.32 N ATOM 2803 CZ ARG A 178 2.822 1.581 -16.332 1.00 64.12 C ATOM 2804 NH1 ARG A 178 1.839 2.153 -17.027 1.00 44.20 N ATOM 2805 NH2 ARG A 178 3.917 1.162 -16.959 1.00 33.31 N ATOM 0 H ARG A 178 2.031 5.027 -11.054 1.00 4.24 H new ATOM 0 HA ARG A 178 0.147 3.105 -9.976 1.00 31.22 H new ATOM 0 HB2 ARG A 178 0.251 1.495 -11.666 1.00 63.23 H new ATOM 0 HB3 ARG A 178 -0.022 2.983 -12.552 1.00 63.23 H new ATOM 0 HG2 ARG A 178 2.605 3.033 -12.757 1.00 73.41 H new ATOM 0 HG3 ARG A 178 2.491 1.329 -12.366 1.00 73.41 H new ATOM 0 HD2 ARG A 178 0.803 1.086 -14.245 1.00 3.14 H new ATOM 0 HD3 ARG A 178 1.126 2.752 -14.682 1.00 3.14 H new ATOM 0 HE ARG A 178 3.494 0.994 -14.518 1.00 44.32 H new ATOM 0 HH11 ARG A 178 1.001 2.482 -16.548 1.00 44.20 H new ATOM 0 HH12 ARG A 178 1.925 2.262 -18.038 1.00 44.20 H new ATOM 0 HH21 ARG A 178 4.674 0.730 -16.429 1.00 33.31 H new ATOM 0 HH22 ARG A 178 4.000 1.272 -17.970 1.00 33.31 H new ATOM 2819 N LYS A 179 2.274 1.521 -9.551 1.00 74.34 N ATOM 2820 CA LYS A 179 3.448 0.947 -8.895 1.00 72.11 C ATOM 2821 C LYS A 179 4.649 0.952 -9.832 1.00 22.44 C ATOM 2822 O LYS A 179 4.560 0.498 -10.975 1.00 42.44 O ATOM 2823 CB LYS A 179 3.172 -0.492 -8.446 1.00 35.33 C ATOM 2824 CG LYS A 179 2.084 -0.624 -7.396 1.00 33.10 C ATOM 2825 CD LYS A 179 2.544 -0.138 -6.030 1.00 21.42 C ATOM 2826 CE LYS A 179 2.280 -1.183 -4.956 1.00 22.14 C ATOM 2827 NZ LYS A 179 0.849 -1.592 -4.905 1.00 71.42 N ATOM 0 H LYS A 179 1.490 0.876 -9.648 1.00 74.34 H new ATOM 0 HA LYS A 179 3.668 1.562 -8.022 1.00 72.11 H new ATOM 0 HB2 LYS A 179 2.893 -1.084 -9.317 1.00 35.33 H new ATOM 0 HB3 LYS A 179 4.094 -0.920 -8.052 1.00 35.33 H new ATOM 0 HG2 LYS A 179 1.209 -0.053 -7.708 1.00 33.10 H new ATOM 0 HG3 LYS A 179 1.775 -1.667 -7.324 1.00 33.10 H new ATOM 0 HD2 LYS A 179 3.609 0.092 -6.063 1.00 21.42 H new ATOM 0 HD3 LYS A 179 2.025 0.787 -5.777 1.00 21.42 H new ATOM 0 HE2 LYS A 179 2.900 -2.060 -5.145 1.00 22.14 H new ATOM 0 HE3 LYS A 179 2.577 -0.786 -3.985 1.00 22.14 H new ATOM 0 HZ1 LYS A 179 0.781 -2.578 -4.582 1.00 71.42 H new ATOM 0 HZ2 LYS A 179 0.335 -0.975 -4.244 1.00 71.42 H new ATOM 0 HZ3 LYS A 179 0.430 -1.509 -5.853 1.00 71.42 H new ATOM 2841 N ALA A 180 5.763 1.476 -9.352 1.00 12.44 N ATOM 2842 CA ALA A 180 6.991 1.461 -10.122 1.00 34.11 C ATOM 2843 C ALA A 180 7.955 0.468 -9.522 1.00 41.01 C ATOM 2844 O ALA A 180 8.437 0.643 -8.402 1.00 14.02 O ATOM 2845 CB ALA A 180 7.626 2.837 -10.177 1.00 3.44 C ATOM 0 H ALA A 180 5.841 1.916 -8.435 1.00 12.44 H new ATOM 0 HA ALA A 180 6.750 1.164 -11.143 1.00 34.11 H new ATOM 0 HB1 ALA A 180 8.545 2.791 -10.762 1.00 3.44 H new ATOM 0 HB2 ALA A 180 6.934 3.539 -10.643 1.00 3.44 H new ATOM 0 HB3 ALA A 180 7.856 3.172 -9.166 1.00 3.44 H new ATOM 2851 N LEU A 181 8.224 -0.577 -10.269 1.00 31.35 N ATOM 2852 CA LEU A 181 9.140 -1.600 -9.829 1.00 65.34 C ATOM 2853 C LEU A 181 10.495 -1.370 -10.460 1.00 54.20 C ATOM 2854 O LEU A 181 10.586 -0.861 -11.581 1.00 52.41 O ATOM 2855 CB LEU A 181 8.620 -2.985 -10.212 1.00 21.51 C ATOM 2856 CG LEU A 181 7.193 -3.300 -9.766 1.00 32.14 C ATOM 2857 CD1 LEU A 181 6.772 -4.655 -10.298 1.00 32.23 C ATOM 2858 CD2 LEU A 181 7.081 -3.267 -8.250 1.00 32.52 C ATOM 0 H LEU A 181 7.818 -0.740 -11.190 1.00 31.35 H new ATOM 0 HA LEU A 181 9.229 -1.550 -8.744 1.00 65.34 H new ATOM 0 HB2 LEU A 181 8.674 -3.087 -11.296 1.00 21.51 H new ATOM 0 HB3 LEU A 181 9.288 -3.735 -9.788 1.00 21.51 H new ATOM 0 HG LEU A 181 6.527 -2.538 -10.171 1.00 32.14 H new ATOM 0 HD11 LEU A 181 5.754 -4.872 -9.976 1.00 32.23 H new ATOM 0 HD12 LEU A 181 6.814 -4.647 -11.387 1.00 32.23 H new ATOM 0 HD13 LEU A 181 7.445 -5.422 -9.914 1.00 32.23 H new ATOM 0 HD21 LEU A 181 6.056 -3.494 -7.956 1.00 32.52 H new ATOM 0 HD22 LEU A 181 7.755 -4.008 -7.819 1.00 32.52 H new ATOM 0 HD23 LEU A 181 7.351 -2.276 -7.887 1.00 32.52 H new