USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1061 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 112 MET CE :methyl -144:sc= -0.262 (180deg=-1.15) USER MOD Set 1.2: A 134 HIS : no HD1:sc= -0.487 K(o=-2.2,f=-1.6) USER MOD Set 1.3: A 135 MET CE :methyl -126:sc= -1.45 (180deg=-2.72!) USER MOD Set 2.1: A 111 HIS : no HD1:sc= 0 X(o=0.037,f=-0.14) USER MOD Set 2.2: A 115 ASN : amide:sc= -0.0392 K(o=0.037,f=-2.2!) USER MOD Set 2.3: A 118 LYS NZ :NH3+ 163:sc= 0.0762 (180deg=-0.0784) USER MOD Set 3.1: A 85 THR OG1 : rot 176:sc= 1.23 USER MOD Set 3.2: A 98 GLN : amide:sc= -4.62! C(o=-3.4!,f=-8.2!) USER MOD Set 4.1: A 69 SER OG : rot -115:sc= -0.914! USER MOD Set 4.2: A 87 HIS : no HE2:sc= 1.13 K(o=0.22,f=-4.6!) USER MOD Set 5.1: A 14 GLN : amide:sc= 0.0325 K(o=0.066,f=-0.52) USER MOD Set 5.2: A 55 TYR OH : rot 131:sc= 0.0334 USER MOD Set 6.1: A 12 HIS : no HE2:sc= -0.0705 K(o=-0.65,f=-2.8) USER MOD Set 6.2: A 28 HIS : no HE2:sc= -0.583 K(o=-0.65,f=-5.8!) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 171:sc= -0.14 USER MOD Single : A 29 LYS NZ :NH3+ 170:sc= 1.22 (180deg=1.14) USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 178:sc= -1.06 (180deg=-1.07) USER MOD Single : A 43 TYR OH : rot 36:sc= 1.25 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.33) USER MOD Single : A 52 LYS NZ :NH3+ -136:sc= 1.24 (180deg=1.13) USER MOD Single : A 53 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00392) USER MOD Single : A 60 LYS NZ :NH3+ 165:sc= -0.0305 (180deg=-0.522) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 MET CE :methyl -171:sc= 0 (180deg=-0.14) USER MOD Single : A 66 SER OG : rot 148:sc= 0.0176 USER MOD Single : A 70 LYS NZ :NH3+ 145:sc= 0.634 (180deg=-0.776!) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0.729 K(o=0.73,f=0) USER MOD Single : A 84 SER OG : rot -179:sc= -2.18! USER MOD Single : A 94 SER OG : rot 180:sc= -0.0142 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -2.36 K(o=-2.4,f=-0.68) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.0302 K(o=-0.03,f=-1.8!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 THR OG1 : rot 90:sc= 1.3 USER MOD Single : A 125 LYS NZ :NH3+ 163:sc= 1.19 (180deg=0.991) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -100:sc= 0.899 USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 36.434 -3.592 1.742 1.00 0.00 N ATOM 98 CA GLU A 7 35.537 -4.000 2.775 1.00 0.00 C ATOM 99 C GLU A 7 34.167 -3.434 2.445 1.00 0.00 C ATOM 100 O GLU A 7 34.058 -2.262 2.054 1.00 0.00 O ATOM 101 CB GLU A 7 36.034 -3.500 4.125 1.00 0.00 C ATOM 102 CG GLU A 7 37.377 -4.086 4.520 1.00 0.00 C ATOM 103 CD GLU A 7 37.922 -3.484 5.778 1.00 0.00 C ATOM 104 OE1 GLU A 7 38.652 -2.480 5.699 1.00 0.00 O ATOM 105 OE2 GLU A 7 37.645 -4.013 6.878 1.00 0.00 O ATOM 0 HA GLU A 7 35.479 -5.087 2.835 1.00 0.00 H new ATOM 0 HB2 GLU A 7 36.113 -2.413 4.096 1.00 0.00 H new ATOM 0 HB3 GLU A 7 35.298 -3.746 4.890 1.00 0.00 H new ATOM 0 HG2 GLU A 7 37.274 -5.163 4.652 1.00 0.00 H new ATOM 0 HG3 GLU A 7 38.089 -3.931 3.710 1.00 0.00 H new ATOM 112 N PRO A 8 33.121 -4.235 2.586 1.00 0.00 N ATOM 113 CA PRO A 8 31.774 -3.854 2.173 1.00 0.00 C ATOM 114 C PRO A 8 31.091 -2.830 3.085 1.00 0.00 C ATOM 115 O PRO A 8 31.708 -2.229 3.975 1.00 0.00 O ATOM 116 CB PRO A 8 31.023 -5.172 2.208 1.00 0.00 C ATOM 117 CG PRO A 8 31.710 -5.954 3.270 1.00 0.00 C ATOM 118 CD PRO A 8 33.155 -5.594 3.165 1.00 0.00 C ATOM 0 HA PRO A 8 31.793 -3.358 1.203 1.00 0.00 H new ATOM 0 HB2 PRO A 8 29.969 -5.024 2.441 1.00 0.00 H new ATOM 0 HB3 PRO A 8 31.068 -5.682 1.246 1.00 0.00 H new ATOM 0 HG2 PRO A 8 31.315 -5.707 4.256 1.00 0.00 H new ATOM 0 HG3 PRO A 8 31.562 -7.024 3.126 1.00 0.00 H new ATOM 0 HD2 PRO A 8 33.645 -5.605 4.139 1.00 0.00 H new ATOM 0 HD3 PRO A 8 33.699 -6.291 2.527 1.00 0.00 H new ATOM 126 N LEU A 9 29.824 -2.648 2.866 1.00 0.00 N ATOM 127 CA LEU A 9 29.050 -1.685 3.600 1.00 0.00 C ATOM 128 C LEU A 9 27.772 -2.371 4.031 1.00 0.00 C ATOM 129 O LEU A 9 27.062 -2.896 3.193 1.00 0.00 O ATOM 130 CB LEU A 9 28.715 -0.484 2.672 1.00 0.00 C ATOM 131 CG LEU A 9 28.517 0.912 3.332 1.00 0.00 C ATOM 132 CD1 LEU A 9 27.330 0.949 4.284 1.00 0.00 C ATOM 133 CD2 LEU A 9 29.788 1.359 4.044 1.00 0.00 C ATOM 0 H LEU A 9 29.291 -3.166 2.168 1.00 0.00 H new ATOM 0 HA LEU A 9 29.599 -1.316 4.466 1.00 0.00 H new ATOM 0 HB2 LEU A 9 29.515 -0.396 1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.804 -0.728 2.125 1.00 0.00 H new ATOM 0 HG LEU A 9 28.298 1.611 2.525 1.00 0.00 H new ATOM 0 HD11 LEU A 9 27.240 1.946 4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 9 26.418 0.706 3.738 1.00 0.00 H new ATOM 0 HD13 LEU A 9 27.480 0.221 5.082 1.00 0.00 H new ATOM 0 HD21 LEU A 9 29.626 2.337 4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 9 30.044 0.637 4.820 1.00 0.00 H new ATOM 0 HD23 LEU A 9 30.605 1.423 3.325 1.00 0.00 H new ATOM 145 N GLN A 10 27.533 -2.428 5.319 1.00 0.00 N ATOM 146 CA GLN A 10 26.309 -2.990 5.863 1.00 0.00 C ATOM 147 C GLN A 10 25.178 -1.995 5.759 1.00 0.00 C ATOM 148 O GLN A 10 25.147 -0.981 6.475 1.00 0.00 O ATOM 149 CB GLN A 10 26.499 -3.432 7.302 1.00 0.00 C ATOM 150 CG GLN A 10 27.313 -4.684 7.447 1.00 0.00 C ATOM 151 CD GLN A 10 27.580 -5.066 8.880 1.00 0.00 C ATOM 152 OE1 GLN A 10 26.797 -4.773 9.789 1.00 0.00 O ATOM 153 NE2 GLN A 10 28.672 -5.729 9.092 1.00 0.00 N ATOM 0 H GLN A 10 28.182 -2.085 6.027 1.00 0.00 H new ATOM 0 HA GLN A 10 26.054 -3.871 5.274 1.00 0.00 H new ATOM 0 HB2 GLN A 10 26.982 -2.629 7.858 1.00 0.00 H new ATOM 0 HB3 GLN A 10 25.521 -3.591 7.756 1.00 0.00 H new ATOM 0 HG2 GLN A 10 26.794 -5.504 6.951 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.264 -4.551 6.932 1.00 0.00 H new ATOM 0 HE21 GLN A 10 29.293 -5.951 8.314 1.00 0.00 H new ATOM 0 HE22 GLN A 10 28.911 -6.029 10.037 1.00 0.00 H new ATOM 162 N VAL A 11 24.294 -2.273 4.858 1.00 0.00 N ATOM 163 CA VAL A 11 23.180 -1.437 4.563 1.00 0.00 C ATOM 164 C VAL A 11 21.911 -2.110 5.037 1.00 0.00 C ATOM 165 O VAL A 11 21.596 -3.226 4.606 1.00 0.00 O ATOM 166 CB VAL A 11 23.033 -1.229 3.045 1.00 0.00 C ATOM 167 CG1 VAL A 11 22.098 -0.086 2.742 1.00 0.00 C ATOM 168 CG2 VAL A 11 24.368 -1.057 2.358 1.00 0.00 C ATOM 0 H VAL A 11 24.330 -3.118 4.288 1.00 0.00 H new ATOM 0 HA VAL A 11 23.342 -0.480 5.060 1.00 0.00 H new ATOM 0 HB VAL A 11 22.591 -2.138 2.637 1.00 0.00 H new ATOM 0 HG11 VAL A 11 22.013 0.038 1.662 1.00 0.00 H new ATOM 0 HG12 VAL A 11 21.115 -0.299 3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 11 22.489 0.831 3.183 1.00 0.00 H new ATOM 0 HG21 VAL A 11 24.211 -0.913 1.289 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.880 -0.187 2.770 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.977 -1.946 2.519 1.00 0.00 H new ATOM 178 N HIS A 12 21.212 -1.460 5.907 1.00 0.00 N ATOM 179 CA HIS A 12 19.934 -1.925 6.362 1.00 0.00 C ATOM 180 C HIS A 12 18.878 -1.174 5.571 1.00 0.00 C ATOM 181 O HIS A 12 18.735 0.035 5.707 1.00 0.00 O ATOM 182 CB HIS A 12 19.790 -1.668 7.867 1.00 0.00 C ATOM 183 CG HIS A 12 18.491 -2.131 8.474 1.00 0.00 C ATOM 184 ND1 HIS A 12 17.835 -1.452 9.473 1.00 0.00 N ATOM 185 CD2 HIS A 12 17.749 -3.239 8.230 1.00 0.00 C ATOM 186 CE1 HIS A 12 16.751 -2.135 9.800 1.00 0.00 C ATOM 187 NE2 HIS A 12 16.644 -3.235 9.076 1.00 0.00 N ATOM 0 H HIS A 12 21.511 -0.581 6.330 1.00 0.00 H new ATOM 0 HA HIS A 12 19.823 -2.998 6.206 1.00 0.00 H new ATOM 0 HB2 HIS A 12 20.612 -2.163 8.384 1.00 0.00 H new ATOM 0 HB3 HIS A 12 19.897 -0.599 8.049 1.00 0.00 H new ATOM 0 HD1 HIS A 12 18.134 -0.571 9.891 1.00 0.00 H new ATOM 0 HD2 HIS A 12 17.978 -4.000 7.499 1.00 0.00 H new ATOM 0 HE1 HIS A 12 16.045 -1.833 10.560 1.00 0.00 H new ATOM 195 N VAL A 13 18.200 -1.867 4.716 1.00 0.00 N ATOM 196 CA VAL A 13 17.231 -1.271 3.864 1.00 0.00 C ATOM 197 C VAL A 13 15.839 -1.628 4.306 1.00 0.00 C ATOM 198 O VAL A 13 15.574 -2.749 4.782 1.00 0.00 O ATOM 199 CB VAL A 13 17.437 -1.684 2.377 1.00 0.00 C ATOM 200 CG1 VAL A 13 18.853 -1.461 1.950 1.00 0.00 C ATOM 201 CG2 VAL A 13 17.056 -3.108 2.119 1.00 0.00 C ATOM 0 H VAL A 13 18.306 -2.874 4.590 1.00 0.00 H new ATOM 0 HA VAL A 13 17.362 -0.191 3.936 1.00 0.00 H new ATOM 0 HB VAL A 13 16.775 -1.049 1.789 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.970 -1.758 0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 13 19.103 -0.406 2.057 1.00 0.00 H new ATOM 0 HG13 VAL A 13 19.519 -2.057 2.574 1.00 0.00 H new ATOM 0 HG21 VAL A 13 17.219 -3.343 1.067 1.00 0.00 H new ATOM 0 HG22 VAL A 13 17.667 -3.766 2.737 1.00 0.00 H new ATOM 0 HG23 VAL A 13 16.004 -3.253 2.364 1.00 0.00 H new ATOM 211 N GLN A 14 14.987 -0.678 4.196 1.00 0.00 N ATOM 212 CA GLN A 14 13.603 -0.863 4.443 1.00 0.00 C ATOM 213 C GLN A 14 12.893 -0.706 3.126 1.00 0.00 C ATOM 214 O GLN A 14 12.988 0.345 2.486 1.00 0.00 O ATOM 215 CB GLN A 14 13.081 0.152 5.463 1.00 0.00 C ATOM 216 CG GLN A 14 11.575 0.067 5.702 1.00 0.00 C ATOM 217 CD GLN A 14 11.085 1.067 6.722 1.00 0.00 C ATOM 218 OE1 GLN A 14 11.794 1.426 7.649 1.00 0.00 O ATOM 219 NE2 GLN A 14 9.875 1.539 6.550 1.00 0.00 N ATOM 0 H GLN A 14 15.236 0.273 3.925 1.00 0.00 H new ATOM 0 HA GLN A 14 13.423 -1.852 4.865 1.00 0.00 H new ATOM 0 HB2 GLN A 14 13.599 0.000 6.410 1.00 0.00 H new ATOM 0 HB3 GLN A 14 13.329 1.157 5.121 1.00 0.00 H new ATOM 0 HG2 GLN A 14 11.053 0.231 4.759 1.00 0.00 H new ATOM 0 HG3 GLN A 14 11.321 -0.939 6.036 1.00 0.00 H new ATOM 0 HE21 GLN A 14 9.309 1.218 5.765 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.499 2.228 7.201 1.00 0.00 H new ATOM 228 N LEU A 15 12.274 -1.750 2.682 1.00 0.00 N ATOM 229 CA LEU A 15 11.541 -1.709 1.473 1.00 0.00 C ATOM 230 C LEU A 15 10.069 -1.553 1.784 1.00 0.00 C ATOM 231 O LEU A 15 9.501 -2.380 2.503 1.00 0.00 O ATOM 232 CB LEU A 15 11.736 -2.984 0.651 1.00 0.00 C ATOM 233 CG LEU A 15 13.145 -3.342 0.143 1.00 0.00 C ATOM 234 CD1 LEU A 15 13.989 -2.131 -0.227 1.00 0.00 C ATOM 235 CD2 LEU A 15 13.863 -4.305 1.045 1.00 0.00 C ATOM 0 H LEU A 15 12.266 -2.655 3.153 1.00 0.00 H new ATOM 0 HA LEU A 15 11.906 -0.863 0.890 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.382 -3.820 1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 15 11.081 -2.918 -0.218 1.00 0.00 H new ATOM 0 HG LEU A 15 12.984 -3.871 -0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.967 -2.462 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 15 13.492 -1.570 -1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 15 14.113 -1.493 0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.850 -4.520 0.636 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.969 -3.865 2.036 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.291 -5.230 1.118 1.00 0.00 H new ATOM 247 N GLU A 16 9.468 -0.509 1.288 1.00 0.00 N ATOM 248 CA GLU A 16 8.048 -0.303 1.463 1.00 0.00 C ATOM 249 C GLU A 16 7.357 -0.655 0.176 1.00 0.00 C ATOM 250 O GLU A 16 7.725 -0.156 -0.878 1.00 0.00 O ATOM 251 CB GLU A 16 7.722 1.149 1.810 1.00 0.00 C ATOM 252 CG GLU A 16 8.365 1.670 3.071 1.00 0.00 C ATOM 253 CD GLU A 16 7.858 3.045 3.428 1.00 0.00 C ATOM 254 OE1 GLU A 16 8.311 4.051 2.829 1.00 0.00 O ATOM 255 OE2 GLU A 16 7.002 3.157 4.324 1.00 0.00 O ATOM 0 H GLU A 16 9.939 0.221 0.754 1.00 0.00 H new ATOM 0 HA GLU A 16 7.709 -0.932 2.286 1.00 0.00 H new ATOM 0 HB2 GLU A 16 8.028 1.782 0.977 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.641 1.249 1.905 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.164 0.983 3.893 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.447 1.703 2.941 1.00 0.00 H new ATOM 262 N LYS A 17 6.380 -1.497 0.232 1.00 0.00 N ATOM 263 CA LYS A 17 5.684 -1.880 -0.968 1.00 0.00 C ATOM 264 C LYS A 17 4.263 -1.443 -0.870 1.00 0.00 C ATOM 265 O LYS A 17 3.476 -2.085 -0.203 1.00 0.00 O ATOM 266 CB LYS A 17 5.767 -3.388 -1.207 1.00 0.00 C ATOM 267 CG LYS A 17 7.181 -3.911 -1.367 1.00 0.00 C ATOM 268 CD LYS A 17 7.187 -5.402 -1.633 1.00 0.00 C ATOM 269 CE LYS A 17 8.604 -5.918 -1.785 1.00 0.00 C ATOM 270 NZ LYS A 17 8.648 -7.360 -2.084 1.00 0.00 N ATOM 0 H LYS A 17 6.040 -1.936 1.088 1.00 0.00 H new ATOM 0 HA LYS A 17 6.160 -1.392 -1.818 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.292 -3.904 -0.373 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.196 -3.636 -2.102 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.673 -3.390 -2.188 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.755 -3.698 -0.465 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.692 -5.924 -0.814 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.618 -5.616 -2.538 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.104 -5.369 -2.583 1.00 0.00 H new ATOM 0 HE3 LYS A 17 9.159 -5.723 -0.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.638 -7.665 -2.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.195 -7.889 -1.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.142 -7.546 -2.973 1.00 0.00 H new ATOM 284 N VAL A 18 3.937 -0.334 -1.498 1.00 0.00 N ATOM 285 CA VAL A 18 2.604 0.217 -1.385 1.00 0.00 C ATOM 286 C VAL A 18 1.712 -0.457 -2.414 1.00 0.00 C ATOM 287 O VAL A 18 1.787 -0.162 -3.604 1.00 0.00 O ATOM 288 CB VAL A 18 2.572 1.773 -1.601 1.00 0.00 C ATOM 289 CG1 VAL A 18 1.262 2.381 -1.124 1.00 0.00 C ATOM 290 CG2 VAL A 18 3.788 2.469 -0.976 1.00 0.00 C ATOM 0 H VAL A 18 4.573 0.201 -2.089 1.00 0.00 H new ATOM 0 HA VAL A 18 2.248 0.029 -0.372 1.00 0.00 H new ATOM 0 HB VAL A 18 2.633 1.944 -2.676 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.279 3.458 -1.290 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.433 1.941 -1.679 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.134 2.180 -0.060 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.722 3.543 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.806 2.276 0.097 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.701 2.083 -1.429 1.00 0.00 H new ATOM 300 N TYR A 19 0.950 -1.405 -1.986 1.00 0.00 N ATOM 301 CA TYR A 19 0.047 -2.087 -2.873 1.00 0.00 C ATOM 302 C TYR A 19 -1.193 -1.240 -3.083 1.00 0.00 C ATOM 303 O TYR A 19 -1.436 -0.311 -2.307 1.00 0.00 O ATOM 304 CB TYR A 19 -0.326 -3.438 -2.310 1.00 0.00 C ATOM 305 CG TYR A 19 0.777 -4.468 -2.304 1.00 0.00 C ATOM 306 CD1 TYR A 19 1.749 -4.478 -1.321 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.822 -5.451 -3.278 1.00 0.00 C ATOM 308 CE1 TYR A 19 2.736 -5.436 -1.310 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.811 -6.415 -3.277 1.00 0.00 C ATOM 310 CZ TYR A 19 2.765 -6.402 -2.288 1.00 0.00 C ATOM 311 OH TYR A 19 3.760 -7.364 -2.272 1.00 0.00 O ATOM 0 H TYR A 19 0.929 -1.733 -1.021 1.00 0.00 H new ATOM 0 HA TYR A 19 0.539 -2.243 -3.833 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -0.677 -3.301 -1.287 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.164 -3.832 -2.884 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.733 -3.722 -0.550 1.00 0.00 H new ATOM 0 HD2 TYR A 19 0.070 -5.464 -4.053 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.487 -5.429 -0.534 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.834 -7.172 -4.047 1.00 0.00 H new ATOM 0 HH TYR A 19 3.638 -7.973 -3.030 1.00 0.00 H new ATOM 321 N LEU A 20 -1.984 -1.570 -4.111 1.00 0.00 N ATOM 322 CA LEU A 20 -3.197 -0.789 -4.454 1.00 0.00 C ATOM 323 C LEU A 20 -4.148 -0.727 -3.285 1.00 0.00 C ATOM 324 O LEU A 20 -4.793 0.273 -3.061 1.00 0.00 O ATOM 325 CB LEU A 20 -3.952 -1.415 -5.619 1.00 0.00 C ATOM 326 CG LEU A 20 -3.217 -1.574 -6.934 1.00 0.00 C ATOM 327 CD1 LEU A 20 -4.145 -2.219 -7.939 1.00 0.00 C ATOM 328 CD2 LEU A 20 -2.720 -0.232 -7.441 1.00 0.00 C ATOM 0 H LEU A 20 -1.814 -2.368 -4.723 1.00 0.00 H new ATOM 0 HA LEU A 20 -2.854 0.210 -4.723 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.294 -2.401 -5.305 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -4.842 -0.813 -5.803 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.344 -2.210 -6.787 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.625 -2.338 -8.890 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.457 -3.196 -7.571 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.022 -1.588 -8.081 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.196 -0.372 -8.386 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.568 0.437 -7.592 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.040 0.204 -6.710 1.00 0.00 H new ATOM 340 N ASP A 21 -4.205 -1.820 -2.560 1.00 0.00 N ATOM 341 CA ASP A 21 -5.096 -1.985 -1.397 1.00 0.00 C ATOM 342 C ASP A 21 -4.779 -1.019 -0.268 1.00 0.00 C ATOM 343 O ASP A 21 -5.644 -0.643 0.500 1.00 0.00 O ATOM 344 CB ASP A 21 -5.000 -3.420 -0.884 1.00 0.00 C ATOM 345 CG ASP A 21 -5.732 -3.670 0.413 1.00 0.00 C ATOM 346 OD1 ASP A 21 -6.835 -3.164 0.588 1.00 0.00 O ATOM 347 OD2 ASP A 21 -5.240 -4.430 1.246 1.00 0.00 O ATOM 0 H ASP A 21 -3.631 -2.642 -2.751 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.109 -1.763 -1.733 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.395 -4.092 -1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.949 -3.675 -0.749 1.00 0.00 H new ATOM 352 N GLY A 22 -3.562 -0.601 -0.186 1.00 0.00 N ATOM 353 CA GLY A 22 -3.175 0.216 0.918 1.00 0.00 C ATOM 354 C GLY A 22 -2.213 -0.528 1.782 1.00 0.00 C ATOM 355 O GLY A 22 -1.525 0.054 2.612 1.00 0.00 O ATOM 0 H GLY A 22 -2.824 -0.807 -0.860 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.718 1.138 0.558 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.053 0.501 1.497 1.00 0.00 H new ATOM 359 N ASP A 23 -2.197 -1.830 1.598 1.00 0.00 N ATOM 360 CA ASP A 23 -1.279 -2.713 2.289 1.00 0.00 C ATOM 361 C ASP A 23 0.132 -2.405 1.870 1.00 0.00 C ATOM 362 O ASP A 23 0.454 -2.419 0.676 1.00 0.00 O ATOM 363 CB ASP A 23 -1.604 -4.187 1.987 1.00 0.00 C ATOM 364 CG ASP A 23 -0.569 -5.161 2.546 1.00 0.00 C ATOM 365 OD1 ASP A 23 -0.419 -5.250 3.787 1.00 0.00 O ATOM 366 OD2 ASP A 23 0.114 -5.854 1.758 1.00 0.00 O ATOM 0 H ASP A 23 -2.828 -2.312 0.957 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.385 -2.551 3.362 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.582 -4.429 2.403 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.674 -4.322 0.908 1.00 0.00 H new ATOM 371 N VAL A 24 0.951 -2.049 2.812 1.00 0.00 N ATOM 372 CA VAL A 24 2.320 -1.805 2.507 1.00 0.00 C ATOM 373 C VAL A 24 3.137 -2.864 3.167 1.00 0.00 C ATOM 374 O VAL A 24 3.171 -2.963 4.395 1.00 0.00 O ATOM 375 CB VAL A 24 2.817 -0.410 2.972 1.00 0.00 C ATOM 376 CG1 VAL A 24 4.204 -0.122 2.430 1.00 0.00 C ATOM 377 CG2 VAL A 24 1.844 0.687 2.589 1.00 0.00 C ATOM 0 H VAL A 24 0.694 -1.923 3.791 1.00 0.00 H new ATOM 0 HA VAL A 24 2.426 -1.825 1.422 1.00 0.00 H new ATOM 0 HB VAL A 24 2.874 -0.428 4.060 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.530 0.861 2.769 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.900 -0.880 2.790 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.180 -0.140 1.340 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.227 1.649 2.931 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.727 0.708 1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.877 0.495 3.054 1.00 0.00 H new ATOM 387 N SER A 25 3.771 -3.658 2.377 1.00 0.00 N ATOM 388 CA SER A 25 4.609 -4.679 2.896 1.00 0.00 C ATOM 389 C SER A 25 5.950 -4.085 3.219 1.00 0.00 C ATOM 390 O SER A 25 6.604 -3.497 2.353 1.00 0.00 O ATOM 391 CB SER A 25 4.731 -5.797 1.901 1.00 0.00 C ATOM 392 OG SER A 25 3.445 -6.305 1.568 1.00 0.00 O ATOM 0 H SER A 25 3.724 -3.618 1.359 1.00 0.00 H new ATOM 0 HA SER A 25 4.179 -5.094 3.807 1.00 0.00 H new ATOM 0 HB2 SER A 25 5.232 -5.439 1.002 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.349 -6.595 2.314 1.00 0.00 H new ATOM 0 HG SER A 25 3.524 -6.929 0.816 1.00 0.00 H new ATOM 398 N ILE A 26 6.316 -4.177 4.464 1.00 0.00 N ATOM 399 CA ILE A 26 7.540 -3.625 4.934 1.00 0.00 C ATOM 400 C ILE A 26 8.578 -4.726 5.054 1.00 0.00 C ATOM 401 O ILE A 26 8.439 -5.659 5.866 1.00 0.00 O ATOM 402 CB ILE A 26 7.337 -2.914 6.300 1.00 0.00 C ATOM 403 CG1 ILE A 26 6.258 -1.828 6.191 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.636 -2.303 6.794 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.566 -0.747 5.179 1.00 0.00 C ATOM 0 H ILE A 26 5.764 -4.643 5.184 1.00 0.00 H new ATOM 0 HA ILE A 26 7.889 -2.879 4.220 1.00 0.00 H new ATOM 0 HB ILE A 26 7.011 -3.665 7.020 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.311 -2.298 5.927 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.123 -1.366 7.169 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.466 -1.812 7.752 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.384 -3.087 6.916 1.00 0.00 H new ATOM 0 HG23 ILE A 26 8.993 -1.571 6.069 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.754 -0.020 5.165 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.496 -0.247 5.452 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.671 -1.193 4.190 1.00 0.00 H new ATOM 417 N GLU A 27 9.585 -4.626 4.259 1.00 0.00 N ATOM 418 CA GLU A 27 10.638 -5.587 4.245 1.00 0.00 C ATOM 419 C GLU A 27 11.921 -4.949 4.739 1.00 0.00 C ATOM 420 O GLU A 27 12.146 -3.771 4.529 1.00 0.00 O ATOM 421 CB GLU A 27 10.806 -6.148 2.831 1.00 0.00 C ATOM 422 CG GLU A 27 12.038 -6.999 2.636 1.00 0.00 C ATOM 423 CD GLU A 27 11.989 -8.312 3.380 1.00 0.00 C ATOM 424 OE1 GLU A 27 11.916 -8.301 4.622 1.00 0.00 O ATOM 425 OE2 GLU A 27 12.078 -9.370 2.733 1.00 0.00 O ATOM 0 H GLU A 27 9.705 -3.865 3.590 1.00 0.00 H new ATOM 0 HA GLU A 27 10.391 -6.413 4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.927 -6.742 2.583 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.839 -5.317 2.126 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.167 -7.198 1.572 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.913 -6.438 2.964 1.00 0.00 H new ATOM 432 N HIS A 28 12.740 -5.724 5.401 1.00 0.00 N ATOM 433 CA HIS A 28 13.996 -5.249 5.944 1.00 0.00 C ATOM 434 C HIS A 28 15.089 -6.194 5.581 1.00 0.00 C ATOM 435 O HIS A 28 15.037 -7.388 5.912 1.00 0.00 O ATOM 436 CB HIS A 28 13.956 -5.066 7.465 1.00 0.00 C ATOM 437 CG HIS A 28 13.141 -3.907 7.933 1.00 0.00 C ATOM 438 ND1 HIS A 28 13.635 -2.880 8.689 1.00 0.00 N ATOM 439 CD2 HIS A 28 11.843 -3.655 7.771 1.00 0.00 C ATOM 440 CE1 HIS A 28 12.636 -2.051 8.969 1.00 0.00 C ATOM 441 NE2 HIS A 28 11.508 -2.476 8.433 1.00 0.00 N ATOM 0 H HIS A 28 12.557 -6.711 5.582 1.00 0.00 H new ATOM 0 HA HIS A 28 14.182 -4.267 5.508 1.00 0.00 H new ATOM 0 HB2 HIS A 28 13.561 -5.976 7.916 1.00 0.00 H new ATOM 0 HB3 HIS A 28 14.976 -4.946 7.830 1.00 0.00 H new ATOM 0 HD1 HIS A 28 14.604 -2.770 8.987 1.00 0.00 H new ATOM 0 HD2 HIS A 28 11.155 -4.271 7.211 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.734 -1.150 9.556 1.00 0.00 H new ATOM 449 N LYS A 29 16.060 -5.683 4.906 1.00 0.00 N ATOM 450 CA LYS A 29 17.189 -6.470 4.468 1.00 0.00 C ATOM 451 C LYS A 29 18.435 -5.818 4.986 1.00 0.00 C ATOM 452 O LYS A 29 18.495 -4.598 5.077 1.00 0.00 O ATOM 453 CB LYS A 29 17.327 -6.479 2.931 1.00 0.00 C ATOM 454 CG LYS A 29 16.111 -6.782 2.127 1.00 0.00 C ATOM 455 CD LYS A 29 15.598 -8.152 2.376 1.00 0.00 C ATOM 456 CE LYS A 29 14.985 -8.657 1.111 1.00 0.00 C ATOM 457 NZ LYS A 29 14.302 -9.948 1.274 1.00 0.00 N ATOM 0 H LYS A 29 16.105 -4.701 4.634 1.00 0.00 H new ATOM 0 HA LYS A 29 17.044 -7.488 4.831 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.698 -5.502 2.622 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.093 -7.208 2.668 1.00 0.00 H new ATOM 0 HG2 LYS A 29 15.332 -6.057 2.363 1.00 0.00 H new ATOM 0 HG3 LYS A 29 16.341 -6.670 1.068 1.00 0.00 H new ATOM 0 HD2 LYS A 29 16.407 -8.809 2.695 1.00 0.00 H new ATOM 0 HD3 LYS A 29 14.860 -8.142 3.178 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.272 -7.920 0.741 1.00 0.00 H new ATOM 0 HE3 LYS A 29 15.762 -8.757 0.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 13.757 -10.163 0.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 15.007 -10.696 1.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.658 -9.900 2.089 1.00 0.00 H new ATOM 471 N HIS A 30 19.396 -6.597 5.333 1.00 0.00 N ATOM 472 CA HIS A 30 20.692 -6.070 5.651 1.00 0.00 C ATOM 473 C HIS A 30 21.694 -6.709 4.711 1.00 0.00 C ATOM 474 O HIS A 30 21.831 -7.936 4.679 1.00 0.00 O ATOM 475 CB HIS A 30 21.083 -6.224 7.164 1.00 0.00 C ATOM 476 CG HIS A 30 21.266 -7.633 7.704 1.00 0.00 C ATOM 477 ND1 HIS A 30 20.299 -8.331 8.388 1.00 0.00 N ATOM 478 CD2 HIS A 30 22.357 -8.443 7.686 1.00 0.00 C ATOM 479 CE1 HIS A 30 20.809 -9.508 8.756 1.00 0.00 C ATOM 480 NE2 HIS A 30 22.062 -9.630 8.353 1.00 0.00 N ATOM 0 H HIS A 30 19.317 -7.611 5.407 1.00 0.00 H new ATOM 0 HA HIS A 30 20.683 -4.990 5.503 1.00 0.00 H new ATOM 0 HB2 HIS A 30 22.012 -5.678 7.328 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.315 -5.733 7.761 1.00 0.00 H new ATOM 0 HD2 HIS A 30 23.305 -8.204 7.226 1.00 0.00 H new ATOM 0 HE1 HIS A 30 20.269 -10.262 9.310 1.00 0.00 H new ATOM 0 HE2 HIS A 30 22.683 -10.426 8.500 1.00 0.00 H new ATOM 488 N GLU A 31 22.322 -5.924 3.885 1.00 0.00 N ATOM 489 CA GLU A 31 23.273 -6.468 2.957 1.00 0.00 C ATOM 490 C GLU A 31 24.583 -5.765 3.053 1.00 0.00 C ATOM 491 O GLU A 31 24.650 -4.630 3.485 1.00 0.00 O ATOM 492 CB GLU A 31 22.755 -6.407 1.520 1.00 0.00 C ATOM 493 CG GLU A 31 22.429 -5.031 0.985 1.00 0.00 C ATOM 494 CD GLU A 31 21.999 -5.112 -0.450 1.00 0.00 C ATOM 495 OE1 GLU A 31 20.806 -5.398 -0.712 1.00 0.00 O ATOM 496 OE2 GLU A 31 22.849 -4.942 -1.348 1.00 0.00 O ATOM 0 H GLU A 31 22.196 -4.913 3.834 1.00 0.00 H new ATOM 0 HA GLU A 31 23.416 -7.514 3.226 1.00 0.00 H new ATOM 0 HB2 GLU A 31 23.501 -6.860 0.867 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.858 -7.022 1.453 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.637 -4.580 1.583 1.00 0.00 H new ATOM 0 HG3 GLU A 31 23.302 -4.384 1.073 1.00 0.00 H new ATOM 503 N LYS A 32 25.613 -6.443 2.685 1.00 0.00 N ATOM 504 CA LYS A 32 26.892 -5.864 2.610 1.00 0.00 C ATOM 505 C LYS A 32 27.236 -5.643 1.171 1.00 0.00 C ATOM 506 O LYS A 32 27.257 -6.578 0.376 1.00 0.00 O ATOM 507 CB LYS A 32 27.944 -6.718 3.282 1.00 0.00 C ATOM 508 CG LYS A 32 27.907 -6.708 4.802 1.00 0.00 C ATOM 509 CD LYS A 32 29.113 -7.426 5.402 1.00 0.00 C ATOM 510 CE LYS A 32 29.298 -8.816 4.822 1.00 0.00 C ATOM 511 NZ LYS A 32 28.164 -9.715 5.131 1.00 0.00 N ATOM 0 H LYS A 32 25.582 -7.429 2.426 1.00 0.00 H new ATOM 0 HA LYS A 32 26.874 -4.913 3.143 1.00 0.00 H new ATOM 0 HB2 LYS A 32 27.830 -7.746 2.938 1.00 0.00 H new ATOM 0 HB3 LYS A 32 28.927 -6.380 2.956 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.882 -5.678 5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.990 -7.187 5.147 1.00 0.00 H new ATOM 0 HD2 LYS A 32 30.012 -6.836 5.222 1.00 0.00 H new ATOM 0 HD3 LYS A 32 28.990 -7.498 6.483 1.00 0.00 H new ATOM 0 HE2 LYS A 32 29.415 -8.742 3.741 1.00 0.00 H new ATOM 0 HE3 LYS A 32 30.218 -9.250 5.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 28.339 -10.651 4.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 28.067 -9.809 6.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 27.288 -9.318 4.735 1.00 0.00 H new ATOM 525 N VAL A 33 27.450 -4.425 0.830 1.00 0.00 N ATOM 526 CA VAL A 33 27.796 -4.087 -0.521 1.00 0.00 C ATOM 527 C VAL A 33 29.125 -3.373 -0.614 1.00 0.00 C ATOM 528 O VAL A 33 29.394 -2.463 0.150 1.00 0.00 O ATOM 529 CB VAL A 33 26.646 -3.348 -1.270 1.00 0.00 C ATOM 530 CG1 VAL A 33 25.873 -2.426 -0.369 1.00 0.00 C ATOM 531 CG2 VAL A 33 27.164 -2.571 -2.429 1.00 0.00 C ATOM 0 H VAL A 33 27.393 -3.631 1.468 1.00 0.00 H new ATOM 0 HA VAL A 33 27.928 -5.030 -1.051 1.00 0.00 H new ATOM 0 HB VAL A 33 25.972 -4.128 -1.625 1.00 0.00 H new ATOM 0 HG11 VAL A 33 25.084 -1.936 -0.940 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.429 -3.000 0.445 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.544 -1.672 0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 33 26.336 -2.068 -2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 33 27.881 -1.829 -2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.655 -3.246 -3.130 1.00 0.00 H new ATOM 541 N PHE A 34 29.961 -3.827 -1.526 1.00 0.00 N ATOM 542 CA PHE A 34 31.269 -3.258 -1.716 1.00 0.00 C ATOM 543 C PHE A 34 31.158 -1.915 -2.402 1.00 0.00 C ATOM 544 O PHE A 34 31.748 -0.923 -1.967 1.00 0.00 O ATOM 545 CB PHE A 34 32.145 -4.173 -2.576 1.00 0.00 C ATOM 546 CG PHE A 34 32.308 -5.582 -2.083 1.00 0.00 C ATOM 547 CD1 PHE A 34 32.797 -5.838 -0.819 1.00 0.00 C ATOM 548 CD2 PHE A 34 31.979 -6.652 -2.899 1.00 0.00 C ATOM 549 CE1 PHE A 34 32.956 -7.136 -0.374 1.00 0.00 C ATOM 550 CE2 PHE A 34 32.137 -7.950 -2.462 1.00 0.00 C ATOM 551 CZ PHE A 34 32.628 -8.192 -1.196 1.00 0.00 C ATOM 0 H PHE A 34 29.747 -4.602 -2.154 1.00 0.00 H new ATOM 0 HA PHE A 34 31.725 -3.141 -0.733 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.723 -4.207 -3.581 1.00 0.00 H new ATOM 0 HB3 PHE A 34 33.134 -3.722 -2.660 1.00 0.00 H new ATOM 0 HD1 PHE A 34 33.058 -5.015 -0.170 1.00 0.00 H new ATOM 0 HD2 PHE A 34 31.594 -6.467 -3.891 1.00 0.00 H new ATOM 0 HE1 PHE A 34 33.338 -7.323 0.619 1.00 0.00 H new ATOM 0 HE2 PHE A 34 31.877 -8.775 -3.109 1.00 0.00 H new ATOM 0 HZ PHE A 34 32.755 -9.207 -0.850 1.00 0.00 H new ATOM 561 N SER A 35 30.378 -1.873 -3.452 1.00 0.00 N ATOM 562 CA SER A 35 30.273 -0.737 -4.230 1.00 0.00 C ATOM 563 C SER A 35 28.864 -0.206 -4.140 1.00 0.00 C ATOM 564 O SER A 35 27.952 -0.790 -4.715 1.00 0.00 O ATOM 565 CB SER A 35 30.618 -1.132 -5.650 1.00 0.00 C ATOM 566 OG SER A 35 31.917 -1.725 -5.707 1.00 0.00 O ATOM 0 H SER A 35 29.804 -2.655 -3.767 1.00 0.00 H new ATOM 0 HA SER A 35 30.949 0.048 -3.892 1.00 0.00 H new ATOM 0 HB2 SER A 35 29.875 -1.834 -6.028 1.00 0.00 H new ATOM 0 HB3 SER A 35 30.585 -0.254 -6.295 1.00 0.00 H new ATOM 0 HG SER A 35 32.122 -1.975 -6.632 1.00 0.00 H new ATOM 572 N MET A 36 28.683 0.889 -3.399 1.00 0.00 N ATOM 573 CA MET A 36 27.363 1.520 -3.210 1.00 0.00 C ATOM 574 C MET A 36 26.659 1.766 -4.523 1.00 0.00 C ATOM 575 O MET A 36 25.451 1.655 -4.610 1.00 0.00 O ATOM 576 CB MET A 36 27.472 2.832 -2.419 1.00 0.00 C ATOM 577 CG MET A 36 27.592 2.644 -0.916 1.00 0.00 C ATOM 578 SD MET A 36 26.150 3.279 -0.009 1.00 0.00 S ATOM 579 CE MET A 36 24.813 2.391 -0.807 1.00 0.00 C ATOM 0 H MET A 36 29.441 1.367 -2.912 1.00 0.00 H new ATOM 0 HA MET A 36 26.765 0.815 -2.633 1.00 0.00 H new ATOM 0 HB2 MET A 36 28.340 3.387 -2.775 1.00 0.00 H new ATOM 0 HB3 MET A 36 26.595 3.444 -2.629 1.00 0.00 H new ATOM 0 HG2 MET A 36 27.716 1.584 -0.696 1.00 0.00 H new ATOM 0 HG3 MET A 36 28.490 3.150 -0.562 1.00 0.00 H new ATOM 0 HE1 MET A 36 23.868 2.652 -0.331 1.00 0.00 H new ATOM 0 HE2 MET A 36 24.775 2.662 -1.862 1.00 0.00 H new ATOM 0 HE3 MET A 36 24.982 1.318 -0.714 1.00 0.00 H new ATOM 589 N ASP A 37 27.427 2.022 -5.542 1.00 0.00 N ATOM 590 CA ASP A 37 26.907 2.293 -6.877 1.00 0.00 C ATOM 591 C ASP A 37 26.202 1.065 -7.463 1.00 0.00 C ATOM 592 O ASP A 37 25.208 1.194 -8.193 1.00 0.00 O ATOM 593 CB ASP A 37 28.026 2.767 -7.786 1.00 0.00 C ATOM 594 CG ASP A 37 27.579 3.039 -9.193 1.00 0.00 C ATOM 595 OD1 ASP A 37 26.907 4.061 -9.430 1.00 0.00 O ATOM 596 OD2 ASP A 37 27.912 2.241 -10.089 1.00 0.00 O ATOM 0 H ASP A 37 28.445 2.052 -5.483 1.00 0.00 H new ATOM 0 HA ASP A 37 26.163 3.085 -6.800 1.00 0.00 H new ATOM 0 HB2 ASP A 37 28.462 3.675 -7.370 1.00 0.00 H new ATOM 0 HB3 ASP A 37 28.814 2.014 -7.803 1.00 0.00 H new ATOM 601 N ASP A 38 26.671 -0.129 -7.089 1.00 0.00 N ATOM 602 CA ASP A 38 26.039 -1.373 -7.549 1.00 0.00 C ATOM 603 C ASP A 38 24.710 -1.522 -6.843 1.00 0.00 C ATOM 604 O ASP A 38 23.717 -1.961 -7.428 1.00 0.00 O ATOM 605 CB ASP A 38 26.906 -2.596 -7.244 1.00 0.00 C ATOM 606 CG ASP A 38 26.285 -3.887 -7.760 1.00 0.00 C ATOM 607 OD1 ASP A 38 26.432 -4.197 -8.957 1.00 0.00 O ATOM 608 OD2 ASP A 38 25.661 -4.620 -6.965 1.00 0.00 O ATOM 0 H ASP A 38 27.476 -0.262 -6.477 1.00 0.00 H new ATOM 0 HA ASP A 38 25.909 -1.316 -8.630 1.00 0.00 H new ATOM 0 HB2 ASP A 38 27.890 -2.463 -7.695 1.00 0.00 H new ATOM 0 HB3 ASP A 38 27.056 -2.673 -6.167 1.00 0.00 H new ATOM 613 N PHE A 39 24.699 -1.096 -5.580 1.00 0.00 N ATOM 614 CA PHE A 39 23.520 -1.111 -4.751 1.00 0.00 C ATOM 615 C PHE A 39 22.471 -0.160 -5.335 1.00 0.00 C ATOM 616 O PHE A 39 21.288 -0.489 -5.413 1.00 0.00 O ATOM 617 CB PHE A 39 23.910 -0.683 -3.327 1.00 0.00 C ATOM 618 CG PHE A 39 22.777 -0.545 -2.360 1.00 0.00 C ATOM 619 CD1 PHE A 39 22.063 0.629 -2.295 1.00 0.00 C ATOM 620 CD2 PHE A 39 22.437 -1.577 -1.510 1.00 0.00 C ATOM 621 CE1 PHE A 39 21.033 0.781 -1.413 1.00 0.00 C ATOM 622 CE2 PHE A 39 21.400 -1.435 -0.618 1.00 0.00 C ATOM 623 CZ PHE A 39 20.698 -0.245 -0.574 1.00 0.00 C ATOM 0 H PHE A 39 25.526 -0.728 -5.109 1.00 0.00 H new ATOM 0 HA PHE A 39 23.094 -2.114 -4.718 1.00 0.00 H new ATOM 0 HB2 PHE A 39 24.617 -1.411 -2.929 1.00 0.00 H new ATOM 0 HB3 PHE A 39 24.433 0.271 -3.384 1.00 0.00 H new ATOM 0 HD1 PHE A 39 22.322 1.445 -2.954 1.00 0.00 H new ATOM 0 HD2 PHE A 39 22.990 -2.504 -1.545 1.00 0.00 H new ATOM 0 HE1 PHE A 39 20.483 1.710 -1.378 1.00 0.00 H new ATOM 0 HE2 PHE A 39 21.136 -2.247 0.043 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.883 -0.126 0.125 1.00 0.00 H new ATOM 633 N TRP A 40 22.919 1.017 -5.758 1.00 0.00 N ATOM 634 CA TRP A 40 22.026 2.008 -6.333 1.00 0.00 C ATOM 635 C TRP A 40 21.458 1.527 -7.634 1.00 0.00 C ATOM 636 O TRP A 40 20.315 1.771 -7.927 1.00 0.00 O ATOM 637 CB TRP A 40 22.702 3.369 -6.508 1.00 0.00 C ATOM 638 CG TRP A 40 23.189 3.958 -5.221 1.00 0.00 C ATOM 639 CD1 TRP A 40 24.433 4.431 -4.964 1.00 0.00 C ATOM 640 CD2 TRP A 40 22.447 4.098 -4.005 1.00 0.00 C ATOM 641 NE1 TRP A 40 24.520 4.849 -3.662 1.00 0.00 N ATOM 642 CE2 TRP A 40 23.314 4.654 -3.053 1.00 0.00 C ATOM 643 CE3 TRP A 40 21.135 3.805 -3.627 1.00 0.00 C ATOM 644 CZ2 TRP A 40 22.914 4.918 -1.754 1.00 0.00 C ATOM 645 CZ3 TRP A 40 20.745 4.069 -2.338 1.00 0.00 C ATOM 646 CH2 TRP A 40 21.630 4.613 -1.419 1.00 0.00 C ATOM 0 H TRP A 40 23.896 1.305 -5.712 1.00 0.00 H new ATOM 0 HA TRP A 40 21.208 2.145 -5.625 1.00 0.00 H new ATOM 0 HB2 TRP A 40 23.544 3.264 -7.193 1.00 0.00 H new ATOM 0 HB3 TRP A 40 21.998 4.060 -6.972 1.00 0.00 H new ATOM 0 HD1 TRP A 40 25.239 4.472 -5.682 1.00 0.00 H new ATOM 0 HE1 TRP A 40 25.351 5.242 -3.220 1.00 0.00 H new ATOM 0 HE3 TRP A 40 20.440 3.379 -4.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 23.594 5.349 -1.034 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 19.732 3.850 -2.034 1.00 0.00 H new ATOM 0 HH2 TRP A 40 21.292 4.800 -0.411 1.00 0.00 H new ATOM 657 N ALA A 41 22.255 0.830 -8.400 1.00 0.00 N ATOM 658 CA ALA A 41 21.778 0.254 -9.645 1.00 0.00 C ATOM 659 C ALA A 41 20.784 -0.863 -9.363 1.00 0.00 C ATOM 660 O ALA A 41 19.779 -1.016 -10.065 1.00 0.00 O ATOM 661 CB ALA A 41 22.939 -0.251 -10.483 1.00 0.00 C ATOM 0 H ALA A 41 23.236 0.644 -8.191 1.00 0.00 H new ATOM 0 HA ALA A 41 21.268 1.031 -10.214 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.559 -0.678 -11.411 1.00 0.00 H new ATOM 0 HB2 ALA A 41 23.609 0.577 -10.713 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.483 -1.015 -9.928 1.00 0.00 H new ATOM 667 N ALA A 42 21.043 -1.597 -8.298 1.00 0.00 N ATOM 668 CA ALA A 42 20.199 -2.707 -7.881 1.00 0.00 C ATOM 669 C ALA A 42 18.811 -2.233 -7.467 1.00 0.00 C ATOM 670 O ALA A 42 17.810 -2.859 -7.802 1.00 0.00 O ATOM 671 CB ALA A 42 20.858 -3.480 -6.742 1.00 0.00 C ATOM 0 H ALA A 42 21.849 -1.441 -7.692 1.00 0.00 H new ATOM 0 HA ALA A 42 20.081 -3.371 -8.737 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.213 -4.306 -6.442 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.819 -3.872 -7.076 1.00 0.00 H new ATOM 0 HB3 ALA A 42 21.013 -2.815 -5.893 1.00 0.00 H new ATOM 677 N TYR A 43 18.748 -1.125 -6.766 1.00 0.00 N ATOM 678 CA TYR A 43 17.480 -0.617 -6.292 1.00 0.00 C ATOM 679 C TYR A 43 17.086 0.669 -7.003 1.00 0.00 C ATOM 680 O TYR A 43 16.243 1.411 -6.510 1.00 0.00 O ATOM 681 CB TYR A 43 17.542 -0.364 -4.788 1.00 0.00 C ATOM 682 CG TYR A 43 17.761 -1.596 -3.936 1.00 0.00 C ATOM 683 CD1 TYR A 43 19.037 -2.072 -3.675 1.00 0.00 C ATOM 684 CD2 TYR A 43 16.686 -2.272 -3.382 1.00 0.00 C ATOM 685 CE1 TYR A 43 19.238 -3.186 -2.892 1.00 0.00 C ATOM 686 CE2 TYR A 43 16.876 -3.392 -2.593 1.00 0.00 C ATOM 687 CZ TYR A 43 18.158 -3.843 -2.354 1.00 0.00 C ATOM 688 OH TYR A 43 18.356 -4.956 -1.568 1.00 0.00 O ATOM 0 H TYR A 43 19.557 -0.559 -6.511 1.00 0.00 H new ATOM 0 HA TYR A 43 16.725 -1.373 -6.510 1.00 0.00 H new ATOM 0 HB2 TYR A 43 18.346 0.344 -4.588 1.00 0.00 H new ATOM 0 HB3 TYR A 43 16.612 0.113 -4.477 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.890 -1.559 -4.094 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.683 -1.918 -3.569 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.240 -3.542 -2.701 1.00 0.00 H new ATOM 0 HE2 TYR A 43 16.028 -3.909 -2.168 1.00 0.00 H new ATOM 0 HH TYR A 43 19.170 -4.839 -1.034 1.00 0.00 H new ATOM 698 N ALA A 44 17.696 0.935 -8.152 1.00 0.00 N ATOM 699 CA ALA A 44 17.402 2.132 -8.957 1.00 0.00 C ATOM 700 C ALA A 44 15.913 2.289 -9.283 1.00 0.00 C ATOM 701 O ALA A 44 15.414 3.410 -9.396 1.00 0.00 O ATOM 702 CB ALA A 44 18.220 2.127 -10.239 1.00 0.00 C ATOM 0 H ALA A 44 18.410 0.331 -8.559 1.00 0.00 H new ATOM 0 HA ALA A 44 17.683 2.990 -8.346 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.989 3.019 -10.821 1.00 0.00 H new ATOM 0 HB2 ALA A 44 19.282 2.119 -9.993 1.00 0.00 H new ATOM 0 HB3 ALA A 44 17.976 1.240 -10.823 1.00 0.00 H new ATOM 708 N GLY A 45 15.216 1.175 -9.424 1.00 0.00 N ATOM 709 CA GLY A 45 13.804 1.220 -9.725 1.00 0.00 C ATOM 710 C GLY A 45 12.965 1.642 -8.526 1.00 0.00 C ATOM 711 O GLY A 45 11.899 2.221 -8.687 1.00 0.00 O ATOM 0 H GLY A 45 15.605 0.236 -9.335 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.633 1.915 -10.547 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.477 0.238 -10.065 1.00 0.00 H new ATOM 715 N TRP A 46 13.422 1.311 -7.325 1.00 0.00 N ATOM 716 CA TRP A 46 12.743 1.696 -6.104 1.00 0.00 C ATOM 717 C TRP A 46 12.868 3.211 -5.905 1.00 0.00 C ATOM 718 O TRP A 46 13.835 3.823 -6.358 1.00 0.00 O ATOM 719 CB TRP A 46 13.396 1.017 -4.903 1.00 0.00 C ATOM 720 CG TRP A 46 13.387 -0.477 -4.878 1.00 0.00 C ATOM 721 CD1 TRP A 46 14.138 -1.323 -5.628 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.613 -1.291 -4.021 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.852 -2.621 -5.306 1.00 0.00 N ATOM 724 CE2 TRP A 46 12.918 -2.629 -4.317 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.681 -1.017 -3.039 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.314 -3.689 -3.654 1.00 0.00 C ATOM 727 CZ3 TRP A 46 11.079 -2.059 -2.399 1.00 0.00 C ATOM 728 CH2 TRP A 46 11.401 -3.380 -2.706 1.00 0.00 C ATOM 0 H TRP A 46 14.273 0.769 -7.175 1.00 0.00 H new ATOM 0 HA TRP A 46 11.697 1.399 -6.183 1.00 0.00 H new ATOM 0 HB2 TRP A 46 14.432 1.350 -4.848 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.899 1.373 -4.001 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.858 -1.015 -6.372 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.270 -3.446 -5.736 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.434 0.003 -2.783 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 12.562 -4.714 -3.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.338 -1.857 -1.639 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.908 -4.179 -2.172 1.00 0.00 H new ATOM 739 N THR A 47 11.917 3.806 -5.240 1.00 0.00 N ATOM 740 CA THR A 47 11.973 5.186 -4.949 1.00 0.00 C ATOM 741 C THR A 47 12.738 5.377 -3.640 1.00 0.00 C ATOM 742 O THR A 47 12.358 4.827 -2.598 1.00 0.00 O ATOM 743 CB THR A 47 10.548 5.739 -4.837 1.00 0.00 C ATOM 744 OG1 THR A 47 9.864 5.529 -6.081 1.00 0.00 O ATOM 745 CG2 THR A 47 10.543 7.213 -4.486 1.00 0.00 C ATOM 0 H THR A 47 11.084 3.333 -4.889 1.00 0.00 H new ATOM 0 HA THR A 47 12.488 5.726 -5.744 1.00 0.00 H new ATOM 0 HB THR A 47 10.037 5.210 -4.032 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.951 5.879 -6.015 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.514 7.567 -4.416 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.044 7.361 -3.529 1.00 0.00 H new ATOM 0 HG23 THR A 47 11.067 7.773 -5.260 1.00 0.00 H new ATOM 753 N LEU A 48 13.832 6.087 -3.723 1.00 0.00 N ATOM 754 CA LEU A 48 14.678 6.369 -2.591 1.00 0.00 C ATOM 755 C LEU A 48 13.991 7.438 -1.747 1.00 0.00 C ATOM 756 O LEU A 48 13.806 8.577 -2.205 1.00 0.00 O ATOM 757 CB LEU A 48 16.075 6.826 -3.128 1.00 0.00 C ATOM 758 CG LEU A 48 17.257 7.011 -2.142 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.158 8.280 -1.320 1.00 0.00 C ATOM 760 CD2 LEU A 48 17.382 5.816 -1.235 1.00 0.00 C ATOM 0 H LEU A 48 14.168 6.494 -4.596 1.00 0.00 H new ATOM 0 HA LEU A 48 14.837 5.495 -1.960 1.00 0.00 H new ATOM 0 HB2 LEU A 48 16.388 6.100 -3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.930 7.775 -3.644 1.00 0.00 H new ATOM 0 HG LEU A 48 18.154 7.102 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 48 18.016 8.348 -0.651 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.147 9.144 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.240 8.262 -0.732 1.00 0.00 H new ATOM 0 HD21 LEU A 48 18.217 5.965 -0.550 1.00 0.00 H new ATOM 0 HD22 LEU A 48 16.462 5.695 -0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 48 17.558 4.922 -1.833 1.00 0.00 H new ATOM 772 N VAL A 49 13.559 7.057 -0.559 1.00 0.00 N ATOM 773 CA VAL A 49 12.878 7.975 0.334 1.00 0.00 C ATOM 774 C VAL A 49 13.893 8.665 1.223 1.00 0.00 C ATOM 775 O VAL A 49 13.864 9.884 1.381 1.00 0.00 O ATOM 776 CB VAL A 49 11.748 7.283 1.161 1.00 0.00 C ATOM 777 CG1 VAL A 49 11.085 8.265 2.112 1.00 0.00 C ATOM 778 CG2 VAL A 49 10.715 6.699 0.220 1.00 0.00 C ATOM 0 H VAL A 49 13.669 6.113 -0.189 1.00 0.00 H new ATOM 0 HA VAL A 49 12.374 8.727 -0.273 1.00 0.00 H new ATOM 0 HB VAL A 49 12.195 6.486 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 49 10.303 7.755 2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.829 8.661 2.803 1.00 0.00 H new ATOM 0 HG13 VAL A 49 10.647 9.084 1.542 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.927 6.217 0.799 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.284 7.495 -0.387 1.00 0.00 H new ATOM 0 HG23 VAL A 49 11.189 5.964 -0.430 1.00 0.00 H new ATOM 788 N GLU A 50 14.795 7.894 1.790 1.00 0.00 N ATOM 789 CA GLU A 50 15.903 8.458 2.528 1.00 0.00 C ATOM 790 C GLU A 50 17.017 7.484 2.586 1.00 0.00 C ATOM 791 O GLU A 50 16.814 6.287 2.421 1.00 0.00 O ATOM 792 CB GLU A 50 15.570 8.918 3.969 1.00 0.00 C ATOM 793 CG GLU A 50 15.101 7.852 4.918 1.00 0.00 C ATOM 794 CD GLU A 50 14.936 8.383 6.328 1.00 0.00 C ATOM 795 OE1 GLU A 50 15.927 8.874 6.920 1.00 0.00 O ATOM 796 OE2 GLU A 50 13.818 8.356 6.867 1.00 0.00 O ATOM 0 H GLU A 50 14.783 6.875 1.754 1.00 0.00 H new ATOM 0 HA GLU A 50 16.178 9.358 1.978 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.459 9.386 4.392 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.801 9.688 3.913 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.151 7.448 4.569 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.816 7.029 4.921 1.00 0.00 H new ATOM 803 N GLN A 51 18.171 7.987 2.768 1.00 0.00 N ATOM 804 CA GLN A 51 19.308 7.204 2.992 1.00 0.00 C ATOM 805 C GLN A 51 20.190 7.886 3.976 1.00 0.00 C ATOM 806 O GLN A 51 20.260 9.117 4.036 1.00 0.00 O ATOM 807 CB GLN A 51 20.076 6.938 1.720 1.00 0.00 C ATOM 808 CG GLN A 51 20.543 8.175 0.988 1.00 0.00 C ATOM 809 CD GLN A 51 21.429 7.811 -0.150 1.00 0.00 C ATOM 810 OE1 GLN A 51 22.660 7.773 -0.028 1.00 0.00 O ATOM 811 NE2 GLN A 51 20.833 7.477 -1.235 1.00 0.00 N ATOM 0 H GLN A 51 18.354 8.991 2.765 1.00 0.00 H new ATOM 0 HA GLN A 51 18.978 6.241 3.382 1.00 0.00 H new ATOM 0 HB2 GLN A 51 20.945 6.325 1.959 1.00 0.00 H new ATOM 0 HB3 GLN A 51 19.448 6.352 1.049 1.00 0.00 H new ATOM 0 HG2 GLN A 51 19.682 8.733 0.620 1.00 0.00 H new ATOM 0 HG3 GLN A 51 21.077 8.830 1.676 1.00 0.00 H new ATOM 0 HE21 GLN A 51 19.816 7.523 -1.293 1.00 0.00 H new ATOM 0 HE22 GLN A 51 21.376 7.165 -2.040 1.00 0.00 H new ATOM 820 N LYS A 52 20.771 7.104 4.770 1.00 0.00 N ATOM 821 CA LYS A 52 21.764 7.496 5.704 1.00 0.00 C ATOM 822 C LYS A 52 22.856 6.456 5.567 1.00 0.00 C ATOM 823 O LYS A 52 22.582 5.377 5.040 1.00 0.00 O ATOM 824 CB LYS A 52 21.143 7.600 7.114 1.00 0.00 C ATOM 825 CG LYS A 52 20.053 6.578 7.379 1.00 0.00 C ATOM 826 CD LYS A 52 18.685 7.192 7.678 1.00 0.00 C ATOM 827 CE LYS A 52 18.660 8.093 8.898 1.00 0.00 C ATOM 828 NZ LYS A 52 17.270 8.503 9.212 1.00 0.00 N ATOM 0 H LYS A 52 20.566 6.105 4.802 1.00 0.00 H new ATOM 0 HA LYS A 52 22.185 8.485 5.523 1.00 0.00 H new ATOM 0 HB2 LYS A 52 21.931 7.479 7.858 1.00 0.00 H new ATOM 0 HB3 LYS A 52 20.731 8.600 7.247 1.00 0.00 H new ATOM 0 HG2 LYS A 52 19.964 5.923 6.512 1.00 0.00 H new ATOM 0 HG3 LYS A 52 20.352 5.953 8.221 1.00 0.00 H new ATOM 0 HD2 LYS A 52 18.359 7.766 6.810 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.962 6.389 7.819 1.00 0.00 H new ATOM 0 HE2 LYS A 52 19.093 7.572 9.752 1.00 0.00 H new ATOM 0 HE3 LYS A 52 19.274 8.975 8.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 17.249 9.519 9.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 16.659 8.315 8.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.925 7.963 10.031 1.00 0.00 H new ATOM 842 N LYS A 53 24.073 6.746 5.962 1.00 0.00 N ATOM 843 CA LYS A 53 25.163 5.829 5.658 1.00 0.00 C ATOM 844 C LYS A 53 25.061 4.546 6.492 1.00 0.00 C ATOM 845 O LYS A 53 25.443 4.504 7.671 1.00 0.00 O ATOM 846 CB LYS A 53 26.539 6.513 5.803 1.00 0.00 C ATOM 847 CG LYS A 53 27.703 5.778 5.121 1.00 0.00 C ATOM 848 CD LYS A 53 27.488 5.682 3.597 1.00 0.00 C ATOM 849 CE LYS A 53 28.650 4.996 2.869 1.00 0.00 C ATOM 850 NZ LYS A 53 29.904 5.784 2.904 1.00 0.00 N ATOM 0 H LYS A 53 24.337 7.584 6.481 1.00 0.00 H new ATOM 0 HA LYS A 53 25.068 5.537 4.612 1.00 0.00 H new ATOM 0 HB2 LYS A 53 26.473 7.520 5.391 1.00 0.00 H new ATOM 0 HB3 LYS A 53 26.766 6.617 6.864 1.00 0.00 H new ATOM 0 HG2 LYS A 53 28.637 6.301 5.327 1.00 0.00 H new ATOM 0 HG3 LYS A 53 27.800 4.777 5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 53 26.568 5.132 3.400 1.00 0.00 H new ATOM 0 HD3 LYS A 53 27.354 6.685 3.191 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.828 4.020 3.321 1.00 0.00 H new ATOM 0 HE3 LYS A 53 28.367 4.820 1.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 30.642 5.285 2.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 29.739 6.719 2.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 30.213 5.902 3.890 1.00 0.00 H new ATOM 864 N GLY A 54 24.485 3.531 5.885 1.00 0.00 N ATOM 865 CA GLY A 54 24.311 2.269 6.538 1.00 0.00 C ATOM 866 C GLY A 54 22.853 1.856 6.636 1.00 0.00 C ATOM 867 O GLY A 54 22.548 0.730 7.025 1.00 0.00 O ATOM 0 H GLY A 54 24.129 3.565 4.930 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.865 1.504 5.995 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.738 2.321 7.540 1.00 0.00 H new ATOM 871 N TYR A 55 21.942 2.750 6.312 1.00 0.00 N ATOM 872 CA TYR A 55 20.562 2.447 6.333 1.00 0.00 C ATOM 873 C TYR A 55 19.891 3.192 5.191 1.00 0.00 C ATOM 874 O TYR A 55 20.043 4.400 5.050 1.00 0.00 O ATOM 875 CB TYR A 55 19.988 2.835 7.702 1.00 0.00 C ATOM 876 CG TYR A 55 18.490 2.833 7.798 1.00 0.00 C ATOM 877 CD1 TYR A 55 17.792 3.894 7.308 1.00 0.00 C ATOM 878 CD2 TYR A 55 17.795 1.801 8.385 1.00 0.00 C ATOM 879 CE1 TYR A 55 16.430 3.964 7.380 1.00 0.00 C ATOM 880 CE2 TYR A 55 16.419 1.841 8.482 1.00 0.00 C ATOM 881 CZ TYR A 55 15.735 2.927 7.977 1.00 0.00 C ATOM 882 OH TYR A 55 14.364 2.976 8.084 1.00 0.00 O ATOM 0 H TYR A 55 22.159 3.706 6.028 1.00 0.00 H new ATOM 0 HA TYR A 55 20.383 1.381 6.193 1.00 0.00 H new ATOM 0 HB2 TYR A 55 20.384 2.148 8.450 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.350 3.830 7.960 1.00 0.00 H new ATOM 0 HD1 TYR A 55 18.333 4.707 6.847 1.00 0.00 H new ATOM 0 HD2 TYR A 55 18.333 0.949 8.775 1.00 0.00 H new ATOM 0 HE1 TYR A 55 15.903 4.816 6.977 1.00 0.00 H new ATOM 0 HE2 TYR A 55 15.882 1.029 8.949 1.00 0.00 H new ATOM 0 HH TYR A 55 13.981 2.133 7.764 1.00 0.00 H new ATOM 892 N VAL A 56 19.164 2.493 4.391 1.00 0.00 N ATOM 893 CA VAL A 56 18.516 3.094 3.261 1.00 0.00 C ATOM 894 C VAL A 56 17.038 2.709 3.241 1.00 0.00 C ATOM 895 O VAL A 56 16.677 1.573 3.504 1.00 0.00 O ATOM 896 CB VAL A 56 19.205 2.692 1.922 1.00 0.00 C ATOM 897 CG1 VAL A 56 18.483 3.299 0.763 1.00 0.00 C ATOM 898 CG2 VAL A 56 20.657 3.144 1.882 1.00 0.00 C ATOM 0 H VAL A 56 18.997 1.492 4.494 1.00 0.00 H new ATOM 0 HA VAL A 56 18.602 4.176 3.359 1.00 0.00 H new ATOM 0 HB VAL A 56 19.172 1.604 1.857 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.976 3.009 -0.165 1.00 0.00 H new ATOM 0 HG12 VAL A 56 17.452 2.946 0.752 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.494 4.385 0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 56 21.105 2.846 0.934 1.00 0.00 H new ATOM 0 HG22 VAL A 56 20.703 4.229 1.981 1.00 0.00 H new ATOM 0 HG23 VAL A 56 21.205 2.681 2.703 1.00 0.00 H new ATOM 908 N LEU A 57 16.208 3.656 2.966 1.00 0.00 N ATOM 909 CA LEU A 57 14.794 3.454 2.902 1.00 0.00 C ATOM 910 C LEU A 57 14.277 3.643 1.466 1.00 0.00 C ATOM 911 O LEU A 57 14.359 4.752 0.888 1.00 0.00 O ATOM 912 CB LEU A 57 14.104 4.386 3.913 1.00 0.00 C ATOM 913 CG LEU A 57 12.626 4.693 3.690 1.00 0.00 C ATOM 914 CD1 LEU A 57 11.747 3.487 3.666 1.00 0.00 C ATOM 915 CD2 LEU A 57 12.116 5.725 4.659 1.00 0.00 C ATOM 0 H LEU A 57 16.496 4.615 2.774 1.00 0.00 H new ATOM 0 HA LEU A 57 14.553 2.427 3.176 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.211 3.946 4.904 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.646 5.331 3.924 1.00 0.00 H new ATOM 0 HG LEU A 57 12.573 5.113 2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.714 3.793 3.503 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.061 2.824 2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.824 2.962 4.618 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.060 5.915 4.466 1.00 0.00 H new ATOM 0 HD22 LEU A 57 12.239 5.359 5.678 1.00 0.00 H new ATOM 0 HD23 LEU A 57 12.679 6.650 4.535 1.00 0.00 H new ATOM 927 N PHE A 58 13.777 2.553 0.906 1.00 0.00 N ATOM 928 CA PHE A 58 13.219 2.505 -0.450 1.00 0.00 C ATOM 929 C PHE A 58 11.747 2.130 -0.452 1.00 0.00 C ATOM 930 O PHE A 58 11.255 1.487 0.465 1.00 0.00 O ATOM 931 CB PHE A 58 13.935 1.456 -1.297 1.00 0.00 C ATOM 932 CG PHE A 58 15.227 1.870 -1.895 1.00 0.00 C ATOM 933 CD1 PHE A 58 15.240 2.740 -2.959 1.00 0.00 C ATOM 934 CD2 PHE A 58 16.417 1.375 -1.425 1.00 0.00 C ATOM 935 CE1 PHE A 58 16.414 3.121 -3.546 1.00 0.00 C ATOM 936 CE2 PHE A 58 17.604 1.749 -2.008 1.00 0.00 C ATOM 937 CZ PHE A 58 17.602 2.628 -3.071 1.00 0.00 C ATOM 0 H PHE A 58 13.744 1.654 1.386 1.00 0.00 H new ATOM 0 HA PHE A 58 13.352 3.507 -0.859 1.00 0.00 H new ATOM 0 HB2 PHE A 58 14.110 0.576 -0.678 1.00 0.00 H new ATOM 0 HB3 PHE A 58 13.267 1.151 -2.102 1.00 0.00 H new ATOM 0 HD1 PHE A 58 14.306 3.129 -3.338 1.00 0.00 H new ATOM 0 HD2 PHE A 58 16.421 0.687 -0.592 1.00 0.00 H new ATOM 0 HE1 PHE A 58 16.406 3.807 -4.380 1.00 0.00 H new ATOM 0 HE2 PHE A 58 18.538 1.355 -1.634 1.00 0.00 H new ATOM 0 HZ PHE A 58 18.534 2.927 -3.528 1.00 0.00 H new ATOM 947 N ARG A 59 11.051 2.522 -1.492 1.00 0.00 N ATOM 948 CA ARG A 59 9.696 2.080 -1.691 1.00 0.00 C ATOM 949 C ARG A 59 9.480 1.666 -3.124 1.00 0.00 C ATOM 950 O ARG A 59 10.024 2.264 -4.048 1.00 0.00 O ATOM 951 CB ARG A 59 8.648 3.118 -1.267 1.00 0.00 C ATOM 952 CG ARG A 59 8.658 4.413 -2.047 1.00 0.00 C ATOM 953 CD ARG A 59 7.589 5.351 -1.548 1.00 0.00 C ATOM 954 NE ARG A 59 7.588 5.449 -0.074 1.00 0.00 N ATOM 955 CZ ARG A 59 6.833 6.268 0.665 1.00 0.00 C ATOM 956 NH1 ARG A 59 6.082 7.203 0.103 1.00 0.00 N ATOM 957 NH2 ARG A 59 6.850 6.147 1.972 1.00 0.00 N ATOM 0 H ARG A 59 11.404 3.149 -2.215 1.00 0.00 H new ATOM 0 HA ARG A 59 9.556 1.218 -1.039 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.659 2.668 -1.358 1.00 0.00 H new ATOM 0 HB3 ARG A 59 8.798 3.349 -0.212 1.00 0.00 H new ATOM 0 HG2 ARG A 59 9.635 4.888 -1.958 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.500 4.206 -3.105 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.745 6.341 -1.978 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.614 5.005 -1.890 1.00 0.00 H new ATOM 0 HE ARG A 59 8.225 4.832 0.429 1.00 0.00 H new ATOM 0 HH11 ARG A 59 6.073 7.308 -0.912 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.513 7.818 0.685 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.434 5.435 2.411 1.00 0.00 H new ATOM 0 HH22 ARG A 59 6.279 6.765 2.549 1.00 0.00 H new ATOM 971 N LYS A 60 8.736 0.635 -3.283 1.00 0.00 N ATOM 972 CA LYS A 60 8.351 0.106 -4.564 1.00 0.00 C ATOM 973 C LYS A 60 6.893 -0.215 -4.459 1.00 0.00 C ATOM 974 O LYS A 60 6.505 -1.167 -3.781 1.00 0.00 O ATOM 975 CB LYS A 60 9.121 -1.169 -4.871 1.00 0.00 C ATOM 976 CG LYS A 60 8.788 -1.849 -6.183 1.00 0.00 C ATOM 977 CD LYS A 60 9.529 -1.244 -7.367 1.00 0.00 C ATOM 978 CE LYS A 60 11.040 -1.468 -7.258 1.00 0.00 C ATOM 979 NZ LYS A 60 11.701 -1.296 -8.560 1.00 0.00 N ATOM 0 H LYS A 60 8.356 0.105 -2.499 1.00 0.00 H new ATOM 0 HA LYS A 60 8.560 0.823 -5.358 1.00 0.00 H new ATOM 0 HB2 LYS A 60 10.186 -0.936 -4.866 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.946 -1.879 -4.063 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.033 -2.909 -6.110 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.714 -1.782 -6.359 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.161 -1.686 -8.293 1.00 0.00 H new ATOM 0 HD3 LYS A 60 9.322 -0.175 -7.420 1.00 0.00 H new ATOM 0 HE2 LYS A 60 11.463 -0.767 -6.538 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.235 -2.471 -6.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.727 -1.201 -8.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.510 -2.125 -9.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.335 -0.441 -9.025 1.00 0.00 H new ATOM 993 N GLN A 61 6.093 0.585 -5.043 1.00 0.00 N ATOM 994 CA GLN A 61 4.695 0.382 -4.953 1.00 0.00 C ATOM 995 C GLN A 61 4.171 -0.508 -6.051 1.00 0.00 C ATOM 996 O GLN A 61 4.565 -0.399 -7.221 1.00 0.00 O ATOM 997 CB GLN A 61 3.948 1.668 -4.678 1.00 0.00 C ATOM 998 CG GLN A 61 4.352 2.847 -5.481 1.00 0.00 C ATOM 999 CD GLN A 61 3.854 4.105 -4.850 1.00 0.00 C ATOM 1000 OE1 GLN A 61 2.763 4.595 -5.142 1.00 0.00 O ATOM 1001 NE2 GLN A 61 4.654 4.630 -3.959 1.00 0.00 N ATOM 0 H GLN A 61 6.379 1.394 -5.594 1.00 0.00 H new ATOM 0 HA GLN A 61 4.481 -0.207 -4.061 1.00 0.00 H new ATOM 0 HB2 GLN A 61 2.886 1.489 -4.844 1.00 0.00 H new ATOM 0 HB3 GLN A 61 4.069 1.915 -3.623 1.00 0.00 H new ATOM 0 HG2 GLN A 61 5.438 2.881 -5.566 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.955 2.759 -6.492 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.549 4.186 -3.752 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.384 5.484 -3.471 1.00 0.00 H new ATOM 1010 N MET A 62 3.299 -1.397 -5.660 1.00 0.00 N ATOM 1011 CA MET A 62 2.939 -2.524 -6.480 1.00 0.00 C ATOM 1012 C MET A 62 1.733 -2.339 -7.344 1.00 0.00 C ATOM 1013 O MET A 62 0.879 -1.490 -7.102 1.00 0.00 O ATOM 1014 CB MET A 62 2.817 -3.787 -5.642 1.00 0.00 C ATOM 1015 CG MET A 62 4.134 -4.228 -5.049 1.00 0.00 C ATOM 1016 SD MET A 62 5.352 -4.543 -6.325 1.00 0.00 S ATOM 1017 CE MET A 62 6.769 -4.990 -5.334 1.00 0.00 C ATOM 0 H MET A 62 2.816 -1.361 -4.762 1.00 0.00 H new ATOM 0 HA MET A 62 3.765 -2.623 -7.184 1.00 0.00 H new ATOM 0 HB2 MET A 62 2.101 -3.616 -4.838 1.00 0.00 H new ATOM 0 HB3 MET A 62 2.416 -4.590 -6.260 1.00 0.00 H new ATOM 0 HG2 MET A 62 4.505 -3.459 -4.371 1.00 0.00 H new ATOM 0 HG3 MET A 62 3.984 -5.130 -4.456 1.00 0.00 H new ATOM 0 HE1 MET A 62 7.651 -5.060 -5.971 1.00 0.00 H new ATOM 0 HE2 MET A 62 6.933 -4.230 -4.570 1.00 0.00 H new ATOM 0 HE3 MET A 62 6.590 -5.953 -4.856 1.00 0.00 H new ATOM 1027 N ASP A 63 1.695 -3.167 -8.351 1.00 0.00 N ATOM 1028 CA ASP A 63 0.657 -3.205 -9.366 1.00 0.00 C ATOM 1029 C ASP A 63 -0.572 -3.965 -8.882 1.00 0.00 C ATOM 1030 O ASP A 63 -1.696 -3.712 -9.333 1.00 0.00 O ATOM 1031 CB ASP A 63 1.241 -3.898 -10.593 1.00 0.00 C ATOM 1032 CG ASP A 63 0.243 -4.149 -11.684 1.00 0.00 C ATOM 1033 OD1 ASP A 63 0.077 -3.279 -12.550 1.00 0.00 O ATOM 1034 OD2 ASP A 63 -0.353 -5.250 -11.725 1.00 0.00 O ATOM 0 H ASP A 63 2.418 -3.871 -8.501 1.00 0.00 H new ATOM 0 HA ASP A 63 0.338 -2.189 -9.599 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.053 -3.288 -10.990 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.677 -4.849 -10.287 1.00 0.00 H new ATOM 1039 N ASP A 64 -0.355 -4.881 -7.969 1.00 0.00 N ATOM 1040 CA ASP A 64 -1.424 -5.723 -7.458 1.00 0.00 C ATOM 1041 C ASP A 64 -1.991 -5.104 -6.177 1.00 0.00 C ATOM 1042 O ASP A 64 -1.461 -4.092 -5.674 1.00 0.00 O ATOM 1043 CB ASP A 64 -0.888 -7.147 -7.184 1.00 0.00 C ATOM 1044 CG ASP A 64 -1.979 -8.179 -6.949 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -2.436 -8.335 -5.815 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -2.403 -8.857 -7.915 1.00 0.00 O ATOM 0 H ASP A 64 0.560 -5.068 -7.558 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.221 -5.793 -8.199 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.277 -7.464 -8.029 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -0.235 -7.118 -6.312 1.00 0.00 H new ATOM 1051 N ILE A 65 -3.041 -5.688 -5.655 1.00 0.00 N ATOM 1052 CA ILE A 65 -3.662 -5.213 -4.453 1.00 0.00 C ATOM 1053 C ILE A 65 -2.912 -5.709 -3.238 1.00 0.00 C ATOM 1054 O ILE A 65 -2.815 -4.982 -2.281 1.00 0.00 O ATOM 1055 CB ILE A 65 -5.166 -5.580 -4.357 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -5.398 -7.097 -4.540 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -5.965 -4.779 -5.370 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -6.840 -7.525 -4.373 1.00 0.00 C ATOM 0 H ILE A 65 -3.488 -6.511 -6.058 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.613 -4.125 -4.486 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.513 -5.323 -3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.056 -7.389 -5.533 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.784 -7.637 -3.820 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.019 -5.045 -5.294 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.844 -3.715 -5.170 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.606 -5.002 -6.375 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -6.919 -8.603 -4.517 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.183 -7.267 -3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.459 -7.014 -5.111 1.00 0.00 H new ATOM 1070 N SER A 66 -2.400 -6.958 -3.326 1.00 0.00 N ATOM 1071 CA SER A 66 -1.565 -7.667 -2.324 1.00 0.00 C ATOM 1072 C SER A 66 -2.010 -9.119 -2.338 1.00 0.00 C ATOM 1073 O SER A 66 -3.211 -9.400 -2.541 1.00 0.00 O ATOM 1074 CB SER A 66 -1.705 -7.122 -0.875 1.00 0.00 C ATOM 1075 OG SER A 66 -0.770 -7.707 0.025 1.00 0.00 O ATOM 0 H SER A 66 -2.568 -7.536 -4.150 1.00 0.00 H new ATOM 0 HA SER A 66 -0.520 -7.526 -2.598 1.00 0.00 H new ATOM 0 HB2 SER A 66 -1.568 -6.041 -0.883 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.716 -7.312 -0.516 1.00 0.00 H new ATOM 0 HG SER A 66 -0.523 -7.052 0.711 1.00 0.00 H new ATOM 1081 N PRO A 67 -1.089 -10.070 -2.128 1.00 0.00 N ATOM 1082 CA PRO A 67 -1.428 -11.478 -2.115 1.00 0.00 C ATOM 1083 C PRO A 67 -2.373 -11.806 -0.964 1.00 0.00 C ATOM 1084 O PRO A 67 -3.250 -12.626 -1.102 1.00 0.00 O ATOM 1085 CB PRO A 67 -0.081 -12.200 -1.940 1.00 0.00 C ATOM 1086 CG PRO A 67 0.858 -11.167 -1.420 1.00 0.00 C ATOM 1087 CD PRO A 67 0.344 -9.836 -1.892 1.00 0.00 C ATOM 0 HA PRO A 67 -1.946 -11.782 -3.024 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.170 -13.035 -1.245 1.00 0.00 H new ATOM 0 HB3 PRO A 67 0.271 -12.610 -2.887 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.904 -11.200 -0.331 1.00 0.00 H new ATOM 0 HG3 PRO A 67 1.869 -11.343 -1.787 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.504 -9.059 -1.145 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.850 -9.512 -2.801 1.00 0.00 H new ATOM 1095 N LEU A 68 -2.231 -11.095 0.140 1.00 0.00 N ATOM 1096 CA LEU A 68 -3.043 -11.354 1.302 1.00 0.00 C ATOM 1097 C LEU A 68 -4.413 -10.685 1.135 1.00 0.00 C ATOM 1098 O LEU A 68 -5.434 -11.242 1.496 1.00 0.00 O ATOM 1099 CB LEU A 68 -2.336 -10.840 2.569 1.00 0.00 C ATOM 1100 CG LEU A 68 -2.622 -11.595 3.889 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -4.086 -11.563 4.284 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -2.147 -13.024 3.773 1.00 0.00 C ATOM 0 H LEU A 68 -1.560 -10.335 0.251 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.190 -12.429 1.406 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.261 -10.865 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.611 -9.795 2.710 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.073 -11.080 4.678 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.223 -12.109 5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.404 -10.529 4.418 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.684 -12.028 3.500 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.350 -13.552 4.705 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.672 -13.517 2.955 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.075 -13.036 3.576 1.00 0.00 H new ATOM 1114 N SER A 69 -4.427 -9.525 0.554 1.00 0.00 N ATOM 1115 CA SER A 69 -5.646 -8.755 0.342 1.00 0.00 C ATOM 1116 C SER A 69 -6.682 -9.493 -0.528 1.00 0.00 C ATOM 1117 O SER A 69 -7.875 -9.189 -0.474 1.00 0.00 O ATOM 1118 CB SER A 69 -5.278 -7.410 -0.231 1.00 0.00 C ATOM 1119 OG SER A 69 -4.330 -6.800 0.621 1.00 0.00 O ATOM 0 H SER A 69 -3.586 -9.066 0.203 1.00 0.00 H new ATOM 0 HA SER A 69 -6.138 -8.616 1.305 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.866 -7.526 -1.233 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.164 -6.782 -0.321 1.00 0.00 H new ATOM 0 HG SER A 69 -4.716 -5.988 1.012 1.00 0.00 H new ATOM 1125 N LYS A 70 -6.218 -10.438 -1.321 1.00 0.00 N ATOM 1126 CA LYS A 70 -7.091 -11.230 -2.160 1.00 0.00 C ATOM 1127 C LYS A 70 -7.451 -12.557 -1.477 1.00 0.00 C ATOM 1128 O LYS A 70 -8.234 -13.347 -2.011 1.00 0.00 O ATOM 1129 CB LYS A 70 -6.452 -11.476 -3.523 1.00 0.00 C ATOM 1130 CG LYS A 70 -5.194 -12.315 -3.481 1.00 0.00 C ATOM 1131 CD LYS A 70 -4.517 -12.367 -4.830 1.00 0.00 C ATOM 1132 CE LYS A 70 -3.997 -10.997 -5.240 1.00 0.00 C ATOM 1133 NZ LYS A 70 -3.210 -11.048 -6.472 1.00 0.00 N ATOM 0 H LYS A 70 -5.230 -10.677 -1.401 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.013 -10.670 -2.314 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.180 -11.967 -4.169 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.218 -10.514 -3.980 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.506 -11.903 -2.743 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.441 -13.326 -3.157 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.691 -13.077 -4.798 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.221 -12.730 -5.579 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.838 -10.318 -5.377 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.384 -10.588 -4.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.370 -10.180 -7.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.200 -11.127 -6.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.499 -11.873 -7.035 1.00 0.00 H new ATOM 1147 N VAL A 71 -6.868 -12.811 -0.309 1.00 0.00 N ATOM 1148 CA VAL A 71 -7.208 -14.010 0.449 1.00 0.00 C ATOM 1149 C VAL A 71 -8.094 -13.606 1.619 1.00 0.00 C ATOM 1150 O VAL A 71 -9.042 -14.306 1.980 1.00 0.00 O ATOM 1151 CB VAL A 71 -5.951 -14.820 0.959 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -4.927 -14.962 -0.114 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -5.311 -14.260 2.212 1.00 0.00 C ATOM 0 H VAL A 71 -6.168 -12.212 0.128 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.734 -14.687 -0.224 1.00 0.00 H new ATOM 0 HB VAL A 71 -6.343 -15.801 1.228 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.075 -15.524 0.268 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.360 -15.492 -0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.596 -13.974 -0.434 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.457 -14.877 2.491 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.976 -13.240 2.025 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.039 -14.260 3.023 1.00 0.00 H new ATOM 1163 N ASN A 72 -7.783 -12.466 2.184 1.00 0.00 N ATOM 1164 CA ASN A 72 -8.521 -11.905 3.273 1.00 0.00 C ATOM 1165 C ASN A 72 -8.409 -10.404 3.248 1.00 0.00 C ATOM 1166 O ASN A 72 -7.561 -9.792 3.911 1.00 0.00 O ATOM 1167 CB ASN A 72 -8.094 -12.501 4.633 1.00 0.00 C ATOM 1168 CG ASN A 72 -8.795 -11.881 5.841 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -8.289 -10.942 6.452 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -9.948 -12.388 6.185 1.00 0.00 N ATOM 0 H ASN A 72 -6.991 -11.895 1.888 1.00 0.00 H new ATOM 0 HA ASN A 72 -9.571 -12.170 3.149 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.291 -13.573 4.624 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -7.017 -12.376 4.749 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -10.456 -12.005 6.982 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -10.340 -13.167 5.657 1.00 0.00 H new ATOM 1177 N GLY A 73 -9.125 -9.842 2.346 1.00 0.00 N ATOM 1178 CA GLY A 73 -9.279 -8.449 2.294 1.00 0.00 C ATOM 1179 C GLY A 73 -10.729 -8.101 2.187 1.00 0.00 C ATOM 1180 O GLY A 73 -11.518 -8.899 1.698 1.00 0.00 O ATOM 0 H GLY A 73 -9.625 -10.350 1.616 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -8.852 -7.994 3.187 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -8.735 -8.046 1.440 1.00 0.00 H new ATOM 1184 N TYR A 74 -11.060 -6.932 2.624 1.00 0.00 N ATOM 1185 CA TYR A 74 -12.374 -6.416 2.656 1.00 0.00 C ATOM 1186 C TYR A 74 -12.233 -4.963 2.482 1.00 0.00 C ATOM 1187 O TYR A 74 -11.289 -4.356 2.986 1.00 0.00 O ATOM 1188 CB TYR A 74 -13.036 -6.659 4.017 1.00 0.00 C ATOM 1189 CG TYR A 74 -13.544 -8.055 4.289 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -12.741 -9.039 4.834 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -14.856 -8.356 4.047 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -13.251 -10.286 5.132 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -15.378 -9.575 4.322 1.00 0.00 C ATOM 1194 CZ TYR A 74 -14.574 -10.552 4.875 1.00 0.00 C ATOM 1195 OH TYR A 74 -15.098 -11.792 5.178 1.00 0.00 O ATOM 0 H TYR A 74 -10.371 -6.275 2.990 1.00 0.00 H new ATOM 0 HA TYR A 74 -12.984 -6.893 1.889 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.317 -6.402 4.795 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -13.873 -5.968 4.116 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.700 -8.829 5.029 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -15.497 -7.597 3.623 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -12.616 -11.046 5.563 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -16.417 -9.782 4.110 1.00 0.00 H new ATOM 0 HH TYR A 74 -16.047 -11.814 4.935 1.00 0.00 H new ATOM 1205 N ILE A 75 -13.073 -4.421 1.739 1.00 0.00 N ATOM 1206 CA ILE A 75 -13.105 -3.015 1.578 1.00 0.00 C ATOM 1207 C ILE A 75 -14.145 -2.486 2.524 1.00 0.00 C ATOM 1208 O ILE A 75 -15.305 -2.887 2.456 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.401 -2.694 0.125 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.197 -3.113 -0.714 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.749 -1.208 -0.089 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.429 -3.106 -2.197 1.00 0.00 C ATOM 0 H ILE A 75 -13.780 -4.927 1.206 1.00 0.00 H new ATOM 0 HA ILE A 75 -12.152 -2.542 1.814 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.284 -3.251 -0.188 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.365 -2.446 -0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.893 -4.116 -0.413 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -13.952 -1.030 -1.145 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.631 -0.953 0.498 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.910 -0.589 0.228 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.519 -3.417 -2.709 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -13.237 -3.795 -2.442 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.700 -2.100 -2.518 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.709 -1.652 3.422 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.551 -1.166 4.468 1.00 0.00 C ATOM 1226 C GLY A 76 -14.824 0.307 4.359 1.00 0.00 C ATOM 1227 O GLY A 76 -13.929 1.170 4.551 1.00 0.00 O ATOM 0 H GLY A 76 -12.756 -1.290 3.447 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.496 -1.708 4.449 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.084 -1.374 5.431 1.00 0.00 H new ATOM 1231 N VAL A 77 -16.027 0.609 4.063 1.00 0.00 N ATOM 1232 CA VAL A 77 -16.431 1.961 3.955 1.00 0.00 C ATOM 1233 C VAL A 77 -17.292 2.315 5.121 1.00 0.00 C ATOM 1234 O VAL A 77 -18.178 1.568 5.495 1.00 0.00 O ATOM 1235 CB VAL A 77 -17.120 2.275 2.613 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -17.599 3.717 2.542 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -16.180 1.960 1.461 1.00 0.00 C ATOM 0 H VAL A 77 -16.765 -0.073 3.887 1.00 0.00 H new ATOM 0 HA VAL A 77 -15.537 2.584 3.971 1.00 0.00 H new ATOM 0 HB VAL A 77 -18.004 1.643 2.535 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -18.078 3.894 1.579 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -18.314 3.903 3.343 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -16.748 4.389 2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -16.675 2.185 0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -15.278 2.565 1.551 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -15.912 0.904 1.488 1.00 0.00 H new ATOM 1247 N SER A 78 -17.000 3.429 5.718 1.00 0.00 N ATOM 1248 CA SER A 78 -17.698 3.854 6.878 1.00 0.00 C ATOM 1249 C SER A 78 -18.680 4.950 6.493 1.00 0.00 C ATOM 1250 O SER A 78 -18.603 5.458 5.374 1.00 0.00 O ATOM 1251 CB SER A 78 -16.677 4.344 7.878 1.00 0.00 C ATOM 1252 OG SER A 78 -15.665 3.357 8.043 1.00 0.00 O ATOM 0 H SER A 78 -16.267 4.067 5.408 1.00 0.00 H new ATOM 0 HA SER A 78 -18.268 3.040 7.325 1.00 0.00 H new ATOM 0 HB2 SER A 78 -16.235 5.280 7.535 1.00 0.00 H new ATOM 0 HB3 SER A 78 -17.158 4.551 8.834 1.00 0.00 H new ATOM 0 HG SER A 78 -15.001 3.674 8.690 1.00 0.00 H new ATOM 1258 N ASP A 79 -19.556 5.312 7.423 1.00 0.00 N ATOM 1259 CA ASP A 79 -20.637 6.312 7.279 1.00 0.00 C ATOM 1260 C ASP A 79 -20.245 7.576 6.504 1.00 0.00 C ATOM 1261 O ASP A 79 -20.989 8.053 5.650 1.00 0.00 O ATOM 1262 CB ASP A 79 -21.162 6.690 8.672 1.00 0.00 C ATOM 1263 CG ASP A 79 -20.151 7.390 9.599 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -18.907 7.305 9.369 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -20.580 8.005 10.601 1.00 0.00 O ATOM 0 H ASP A 79 -19.540 4.899 8.355 1.00 0.00 H new ATOM 0 HA ASP A 79 -21.413 5.837 6.678 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -22.027 7.342 8.550 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -21.513 5.784 9.166 1.00 0.00 H new ATOM 1270 N ASN A 80 -19.079 8.078 6.776 1.00 0.00 N ATOM 1271 CA ASN A 80 -18.552 9.289 6.134 1.00 0.00 C ATOM 1272 C ASN A 80 -17.954 8.997 4.768 1.00 0.00 C ATOM 1273 O ASN A 80 -17.211 9.804 4.226 1.00 0.00 O ATOM 1274 CB ASN A 80 -17.510 9.965 7.033 1.00 0.00 C ATOM 1275 CG ASN A 80 -18.118 10.729 8.192 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -18.393 11.927 8.084 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -18.377 10.064 9.279 1.00 0.00 N ATOM 0 H ASN A 80 -18.441 7.667 7.458 1.00 0.00 H new ATOM 0 HA ASN A 80 -19.393 9.967 5.987 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -16.832 9.207 7.424 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -16.911 10.649 6.431 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -18.819 10.532 10.070 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -18.139 9.074 9.340 1.00 0.00 H new ATOM 1284 N GLY A 81 -18.287 7.837 4.224 1.00 0.00 N ATOM 1285 CA GLY A 81 -17.837 7.425 2.930 1.00 0.00 C ATOM 1286 C GLY A 81 -16.384 7.153 2.936 1.00 0.00 C ATOM 1287 O GLY A 81 -15.704 7.402 1.980 1.00 0.00 O ATOM 0 H GLY A 81 -18.887 7.154 4.687 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -18.377 6.530 2.621 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -18.062 8.201 2.199 1.00 0.00 H new ATOM 1291 N VAL A 82 -15.919 6.665 4.037 1.00 0.00 N ATOM 1292 CA VAL A 82 -14.524 6.393 4.228 1.00 0.00 C ATOM 1293 C VAL A 82 -14.150 5.132 3.444 1.00 0.00 C ATOM 1294 O VAL A 82 -14.525 4.055 3.808 1.00 0.00 O ATOM 1295 CB VAL A 82 -14.215 6.226 5.732 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -12.732 6.225 5.990 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -14.902 7.315 6.540 1.00 0.00 C ATOM 0 H VAL A 82 -16.501 6.439 4.844 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.929 7.228 3.858 1.00 0.00 H new ATOM 0 HB VAL A 82 -14.606 5.259 6.050 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.549 6.106 7.058 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.269 5.400 5.448 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.303 7.168 5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.674 7.182 7.598 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.546 8.291 6.212 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.980 7.253 6.391 1.00 0.00 H new ATOM 1307 N ILE A 83 -13.374 5.331 2.418 1.00 0.00 N ATOM 1308 CA ILE A 83 -12.981 4.353 1.370 1.00 0.00 C ATOM 1309 C ILE A 83 -11.835 3.439 1.805 1.00 0.00 C ATOM 1310 O ILE A 83 -10.894 3.199 1.067 1.00 0.00 O ATOM 1311 CB ILE A 83 -12.738 5.028 -0.037 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -13.928 5.931 -0.373 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -12.582 3.973 -1.157 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -15.261 5.222 -0.268 1.00 0.00 C ATOM 0 H ILE A 83 -12.951 6.245 2.253 1.00 0.00 H new ATOM 0 HA ILE A 83 -13.841 3.697 1.237 1.00 0.00 H new ATOM 0 HB ILE A 83 -11.815 5.606 0.022 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.926 6.789 0.299 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -13.808 6.318 -1.385 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -12.416 4.476 -2.110 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -11.732 3.329 -0.934 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -13.488 3.370 -1.218 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -16.063 5.916 -0.518 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.281 4.380 -0.960 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.401 4.858 0.750 1.00 0.00 H new ATOM 1326 N SER A 84 -11.837 3.045 3.033 1.00 0.00 N ATOM 1327 CA SER A 84 -10.666 2.389 3.561 1.00 0.00 C ATOM 1328 C SER A 84 -10.778 0.883 3.398 1.00 0.00 C ATOM 1329 O SER A 84 -11.831 0.357 3.082 1.00 0.00 O ATOM 1330 CB SER A 84 -10.556 2.748 5.013 1.00 0.00 C ATOM 1331 OG SER A 84 -10.648 4.144 5.127 1.00 0.00 O ATOM 0 H SER A 84 -12.612 3.157 3.686 1.00 0.00 H new ATOM 0 HA SER A 84 -9.777 2.714 3.020 1.00 0.00 H new ATOM 0 HB2 SER A 84 -11.349 2.267 5.585 1.00 0.00 H new ATOM 0 HB3 SER A 84 -9.609 2.395 5.421 1.00 0.00 H new ATOM 0 HG SER A 84 -10.564 4.402 6.069 1.00 0.00 H new ATOM 1337 N THR A 85 -9.694 0.207 3.506 1.00 0.00 N ATOM 1338 CA THR A 85 -9.735 -1.207 3.408 1.00 0.00 C ATOM 1339 C THR A 85 -9.380 -1.825 4.734 1.00 0.00 C ATOM 1340 O THR A 85 -8.781 -1.156 5.611 1.00 0.00 O ATOM 1341 CB THR A 85 -8.829 -1.723 2.292 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.481 -1.349 2.544 1.00 0.00 O ATOM 1343 CG2 THR A 85 -9.262 -1.147 0.953 1.00 0.00 C ATOM 0 H THR A 85 -8.769 0.607 3.662 1.00 0.00 H new ATOM 0 HA THR A 85 -10.752 -1.502 3.148 1.00 0.00 H new ATOM 0 HB THR A 85 -8.907 -2.810 2.262 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.901 -1.733 1.854 1.00 0.00 H new ATOM 0 HG21 THR A 85 -8.608 -1.523 0.166 1.00 0.00 H new ATOM 0 HG22 THR A 85 -10.289 -1.445 0.744 1.00 0.00 H new ATOM 0 HG23 THR A 85 -9.200 -0.059 0.988 1.00 0.00 H new ATOM 1351 N PHE A 86 -9.779 -3.061 4.919 1.00 0.00 N ATOM 1352 CA PHE A 86 -9.550 -3.761 6.149 1.00 0.00 C ATOM 1353 C PHE A 86 -9.146 -5.205 5.861 1.00 0.00 C ATOM 1354 O PHE A 86 -9.435 -5.741 4.775 1.00 0.00 O ATOM 1355 CB PHE A 86 -10.839 -3.812 7.011 1.00 0.00 C ATOM 1356 CG PHE A 86 -11.369 -2.507 7.560 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.908 -1.542 6.728 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -11.354 -2.272 8.917 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -12.413 -0.365 7.241 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -11.865 -1.101 9.441 1.00 0.00 C ATOM 1361 CZ PHE A 86 -12.395 -0.146 8.600 1.00 0.00 C ATOM 0 H PHE A 86 -10.274 -3.607 4.214 1.00 0.00 H new ATOM 0 HA PHE A 86 -8.762 -3.229 6.682 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -11.626 -4.268 6.410 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -10.653 -4.479 7.853 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -11.934 -1.712 5.662 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -10.936 -3.014 9.581 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -12.822 0.383 6.578 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -11.849 -0.934 10.508 1.00 0.00 H new ATOM 0 HZ PHE A 86 -12.795 0.771 9.006 1.00 0.00 H new ATOM 1371 N HIS A 87 -8.473 -5.813 6.807 1.00 0.00 N ATOM 1372 CA HIS A 87 -8.239 -7.238 6.783 1.00 0.00 C ATOM 1373 C HIS A 87 -9.225 -7.845 7.739 1.00 0.00 C ATOM 1374 O HIS A 87 -9.191 -7.562 8.950 1.00 0.00 O ATOM 1375 CB HIS A 87 -6.798 -7.634 7.163 1.00 0.00 C ATOM 1376 CG HIS A 87 -5.763 -7.311 6.124 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -5.720 -7.903 4.877 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -4.719 -6.450 6.162 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -4.678 -7.397 4.212 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -4.031 -6.507 4.950 1.00 0.00 N ATOM 0 H HIS A 87 -8.072 -5.336 7.615 1.00 0.00 H new ATOM 0 HA HIS A 87 -8.370 -7.606 5.765 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -6.530 -7.130 8.092 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -6.771 -8.705 7.362 1.00 0.00 H new ATOM 0 HD1 HIS A 87 -6.371 -8.605 4.525 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -4.460 -5.818 6.999 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -4.400 -7.676 3.206 1.00 0.00 H new ATOM 1388 N GLY A 88 -10.121 -8.618 7.220 1.00 0.00 N ATOM 1389 CA GLY A 88 -11.187 -9.118 8.024 1.00 0.00 C ATOM 1390 C GLY A 88 -12.362 -8.155 7.996 1.00 0.00 C ATOM 1391 O GLY A 88 -12.291 -7.100 7.352 1.00 0.00 O ATOM 0 H GLY A 88 -10.137 -8.917 6.245 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -11.500 -10.096 7.658 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.845 -9.256 9.050 1.00 0.00 H new ATOM 1395 N ARG A 89 -13.429 -8.521 8.658 1.00 0.00 N ATOM 1396 CA ARG A 89 -14.642 -7.721 8.724 1.00 0.00 C ATOM 1397 C ARG A 89 -14.376 -6.335 9.316 1.00 0.00 C ATOM 1398 O ARG A 89 -13.670 -6.211 10.337 1.00 0.00 O ATOM 1399 CB ARG A 89 -15.718 -8.443 9.545 1.00 0.00 C ATOM 1400 CG ARG A 89 -16.247 -9.722 8.910 1.00 0.00 C ATOM 1401 CD ARG A 89 -16.988 -9.434 7.616 1.00 0.00 C ATOM 1402 NE ARG A 89 -17.554 -10.644 7.018 1.00 0.00 N ATOM 1403 CZ ARG A 89 -18.381 -10.671 5.965 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -18.688 -9.548 5.321 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -18.874 -11.825 5.544 1.00 0.00 N ATOM 0 H ARG A 89 -13.488 -9.397 9.178 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.999 -7.587 7.703 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -15.308 -8.683 10.526 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.553 -7.761 9.706 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -15.418 -10.402 8.713 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.914 -10.227 9.608 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -17.788 -8.719 7.809 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -16.306 -8.965 6.906 1.00 0.00 H new ATOM 0 HE ARG A 89 -17.298 -11.538 7.437 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -18.293 -8.659 5.629 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -19.319 -9.576 4.520 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -18.624 -12.691 6.021 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -19.504 -11.848 4.742 1.00 0.00 H new ATOM 1419 N PRO A 90 -14.893 -5.282 8.666 1.00 0.00 N ATOM 1420 CA PRO A 90 -14.766 -3.925 9.146 1.00 0.00 C ATOM 1421 C PRO A 90 -15.718 -3.655 10.310 1.00 0.00 C ATOM 1422 O PRO A 90 -16.883 -3.299 10.134 1.00 0.00 O ATOM 1423 CB PRO A 90 -15.089 -3.039 7.939 1.00 0.00 C ATOM 1424 CG PRO A 90 -15.744 -3.925 6.926 1.00 0.00 C ATOM 1425 CD PRO A 90 -15.626 -5.354 7.398 1.00 0.00 C ATOM 0 HA PRO A 90 -13.767 -3.726 9.534 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -15.750 -2.221 8.224 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.182 -2.590 7.533 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.792 -3.651 6.803 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.267 -3.806 5.953 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.609 -5.805 7.536 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -15.094 -5.966 6.670 1.00 0.00 H new ATOM 1433 N GLU A 91 -15.222 -3.906 11.477 1.00 0.00 N ATOM 1434 CA GLU A 91 -15.946 -3.751 12.704 1.00 0.00 C ATOM 1435 C GLU A 91 -15.157 -2.758 13.575 1.00 0.00 C ATOM 1436 O GLU A 91 -14.020 -2.438 13.230 1.00 0.00 O ATOM 1437 CB GLU A 91 -16.037 -5.143 13.367 1.00 0.00 C ATOM 1438 CG GLU A 91 -14.683 -5.747 13.689 1.00 0.00 C ATOM 1439 CD GLU A 91 -14.767 -7.141 14.220 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -15.276 -7.342 15.328 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -14.291 -8.070 13.554 1.00 0.00 O ATOM 0 H GLU A 91 -14.267 -4.237 11.611 1.00 0.00 H new ATOM 0 HA GLU A 91 -16.956 -3.368 12.557 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -16.618 -5.062 14.286 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -16.579 -5.818 12.705 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.069 -5.745 12.788 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -14.177 -5.117 14.421 1.00 0.00 H new ATOM 1448 N PRO A 92 -15.713 -2.251 14.700 1.00 0.00 N ATOM 1449 CA PRO A 92 -14.988 -1.317 15.574 1.00 0.00 C ATOM 1450 C PRO A 92 -13.779 -1.972 16.251 1.00 0.00 C ATOM 1451 O PRO A 92 -12.876 -1.293 16.727 1.00 0.00 O ATOM 1452 CB PRO A 92 -16.018 -0.876 16.615 1.00 0.00 C ATOM 1453 CG PRO A 92 -17.115 -1.879 16.555 1.00 0.00 C ATOM 1454 CD PRO A 92 -17.073 -2.517 15.191 1.00 0.00 C ATOM 0 HA PRO A 92 -14.581 -0.482 15.004 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.576 -0.840 17.611 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -16.391 0.124 16.396 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -16.989 -2.631 17.334 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -18.080 -1.402 16.725 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -17.272 -3.587 15.247 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -17.825 -2.087 14.529 1.00 0.00 H new ATOM 1462 N ALA A 93 -13.771 -3.298 16.274 1.00 0.00 N ATOM 1463 CA ALA A 93 -12.663 -4.057 16.820 1.00 0.00 C ATOM 1464 C ALA A 93 -11.619 -4.334 15.730 1.00 0.00 C ATOM 1465 O ALA A 93 -10.626 -5.053 15.946 1.00 0.00 O ATOM 1466 CB ALA A 93 -13.168 -5.353 17.428 1.00 0.00 C ATOM 0 H ALA A 93 -14.533 -3.873 15.915 1.00 0.00 H new ATOM 0 HA ALA A 93 -12.186 -3.472 17.606 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -12.328 -5.916 17.835 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -13.876 -5.129 18.226 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -13.664 -5.946 16.660 1.00 0.00 H new ATOM 1472 N SER A 94 -11.862 -3.782 14.565 1.00 0.00 N ATOM 1473 CA SER A 94 -10.953 -3.874 13.454 1.00 0.00 C ATOM 1474 C SER A 94 -10.448 -2.462 13.152 1.00 0.00 C ATOM 1475 O SER A 94 -11.054 -1.470 13.591 1.00 0.00 O ATOM 1476 CB SER A 94 -11.674 -4.484 12.244 1.00 0.00 C ATOM 1477 OG SER A 94 -10.806 -4.767 11.157 1.00 0.00 O ATOM 0 H SER A 94 -12.708 -3.250 14.362 1.00 0.00 H new ATOM 0 HA SER A 94 -10.107 -4.520 13.688 1.00 0.00 H new ATOM 0 HB2 SER A 94 -12.171 -5.404 12.552 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.452 -3.798 11.910 1.00 0.00 H new ATOM 0 HG SER A 94 -11.322 -5.154 10.419 1.00 0.00 H new ATOM 1483 N GLU A 95 -9.374 -2.369 12.419 1.00 0.00 N ATOM 1484 CA GLU A 95 -8.730 -1.102 12.148 1.00 0.00 C ATOM 1485 C GLU A 95 -8.544 -0.926 10.652 1.00 0.00 C ATOM 1486 O GLU A 95 -8.203 -1.890 9.959 1.00 0.00 O ATOM 1487 CB GLU A 95 -7.361 -1.078 12.816 1.00 0.00 C ATOM 1488 CG GLU A 95 -7.400 -1.321 14.306 1.00 0.00 C ATOM 1489 CD GLU A 95 -6.031 -1.364 14.900 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -5.400 -2.450 14.896 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -5.534 -0.328 15.373 1.00 0.00 O ATOM 0 H GLU A 95 -8.914 -3.171 11.988 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.353 -0.297 12.537 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.728 -1.834 12.351 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.893 -0.112 12.628 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.980 -0.533 14.787 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.912 -2.262 14.507 1.00 0.00 H new ATOM 1498 N PRO A 96 -8.779 0.285 10.118 1.00 0.00 N ATOM 1499 CA PRO A 96 -8.553 0.565 8.707 1.00 0.00 C ATOM 1500 C PRO A 96 -7.070 0.505 8.389 1.00 0.00 C ATOM 1501 O PRO A 96 -6.239 1.024 9.144 1.00 0.00 O ATOM 1502 CB PRO A 96 -9.071 1.998 8.509 1.00 0.00 C ATOM 1503 CG PRO A 96 -9.839 2.323 9.741 1.00 0.00 C ATOM 1504 CD PRO A 96 -9.270 1.473 10.836 1.00 0.00 C ATOM 0 HA PRO A 96 -9.051 -0.156 8.059 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -8.246 2.696 8.366 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -9.703 2.067 7.624 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -9.749 3.381 9.986 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -10.900 2.117 9.602 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.466 1.984 11.366 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.025 1.212 11.577 1.00 0.00 H new ATOM 1512 N ILE A 97 -6.748 -0.129 7.294 1.00 0.00 N ATOM 1513 CA ILE A 97 -5.365 -0.287 6.852 1.00 0.00 C ATOM 1514 C ILE A 97 -4.795 1.077 6.470 1.00 0.00 C ATOM 1515 O ILE A 97 -3.642 1.395 6.773 1.00 0.00 O ATOM 1516 CB ILE A 97 -5.299 -1.252 5.638 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -5.889 -2.608 6.018 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -3.860 -1.421 5.146 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.170 -3.508 4.841 1.00 0.00 C ATOM 0 H ILE A 97 -7.433 -0.557 6.671 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.774 -0.710 7.664 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.884 -0.821 4.826 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.200 -3.115 6.694 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.816 -2.448 6.569 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.844 -2.102 4.295 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.463 -0.452 4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.246 -1.829 5.949 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.587 -4.451 5.195 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.883 -3.023 4.174 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.243 -3.701 4.301 1.00 0.00 H new ATOM 1531 N GLN A 98 -5.624 1.870 5.841 1.00 0.00 N ATOM 1532 CA GLN A 98 -5.295 3.204 5.406 1.00 0.00 C ATOM 1533 C GLN A 98 -6.608 3.918 5.237 1.00 0.00 C ATOM 1534 O GLN A 98 -7.617 3.402 5.702 1.00 0.00 O ATOM 1535 CB GLN A 98 -4.504 3.176 4.069 1.00 0.00 C ATOM 1536 CG GLN A 98 -5.279 2.889 2.773 1.00 0.00 C ATOM 1537 CD GLN A 98 -6.274 1.774 2.896 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -7.472 2.002 3.047 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.776 0.656 3.109 1.00 0.00 N ATOM 0 H GLN A 98 -6.579 1.596 5.610 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.656 3.710 6.130 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -4.009 4.140 3.955 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.720 2.424 4.162 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -5.800 3.795 2.464 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -4.569 2.644 1.983 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.776 0.508 2.971 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.367 -0.114 3.421 1.00 0.00 H new ATOM 1548 N SER A 99 -6.619 5.064 4.620 1.00 0.00 N ATOM 1549 CA SER A 99 -7.848 5.664 4.241 1.00 0.00 C ATOM 1550 C SER A 99 -7.672 6.438 2.938 1.00 0.00 C ATOM 1551 O SER A 99 -6.970 7.446 2.894 1.00 0.00 O ATOM 1552 CB SER A 99 -8.455 6.500 5.377 1.00 0.00 C ATOM 1553 OG SER A 99 -7.483 7.341 5.989 1.00 0.00 O ATOM 0 H SER A 99 -5.785 5.596 4.372 1.00 0.00 H new ATOM 0 HA SER A 99 -8.580 4.879 4.050 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.269 7.110 4.985 1.00 0.00 H new ATOM 0 HB3 SER A 99 -8.886 5.837 6.127 1.00 0.00 H new ATOM 0 HG SER A 99 -7.904 7.860 6.706 1.00 0.00 H new ATOM 1559 N PHE A 100 -8.266 5.937 1.872 1.00 0.00 N ATOM 1560 CA PHE A 100 -8.107 6.555 0.570 1.00 0.00 C ATOM 1561 C PHE A 100 -8.831 7.883 0.434 1.00 0.00 C ATOM 1562 O PHE A 100 -8.203 8.907 0.169 1.00 0.00 O ATOM 1563 CB PHE A 100 -8.525 5.615 -0.561 1.00 0.00 C ATOM 1564 CG PHE A 100 -7.640 4.422 -0.715 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -6.368 4.560 -1.241 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -8.071 3.166 -0.337 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -5.545 3.469 -1.387 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -7.254 2.072 -0.483 1.00 0.00 C ATOM 1569 CZ PHE A 100 -5.989 2.225 -1.007 1.00 0.00 C ATOM 0 H PHE A 100 -8.860 5.108 1.881 1.00 0.00 H new ATOM 0 HA PHE A 100 -7.040 6.762 0.485 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -9.546 5.277 -0.381 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -8.534 6.172 -1.498 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -6.017 5.537 -1.540 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.061 3.043 0.078 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.554 3.589 -1.799 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.602 1.093 -0.188 1.00 0.00 H new ATOM 0 HZ PHE A 100 -5.345 1.365 -1.119 1.00 0.00 H new ATOM 1579 N PHE A 101 -10.126 7.877 0.635 1.00 0.00 N ATOM 1580 CA PHE A 101 -10.925 9.049 0.354 1.00 0.00 C ATOM 1581 C PHE A 101 -12.243 8.935 1.126 1.00 0.00 C ATOM 1582 O PHE A 101 -12.477 7.907 1.790 1.00 0.00 O ATOM 1583 CB PHE A 101 -11.162 9.067 -1.180 1.00 0.00 C ATOM 1584 CG PHE A 101 -11.740 10.323 -1.757 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -11.072 11.523 -1.626 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -12.928 10.294 -2.464 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -11.575 12.676 -2.183 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -13.440 11.446 -3.021 1.00 0.00 C ATOM 1589 CZ PHE A 101 -12.761 12.638 -2.881 1.00 0.00 C ATOM 0 H PHE A 101 -10.650 7.077 0.991 1.00 0.00 H new ATOM 0 HA PHE A 101 -10.437 9.974 0.661 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -10.210 8.873 -1.674 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -11.826 8.240 -1.431 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.142 11.558 -1.079 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.459 9.361 -2.581 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -11.041 13.608 -2.073 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.372 11.415 -3.566 1.00 0.00 H new ATOM 0 HZ PHE A 101 -13.159 13.541 -3.319 1.00 0.00 H new ATOM 1599 N GLN A 102 -13.065 9.975 1.073 1.00 0.00 N ATOM 1600 CA GLN A 102 -14.382 9.987 1.682 1.00 0.00 C ATOM 1601 C GLN A 102 -15.445 10.479 0.711 1.00 0.00 C ATOM 1602 O GLN A 102 -15.165 11.301 -0.172 1.00 0.00 O ATOM 1603 CB GLN A 102 -14.419 10.792 2.968 1.00 0.00 C ATOM 1604 CG GLN A 102 -13.924 10.027 4.180 1.00 0.00 C ATOM 1605 CD GLN A 102 -13.981 10.833 5.457 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -13.165 10.652 6.350 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -14.976 11.676 5.585 1.00 0.00 N ATOM 0 H GLN A 102 -12.829 10.846 0.597 1.00 0.00 H new ATOM 0 HA GLN A 102 -14.608 8.952 1.940 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -13.812 11.689 2.843 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -15.442 11.122 3.150 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -14.522 9.124 4.301 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -12.897 9.707 4.005 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -15.639 11.803 4.820 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -15.088 12.206 6.450 1.00 0.00 H new ATOM 1616 N ILE A 103 -16.651 9.955 0.870 1.00 0.00 N ATOM 1617 CA ILE A 103 -17.805 10.259 0.010 1.00 0.00 C ATOM 1618 C ILE A 103 -19.085 10.258 0.877 1.00 0.00 C ATOM 1619 O ILE A 103 -19.018 10.020 2.075 1.00 0.00 O ATOM 1620 CB ILE A 103 -17.970 9.196 -1.147 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -18.265 7.814 -0.555 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -16.718 9.141 -2.020 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -18.516 6.755 -1.583 1.00 0.00 C ATOM 0 H ILE A 103 -16.868 9.292 1.614 1.00 0.00 H new ATOM 0 HA ILE A 103 -17.641 11.235 -0.448 1.00 0.00 H new ATOM 0 HB ILE A 103 -18.808 9.500 -1.774 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -17.424 7.510 0.068 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.135 7.887 0.097 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -16.857 8.402 -2.809 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -16.542 10.120 -2.466 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -15.860 8.862 -1.408 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -18.717 5.806 -1.086 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -19.376 7.035 -2.192 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -17.638 6.652 -2.221 1.00 0.00 H new ATOM 1635 N ASP A 104 -20.235 10.514 0.289 1.00 0.00 N ATOM 1636 CA ASP A 104 -21.489 10.479 1.051 1.00 0.00 C ATOM 1637 C ASP A 104 -22.211 9.180 0.868 1.00 0.00 C ATOM 1638 O ASP A 104 -22.692 8.877 -0.235 1.00 0.00 O ATOM 1639 CB ASP A 104 -22.447 11.604 0.662 1.00 0.00 C ATOM 1640 CG ASP A 104 -22.028 12.949 1.141 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -21.300 13.630 0.434 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -22.442 13.359 2.239 1.00 0.00 O ATOM 0 H ASP A 104 -20.339 10.746 -0.699 1.00 0.00 H new ATOM 0 HA ASP A 104 -21.193 10.604 2.093 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -22.540 11.629 -0.424 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -23.436 11.379 1.061 1.00 0.00 H new ATOM 1647 N LEU A 105 -22.355 8.427 1.935 1.00 0.00 N ATOM 1648 CA LEU A 105 -23.100 7.193 1.866 1.00 0.00 C ATOM 1649 C LEU A 105 -24.566 7.498 1.758 1.00 0.00 C ATOM 1650 O LEU A 105 -25.318 6.717 1.224 1.00 0.00 O ATOM 1651 CB LEU A 105 -22.895 6.278 3.069 1.00 0.00 C ATOM 1652 CG LEU A 105 -21.531 5.646 3.283 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -21.708 4.382 4.099 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -20.846 5.347 1.970 1.00 0.00 C ATOM 0 H LEU A 105 -21.969 8.646 2.853 1.00 0.00 H new ATOM 0 HA LEU A 105 -22.726 6.667 0.988 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -23.138 6.850 3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -23.625 5.472 2.999 1.00 0.00 H new ATOM 0 HG LEU A 105 -20.892 6.347 3.819 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -20.737 3.915 4.262 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -22.157 4.630 5.061 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -22.358 3.690 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -19.873 4.896 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -21.458 4.657 1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -20.713 6.273 1.410 1.00 0.00 H new ATOM 1666 N GLU A 106 -24.960 8.642 2.273 1.00 0.00 N ATOM 1667 CA GLU A 106 -26.335 9.089 2.174 1.00 0.00 C ATOM 1668 C GLU A 106 -26.698 9.403 0.721 1.00 0.00 C ATOM 1669 O GLU A 106 -27.861 9.444 0.361 1.00 0.00 O ATOM 1670 CB GLU A 106 -26.577 10.306 3.073 1.00 0.00 C ATOM 1671 CG GLU A 106 -25.599 11.451 2.851 1.00 0.00 C ATOM 1672 CD GLU A 106 -25.930 12.673 3.668 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -25.586 12.711 4.857 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -26.522 13.625 3.128 1.00 0.00 O ATOM 0 H GLU A 106 -24.343 9.285 2.769 1.00 0.00 H new ATOM 0 HA GLU A 106 -26.982 8.282 2.518 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -27.590 10.671 2.906 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -26.520 9.991 4.115 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -24.592 11.115 3.100 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -25.594 11.718 1.794 1.00 0.00 H new ATOM 1681 N ARG A 107 -25.689 9.625 -0.102 1.00 0.00 N ATOM 1682 CA ARG A 107 -25.919 9.886 -1.497 1.00 0.00 C ATOM 1683 C ARG A 107 -25.719 8.585 -2.290 1.00 0.00 C ATOM 1684 O ARG A 107 -26.087 8.487 -3.463 1.00 0.00 O ATOM 1685 CB ARG A 107 -25.024 11.044 -1.990 1.00 0.00 C ATOM 1686 CG ARG A 107 -23.852 10.659 -2.874 1.00 0.00 C ATOM 1687 CD ARG A 107 -22.997 11.869 -3.223 1.00 0.00 C ATOM 1688 NE ARG A 107 -23.794 13.007 -3.708 1.00 0.00 N ATOM 1689 CZ ARG A 107 -23.296 14.123 -4.257 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -22.006 14.197 -4.586 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -24.109 15.151 -4.517 1.00 0.00 N ATOM 0 H ARG A 107 -24.708 9.628 0.178 1.00 0.00 H new ATOM 0 HA ARG A 107 -26.946 10.215 -1.656 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -25.649 11.750 -2.538 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.636 11.572 -1.119 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -23.240 9.914 -2.365 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -24.221 10.197 -3.789 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -22.432 12.175 -2.343 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -22.271 11.588 -3.986 1.00 0.00 H new ATOM 0 HE ARG A 107 -24.808 12.941 -3.619 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -21.391 13.400 -4.420 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -21.634 15.050 -5.004 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -25.103 15.083 -4.298 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -23.736 16.003 -4.935 1.00 0.00 H new ATOM 1705 N LEU A 108 -25.104 7.594 -1.622 1.00 0.00 N ATOM 1706 CA LEU A 108 -24.960 6.243 -2.177 1.00 0.00 C ATOM 1707 C LEU A 108 -26.287 5.588 -2.384 1.00 0.00 C ATOM 1708 O LEU A 108 -27.341 6.074 -1.961 1.00 0.00 O ATOM 1709 CB LEU A 108 -24.164 5.279 -1.258 1.00 0.00 C ATOM 1710 CG LEU A 108 -22.826 4.867 -1.782 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -21.840 5.922 -1.608 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -22.313 3.613 -1.193 1.00 0.00 C ATOM 0 H LEU A 108 -24.698 7.707 -0.693 1.00 0.00 H new ATOM 0 HA LEU A 108 -24.427 6.400 -3.115 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -24.026 5.757 -0.288 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -24.763 4.384 -1.090 1.00 0.00 H new ATOM 0 HG LEU A 108 -22.985 4.681 -2.844 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -20.879 5.590 -1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.162 6.814 -2.146 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -21.739 6.155 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -21.339 3.381 -1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -22.214 3.732 -0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -23.007 2.800 -1.407 1.00 0.00 H new ATOM 1724 N GLU A 109 -26.234 4.478 -3.023 1.00 0.00 N ATOM 1725 CA GLU A 109 -27.358 3.654 -3.124 1.00 0.00 C ATOM 1726 C GLU A 109 -27.247 2.668 -1.975 1.00 0.00 C ATOM 1727 O GLU A 109 -26.143 2.172 -1.689 1.00 0.00 O ATOM 1728 CB GLU A 109 -27.416 3.012 -4.499 1.00 0.00 C ATOM 1729 CG GLU A 109 -27.280 4.065 -5.599 1.00 0.00 C ATOM 1730 CD GLU A 109 -27.652 3.587 -6.960 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -26.886 2.814 -7.572 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -28.736 3.993 -7.458 1.00 0.00 O ATOM 0 H GLU A 109 -25.400 4.122 -3.490 1.00 0.00 H new ATOM 0 HA GLU A 109 -28.300 4.196 -3.038 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -26.618 2.275 -4.595 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -28.359 2.478 -4.616 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -27.905 4.921 -5.345 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -26.249 4.419 -5.621 1.00 0.00 H new ATOM 1739 N SER A 110 -28.350 2.454 -1.297 1.00 0.00 N ATOM 1740 CA SER A 110 -28.427 1.709 -0.050 1.00 0.00 C ATOM 1741 C SER A 110 -27.596 0.414 0.020 1.00 0.00 C ATOM 1742 O SER A 110 -26.823 0.231 0.966 1.00 0.00 O ATOM 1743 CB SER A 110 -29.889 1.458 0.296 1.00 0.00 C ATOM 1744 OG SER A 110 -30.574 2.698 0.445 1.00 0.00 O ATOM 0 H SER A 110 -29.256 2.805 -1.606 1.00 0.00 H new ATOM 0 HA SER A 110 -27.955 2.343 0.701 1.00 0.00 H new ATOM 0 HB2 SER A 110 -30.360 0.865 -0.488 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.959 0.881 1.218 1.00 0.00 H new ATOM 0 HG SER A 110 -31.514 2.528 0.666 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.685 -0.444 -0.974 1.00 0.00 N ATOM 1751 CA HIS A 111 -27.006 -1.727 -0.862 1.00 0.00 C ATOM 1752 C HIS A 111 -25.519 -1.592 -1.119 1.00 0.00 C ATOM 1753 O HIS A 111 -24.723 -2.329 -0.541 1.00 0.00 O ATOM 1754 CB HIS A 111 -27.672 -2.823 -1.715 1.00 0.00 C ATOM 1755 CG HIS A 111 -27.266 -4.232 -1.362 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -26.724 -5.128 -2.253 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -27.399 -4.907 -0.193 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -26.553 -6.291 -1.623 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -26.947 -6.211 -0.362 1.00 0.00 N ATOM 0 H HIS A 111 -28.200 -0.291 -1.841 1.00 0.00 H new ATOM 0 HA HIS A 111 -27.113 -2.061 0.170 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -28.754 -2.735 -1.614 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -27.434 -2.643 -2.763 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -27.794 -4.496 0.725 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -26.147 -7.181 -2.081 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -26.924 -6.951 0.339 1.00 0.00 H new ATOM 1767 N MET A 112 -25.158 -0.619 -1.929 1.00 0.00 N ATOM 1768 CA MET A 112 -23.766 -0.312 -2.196 1.00 0.00 C ATOM 1769 C MET A 112 -23.030 -0.018 -0.902 1.00 0.00 C ATOM 1770 O MET A 112 -22.059 -0.697 -0.568 1.00 0.00 O ATOM 1771 CB MET A 112 -23.643 0.868 -3.162 1.00 0.00 C ATOM 1772 CG MET A 112 -23.818 0.505 -4.622 1.00 0.00 C ATOM 1773 SD MET A 112 -22.464 -0.523 -5.234 1.00 0.00 S ATOM 1774 CE MET A 112 -21.083 0.590 -4.986 1.00 0.00 C ATOM 0 H MET A 112 -25.819 -0.018 -2.421 1.00 0.00 H new ATOM 0 HA MET A 112 -23.310 -1.184 -2.665 1.00 0.00 H new ATOM 0 HB2 MET A 112 -24.387 1.619 -2.896 1.00 0.00 H new ATOM 0 HB3 MET A 112 -22.664 1.329 -3.030 1.00 0.00 H new ATOM 0 HG2 MET A 112 -24.762 -0.024 -4.753 1.00 0.00 H new ATOM 0 HG3 MET A 112 -23.878 1.416 -5.217 1.00 0.00 H new ATOM 0 HE1 MET A 112 -20.366 0.466 -5.798 1.00 0.00 H new ATOM 0 HE2 MET A 112 -21.443 1.619 -4.973 1.00 0.00 H new ATOM 0 HE3 MET A 112 -20.599 0.363 -4.036 1.00 0.00 H new ATOM 1784 N GLN A 113 -23.539 0.944 -0.135 1.00 0.00 N ATOM 1785 CA GLN A 113 -22.902 1.313 1.136 1.00 0.00 C ATOM 1786 C GLN A 113 -22.902 0.166 2.096 1.00 0.00 C ATOM 1787 O GLN A 113 -21.889 -0.136 2.693 1.00 0.00 O ATOM 1788 CB GLN A 113 -23.514 2.557 1.807 1.00 0.00 C ATOM 1789 CG GLN A 113 -24.923 2.834 1.461 1.00 0.00 C ATOM 1790 CD GLN A 113 -25.738 3.299 2.642 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -26.309 2.499 3.382 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -25.846 4.575 2.804 1.00 0.00 N ATOM 0 H GLN A 113 -24.378 1.478 -0.363 1.00 0.00 H new ATOM 0 HA GLN A 113 -21.876 1.573 0.874 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -23.439 2.440 2.888 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -22.914 3.426 1.538 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -24.957 3.594 0.681 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -25.374 1.932 1.047 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -25.360 5.212 2.173 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -26.418 4.946 3.563 1.00 0.00 H new ATOM 1801 N LYS A 114 -24.035 -0.497 2.209 1.00 0.00 N ATOM 1802 CA LYS A 114 -24.165 -1.624 3.116 1.00 0.00 C ATOM 1803 C LYS A 114 -23.211 -2.777 2.797 1.00 0.00 C ATOM 1804 O LYS A 114 -22.791 -3.499 3.703 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.596 -2.108 3.213 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.517 -1.077 3.828 1.00 0.00 C ATOM 1807 CD LYS A 114 -27.918 -1.613 4.043 1.00 0.00 C ATOM 1808 CE LYS A 114 -28.606 -1.958 2.732 1.00 0.00 C ATOM 1809 NZ LYS A 114 -30.007 -2.365 2.935 1.00 0.00 N ATOM 0 H LYS A 114 -24.881 -0.276 1.684 1.00 0.00 H new ATOM 0 HA LYS A 114 -23.869 -1.246 4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.957 -2.365 2.217 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.628 -3.020 3.809 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -26.105 -0.749 4.782 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -26.561 -0.201 3.181 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -27.873 -2.501 4.673 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -28.511 -0.872 4.579 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -28.572 -1.095 2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -28.062 -2.763 2.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -30.439 -2.592 2.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -30.039 -3.204 3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -30.533 -1.588 3.383 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.874 -2.970 1.525 1.00 0.00 N ATOM 1824 CA ASN A 115 -21.891 -4.002 1.158 1.00 0.00 C ATOM 1825 C ASN A 115 -20.535 -3.624 1.661 1.00 0.00 C ATOM 1826 O ASN A 115 -19.790 -4.451 2.176 1.00 0.00 O ATOM 1827 CB ASN A 115 -21.815 -4.266 -0.350 1.00 0.00 C ATOM 1828 CG ASN A 115 -23.000 -5.014 -0.888 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -23.647 -5.782 -0.162 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -23.257 -4.859 -2.162 1.00 0.00 N ATOM 0 H ASN A 115 -23.254 -2.441 0.740 1.00 0.00 H new ATOM 0 HA ASN A 115 -22.232 -4.925 1.628 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -21.728 -3.314 -0.873 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -20.909 -4.832 -0.566 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -24.017 -5.382 -2.596 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.697 -4.215 -2.721 1.00 0.00 H new ATOM 1837 N LEU A 116 -20.244 -2.365 1.549 1.00 0.00 N ATOM 1838 CA LEU A 116 -18.984 -1.815 1.971 1.00 0.00 C ATOM 1839 C LEU A 116 -18.888 -1.818 3.503 1.00 0.00 C ATOM 1840 O LEU A 116 -17.808 -1.960 4.064 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.879 -0.412 1.435 1.00 0.00 C ATOM 1842 CG LEU A 116 -19.047 -0.266 -0.078 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -19.209 1.183 -0.445 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.862 -0.868 -0.812 1.00 0.00 C ATOM 0 H LEU A 116 -20.884 -1.675 1.155 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.163 -2.419 1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.633 0.203 1.927 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.906 -0.008 1.715 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.944 -0.807 -0.378 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -19.328 1.274 -1.525 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -20.090 1.588 0.052 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -18.326 1.739 -0.129 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -18.003 -0.753 -1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.948 -0.357 -0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.783 -1.927 -0.568 1.00 0.00 H new ATOM 1856 N LEU A 117 -20.034 -1.638 4.155 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.144 -1.704 5.613 1.00 0.00 C ATOM 1858 C LEU A 117 -19.704 -3.068 6.157 1.00 0.00 C ATOM 1859 O LEU A 117 -18.975 -3.134 7.141 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.580 -1.430 6.093 1.00 0.00 C ATOM 1861 CG LEU A 117 -22.224 -0.096 5.712 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.597 0.031 6.344 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -21.356 1.067 6.113 1.00 0.00 C ATOM 0 H LEU A 117 -20.918 -1.441 3.686 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.480 -0.929 5.996 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.217 -2.229 5.713 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -21.589 -1.506 7.180 1.00 0.00 H new ATOM 0 HG LEU A 117 -22.331 -0.077 4.627 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -24.040 0.986 6.062 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.234 -0.782 5.996 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -23.504 -0.020 7.429 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -21.843 2.000 5.828 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -21.204 1.052 7.192 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -20.392 0.992 5.610 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.169 -4.170 5.546 1.00 0.00 N ATOM 1876 CA LYS A 118 -19.757 -5.488 6.053 1.00 0.00 C ATOM 1877 C LYS A 118 -18.448 -5.931 5.404 1.00 0.00 C ATOM 1878 O LYS A 118 -17.843 -6.938 5.805 1.00 0.00 O ATOM 1879 CB LYS A 118 -20.825 -6.601 5.895 1.00 0.00 C ATOM 1880 CG LYS A 118 -20.945 -7.198 4.497 1.00 0.00 C ATOM 1881 CD LYS A 118 -21.917 -6.480 3.595 1.00 0.00 C ATOM 1882 CE LYS A 118 -23.355 -6.764 3.984 1.00 0.00 C ATOM 1883 NZ LYS A 118 -24.313 -6.016 3.149 1.00 0.00 N ATOM 0 H LYS A 118 -20.797 -4.180 4.743 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.620 -5.350 7.126 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.595 -7.404 6.596 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -21.795 -6.194 6.183 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -19.961 -7.194 4.028 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -21.252 -8.240 4.585 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -21.732 -5.407 3.641 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -21.751 -6.788 2.563 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -23.551 -7.832 3.892 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -23.505 -6.502 5.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -25.258 -6.440 3.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -24.346 -5.025 3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -24.011 -6.055 2.155 1.00 0.00 H new ATOM 1897 N GLY A 119 -18.049 -5.210 4.385 1.00 0.00 N ATOM 1898 CA GLY A 119 -16.826 -5.456 3.715 1.00 0.00 C ATOM 1899 C GLY A 119 -17.006 -6.389 2.556 1.00 0.00 C ATOM 1900 O GLY A 119 -17.839 -7.323 2.611 1.00 0.00 O ATOM 0 H GLY A 119 -18.582 -4.429 4.004 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.409 -4.513 3.362 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.107 -5.880 4.415 1.00 0.00 H new ATOM 1904 N ILE A 120 -16.269 -6.148 1.499 1.00 0.00 N ATOM 1905 CA ILE A 120 -16.317 -7.036 0.361 1.00 0.00 C ATOM 1906 C ILE A 120 -15.306 -8.138 0.595 1.00 0.00 C ATOM 1907 O ILE A 120 -14.118 -7.875 0.628 1.00 0.00 O ATOM 1908 CB ILE A 120 -15.997 -6.355 -0.994 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.637 -4.959 -1.079 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -16.541 -7.241 -2.123 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -18.114 -4.952 -0.802 1.00 0.00 C ATOM 0 H ILE A 120 -15.636 -5.354 1.402 1.00 0.00 H new ATOM 0 HA ILE A 120 -17.340 -7.404 0.284 1.00 0.00 H new ATOM 0 HB ILE A 120 -14.918 -6.235 -1.086 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -16.140 -4.298 -0.369 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -16.461 -4.549 -2.073 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -16.325 -6.777 -3.086 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -16.066 -8.221 -2.077 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -17.619 -7.355 -2.009 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -18.494 -3.933 -0.880 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.623 -5.586 -1.528 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.297 -5.331 0.203 1.00 0.00 H new ATOM 1923 N PRO A 121 -15.778 -9.378 0.740 1.00 0.00 N ATOM 1924 CA PRO A 121 -14.946 -10.533 1.133 1.00 0.00 C ATOM 1925 C PRO A 121 -14.097 -11.075 0.003 1.00 0.00 C ATOM 1926 O PRO A 121 -13.216 -11.917 0.208 1.00 0.00 O ATOM 1927 CB PRO A 121 -15.995 -11.566 1.533 1.00 0.00 C ATOM 1928 CG PRO A 121 -17.174 -11.246 0.685 1.00 0.00 C ATOM 1929 CD PRO A 121 -17.179 -9.767 0.515 1.00 0.00 C ATOM 0 HA PRO A 121 -14.230 -10.270 1.912 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -15.641 -12.581 1.354 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -16.238 -11.495 2.593 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -17.106 -11.748 -0.280 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -18.096 -11.586 1.157 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -17.518 -9.481 -0.481 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -17.847 -9.285 1.229 1.00 0.00 H new ATOM 1937 N PHE A 122 -14.337 -10.581 -1.154 1.00 0.00 N ATOM 1938 CA PHE A 122 -13.661 -11.059 -2.339 1.00 0.00 C ATOM 1939 C PHE A 122 -13.269 -9.901 -3.197 1.00 0.00 C ATOM 1940 O PHE A 122 -14.081 -9.011 -3.448 1.00 0.00 O ATOM 1941 CB PHE A 122 -14.499 -12.112 -3.136 1.00 0.00 C ATOM 1942 CG PHE A 122 -15.853 -11.653 -3.663 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -15.960 -10.966 -4.869 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -17.009 -11.930 -2.962 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -17.190 -10.564 -5.349 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -18.245 -11.530 -3.437 1.00 0.00 C ATOM 1947 CZ PHE A 122 -18.333 -10.844 -4.633 1.00 0.00 C ATOM 0 H PHE A 122 -15.007 -9.831 -1.325 1.00 0.00 H new ATOM 0 HA PHE A 122 -12.761 -11.584 -2.018 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -13.902 -12.452 -3.982 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -14.660 -12.977 -2.492 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -15.068 -10.745 -5.437 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -16.948 -12.468 -2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -17.256 -10.030 -6.285 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -19.139 -11.753 -2.874 1.00 0.00 H new ATOM 0 HZ PHE A 122 -19.296 -10.528 -5.006 1.00 0.00 H new ATOM 1957 N ARG A 123 -12.018 -9.840 -3.542 1.00 0.00 N ATOM 1958 CA ARG A 123 -11.538 -8.799 -4.386 1.00 0.00 C ATOM 1959 C ARG A 123 -10.283 -9.201 -5.136 1.00 0.00 C ATOM 1960 O ARG A 123 -9.342 -9.753 -4.563 1.00 0.00 O ATOM 1961 CB ARG A 123 -11.303 -7.529 -3.580 1.00 0.00 C ATOM 1962 CG ARG A 123 -10.384 -7.730 -2.406 1.00 0.00 C ATOM 1963 CD ARG A 123 -10.238 -6.472 -1.629 1.00 0.00 C ATOM 1964 NE ARG A 123 -9.295 -6.629 -0.542 1.00 0.00 N ATOM 1965 CZ ARG A 123 -8.642 -5.625 0.020 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -8.851 -4.393 -0.402 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -7.783 -5.841 1.014 1.00 0.00 N ATOM 0 H ARG A 123 -11.308 -10.509 -3.246 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.307 -8.606 -5.134 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -10.884 -6.764 -4.234 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -12.261 -7.152 -3.222 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -10.776 -8.517 -1.762 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -9.407 -8.062 -2.756 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -9.904 -5.671 -2.289 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.208 -6.174 -1.231 1.00 0.00 H new ATOM 0 HE ARG A 123 -9.124 -7.570 -0.188 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -9.513 -4.218 -1.158 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -8.350 -3.615 0.028 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -7.622 -6.790 1.351 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -7.286 -5.058 1.438 1.00 0.00 H new ATOM 1981 N THR A 124 -10.308 -8.974 -6.398 1.00 0.00 N ATOM 1982 CA THR A 124 -9.162 -9.078 -7.241 1.00 0.00 C ATOM 1983 C THR A 124 -8.815 -7.619 -7.625 1.00 0.00 C ATOM 1984 O THR A 124 -9.589 -6.710 -7.271 1.00 0.00 O ATOM 1985 CB THR A 124 -9.520 -9.933 -8.483 1.00 0.00 C ATOM 1986 OG1 THR A 124 -10.178 -11.137 -8.040 1.00 0.00 O ATOM 1987 CG2 THR A 124 -8.282 -10.311 -9.271 1.00 0.00 C ATOM 0 H THR A 124 -11.155 -8.700 -6.896 1.00 0.00 H new ATOM 0 HA THR A 124 -8.313 -9.564 -6.760 1.00 0.00 H new ATOM 0 HB THR A 124 -10.171 -9.346 -9.131 1.00 0.00 H new ATOM 0 HG1 THR A 124 -11.145 -10.985 -7.998 1.00 0.00 H new ATOM 0 HG21 THR A 124 -8.570 -10.910 -10.135 1.00 0.00 H new ATOM 0 HG22 THR A 124 -7.776 -9.407 -9.609 1.00 0.00 H new ATOM 0 HG23 THR A 124 -7.609 -10.888 -8.637 1.00 0.00 H new ATOM 1995 N LYS A 125 -7.707 -7.373 -8.320 1.00 0.00 N ATOM 1996 CA LYS A 125 -7.290 -6.006 -8.643 1.00 0.00 C ATOM 1997 C LYS A 125 -8.354 -5.231 -9.418 1.00 0.00 C ATOM 1998 O LYS A 125 -8.609 -4.069 -9.118 1.00 0.00 O ATOM 1999 CB LYS A 125 -5.941 -5.979 -9.387 1.00 0.00 C ATOM 2000 CG LYS A 125 -5.932 -6.728 -10.721 1.00 0.00 C ATOM 2001 CD LYS A 125 -4.574 -6.652 -11.410 1.00 0.00 C ATOM 2002 CE LYS A 125 -4.193 -5.213 -11.762 1.00 0.00 C ATOM 2003 NZ LYS A 125 -2.905 -5.119 -12.490 1.00 0.00 N ATOM 0 H LYS A 125 -7.082 -8.098 -8.671 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.159 -5.499 -7.687 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -5.661 -4.941 -9.567 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -5.176 -6.408 -8.740 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -6.195 -7.772 -10.552 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -6.695 -6.309 -11.377 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.812 -7.080 -10.759 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.593 -7.255 -12.318 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -4.982 -4.772 -12.371 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -4.131 -4.625 -10.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.833 -4.189 -12.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.118 -5.236 -11.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -2.859 -5.866 -13.212 1.00 0.00 H new ATOM 2017 N ALA A 126 -9.028 -5.908 -10.341 1.00 0.00 N ATOM 2018 CA ALA A 126 -10.013 -5.269 -11.187 1.00 0.00 C ATOM 2019 C ALA A 126 -11.258 -4.959 -10.404 1.00 0.00 C ATOM 2020 O ALA A 126 -11.905 -3.935 -10.616 1.00 0.00 O ATOM 2021 CB ALA A 126 -10.351 -6.167 -12.346 1.00 0.00 C ATOM 0 H ALA A 126 -8.905 -6.905 -10.518 1.00 0.00 H new ATOM 0 HA ALA A 126 -9.595 -4.335 -11.563 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -11.093 -5.680 -12.979 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -9.451 -6.364 -12.928 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -10.755 -7.108 -11.972 1.00 0.00 H new ATOM 2027 N GLU A 127 -11.555 -5.822 -9.461 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.754 -5.700 -8.661 1.00 0.00 C ATOM 2029 C GLU A 127 -12.567 -4.571 -7.651 1.00 0.00 C ATOM 2030 O GLU A 127 -13.490 -3.828 -7.351 1.00 0.00 O ATOM 2031 CB GLU A 127 -13.042 -7.028 -7.965 1.00 0.00 C ATOM 2032 CG GLU A 127 -12.808 -8.228 -8.875 1.00 0.00 C ATOM 2033 CD GLU A 127 -13.285 -9.541 -8.286 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -12.544 -10.125 -7.481 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -14.370 -10.014 -8.638 1.00 0.00 O ATOM 0 H GLU A 127 -10.975 -6.627 -9.226 1.00 0.00 H new ATOM 0 HA GLU A 127 -13.609 -5.460 -9.294 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.408 -7.117 -7.082 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -14.075 -7.036 -7.618 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.318 -8.059 -9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.743 -8.304 -9.095 1.00 0.00 H new ATOM 2042 N PHE A 128 -11.340 -4.431 -7.177 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.964 -3.375 -6.267 1.00 0.00 C ATOM 2044 C PHE A 128 -11.092 -2.018 -6.953 1.00 0.00 C ATOM 2045 O PHE A 128 -11.751 -1.119 -6.440 1.00 0.00 O ATOM 2046 CB PHE A 128 -9.522 -3.605 -5.787 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.929 -2.467 -5.006 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -8.306 -1.418 -5.668 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -8.986 -2.450 -3.631 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -7.758 -0.370 -4.964 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -8.440 -1.404 -2.919 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.826 -0.362 -3.587 1.00 0.00 C ATOM 0 H PHE A 128 -10.572 -5.057 -7.419 1.00 0.00 H new ATOM 0 HA PHE A 128 -11.631 -3.384 -5.405 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -9.499 -4.503 -5.169 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.892 -3.799 -6.655 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -8.251 -1.424 -6.747 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -9.463 -3.264 -3.105 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -7.277 0.443 -5.488 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.492 -1.399 -1.840 1.00 0.00 H new ATOM 0 HZ PHE A 128 -7.399 0.459 -3.030 1.00 0.00 H new ATOM 2062 N GLU A 129 -10.469 -1.872 -8.104 1.00 0.00 N ATOM 2063 CA GLU A 129 -10.539 -0.608 -8.811 1.00 0.00 C ATOM 2064 C GLU A 129 -11.960 -0.327 -9.287 1.00 0.00 C ATOM 2065 O GLU A 129 -12.334 0.810 -9.437 1.00 0.00 O ATOM 2066 CB GLU A 129 -9.528 -0.529 -9.961 1.00 0.00 C ATOM 2067 CG GLU A 129 -9.612 -1.688 -10.913 1.00 0.00 C ATOM 2068 CD GLU A 129 -8.798 -1.509 -12.161 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -7.614 -1.900 -12.179 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -9.337 -1.003 -13.169 1.00 0.00 O ATOM 0 H GLU A 129 -9.918 -2.597 -8.564 1.00 0.00 H new ATOM 0 HA GLU A 129 -10.263 0.174 -8.104 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -9.689 0.397 -10.513 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -8.521 -0.482 -9.546 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -9.280 -2.591 -10.401 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -10.655 -1.843 -11.190 1.00 0.00 H new ATOM 2077 N ASP A 130 -12.754 -1.384 -9.464 1.00 0.00 N ATOM 2078 CA ASP A 130 -14.160 -1.264 -9.895 1.00 0.00 C ATOM 2079 C ASP A 130 -14.984 -0.595 -8.826 1.00 0.00 C ATOM 2080 O ASP A 130 -15.771 0.323 -9.091 1.00 0.00 O ATOM 2081 CB ASP A 130 -14.764 -2.637 -10.166 1.00 0.00 C ATOM 2082 CG ASP A 130 -16.177 -2.558 -10.693 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -17.142 -2.553 -9.882 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -16.355 -2.496 -11.932 1.00 0.00 O ATOM 0 H ASP A 130 -12.449 -2.346 -9.315 1.00 0.00 H new ATOM 0 HA ASP A 130 -14.171 -0.668 -10.808 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -14.141 -3.168 -10.886 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -14.756 -3.221 -9.246 1.00 0.00 H new ATOM 2089 N VAL A 131 -14.815 -1.056 -7.623 1.00 0.00 N ATOM 2090 CA VAL A 131 -15.536 -0.496 -6.517 1.00 0.00 C ATOM 2091 C VAL A 131 -14.986 0.894 -6.172 1.00 0.00 C ATOM 2092 O VAL A 131 -15.749 1.829 -5.948 1.00 0.00 O ATOM 2093 CB VAL A 131 -15.592 -1.465 -5.283 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -14.229 -1.925 -4.863 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -16.296 -0.837 -4.108 1.00 0.00 C ATOM 0 H VAL A 131 -14.183 -1.820 -7.381 1.00 0.00 H new ATOM 0 HA VAL A 131 -16.576 -0.368 -6.819 1.00 0.00 H new ATOM 0 HB VAL A 131 -16.163 -2.334 -5.610 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -14.318 -2.593 -4.006 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -13.754 -2.455 -5.688 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -13.622 -1.062 -4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -16.313 -1.540 -3.276 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -15.767 0.068 -3.808 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -17.318 -0.583 -4.389 1.00 0.00 H new ATOM 2105 N ILE A 132 -13.669 1.046 -6.229 1.00 0.00 N ATOM 2106 CA ILE A 132 -13.022 2.323 -5.966 1.00 0.00 C ATOM 2107 C ILE A 132 -13.431 3.401 -6.997 1.00 0.00 C ATOM 2108 O ILE A 132 -13.683 4.564 -6.628 1.00 0.00 O ATOM 2109 CB ILE A 132 -11.458 2.166 -5.836 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -11.030 1.917 -4.367 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -10.693 3.337 -6.426 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -11.620 0.682 -3.717 1.00 0.00 C ATOM 0 H ILE A 132 -13.023 0.291 -6.458 1.00 0.00 H new ATOM 0 HA ILE A 132 -13.379 2.677 -4.999 1.00 0.00 H new ATOM 0 HB ILE A 132 -11.196 1.287 -6.426 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -9.943 1.841 -4.331 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -11.309 2.787 -3.773 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.623 3.170 -6.306 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.929 3.429 -7.486 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -10.977 4.254 -5.910 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -11.257 0.601 -2.692 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -12.707 0.758 -3.712 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -11.321 -0.203 -4.279 1.00 0.00 H new ATOM 2124 N GLU A 133 -13.556 3.013 -8.265 1.00 0.00 N ATOM 2125 CA GLU A 133 -13.964 3.949 -9.303 1.00 0.00 C ATOM 2126 C GLU A 133 -15.429 4.342 -9.113 1.00 0.00 C ATOM 2127 O GLU A 133 -15.843 5.453 -9.454 1.00 0.00 O ATOM 2128 CB GLU A 133 -13.703 3.400 -10.725 1.00 0.00 C ATOM 2129 CG GLU A 133 -14.552 2.215 -11.114 1.00 0.00 C ATOM 2130 CD GLU A 133 -14.259 1.706 -12.505 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -14.627 2.384 -13.482 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -13.631 0.624 -12.661 1.00 0.00 O ATOM 0 H GLU A 133 -13.381 2.063 -8.594 1.00 0.00 H new ATOM 0 HA GLU A 133 -13.349 4.843 -9.204 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -13.872 4.201 -11.445 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.653 3.117 -10.803 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.391 1.410 -10.398 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -15.604 2.493 -11.050 1.00 0.00 H new ATOM 2139 N HIS A 134 -16.194 3.457 -8.512 1.00 0.00 N ATOM 2140 CA HIS A 134 -17.587 3.721 -8.256 1.00 0.00 C ATOM 2141 C HIS A 134 -17.687 4.644 -7.028 1.00 0.00 C ATOM 2142 O HIS A 134 -18.547 5.489 -6.949 1.00 0.00 O ATOM 2143 CB HIS A 134 -18.340 2.402 -8.026 1.00 0.00 C ATOM 2144 CG HIS A 134 -19.816 2.464 -8.327 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -20.434 1.664 -9.261 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -20.796 3.228 -7.791 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -21.732 1.954 -9.269 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -22.013 2.906 -8.387 1.00 0.00 N ATOM 0 H HIS A 134 -15.870 2.545 -8.191 1.00 0.00 H new ATOM 0 HA HIS A 134 -18.046 4.214 -9.113 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -17.888 1.627 -8.646 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -18.206 2.098 -6.988 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -20.656 3.972 -7.021 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -22.461 1.478 -9.908 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -22.926 3.315 -8.188 1.00 0.00 H new ATOM 2156 N MET A 135 -16.759 4.492 -6.100 1.00 0.00 N ATOM 2157 CA MET A 135 -16.699 5.344 -4.902 1.00 0.00 C ATOM 2158 C MET A 135 -16.408 6.782 -5.301 1.00 0.00 C ATOM 2159 O MET A 135 -17.113 7.718 -4.902 1.00 0.00 O ATOM 2160 CB MET A 135 -15.622 4.861 -3.927 1.00 0.00 C ATOM 2161 CG MET A 135 -15.789 3.443 -3.360 1.00 0.00 C ATOM 2162 SD MET A 135 -17.274 3.185 -2.352 1.00 0.00 S ATOM 2163 CE MET A 135 -18.548 2.880 -3.577 1.00 0.00 C ATOM 0 H MET A 135 -16.027 3.784 -6.145 1.00 0.00 H new ATOM 0 HA MET A 135 -17.667 5.286 -4.404 1.00 0.00 H new ATOM 0 HB2 MET A 135 -14.658 4.914 -4.432 1.00 0.00 H new ATOM 0 HB3 MET A 135 -15.582 5.559 -3.091 1.00 0.00 H new ATOM 0 HG2 MET A 135 -15.805 2.737 -4.190 1.00 0.00 H new ATOM 0 HG3 MET A 135 -14.913 3.205 -2.756 1.00 0.00 H new ATOM 0 HE1 MET A 135 -19.378 3.568 -3.418 1.00 0.00 H new ATOM 0 HE2 MET A 135 -18.137 3.032 -4.575 1.00 0.00 H new ATOM 0 HE3 MET A 135 -18.904 1.854 -3.484 1.00 0.00 H new ATOM 2173 N LYS A 136 -15.401 6.953 -6.139 1.00 0.00 N ATOM 2174 CA LYS A 136 -15.013 8.274 -6.617 1.00 0.00 C ATOM 2175 C LYS A 136 -16.066 8.867 -7.543 1.00 0.00 C ATOM 2176 O LYS A 136 -16.072 10.069 -7.790 1.00 0.00 O ATOM 2177 CB LYS A 136 -13.619 8.291 -7.247 1.00 0.00 C ATOM 2178 CG LYS A 136 -13.450 7.360 -8.414 1.00 0.00 C ATOM 2179 CD LYS A 136 -12.024 7.371 -8.960 1.00 0.00 C ATOM 2180 CE LYS A 136 -11.003 6.974 -7.898 1.00 0.00 C ATOM 2181 NZ LYS A 136 -9.640 6.866 -8.448 1.00 0.00 N ATOM 0 H LYS A 136 -14.832 6.190 -6.506 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.954 8.916 -5.738 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.394 9.306 -7.573 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.886 8.032 -6.483 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -13.713 6.347 -8.109 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.143 7.644 -9.206 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.954 6.686 -9.805 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.787 8.366 -9.336 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -11.011 7.711 -7.095 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -11.292 6.020 -7.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -8.981 6.594 -7.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -9.624 6.144 -9.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -9.352 7.783 -8.845 1.00 0.00 H new ATOM 2195 N THR A 137 -16.946 8.022 -8.069 1.00 0.00 N ATOM 2196 CA THR A 137 -18.014 8.491 -8.911 1.00 0.00 C ATOM 2197 C THR A 137 -19.056 9.264 -8.056 1.00 0.00 C ATOM 2198 O THR A 137 -19.825 10.071 -8.577 1.00 0.00 O ATOM 2199 CB THR A 137 -18.663 7.317 -9.742 1.00 0.00 C ATOM 2200 OG1 THR A 137 -18.851 7.722 -11.099 1.00 0.00 O ATOM 2201 CG2 THR A 137 -20.016 6.866 -9.189 1.00 0.00 C ATOM 0 H THR A 137 -16.932 7.013 -7.921 1.00 0.00 H new ATOM 0 HA THR A 137 -17.604 9.183 -9.647 1.00 0.00 H new ATOM 0 HB THR A 137 -17.971 6.478 -9.671 1.00 0.00 H new ATOM 0 HG1 THR A 137 -19.253 6.987 -11.607 1.00 0.00 H new ATOM 0 HG21 THR A 137 -20.409 6.057 -9.804 1.00 0.00 H new ATOM 0 HG22 THR A 137 -19.892 6.515 -8.165 1.00 0.00 H new ATOM 0 HG23 THR A 137 -20.713 7.704 -9.203 1.00 0.00 H new ATOM 2209 N TYR A 138 -19.062 9.020 -6.734 1.00 0.00 N ATOM 2210 CA TYR A 138 -19.915 9.777 -5.858 1.00 0.00 C ATOM 2211 C TYR A 138 -19.201 11.021 -5.462 1.00 0.00 C ATOM 2212 O TYR A 138 -19.740 12.118 -5.603 1.00 0.00 O ATOM 2213 CB TYR A 138 -20.289 8.996 -4.606 1.00 0.00 C ATOM 2214 CG TYR A 138 -21.160 7.813 -4.860 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -22.514 7.977 -5.034 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -20.637 6.544 -4.915 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -23.340 6.899 -5.262 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -21.445 5.451 -5.139 1.00 0.00 C ATOM 2219 CZ TYR A 138 -22.801 5.634 -5.312 1.00 0.00 C ATOM 2220 OH TYR A 138 -23.620 4.549 -5.532 1.00 0.00 O ATOM 0 H TYR A 138 -18.489 8.313 -6.273 1.00 0.00 H new ATOM 0 HA TYR A 138 -20.837 10.004 -6.393 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -19.376 8.661 -4.114 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -20.798 9.665 -3.912 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -22.938 8.970 -4.991 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -19.575 6.401 -4.780 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -24.401 7.045 -5.400 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -21.020 4.459 -5.179 1.00 0.00 H new ATOM 0 HH TYR A 138 -23.082 3.730 -5.539 1.00 0.00 H new ATOM 2230 N SER A 139 -17.974 10.825 -4.928 1.00 0.00 N ATOM 2231 CA SER A 139 -17.072 11.899 -4.493 1.00 0.00 C ATOM 2232 C SER A 139 -17.785 13.040 -3.759 1.00 0.00 C ATOM 2233 O SER A 139 -17.459 14.212 -3.931 1.00 0.00 O ATOM 2234 CB SER A 139 -16.201 12.377 -5.665 1.00 0.00 C ATOM 2235 OG SER A 139 -16.959 12.531 -6.864 1.00 0.00 O ATOM 0 H SER A 139 -17.582 9.894 -4.787 1.00 0.00 H new ATOM 0 HA SER A 139 -16.406 11.478 -3.740 1.00 0.00 H new ATOM 0 HB2 SER A 139 -15.734 13.327 -5.406 1.00 0.00 H new ATOM 0 HB3 SER A 139 -15.396 11.662 -5.834 1.00 0.00 H new ATOM 0 HG SER A 139 -16.829 11.746 -7.436 1.00 0.00 H new ATOM 2241 N GLY A 140 -18.760 12.672 -2.935 1.00 0.00 N ATOM 2242 CA GLY A 140 -19.481 13.662 -2.197 1.00 0.00 C ATOM 2243 C GLY A 140 -18.622 14.270 -1.119 1.00 0.00 C ATOM 2244 O GLY A 140 -17.793 13.549 -0.527 1.00 0.00 O ATOM 2245 OXT GLY A 140 -18.712 15.485 -0.899 1.00 0.00 O ATOM 0 H GLY A 140 -19.054 11.709 -2.773 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -19.827 14.443 -2.874 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -20.367 13.212 -1.749 1.00 0.00 H new