USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 961 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 161 THR OG1 : rot 180:sc= -0.044 USER MOD Set 1.2: A 171 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 66 MET CE :methyl -125:sc= -3.22 (180deg=-5.22!) USER MOD Set 2.2: A 159 THR OG1 : rot 180:sc= -1.5 USER MOD Set 2.3: A 173 HIS : no HD1:sc= -3.64 K(o=-8.4,f=-5) USER MOD Set 3.1: A 123 GLN : amide:sc= -5.15 K(o=-7.9,f=-13!) USER MOD Set 3.2: A 163 GLN : amide:sc= -2.99 K(o=-7.9,f=-9.2!) USER MOD Set 3.3: A 170 SER OG : rot 130:sc= 0.249 USER MOD Set 4.1: A 50 SER OG : rot 180:sc= -0.622 USER MOD Set 4.2: A 71 LYS NZ :NH3+ -153:sc=-0.00722 (180deg=-0.345) USER MOD Set 5.1: A 19 THR OG1 : rot -147:sc= 0.031 USER MOD Set 5.2: A 42 LYS NZ :NH3+ -137:sc= 0.506 (180deg=-0.0551) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 21 THR OG1 : rot 23:sc= 0.0636 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -160:sc= -0.525 (180deg=-1.25) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 ASN : amide:sc= -3.8 K(o=-3.8,f=-5.6!) USER MOD Single : A 43 TYR OH : rot 170:sc= -3.49 USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 HIS : no HE2:sc= -2.49! C(o=-2.5!,f=-5.1!) USER MOD Single : A 51 SER OG : rot 57:sc= 0.494 USER MOD Single : A 54 THR OG1 : rot 31:sc= 0.358 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -2.64 X(o=-2.6,f=-2.5!) USER MOD Single : A 64 HIS : no HD1:sc= -0.0976 X(o=-0.098,f=-0.32) USER MOD Single : A 65 THR OG1 : rot -160:sc= -3.72 USER MOD Single : A 67 TYR OH : rot 176:sc= -0.766! USER MOD Single : A 69 ASN : amide:sc= -2.32 K(o=-2.3,f=-4.4!) USER MOD Single : A 109 MET CE :methyl -129:sc= -3.92 (180deg=-10.1!) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -132:sc= -0.314 (180deg=-1.5!) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -152:sc= -0.66 (180deg=-1.89!) USER MOD Single : A 136 LYS NZ :NH3+ -116:sc= 0.57 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc= -1.78 X(o=-1.8,f=-1.3) USER MOD Single : A 144 MET CE :methyl 180:sc= -3! (180deg=-3!) USER MOD Single : A 146 GLN : amide:sc= -1.87 K(o=-1.9,f=-0.54) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 TYR OH : rot -130:sc= -5.08! USER MOD Single : A 167 ASN : amide:sc= -0.468 X(o=-0.47,f=-0.054) USER MOD Single : A 169 ASN : amide:sc= -2.7 K(o=-2.7,f=-8.2!) USER MOD Single : A 175 HIS : no HD1:sc= -0.165 X(o=-0.16,f=-0.35) USER MOD Single : A 176 TYR OH : rot -85:sc= -1.83 USER MOD ----------------------------------------------------------------- ATOM 79 N GLU A 7 4.485 -0.164 12.474 1.00 0.00 N ATOM 80 CA GLU A 7 5.308 -1.266 11.996 1.00 0.00 C ATOM 81 C GLU A 7 4.545 -2.585 12.063 1.00 0.00 C ATOM 82 O GLU A 7 5.071 -3.597 12.527 1.00 0.00 O ATOM 83 CB GLU A 7 6.596 -1.362 12.817 1.00 0.00 C ATOM 84 CG GLU A 7 7.694 -0.428 12.336 1.00 0.00 C ATOM 85 CD GLU A 7 9.077 -1.036 12.470 1.00 0.00 C ATOM 86 OE1 GLU A 7 9.235 -2.230 12.140 1.00 0.00 O ATOM 87 OE2 GLU A 7 10.001 -0.318 12.906 1.00 0.00 O ATOM 0 HA GLU A 7 5.565 -1.070 10.955 1.00 0.00 H new ATOM 0 HB2 GLU A 7 6.370 -1.138 13.859 1.00 0.00 H new ATOM 0 HB3 GLU A 7 6.963 -2.388 12.784 1.00 0.00 H new ATOM 0 HG2 GLU A 7 7.514 -0.169 11.293 1.00 0.00 H new ATOM 0 HG3 GLU A 7 7.652 0.500 12.906 1.00 0.00 H new ATOM 94 N GLU A 8 3.301 -2.566 11.595 1.00 0.00 N ATOM 95 CA GLU A 8 2.464 -3.760 11.599 1.00 0.00 C ATOM 96 C GLU A 8 2.943 -4.764 10.555 1.00 0.00 C ATOM 97 O GLU A 8 3.157 -5.937 10.858 1.00 0.00 O ATOM 98 CB GLU A 8 1.005 -3.385 11.332 1.00 0.00 C ATOM 99 CG GLU A 8 0.446 -2.378 12.324 1.00 0.00 C ATOM 100 CD GLU A 8 -0.838 -1.733 11.839 1.00 0.00 C ATOM 101 OE1 GLU A 8 -0.906 -1.371 10.646 1.00 0.00 O ATOM 102 OE2 GLU A 8 -1.775 -1.591 12.652 1.00 0.00 O ATOM 0 H GLU A 8 2.850 -1.737 11.208 1.00 0.00 H new ATOM 0 HA GLU A 8 2.539 -4.223 12.583 1.00 0.00 H new ATOM 0 HB2 GLU A 8 0.922 -2.976 10.325 1.00 0.00 H new ATOM 0 HB3 GLU A 8 0.395 -4.288 11.360 1.00 0.00 H new ATOM 0 HG2 GLU A 8 0.261 -2.876 13.276 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.190 -1.603 12.508 1.00 0.00 H new ATOM 109 N PHE A 9 3.110 -4.292 9.323 1.00 0.00 N ATOM 110 CA PHE A 9 3.564 -5.145 8.231 1.00 0.00 C ATOM 111 C PHE A 9 5.009 -5.589 8.445 1.00 0.00 C ATOM 112 O PHE A 9 5.431 -6.628 7.938 1.00 0.00 O ATOM 113 CB PHE A 9 3.439 -4.406 6.898 1.00 0.00 C ATOM 114 CG PHE A 9 2.122 -4.623 6.209 1.00 0.00 C ATOM 115 CD1 PHE A 9 1.018 -3.855 6.541 1.00 0.00 C ATOM 116 CD2 PHE A 9 1.989 -5.592 5.227 1.00 0.00 C ATOM 117 CE1 PHE A 9 -0.195 -4.049 5.908 1.00 0.00 C ATOM 118 CE2 PHE A 9 0.778 -5.790 4.590 1.00 0.00 C ATOM 119 CZ PHE A 9 -0.315 -5.018 4.931 1.00 0.00 C ATOM 0 H PHE A 9 2.937 -3.323 9.056 1.00 0.00 H new ATOM 0 HA PHE A 9 2.932 -6.033 8.211 1.00 0.00 H new ATOM 0 HB2 PHE A 9 3.578 -3.339 7.070 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.243 -4.729 6.237 1.00 0.00 H new ATOM 0 HD1 PHE A 9 1.106 -3.095 7.304 1.00 0.00 H new ATOM 0 HD2 PHE A 9 2.840 -6.199 4.957 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -1.048 -3.444 6.177 1.00 0.00 H new ATOM 0 HE2 PHE A 9 0.687 -6.548 3.826 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.262 -5.172 4.435 1.00 0.00 H new ATOM 129 N ALA A 10 5.763 -4.793 9.198 1.00 0.00 N ATOM 130 CA ALA A 10 7.162 -5.097 9.482 1.00 0.00 C ATOM 131 C ALA A 10 7.927 -5.435 8.206 1.00 0.00 C ATOM 132 O ALA A 10 7.953 -6.586 7.771 1.00 0.00 O ATOM 133 CB ALA A 10 7.261 -6.241 10.481 1.00 0.00 C ATOM 0 H ALA A 10 5.427 -3.929 9.624 1.00 0.00 H new ATOM 0 HA ALA A 10 7.618 -4.208 9.917 1.00 0.00 H new ATOM 0 HB1 ALA A 10 8.310 -6.457 10.684 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.763 -5.958 11.408 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.781 -7.128 10.067 1.00 0.00 H new ATOM 139 N VAL A 11 8.550 -4.423 7.612 1.00 0.00 N ATOM 140 CA VAL A 11 9.317 -4.615 6.386 1.00 0.00 C ATOM 141 C VAL A 11 10.776 -4.920 6.691 1.00 0.00 C ATOM 142 O VAL A 11 11.388 -4.285 7.550 1.00 0.00 O ATOM 143 CB VAL A 11 9.257 -3.379 5.470 1.00 0.00 C ATOM 144 CG1 VAL A 11 7.951 -3.351 4.692 1.00 0.00 C ATOM 145 CG2 VAL A 11 9.436 -2.100 6.274 1.00 0.00 C ATOM 0 H VAL A 11 8.539 -3.464 7.958 1.00 0.00 H new ATOM 0 HA VAL A 11 8.862 -5.462 5.872 1.00 0.00 H new ATOM 0 HB VAL A 11 10.077 -3.445 4.755 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.928 -2.470 4.051 1.00 0.00 H new ATOM 0 HG12 VAL A 11 7.874 -4.249 4.078 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.113 -3.314 5.388 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.390 -1.240 5.605 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.643 -2.024 7.018 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.404 -2.118 6.776 1.00 0.00 H new ATOM 155 N GLU A 12 11.331 -5.890 5.975 1.00 0.00 N ATOM 156 CA GLU A 12 12.723 -6.272 6.162 1.00 0.00 C ATOM 157 C GLU A 12 13.438 -6.366 4.819 1.00 0.00 C ATOM 158 O GLU A 12 13.240 -7.319 4.065 1.00 0.00 O ATOM 159 CB GLU A 12 12.816 -7.608 6.901 1.00 0.00 C ATOM 160 CG GLU A 12 12.417 -7.521 8.365 1.00 0.00 C ATOM 161 CD GLU A 12 11.914 -8.843 8.911 1.00 0.00 C ATOM 162 OE1 GLU A 12 12.637 -9.853 8.781 1.00 0.00 O ATOM 163 OE2 GLU A 12 10.796 -8.869 9.468 1.00 0.00 O ATOM 0 H GLU A 12 10.838 -6.425 5.260 1.00 0.00 H new ATOM 0 HA GLU A 12 13.210 -5.504 6.763 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.177 -8.336 6.401 1.00 0.00 H new ATOM 0 HB3 GLU A 12 13.838 -7.981 6.833 1.00 0.00 H new ATOM 0 HG2 GLU A 12 13.274 -7.192 8.953 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.641 -6.765 8.482 1.00 0.00 H new ATOM 170 N ILE A 13 14.266 -5.370 4.525 1.00 0.00 N ATOM 171 CA ILE A 13 15.005 -5.341 3.270 1.00 0.00 C ATOM 172 C ILE A 13 16.388 -5.964 3.429 1.00 0.00 C ATOM 173 O ILE A 13 17.204 -5.497 4.224 1.00 0.00 O ATOM 174 CB ILE A 13 15.163 -3.901 2.743 1.00 0.00 C ATOM 175 CG1 ILE A 13 13.808 -3.190 2.716 1.00 0.00 C ATOM 176 CG2 ILE A 13 15.790 -3.909 1.357 1.00 0.00 C ATOM 177 CD1 ILE A 13 13.910 -1.690 2.884 1.00 0.00 C ATOM 0 H ILE A 13 14.442 -4.574 5.138 1.00 0.00 H new ATOM 0 HA ILE A 13 14.427 -5.923 2.552 1.00 0.00 H new ATOM 0 HB ILE A 13 15.824 -3.356 3.417 1.00 0.00 H new ATOM 0 HG12 ILE A 13 13.311 -3.409 1.771 1.00 0.00 H new ATOM 0 HG13 ILE A 13 13.179 -3.594 3.509 1.00 0.00 H new ATOM 0 HG21 ILE A 13 15.895 -2.885 0.999 1.00 0.00 H new ATOM 0 HG22 ILE A 13 16.772 -4.379 1.405 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.153 -4.469 0.673 1.00 0.00 H new ATOM 0 HD11 ILE A 13 12.912 -1.252 2.855 1.00 0.00 H new ATOM 0 HD12 ILE A 13 14.379 -1.462 3.841 1.00 0.00 H new ATOM 0 HD13 ILE A 13 14.513 -1.274 2.077 1.00 0.00 H new ATOM 189 N SER A 14 16.645 -7.019 2.664 1.00 0.00 N ATOM 190 CA SER A 14 17.930 -7.707 2.713 1.00 0.00 C ATOM 191 C SER A 14 18.537 -7.811 1.319 1.00 0.00 C ATOM 192 O SER A 14 18.061 -8.576 0.479 1.00 0.00 O ATOM 193 CB SER A 14 17.764 -9.103 3.317 1.00 0.00 C ATOM 194 OG SER A 14 17.626 -9.037 4.726 1.00 0.00 O ATOM 0 H SER A 14 15.979 -7.417 2.001 1.00 0.00 H new ATOM 0 HA SER A 14 18.604 -7.127 3.344 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.888 -9.587 2.885 1.00 0.00 H new ATOM 0 HB3 SER A 14 18.627 -9.718 3.062 1.00 0.00 H new ATOM 0 HG SER A 14 17.520 -9.942 5.087 1.00 0.00 H new ATOM 200 N GLY A 15 19.588 -7.034 1.075 1.00 0.00 N ATOM 201 CA GLY A 15 20.235 -7.053 -0.223 1.00 0.00 C ATOM 202 C GLY A 15 19.293 -6.647 -1.339 1.00 0.00 C ATOM 203 O GLY A 15 18.822 -5.510 -1.379 1.00 0.00 O ATOM 0 H GLY A 15 20.002 -6.393 1.752 1.00 0.00 H new ATOM 0 HA2 GLY A 15 21.092 -6.379 -0.210 1.00 0.00 H new ATOM 0 HA3 GLY A 15 20.620 -8.054 -0.421 1.00 0.00 H new ATOM 207 N THR A 16 19.012 -7.578 -2.243 1.00 0.00 N ATOM 208 CA THR A 16 18.112 -7.311 -3.359 1.00 0.00 C ATOM 209 C THR A 16 16.734 -7.922 -3.111 1.00 0.00 C ATOM 210 O THR A 16 15.913 -8.011 -4.024 1.00 0.00 O ATOM 211 CB THR A 16 18.699 -7.864 -4.658 1.00 0.00 C ATOM 212 OG1 THR A 16 19.467 -9.027 -4.407 1.00 0.00 O ATOM 213 CG2 THR A 16 19.587 -6.875 -5.382 1.00 0.00 C ATOM 0 H THR A 16 19.394 -8.524 -2.225 1.00 0.00 H new ATOM 0 HA THR A 16 17.999 -6.231 -3.448 1.00 0.00 H new ATOM 0 HB THR A 16 17.840 -8.088 -5.290 1.00 0.00 H new ATOM 0 HG1 THR A 16 19.832 -9.366 -5.251 1.00 0.00 H new ATOM 0 HG21 THR A 16 19.971 -7.331 -6.295 1.00 0.00 H new ATOM 0 HG22 THR A 16 19.010 -5.986 -5.635 1.00 0.00 H new ATOM 0 HG23 THR A 16 20.421 -6.595 -4.738 1.00 0.00 H new ATOM 221 N THR A 17 16.485 -8.343 -1.873 1.00 0.00 N ATOM 222 CA THR A 17 15.206 -8.945 -1.514 1.00 0.00 C ATOM 223 C THR A 17 14.700 -8.399 -0.182 1.00 0.00 C ATOM 224 O THR A 17 15.446 -8.324 0.793 1.00 0.00 O ATOM 225 CB THR A 17 15.342 -10.467 -1.435 1.00 0.00 C ATOM 226 OG1 THR A 17 15.804 -10.993 -2.667 1.00 0.00 O ATOM 227 CG2 THR A 17 14.045 -11.168 -1.093 1.00 0.00 C ATOM 0 H THR A 17 17.152 -8.278 -1.104 1.00 0.00 H new ATOM 0 HA THR A 17 14.482 -8.689 -2.288 1.00 0.00 H new ATOM 0 HB THR A 17 16.057 -10.652 -0.633 1.00 0.00 H new ATOM 0 HG1 THR A 17 15.886 -11.967 -2.597 1.00 0.00 H new ATOM 0 HG21 THR A 17 14.213 -12.244 -1.053 1.00 0.00 H new ATOM 0 HG22 THR A 17 13.688 -10.820 -0.124 1.00 0.00 H new ATOM 0 HG23 THR A 17 13.299 -10.945 -1.856 1.00 0.00 H new ATOM 235 N VAL A 18 13.424 -8.028 -0.147 1.00 0.00 N ATOM 236 CA VAL A 18 12.812 -7.498 1.066 1.00 0.00 C ATOM 237 C VAL A 18 11.547 -8.284 1.414 1.00 0.00 C ATOM 238 O VAL A 18 10.771 -8.649 0.531 1.00 0.00 O ATOM 239 CB VAL A 18 12.480 -5.992 0.925 1.00 0.00 C ATOM 240 CG1 VAL A 18 11.872 -5.694 -0.435 1.00 0.00 C ATOM 241 CG2 VAL A 18 11.551 -5.528 2.039 1.00 0.00 C ATOM 0 H VAL A 18 12.793 -8.085 -0.946 1.00 0.00 H new ATOM 0 HA VAL A 18 13.535 -7.609 1.874 1.00 0.00 H new ATOM 0 HB VAL A 18 13.415 -5.438 1.010 1.00 0.00 H new ATOM 0 HG11 VAL A 18 11.648 -4.630 -0.508 1.00 0.00 H new ATOM 0 HG12 VAL A 18 12.578 -5.971 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 18 10.953 -6.267 -0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 18 11.335 -4.467 1.914 1.00 0.00 H new ATOM 0 HG22 VAL A 18 10.621 -6.095 1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 18 12.031 -5.690 3.004 1.00 0.00 H new ATOM 251 N THR A 19 11.357 -8.556 2.703 1.00 0.00 N ATOM 252 CA THR A 19 10.196 -9.317 3.159 1.00 0.00 C ATOM 253 C THR A 19 9.248 -8.458 3.994 1.00 0.00 C ATOM 254 O THR A 19 9.674 -7.550 4.707 1.00 0.00 O ATOM 255 CB THR A 19 10.650 -10.527 3.976 1.00 0.00 C ATOM 256 OG1 THR A 19 11.492 -10.125 5.042 1.00 0.00 O ATOM 257 CG2 THR A 19 11.404 -11.553 3.157 1.00 0.00 C ATOM 0 H THR A 19 11.989 -8.262 3.448 1.00 0.00 H new ATOM 0 HA THR A 19 9.654 -9.653 2.275 1.00 0.00 H new ATOM 0 HB THR A 19 9.733 -10.985 4.348 1.00 0.00 H new ATOM 0 HG1 THR A 19 12.159 -10.822 5.213 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.697 -12.385 3.797 1.00 0.00 H new ATOM 0 HG22 THR A 19 10.764 -11.920 2.355 1.00 0.00 H new ATOM 0 HG23 THR A 19 12.295 -11.093 2.729 1.00 0.00 H new ATOM 265 N ILE A 20 7.955 -8.766 3.901 1.00 0.00 N ATOM 266 CA ILE A 20 6.927 -8.043 4.645 1.00 0.00 C ATOM 267 C ILE A 20 5.979 -9.025 5.331 1.00 0.00 C ATOM 268 O ILE A 20 5.337 -9.837 4.669 1.00 0.00 O ATOM 269 CB ILE A 20 6.099 -7.121 3.725 1.00 0.00 C ATOM 270 CG1 ILE A 20 7.000 -6.378 2.733 1.00 0.00 C ATOM 271 CG2 ILE A 20 5.295 -6.134 4.556 1.00 0.00 C ATOM 272 CD1 ILE A 20 6.569 -6.540 1.292 1.00 0.00 C ATOM 0 H ILE A 20 7.594 -9.517 3.313 1.00 0.00 H new ATOM 0 HA ILE A 20 7.440 -7.432 5.388 1.00 0.00 H new ATOM 0 HB ILE A 20 5.410 -7.742 3.152 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.008 -5.318 2.985 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.023 -6.739 2.841 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.715 -5.489 3.895 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.620 -6.679 5.215 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.973 -5.525 5.154 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.250 -5.988 0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 20 6.588 -7.596 1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 20 5.558 -6.152 1.169 1.00 0.00 H new ATOM 284 N THR A 21 5.895 -8.957 6.657 1.00 0.00 N ATOM 285 CA THR A 21 5.023 -9.862 7.403 1.00 0.00 C ATOM 286 C THR A 21 3.603 -9.310 7.502 1.00 0.00 C ATOM 287 O THR A 21 3.400 -8.097 7.548 1.00 0.00 O ATOM 288 CB THR A 21 5.592 -10.124 8.803 1.00 0.00 C ATOM 289 OG1 THR A 21 4.952 -11.238 9.401 1.00 0.00 O ATOM 290 CG2 THR A 21 5.450 -8.953 9.753 1.00 0.00 C ATOM 0 H THR A 21 6.413 -8.293 7.232 1.00 0.00 H new ATOM 0 HA THR A 21 4.979 -10.805 6.859 1.00 0.00 H new ATOM 0 HB THR A 21 6.655 -10.307 8.645 1.00 0.00 H new ATOM 0 HG1 THR A 21 4.575 -11.813 8.702 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.876 -9.216 10.721 1.00 0.00 H new ATOM 0 HG22 THR A 21 5.977 -8.090 9.348 1.00 0.00 H new ATOM 0 HG23 THR A 21 4.395 -8.709 9.875 1.00 0.00 H new ATOM 298 N CYS A 22 2.624 -10.211 7.536 1.00 0.00 N ATOM 299 CA CYS A 22 1.224 -9.812 7.632 1.00 0.00 C ATOM 300 C CYS A 22 0.772 -9.759 9.092 1.00 0.00 C ATOM 301 O CYS A 22 0.787 -10.773 9.789 1.00 0.00 O ATOM 302 CB CYS A 22 0.332 -10.782 6.855 1.00 0.00 C ATOM 303 SG CYS A 22 -1.320 -10.114 6.477 1.00 0.00 S ATOM 0 H CYS A 22 2.775 -11.219 7.499 1.00 0.00 H new ATOM 0 HA CYS A 22 1.132 -8.817 7.198 1.00 0.00 H new ATOM 0 HB2 CYS A 22 0.828 -11.050 5.922 1.00 0.00 H new ATOM 0 HB3 CYS A 22 0.220 -11.700 7.432 1.00 0.00 H new ATOM 308 N PRO A 23 0.365 -8.572 9.577 1.00 0.00 N ATOM 309 CA PRO A 23 -0.088 -8.396 10.954 1.00 0.00 C ATOM 310 C PRO A 23 -1.574 -8.702 11.135 1.00 0.00 C ATOM 311 O PRO A 23 -2.092 -8.656 12.250 1.00 0.00 O ATOM 312 CB PRO A 23 0.185 -6.916 11.201 1.00 0.00 C ATOM 313 CG PRO A 23 -0.029 -6.270 9.872 1.00 0.00 C ATOM 314 CD PRO A 23 0.315 -7.303 8.824 1.00 0.00 C ATOM 0 HA PRO A 23 0.416 -9.073 11.644 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -0.489 -6.508 11.954 1.00 0.00 H new ATOM 0 HB3 PRO A 23 1.201 -6.754 11.562 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -1.062 -5.940 9.765 1.00 0.00 H new ATOM 0 HG3 PRO A 23 0.601 -5.387 9.766 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -0.436 -7.336 8.035 1.00 0.00 H new ATOM 0 HD3 PRO A 23 1.270 -7.084 8.346 1.00 0.00 H new ATOM 322 N SER A 24 -2.258 -9.008 10.034 1.00 0.00 N ATOM 323 CA SER A 24 -3.683 -9.312 10.082 1.00 0.00 C ATOM 324 C SER A 24 -3.971 -10.478 11.020 1.00 0.00 C ATOM 325 O SER A 24 -5.003 -10.507 11.692 1.00 0.00 O ATOM 326 CB SER A 24 -4.204 -9.625 8.679 1.00 0.00 C ATOM 327 OG SER A 24 -4.583 -8.441 7.999 1.00 0.00 O ATOM 0 H SER A 24 -1.848 -9.051 9.101 1.00 0.00 H new ATOM 0 HA SER A 24 -4.200 -8.434 10.469 1.00 0.00 H new ATOM 0 HB2 SER A 24 -3.433 -10.144 8.109 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.058 -10.298 8.747 1.00 0.00 H new ATOM 0 HG SER A 24 -4.911 -8.669 7.104 1.00 0.00 H new ATOM 333 N SER A 25 -3.054 -11.435 11.064 1.00 0.00 N ATOM 334 CA SER A 25 -3.210 -12.605 11.926 1.00 0.00 C ATOM 335 C SER A 25 -2.020 -13.556 11.793 1.00 0.00 C ATOM 336 O SER A 25 -1.068 -13.481 12.570 1.00 0.00 O ATOM 337 CB SER A 25 -4.514 -13.339 11.600 1.00 0.00 C ATOM 338 OG SER A 25 -4.579 -14.586 12.270 1.00 0.00 O ATOM 0 H SER A 25 -2.195 -11.427 10.515 1.00 0.00 H new ATOM 0 HA SER A 25 -3.249 -12.256 12.958 1.00 0.00 H new ATOM 0 HB2 SER A 25 -5.364 -12.722 11.890 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.587 -13.497 10.524 1.00 0.00 H new ATOM 0 HG SER A 25 -5.422 -15.034 12.047 1.00 0.00 H new ATOM 344 N GLY A 26 -2.077 -14.451 10.808 1.00 0.00 N ATOM 345 CA GLY A 26 -0.995 -15.398 10.605 1.00 0.00 C ATOM 346 C GLY A 26 -1.483 -16.832 10.511 1.00 0.00 C ATOM 347 O GLY A 26 -1.032 -17.697 11.262 1.00 0.00 O ATOM 0 H GLY A 26 -2.851 -14.536 10.149 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -0.458 -15.140 9.692 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -0.284 -15.313 11.427 1.00 0.00 H new ATOM 351 N ASP A 27 -2.406 -17.085 9.587 1.00 0.00 N ATOM 352 CA ASP A 27 -2.953 -18.425 9.399 1.00 0.00 C ATOM 353 C ASP A 27 -3.384 -18.641 7.951 1.00 0.00 C ATOM 354 O ASP A 27 -3.082 -19.672 7.349 1.00 0.00 O ATOM 355 CB ASP A 27 -4.143 -18.648 10.335 1.00 0.00 C ATOM 356 CG ASP A 27 -3.719 -18.797 11.783 1.00 0.00 C ATOM 357 OD1 ASP A 27 -3.262 -17.796 12.374 1.00 0.00 O ATOM 358 OD2 ASP A 27 -3.845 -19.915 12.326 1.00 0.00 O ATOM 0 H ASP A 27 -2.790 -16.380 8.958 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.170 -19.145 9.637 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -4.834 -17.810 10.246 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.684 -19.542 10.024 1.00 0.00 H new ATOM 363 N ASP A 28 -4.089 -17.661 7.397 1.00 0.00 N ATOM 364 CA ASP A 28 -4.563 -17.735 6.020 1.00 0.00 C ATOM 365 C ASP A 28 -4.581 -16.348 5.389 1.00 0.00 C ATOM 366 O ASP A 28 -5.642 -15.803 5.083 1.00 0.00 O ATOM 367 CB ASP A 28 -5.961 -18.355 5.970 1.00 0.00 C ATOM 368 CG ASP A 28 -6.233 -19.063 4.658 1.00 0.00 C ATOM 369 OD1 ASP A 28 -5.622 -18.680 3.638 1.00 0.00 O ATOM 370 OD2 ASP A 28 -7.058 -20.002 4.650 1.00 0.00 O ATOM 0 H ASP A 28 -4.346 -16.802 7.883 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.880 -18.368 5.454 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.071 -19.063 6.791 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -6.707 -17.575 6.120 1.00 0.00 H new ATOM 375 N ILE A 29 -3.395 -15.776 5.212 1.00 0.00 N ATOM 376 CA ILE A 29 -3.263 -14.447 4.634 1.00 0.00 C ATOM 377 C ILE A 29 -3.319 -14.486 3.110 1.00 0.00 C ATOM 378 O ILE A 29 -2.890 -15.454 2.482 1.00 0.00 O ATOM 379 CB ILE A 29 -1.946 -13.782 5.088 1.00 0.00 C ATOM 380 CG1 ILE A 29 -1.973 -13.559 6.598 1.00 0.00 C ATOM 381 CG2 ILE A 29 -1.720 -12.466 4.356 1.00 0.00 C ATOM 382 CD1 ILE A 29 -1.319 -14.665 7.392 1.00 0.00 C ATOM 0 H ILE A 29 -2.509 -16.215 5.462 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.107 -13.857 4.992 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.118 -14.446 4.842 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.473 -12.617 6.825 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.009 -13.456 6.922 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -0.786 -12.018 4.694 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.667 -12.651 3.283 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.546 -11.786 4.566 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.379 -14.434 8.455 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.833 -15.606 7.196 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.273 -14.754 7.098 1.00 0.00 H new ATOM 394 N LYS A 30 -3.850 -13.416 2.526 1.00 0.00 N ATOM 395 CA LYS A 30 -3.967 -13.304 1.078 1.00 0.00 C ATOM 396 C LYS A 30 -3.479 -11.938 0.608 1.00 0.00 C ATOM 397 O LYS A 30 -3.877 -10.907 1.149 1.00 0.00 O ATOM 398 CB LYS A 30 -5.419 -13.518 0.646 1.00 0.00 C ATOM 399 CG LYS A 30 -5.943 -14.913 0.943 1.00 0.00 C ATOM 400 CD LYS A 30 -5.716 -15.854 -0.228 1.00 0.00 C ATOM 401 CE LYS A 30 -6.771 -16.948 -0.276 1.00 0.00 C ATOM 402 NZ LYS A 30 -6.932 -17.505 -1.647 1.00 0.00 N ATOM 0 H LYS A 30 -4.208 -12.610 3.038 1.00 0.00 H new ATOM 0 HA LYS A 30 -3.345 -14.074 0.621 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.051 -12.787 1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -5.503 -13.328 -0.424 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.447 -15.308 1.830 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.008 -14.862 1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.734 -15.288 -1.160 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.727 -16.304 -0.148 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -6.495 -17.748 0.411 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -7.725 -16.548 0.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -7.660 -18.248 -1.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -7.220 -16.747 -2.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.029 -17.910 -1.965 1.00 0.00 H new ATOM 416 N TRP A 31 -2.611 -11.937 -0.397 1.00 0.00 N ATOM 417 CA TRP A 31 -2.066 -10.696 -0.934 1.00 0.00 C ATOM 418 C TRP A 31 -2.796 -10.284 -2.210 1.00 0.00 C ATOM 419 O TRP A 31 -3.670 -11.003 -2.694 1.00 0.00 O ATOM 420 CB TRP A 31 -0.566 -10.853 -1.191 1.00 0.00 C ATOM 421 CG TRP A 31 0.205 -11.150 0.059 1.00 0.00 C ATOM 422 CD1 TRP A 31 0.504 -12.382 0.568 1.00 0.00 C ATOM 423 CD2 TRP A 31 0.766 -10.196 0.966 1.00 0.00 C ATOM 424 NE1 TRP A 31 1.216 -12.251 1.735 1.00 0.00 N ATOM 425 CE2 TRP A 31 1.390 -10.918 2.000 1.00 0.00 C ATOM 426 CE3 TRP A 31 0.802 -8.801 1.002 1.00 0.00 C ATOM 427 CZ2 TRP A 31 2.041 -10.290 3.059 1.00 0.00 C ATOM 428 CZ3 TRP A 31 1.448 -8.179 2.052 1.00 0.00 C ATOM 429 CH2 TRP A 31 2.061 -8.923 3.068 1.00 0.00 C ATOM 0 H TRP A 31 -2.270 -12.781 -0.856 1.00 0.00 H new ATOM 0 HA TRP A 31 -2.215 -9.905 -0.199 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -0.407 -11.656 -1.911 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -0.181 -9.939 -1.642 1.00 0.00 H new ATOM 0 HD1 TRP A 31 0.222 -13.322 0.118 1.00 0.00 H new ATOM 0 HE1 TRP A 31 1.559 -13.020 2.310 1.00 0.00 H new ATOM 0 HE3 TRP A 31 0.333 -8.219 0.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 2.513 -10.862 3.844 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 1.481 -7.100 2.090 1.00 0.00 H new ATOM 0 HH2 TRP A 31 2.560 -8.406 3.875 1.00 0.00 H new ATOM 440 N LYS A 32 -2.448 -9.114 -2.741 1.00 0.00 N ATOM 441 CA LYS A 32 -3.095 -8.608 -3.954 1.00 0.00 C ATOM 442 C LYS A 32 -2.089 -8.044 -4.962 1.00 0.00 C ATOM 443 O LYS A 32 -2.001 -8.535 -6.087 1.00 0.00 O ATOM 444 CB LYS A 32 -4.137 -7.536 -3.608 1.00 0.00 C ATOM 445 CG LYS A 32 -4.758 -7.695 -2.228 1.00 0.00 C ATOM 446 CD LYS A 32 -5.737 -8.857 -2.190 1.00 0.00 C ATOM 447 CE LYS A 32 -5.677 -9.592 -0.861 1.00 0.00 C ATOM 448 NZ LYS A 32 -6.392 -10.897 -0.915 1.00 0.00 N ATOM 0 H LYS A 32 -1.729 -8.502 -2.356 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.590 -9.460 -4.421 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.668 -6.554 -3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.929 -7.560 -4.356 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -3.972 -7.855 -1.490 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.272 -6.775 -1.951 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.749 -8.487 -2.357 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -5.513 -9.550 -3.001 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -4.636 -9.760 -0.586 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.116 -8.969 -0.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -6.625 -11.205 0.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.268 -10.790 -1.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -5.783 -11.608 -1.368 1.00 0.00 H new ATOM 462 N PRO A 33 -1.321 -6.996 -4.588 1.00 0.00 N ATOM 463 CA PRO A 33 -0.336 -6.366 -5.471 1.00 0.00 C ATOM 464 C PRO A 33 0.404 -7.365 -6.353 1.00 0.00 C ATOM 465 O PRO A 33 0.528 -7.169 -7.562 1.00 0.00 O ATOM 466 CB PRO A 33 0.640 -5.683 -4.495 1.00 0.00 C ATOM 467 CG PRO A 33 0.106 -5.951 -3.120 1.00 0.00 C ATOM 468 CD PRO A 33 -1.339 -6.321 -3.290 1.00 0.00 C ATOM 0 HA PRO A 33 -0.813 -5.681 -6.173 1.00 0.00 H new ATOM 0 HB2 PRO A 33 1.648 -6.083 -4.607 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.699 -4.612 -4.688 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.659 -6.758 -2.639 1.00 0.00 H new ATOM 0 HG3 PRO A 33 0.209 -5.071 -2.485 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.690 -6.976 -2.493 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -1.988 -5.445 -3.293 1.00 0.00 H new ATOM 476 N ASP A 34 0.894 -8.435 -5.743 1.00 0.00 N ATOM 477 CA ASP A 34 1.621 -9.462 -6.474 1.00 0.00 C ATOM 478 C ASP A 34 1.724 -10.741 -5.648 1.00 0.00 C ATOM 479 O ASP A 34 2.664 -10.917 -4.873 1.00 0.00 O ATOM 480 CB ASP A 34 3.016 -8.959 -6.850 1.00 0.00 C ATOM 481 CG ASP A 34 3.351 -9.218 -8.306 1.00 0.00 C ATOM 482 OD1 ASP A 34 3.164 -10.365 -8.763 1.00 0.00 O ATOM 483 OD2 ASP A 34 3.801 -8.274 -8.989 1.00 0.00 O ATOM 0 H ASP A 34 0.801 -8.614 -4.743 1.00 0.00 H new ATOM 0 HA ASP A 34 1.071 -9.687 -7.388 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.080 -7.889 -6.650 1.00 0.00 H new ATOM 0 HB3 ASP A 34 3.758 -9.446 -6.217 1.00 0.00 H new ATOM 488 N PRO A 35 0.755 -11.655 -5.808 1.00 0.00 N ATOM 489 CA PRO A 35 0.735 -12.925 -5.080 1.00 0.00 C ATOM 490 C PRO A 35 1.941 -13.782 -5.428 1.00 0.00 C ATOM 491 O PRO A 35 2.361 -14.636 -4.647 1.00 0.00 O ATOM 492 CB PRO A 35 -0.563 -13.596 -5.549 1.00 0.00 C ATOM 493 CG PRO A 35 -1.379 -12.488 -6.123 1.00 0.00 C ATOM 494 CD PRO A 35 -0.392 -11.530 -6.715 1.00 0.00 C ATOM 0 HA PRO A 35 0.775 -12.785 -4.000 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.363 -14.367 -6.293 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -1.080 -14.080 -4.720 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -2.068 -12.860 -6.881 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -1.982 -12.005 -5.354 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -0.131 -11.797 -7.739 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -0.780 -10.512 -6.741 1.00 0.00 H new ATOM 502 N ALA A 36 2.504 -13.535 -6.606 1.00 0.00 N ATOM 503 CA ALA A 36 3.677 -14.271 -7.061 1.00 0.00 C ATOM 504 C ALA A 36 4.812 -14.146 -6.050 1.00 0.00 C ATOM 505 O ALA A 36 5.633 -15.051 -5.903 1.00 0.00 O ATOM 506 CB ALA A 36 4.122 -13.768 -8.426 1.00 0.00 C ATOM 0 H ALA A 36 2.167 -12.831 -7.263 1.00 0.00 H new ATOM 0 HA ALA A 36 3.411 -15.324 -7.150 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.999 -14.328 -8.752 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.315 -13.907 -9.146 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.371 -12.709 -8.360 1.00 0.00 H new ATOM 512 N LEU A 37 4.841 -13.016 -5.347 1.00 0.00 N ATOM 513 CA LEU A 37 5.862 -12.764 -4.337 1.00 0.00 C ATOM 514 C LEU A 37 5.215 -12.547 -2.974 1.00 0.00 C ATOM 515 O LEU A 37 5.575 -11.626 -2.240 1.00 0.00 O ATOM 516 CB LEU A 37 6.707 -11.542 -4.714 1.00 0.00 C ATOM 517 CG LEU A 37 5.974 -10.460 -5.506 1.00 0.00 C ATOM 518 CD1 LEU A 37 6.758 -9.157 -5.481 1.00 0.00 C ATOM 519 CD2 LEU A 37 5.738 -10.920 -6.937 1.00 0.00 C ATOM 0 H LEU A 37 4.166 -12.259 -5.460 1.00 0.00 H new ATOM 0 HA LEU A 37 6.514 -13.636 -4.286 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.100 -11.097 -3.800 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.563 -11.879 -5.298 1.00 0.00 H new ATOM 0 HG LEU A 37 5.006 -10.283 -5.038 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.221 -8.398 -6.050 1.00 0.00 H new ATOM 0 HD12 LEU A 37 6.875 -8.822 -4.450 1.00 0.00 H new ATOM 0 HD13 LEU A 37 7.741 -9.315 -5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 37 5.215 -10.139 -7.489 1.00 0.00 H new ATOM 0 HD22 LEU A 37 6.696 -11.124 -7.416 1.00 0.00 H new ATOM 0 HD23 LEU A 37 5.134 -11.827 -6.933 1.00 0.00 H new ATOM 531 N GLY A 38 4.254 -13.403 -2.644 1.00 0.00 N ATOM 532 CA GLY A 38 3.563 -13.295 -1.375 1.00 0.00 C ATOM 533 C GLY A 38 3.593 -14.588 -0.591 1.00 0.00 C ATOM 534 O GLY A 38 2.885 -15.540 -0.919 1.00 0.00 O ATOM 0 H GLY A 38 3.941 -14.172 -3.236 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.020 -12.503 -0.782 1.00 0.00 H new ATOM 0 HA3 GLY A 38 2.527 -13.004 -1.552 1.00 0.00 H new ATOM 538 N ASP A 39 4.410 -14.617 0.452 1.00 0.00 N ATOM 539 CA ASP A 39 4.526 -15.801 1.296 1.00 0.00 C ATOM 540 C ASP A 39 3.279 -15.965 2.159 1.00 0.00 C ATOM 541 O ASP A 39 2.496 -15.027 2.310 1.00 0.00 O ATOM 542 CB ASP A 39 5.769 -15.703 2.183 1.00 0.00 C ATOM 543 CG ASP A 39 6.977 -16.376 1.563 1.00 0.00 C ATOM 544 OD1 ASP A 39 7.155 -16.259 0.332 1.00 0.00 O ATOM 545 OD2 ASP A 39 7.744 -17.022 2.307 1.00 0.00 O ATOM 0 H ASP A 39 5.002 -13.836 0.735 1.00 0.00 H new ATOM 0 HA ASP A 39 4.622 -16.675 0.651 1.00 0.00 H new ATOM 0 HB2 ASP A 39 5.997 -14.654 2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 39 5.559 -16.160 3.150 1.00 0.00 H new ATOM 550 N ASN A 40 3.100 -17.160 2.723 1.00 0.00 N ATOM 551 CA ASN A 40 1.944 -17.450 3.575 1.00 0.00 C ATOM 552 C ASN A 40 1.595 -16.254 4.456 1.00 0.00 C ATOM 553 O ASN A 40 0.625 -15.544 4.199 1.00 0.00 O ATOM 554 CB ASN A 40 2.222 -18.676 4.447 1.00 0.00 C ATOM 555 CG ASN A 40 1.967 -19.978 3.713 1.00 0.00 C ATOM 556 OD1 ASN A 40 2.902 -20.672 3.315 1.00 0.00 O ATOM 557 ND2 ASN A 40 0.696 -20.315 3.530 1.00 0.00 N ATOM 0 H ASN A 40 3.741 -17.944 2.605 1.00 0.00 H new ATOM 0 HA ASN A 40 1.093 -17.657 2.926 1.00 0.00 H new ATOM 0 HB2 ASN A 40 3.258 -18.650 4.786 1.00 0.00 H new ATOM 0 HB3 ASN A 40 1.594 -18.635 5.337 1.00 0.00 H new ATOM 0 HD21 ASN A 40 0.463 -21.180 3.042 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -0.047 -19.709 3.877 1.00 0.00 H new ATOM 564 N ASN A 41 2.404 -16.029 5.484 1.00 0.00 N ATOM 565 CA ASN A 41 2.194 -14.909 6.392 1.00 0.00 C ATOM 566 C ASN A 41 3.279 -13.858 6.187 1.00 0.00 C ATOM 567 O ASN A 41 3.690 -13.178 7.128 1.00 0.00 O ATOM 568 CB ASN A 41 2.199 -15.393 7.844 1.00 0.00 C ATOM 569 CG ASN A 41 1.859 -14.287 8.825 1.00 0.00 C ATOM 570 OD1 ASN A 41 1.564 -13.159 8.429 1.00 0.00 O ATOM 571 ND2 ASN A 41 1.898 -14.606 10.113 1.00 0.00 N ATOM 0 H ASN A 41 3.213 -16.608 5.710 1.00 0.00 H new ATOM 0 HA ASN A 41 1.223 -14.462 6.176 1.00 0.00 H new ATOM 0 HB2 ASN A 41 1.482 -16.206 7.955 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.181 -15.799 8.085 1.00 0.00 H new ATOM 0 HD21 ASN A 41 1.678 -13.904 10.819 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.148 -15.554 10.396 1.00 0.00 H new ATOM 578 N LYS A 42 3.745 -13.740 4.947 1.00 0.00 N ATOM 579 CA LYS A 42 4.793 -12.784 4.609 1.00 0.00 C ATOM 580 C LYS A 42 4.774 -12.461 3.118 1.00 0.00 C ATOM 581 O LYS A 42 4.094 -13.125 2.340 1.00 0.00 O ATOM 582 CB LYS A 42 6.161 -13.347 5.004 1.00 0.00 C ATOM 583 CG LYS A 42 7.265 -12.304 5.047 1.00 0.00 C ATOM 584 CD LYS A 42 8.344 -12.676 6.050 1.00 0.00 C ATOM 585 CE LYS A 42 8.861 -11.454 6.792 1.00 0.00 C ATOM 586 NZ LYS A 42 10.251 -11.653 7.289 1.00 0.00 N ATOM 0 H LYS A 42 3.412 -14.296 4.159 1.00 0.00 H new ATOM 0 HA LYS A 42 4.609 -11.863 5.162 1.00 0.00 H new ATOM 0 HB2 LYS A 42 6.080 -13.818 5.984 1.00 0.00 H new ATOM 0 HB3 LYS A 42 6.440 -14.128 4.297 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.708 -12.200 4.056 1.00 0.00 H new ATOM 0 HG3 LYS A 42 6.841 -11.335 5.310 1.00 0.00 H new ATOM 0 HD2 LYS A 42 7.945 -13.395 6.765 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.170 -13.165 5.533 1.00 0.00 H new ATOM 0 HE2 LYS A 42 8.833 -10.588 6.130 1.00 0.00 H new ATOM 0 HE3 LYS A 42 8.203 -11.234 7.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 10.329 -11.286 8.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 10.480 -12.667 7.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.916 -11.144 6.672 1.00 0.00 H new ATOM 600 N TYR A 43 5.525 -11.437 2.730 1.00 0.00 N ATOM 601 CA TYR A 43 5.607 -11.020 1.333 1.00 0.00 C ATOM 602 C TYR A 43 7.067 -10.919 0.907 1.00 0.00 C ATOM 603 O TYR A 43 7.749 -9.944 1.224 1.00 0.00 O ATOM 604 CB TYR A 43 4.915 -9.668 1.149 1.00 0.00 C ATOM 605 CG TYR A 43 4.445 -9.393 -0.264 1.00 0.00 C ATOM 606 CD1 TYR A 43 3.340 -10.049 -0.791 1.00 0.00 C ATOM 607 CD2 TYR A 43 5.103 -8.470 -1.069 1.00 0.00 C ATOM 608 CE1 TYR A 43 2.905 -9.796 -2.078 1.00 0.00 C ATOM 609 CE2 TYR A 43 4.675 -8.212 -2.356 1.00 0.00 C ATOM 610 CZ TYR A 43 3.576 -8.877 -2.856 1.00 0.00 C ATOM 611 OH TYR A 43 3.146 -8.620 -4.137 1.00 0.00 O ATOM 0 H TYR A 43 6.090 -10.876 3.367 1.00 0.00 H new ATOM 0 HA TYR A 43 5.105 -11.762 0.711 1.00 0.00 H new ATOM 0 HB2 TYR A 43 4.058 -9.618 1.820 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.602 -8.878 1.451 1.00 0.00 H new ATOM 0 HD1 TYR A 43 2.811 -10.769 -0.184 1.00 0.00 H new ATOM 0 HD2 TYR A 43 5.964 -7.946 -0.681 1.00 0.00 H new ATOM 0 HE1 TYR A 43 2.044 -10.315 -2.472 1.00 0.00 H new ATOM 0 HE2 TYR A 43 5.199 -7.493 -2.968 1.00 0.00 H new ATOM 0 HH TYR A 43 3.622 -7.840 -4.492 1.00 0.00 H new ATOM 621 N ILE A 44 7.543 -11.934 0.199 1.00 0.00 N ATOM 622 CA ILE A 44 8.927 -11.964 -0.257 1.00 0.00 C ATOM 623 C ILE A 44 9.100 -11.190 -1.558 1.00 0.00 C ATOM 624 O ILE A 44 8.776 -11.690 -2.634 1.00 0.00 O ATOM 625 CB ILE A 44 9.410 -13.411 -0.465 1.00 0.00 C ATOM 626 CG1 ILE A 44 9.088 -14.260 0.766 1.00 0.00 C ATOM 627 CG2 ILE A 44 10.903 -13.436 -0.760 1.00 0.00 C ATOM 628 CD1 ILE A 44 9.841 -13.836 2.008 1.00 0.00 C ATOM 0 H ILE A 44 6.992 -12.748 -0.072 1.00 0.00 H new ATOM 0 HA ILE A 44 9.527 -11.491 0.520 1.00 0.00 H new ATOM 0 HB ILE A 44 8.886 -13.834 -1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.018 -14.206 0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 44 9.320 -15.303 0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.228 -14.466 -0.904 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.105 -12.862 -1.664 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.447 -12.998 0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.563 -14.482 2.841 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.913 -13.917 1.829 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.590 -12.803 2.251 1.00 0.00 H new ATOM 640 N ILE A 45 9.620 -9.972 -1.453 1.00 0.00 N ATOM 641 CA ILE A 45 9.840 -9.134 -2.626 1.00 0.00 C ATOM 642 C ILE A 45 11.199 -9.413 -3.254 1.00 0.00 C ATOM 643 O ILE A 45 12.210 -9.499 -2.557 1.00 0.00 O ATOM 644 CB ILE A 45 9.757 -7.635 -2.284 1.00 0.00 C ATOM 645 CG1 ILE A 45 8.607 -7.361 -1.314 1.00 0.00 C ATOM 646 CG2 ILE A 45 9.588 -6.817 -3.554 1.00 0.00 C ATOM 647 CD1 ILE A 45 8.488 -5.905 -0.922 1.00 0.00 C ATOM 0 H ILE A 45 9.897 -9.544 -0.570 1.00 0.00 H new ATOM 0 HA ILE A 45 9.048 -9.382 -3.333 1.00 0.00 H new ATOM 0 HB ILE A 45 10.687 -7.341 -1.798 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.671 -7.685 -1.770 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.748 -7.962 -0.415 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.530 -5.759 -3.300 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.440 -6.986 -4.212 1.00 0.00 H new ATOM 0 HG23 ILE A 45 8.672 -7.119 -4.062 1.00 0.00 H new ATOM 0 HD11 ILE A 45 7.653 -5.781 -0.233 1.00 0.00 H new ATOM 0 HD12 ILE A 45 9.409 -5.582 -0.437 1.00 0.00 H new ATOM 0 HD13 ILE A 45 8.316 -5.301 -1.813 1.00 0.00 H new ATOM 659 N GLN A 46 11.217 -9.551 -4.576 1.00 0.00 N ATOM 660 CA GLN A 46 12.450 -9.819 -5.298 1.00 0.00 C ATOM 661 C GLN A 46 12.476 -9.067 -6.624 1.00 0.00 C ATOM 662 O GLN A 46 11.456 -8.952 -7.303 1.00 0.00 O ATOM 663 CB GLN A 46 12.595 -11.318 -5.541 1.00 0.00 C ATOM 664 CG GLN A 46 12.940 -12.097 -4.285 1.00 0.00 C ATOM 665 CD GLN A 46 12.840 -13.597 -4.481 1.00 0.00 C ATOM 666 OE1 GLN A 46 12.413 -14.070 -5.534 1.00 0.00 O ATOM 667 NE2 GLN A 46 13.233 -14.355 -3.463 1.00 0.00 N ATOM 0 H GLN A 46 10.389 -9.481 -5.167 1.00 0.00 H new ATOM 0 HA GLN A 46 13.287 -9.472 -4.692 1.00 0.00 H new ATOM 0 HB2 GLN A 46 11.664 -11.704 -5.956 1.00 0.00 H new ATOM 0 HB3 GLN A 46 13.370 -11.485 -6.289 1.00 0.00 H new ATOM 0 HG2 GLN A 46 13.952 -11.842 -3.971 1.00 0.00 H new ATOM 0 HG3 GLN A 46 12.271 -11.795 -3.479 1.00 0.00 H new ATOM 0 HE21 GLN A 46 13.581 -13.921 -2.608 1.00 0.00 H new ATOM 0 HE22 GLN A 46 13.187 -15.371 -3.536 1.00 0.00 H new ATOM 676 N ASN A 47 13.647 -8.550 -6.985 1.00 0.00 N ATOM 677 CA ASN A 47 13.799 -7.802 -8.228 1.00 0.00 C ATOM 678 C ASN A 47 12.822 -6.630 -8.274 1.00 0.00 C ATOM 679 O ASN A 47 12.431 -6.175 -9.349 1.00 0.00 O ATOM 680 CB ASN A 47 13.573 -8.719 -9.431 1.00 0.00 C ATOM 681 CG ASN A 47 14.530 -8.425 -10.570 1.00 0.00 C ATOM 682 OD1 ASN A 47 14.173 -7.756 -11.539 1.00 0.00 O ATOM 683 ND2 ASN A 47 15.755 -8.927 -10.457 1.00 0.00 N ATOM 0 H ASN A 47 14.502 -8.635 -6.436 1.00 0.00 H new ATOM 0 HA ASN A 47 14.815 -7.409 -8.268 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.690 -9.757 -9.120 1.00 0.00 H new ATOM 0 HB3 ASN A 47 12.548 -8.606 -9.783 1.00 0.00 H new ATOM 0 HD21 ASN A 47 16.443 -8.763 -11.192 1.00 0.00 H new ATOM 0 HD22 ASN A 47 16.007 -9.476 -9.635 1.00 0.00 H new ATOM 690 N HIS A 48 12.431 -6.149 -7.097 1.00 0.00 N ATOM 691 CA HIS A 48 11.498 -5.033 -6.994 1.00 0.00 C ATOM 692 C HIS A 48 12.031 -3.804 -7.721 1.00 0.00 C ATOM 693 O HIS A 48 13.197 -3.757 -8.113 1.00 0.00 O ATOM 694 CB HIS A 48 11.240 -4.696 -5.526 1.00 0.00 C ATOM 695 CG HIS A 48 9.970 -3.936 -5.299 1.00 0.00 C ATOM 696 ND1 HIS A 48 8.754 -4.329 -5.815 1.00 0.00 N ATOM 697 CD2 HIS A 48 9.732 -2.799 -4.603 1.00 0.00 C ATOM 698 CE1 HIS A 48 7.823 -3.466 -5.449 1.00 0.00 C ATOM 699 NE2 HIS A 48 8.390 -2.529 -4.713 1.00 0.00 N ATOM 0 H HIS A 48 12.747 -6.516 -6.200 1.00 0.00 H new ATOM 0 HA HIS A 48 10.562 -5.331 -7.465 1.00 0.00 H new ATOM 0 HB2 HIS A 48 11.208 -5.621 -4.950 1.00 0.00 H new ATOM 0 HB3 HIS A 48 12.077 -4.111 -5.144 1.00 0.00 H new ATOM 0 HD1 HIS A 48 8.597 -5.157 -6.390 1.00 0.00 H new ATOM 0 HD2 HIS A 48 10.461 -2.214 -4.062 1.00 0.00 H new ATOM 0 HE1 HIS A 48 6.776 -3.519 -5.708 1.00 0.00 H new ATOM 707 N ASP A 49 11.167 -2.810 -7.895 1.00 0.00 N ATOM 708 CA ASP A 49 11.546 -1.576 -8.572 1.00 0.00 C ATOM 709 C ASP A 49 11.390 -0.379 -7.641 1.00 0.00 C ATOM 710 O ASP A 49 10.358 -0.217 -6.990 1.00 0.00 O ATOM 711 CB ASP A 49 10.695 -1.377 -9.827 1.00 0.00 C ATOM 712 CG ASP A 49 11.483 -0.763 -10.968 1.00 0.00 C ATOM 713 OD1 ASP A 49 11.870 0.419 -10.855 1.00 0.00 O ATOM 714 OD2 ASP A 49 11.713 -1.465 -11.976 1.00 0.00 O ATOM 0 H ASP A 49 10.198 -2.835 -7.576 1.00 0.00 H new ATOM 0 HA ASP A 49 12.594 -1.654 -8.862 1.00 0.00 H new ATOM 0 HB2 ASP A 49 10.290 -2.338 -10.144 1.00 0.00 H new ATOM 0 HB3 ASP A 49 9.846 -0.736 -9.589 1.00 0.00 H new ATOM 719 N SER A 50 12.420 0.460 -7.585 1.00 0.00 N ATOM 720 CA SER A 50 12.399 1.647 -6.736 1.00 0.00 C ATOM 721 C SER A 50 11.140 2.471 -6.984 1.00 0.00 C ATOM 722 O SER A 50 11.096 3.292 -7.900 1.00 0.00 O ATOM 723 CB SER A 50 13.639 2.504 -6.995 1.00 0.00 C ATOM 724 OG SER A 50 13.623 3.678 -6.201 1.00 0.00 O ATOM 0 H SER A 50 13.281 0.340 -8.118 1.00 0.00 H new ATOM 0 HA SER A 50 12.399 1.320 -5.696 1.00 0.00 H new ATOM 0 HB2 SER A 50 14.537 1.926 -6.776 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.684 2.775 -8.050 1.00 0.00 H new ATOM 0 HG SER A 50 14.427 4.208 -6.384 1.00 0.00 H new ATOM 730 N SER A 51 10.115 2.245 -6.167 1.00 0.00 N ATOM 731 CA SER A 51 8.858 2.971 -6.312 1.00 0.00 C ATOM 732 C SER A 51 7.864 2.595 -5.220 1.00 0.00 C ATOM 733 O SER A 51 8.131 1.722 -4.391 1.00 0.00 O ATOM 734 CB SER A 51 8.247 2.702 -7.690 1.00 0.00 C ATOM 735 OG SER A 51 8.416 3.816 -8.549 1.00 0.00 O ATOM 0 H SER A 51 10.130 1.570 -5.403 1.00 0.00 H new ATOM 0 HA SER A 51 9.077 4.034 -6.215 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.715 1.823 -8.133 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.185 2.479 -7.583 1.00 0.00 H new ATOM 0 HG SER A 51 9.370 4.027 -8.628 1.00 0.00 H new ATOM 741 N PRO A 52 6.704 3.277 -5.202 1.00 0.00 N ATOM 742 CA PRO A 52 5.657 3.053 -4.215 1.00 0.00 C ATOM 743 C PRO A 52 4.631 2.011 -4.642 1.00 0.00 C ATOM 744 O PRO A 52 4.649 1.523 -5.772 1.00 0.00 O ATOM 745 CB PRO A 52 4.994 4.420 -4.137 1.00 0.00 C ATOM 746 CG PRO A 52 5.101 4.969 -5.517 1.00 0.00 C ATOM 747 CD PRO A 52 6.329 4.353 -6.142 1.00 0.00 C ATOM 0 HA PRO A 52 6.061 2.672 -3.277 1.00 0.00 H new ATOM 0 HB2 PRO A 52 3.954 4.339 -3.822 1.00 0.00 H new ATOM 0 HB3 PRO A 52 5.496 5.063 -3.414 1.00 0.00 H new ATOM 0 HG2 PRO A 52 4.211 4.729 -6.098 1.00 0.00 H new ATOM 0 HG3 PRO A 52 5.183 6.056 -5.495 1.00 0.00 H new ATOM 0 HD2 PRO A 52 6.117 3.959 -7.136 1.00 0.00 H new ATOM 0 HD3 PRO A 52 7.130 5.084 -6.253 1.00 0.00 H new ATOM 755 N LEU A 53 3.724 1.698 -3.722 1.00 0.00 N ATOM 756 CA LEU A 53 2.658 0.737 -3.971 1.00 0.00 C ATOM 757 C LEU A 53 1.807 0.555 -2.723 1.00 0.00 C ATOM 758 O LEU A 53 2.306 0.627 -1.601 1.00 0.00 O ATOM 759 CB LEU A 53 3.225 -0.615 -4.437 1.00 0.00 C ATOM 760 CG LEU A 53 3.431 -1.679 -3.354 1.00 0.00 C ATOM 761 CD1 LEU A 53 2.108 -2.306 -2.938 1.00 0.00 C ATOM 762 CD2 LEU A 53 4.385 -2.754 -3.847 1.00 0.00 C ATOM 0 H LEU A 53 3.708 2.103 -2.786 1.00 0.00 H new ATOM 0 HA LEU A 53 2.030 1.130 -4.770 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.555 -1.023 -5.194 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.183 -0.434 -4.924 1.00 0.00 H new ATOM 0 HG LEU A 53 3.864 -1.190 -2.481 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.287 -3.057 -2.169 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.447 -1.534 -2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.641 -2.777 -3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.523 -3.504 -3.068 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.971 -3.228 -4.737 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.347 -2.303 -4.090 1.00 0.00 H new ATOM 774 N THR A 54 0.527 0.296 -2.928 1.00 0.00 N ATOM 775 CA THR A 54 -0.390 0.077 -1.822 1.00 0.00 C ATOM 776 C THR A 54 -0.627 -1.420 -1.665 1.00 0.00 C ATOM 777 O THR A 54 -1.280 -2.047 -2.498 1.00 0.00 O ATOM 778 CB THR A 54 -1.704 0.839 -2.055 1.00 0.00 C ATOM 779 OG1 THR A 54 -1.595 2.165 -1.569 1.00 0.00 O ATOM 780 CG2 THR A 54 -2.913 0.212 -1.385 1.00 0.00 C ATOM 0 H THR A 54 0.098 0.232 -3.851 1.00 0.00 H new ATOM 0 HA THR A 54 0.043 0.460 -0.898 1.00 0.00 H new ATOM 0 HB THR A 54 -1.860 0.808 -3.133 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.667 2.469 -1.652 1.00 0.00 H new ATOM 0 HG21 THR A 54 -3.799 0.811 -1.599 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.057 -0.799 -1.767 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.753 0.173 -0.308 1.00 0.00 H new ATOM 788 N VAL A 55 -0.064 -1.990 -0.607 1.00 0.00 N ATOM 789 CA VAL A 55 -0.186 -3.418 -0.362 1.00 0.00 C ATOM 790 C VAL A 55 -1.310 -3.727 0.620 1.00 0.00 C ATOM 791 O VAL A 55 -1.393 -3.136 1.697 1.00 0.00 O ATOM 792 CB VAL A 55 1.147 -4.009 0.155 1.00 0.00 C ATOM 793 CG1 VAL A 55 1.322 -3.765 1.648 1.00 0.00 C ATOM 794 CG2 VAL A 55 1.229 -5.493 -0.162 1.00 0.00 C ATOM 0 H VAL A 55 0.480 -1.485 0.093 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.431 -3.886 -1.316 1.00 0.00 H new ATOM 0 HB VAL A 55 1.961 -3.499 -0.359 1.00 0.00 H new ATOM 0 HG11 VAL A 55 2.269 -4.193 1.978 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.321 -2.693 1.844 1.00 0.00 H new ATOM 0 HG13 VAL A 55 0.502 -4.234 2.192 1.00 0.00 H new ATOM 0 HG21 VAL A 55 2.173 -5.893 0.209 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.401 -6.014 0.318 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.172 -5.638 -1.241 1.00 0.00 H new ATOM 804 N SER A 56 -2.174 -4.658 0.232 1.00 0.00 N ATOM 805 CA SER A 56 -3.299 -5.051 1.067 1.00 0.00 C ATOM 806 C SER A 56 -3.135 -6.480 1.565 1.00 0.00 C ATOM 807 O SER A 56 -2.762 -7.377 0.809 1.00 0.00 O ATOM 808 CB SER A 56 -4.610 -4.915 0.291 1.00 0.00 C ATOM 809 OG SER A 56 -5.714 -5.336 1.074 1.00 0.00 O ATOM 0 H SER A 56 -2.115 -5.154 -0.657 1.00 0.00 H new ATOM 0 HA SER A 56 -3.326 -4.387 1.931 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.750 -3.878 -0.012 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.559 -5.510 -0.621 1.00 0.00 H new ATOM 0 HG SER A 56 -6.540 -5.237 0.555 1.00 0.00 H new ATOM 815 N CYS A 57 -3.417 -6.681 2.845 1.00 0.00 N ATOM 816 CA CYS A 57 -3.307 -7.996 3.459 1.00 0.00 C ATOM 817 C CYS A 57 -4.659 -8.445 3.997 1.00 0.00 C ATOM 818 O CYS A 57 -5.443 -7.631 4.484 1.00 0.00 O ATOM 819 CB CYS A 57 -2.275 -7.961 4.586 1.00 0.00 C ATOM 820 SG CYS A 57 -1.131 -9.376 4.598 1.00 0.00 S ATOM 0 H CYS A 57 -3.725 -5.945 3.481 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.981 -8.710 2.703 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -1.696 -7.041 4.504 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -2.799 -7.924 5.541 1.00 0.00 H new ATOM 825 N THR A 58 -4.933 -9.739 3.895 1.00 0.00 N ATOM 826 CA THR A 58 -6.200 -10.279 4.363 1.00 0.00 C ATOM 827 C THR A 58 -6.013 -11.611 5.080 1.00 0.00 C ATOM 828 O THR A 58 -5.865 -12.654 4.443 1.00 0.00 O ATOM 829 CB THR A 58 -7.148 -10.461 3.179 1.00 0.00 C ATOM 830 OG1 THR A 58 -7.393 -9.221 2.539 1.00 0.00 O ATOM 831 CG2 THR A 58 -8.487 -11.054 3.562 1.00 0.00 C ATOM 0 H THR A 58 -4.298 -10.430 3.495 1.00 0.00 H new ATOM 0 HA THR A 58 -6.624 -9.572 5.076 1.00 0.00 H new ATOM 0 HB THR A 58 -6.642 -11.159 2.512 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.001 -9.358 1.782 1.00 0.00 H new ATOM 0 HG21 THR A 58 -9.108 -11.155 2.672 1.00 0.00 H new ATOM 0 HG22 THR A 58 -8.335 -12.035 4.011 1.00 0.00 H new ATOM 0 HG23 THR A 58 -8.983 -10.400 4.279 1.00 0.00 H new ATOM 839 N ALA A 59 -6.042 -11.573 6.407 1.00 0.00 N ATOM 840 CA ALA A 59 -5.896 -12.782 7.206 1.00 0.00 C ATOM 841 C ALA A 59 -7.204 -13.114 7.915 1.00 0.00 C ATOM 842 O ALA A 59 -7.571 -12.465 8.894 1.00 0.00 O ATOM 843 CB ALA A 59 -4.773 -12.623 8.219 1.00 0.00 C ATOM 0 H ALA A 59 -6.165 -10.719 6.951 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.644 -13.605 6.537 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.680 -13.537 8.806 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -3.836 -12.431 7.696 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -4.997 -11.787 8.882 1.00 0.00 H new ATOM 849 N GLY A 60 -7.908 -14.122 7.412 1.00 0.00 N ATOM 850 CA GLY A 60 -9.170 -14.509 8.012 1.00 0.00 C ATOM 851 C GLY A 60 -10.215 -13.416 7.902 1.00 0.00 C ATOM 852 O GLY A 60 -10.805 -13.217 6.841 1.00 0.00 O ATOM 0 H GLY A 60 -7.628 -14.676 6.602 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -9.539 -15.413 7.527 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -9.011 -14.753 9.062 1.00 0.00 H new ATOM 856 N ASP A 61 -10.442 -12.704 9.002 1.00 0.00 N ATOM 857 CA ASP A 61 -11.421 -11.623 9.024 1.00 0.00 C ATOM 858 C ASP A 61 -10.750 -10.284 9.314 1.00 0.00 C ATOM 859 O ASP A 61 -11.355 -9.392 9.908 1.00 0.00 O ATOM 860 CB ASP A 61 -12.498 -11.905 10.073 1.00 0.00 C ATOM 861 CG ASP A 61 -13.859 -11.378 9.661 1.00 0.00 C ATOM 862 OD1 ASP A 61 -14.371 -11.815 8.609 1.00 0.00 O ATOM 863 OD2 ASP A 61 -14.413 -10.529 10.391 1.00 0.00 O ATOM 0 H ASP A 61 -9.962 -12.856 9.889 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.886 -11.568 8.040 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.564 -12.980 10.242 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.207 -11.450 11.020 1.00 0.00 H new ATOM 868 N GLN A 62 -9.495 -10.151 8.893 1.00 0.00 N ATOM 869 CA GLN A 62 -8.742 -8.919 9.111 1.00 0.00 C ATOM 870 C GLN A 62 -8.370 -8.263 7.784 1.00 0.00 C ATOM 871 O GLN A 62 -8.198 -8.941 6.771 1.00 0.00 O ATOM 872 CB GLN A 62 -7.479 -9.207 9.925 1.00 0.00 C ATOM 873 CG GLN A 62 -7.636 -8.927 11.411 1.00 0.00 C ATOM 874 CD GLN A 62 -7.675 -10.194 12.244 1.00 0.00 C ATOM 875 OE1 GLN A 62 -6.952 -10.324 13.231 1.00 0.00 O ATOM 876 NE2 GLN A 62 -8.522 -11.137 11.848 1.00 0.00 N ATOM 0 H GLN A 62 -8.979 -10.880 8.400 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.376 -8.229 9.668 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -7.199 -10.251 9.788 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -6.660 -8.603 9.535 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -6.810 -8.301 11.748 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -8.553 -8.361 11.575 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -9.103 -10.987 11.023 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -8.592 -12.011 12.369 1.00 0.00 H new ATOM 885 N GLU A 63 -8.248 -6.939 7.798 1.00 0.00 N ATOM 886 CA GLU A 63 -7.897 -6.188 6.597 1.00 0.00 C ATOM 887 C GLU A 63 -6.868 -5.106 6.911 1.00 0.00 C ATOM 888 O GLU A 63 -7.211 -4.037 7.417 1.00 0.00 O ATOM 889 CB GLU A 63 -9.147 -5.556 5.982 1.00 0.00 C ATOM 890 CG GLU A 63 -10.146 -6.573 5.455 1.00 0.00 C ATOM 891 CD GLU A 63 -11.558 -6.025 5.391 1.00 0.00 C ATOM 892 OE1 GLU A 63 -12.227 -5.982 6.445 1.00 0.00 O ATOM 893 OE2 GLU A 63 -11.995 -5.639 4.286 1.00 0.00 O ATOM 0 H GLU A 63 -8.387 -6.364 8.629 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.459 -6.883 5.880 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.636 -4.934 6.732 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.847 -4.897 5.167 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.840 -6.895 4.460 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.132 -7.456 6.094 1.00 0.00 H new ATOM 900 N HIS A 64 -5.605 -5.391 6.609 1.00 0.00 N ATOM 901 CA HIS A 64 -4.526 -4.441 6.859 1.00 0.00 C ATOM 902 C HIS A 64 -3.809 -4.073 5.564 1.00 0.00 C ATOM 903 O HIS A 64 -3.469 -4.942 4.761 1.00 0.00 O ATOM 904 CB HIS A 64 -3.527 -5.026 7.859 1.00 0.00 C ATOM 905 CG HIS A 64 -3.920 -4.817 9.289 1.00 0.00 C ATOM 906 ND1 HIS A 64 -5.161 -5.155 9.786 1.00 0.00 N ATOM 907 CD2 HIS A 64 -3.226 -4.303 10.332 1.00 0.00 C ATOM 908 CE1 HIS A 64 -5.215 -4.857 11.072 1.00 0.00 C ATOM 909 NE2 HIS A 64 -4.054 -4.339 11.428 1.00 0.00 N ATOM 0 H HIS A 64 -5.304 -6.271 6.191 1.00 0.00 H new ATOM 0 HA HIS A 64 -4.965 -3.535 7.278 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.422 -6.095 7.672 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -2.549 -4.575 7.690 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -2.211 -3.934 10.307 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -6.064 -5.011 11.721 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -3.811 -4.018 12.365 1.00 0.00 H new ATOM 917 N THR A 65 -3.580 -2.778 5.369 1.00 0.00 N ATOM 918 CA THR A 65 -2.900 -2.291 4.173 1.00 0.00 C ATOM 919 C THR A 65 -1.764 -1.342 4.542 1.00 0.00 C ATOM 920 O THR A 65 -1.826 -0.647 5.556 1.00 0.00 O ATOM 921 CB THR A 65 -3.889 -1.577 3.247 1.00 0.00 C ATOM 922 OG1 THR A 65 -4.718 -0.695 3.981 1.00 0.00 O ATOM 923 CG2 THR A 65 -4.790 -2.522 2.485 1.00 0.00 C ATOM 0 H THR A 65 -3.855 -2.046 6.024 1.00 0.00 H new ATOM 0 HA THR A 65 -2.481 -3.152 3.652 1.00 0.00 H new ATOM 0 HB THR A 65 -3.270 -1.036 2.532 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.525 -0.496 3.461 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.464 -1.948 1.849 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.183 -3.184 1.867 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.373 -3.116 3.189 1.00 0.00 H new ATOM 931 N MET A 66 -0.729 -1.314 3.711 1.00 0.00 N ATOM 932 CA MET A 66 0.417 -0.444 3.950 1.00 0.00 C ATOM 933 C MET A 66 1.019 0.027 2.633 1.00 0.00 C ATOM 934 O MET A 66 1.029 -0.709 1.647 1.00 0.00 O ATOM 935 CB MET A 66 1.478 -1.170 4.779 1.00 0.00 C ATOM 936 CG MET A 66 2.690 -0.310 5.098 1.00 0.00 C ATOM 937 SD MET A 66 3.440 -0.723 6.686 1.00 0.00 S ATOM 938 CE MET A 66 2.038 -0.534 7.784 1.00 0.00 C ATOM 0 H MET A 66 -0.659 -1.882 2.867 1.00 0.00 H new ATOM 0 HA MET A 66 0.070 0.427 4.506 1.00 0.00 H new ATOM 0 HB2 MET A 66 1.029 -1.511 5.712 1.00 0.00 H new ATOM 0 HB3 MET A 66 1.805 -2.059 4.239 1.00 0.00 H new ATOM 0 HG2 MET A 66 3.432 -0.429 4.309 1.00 0.00 H new ATOM 0 HG3 MET A 66 2.395 0.739 5.102 1.00 0.00 H new ATOM 0 HE1 MET A 66 2.292 0.164 8.581 1.00 0.00 H new ATOM 0 HE2 MET A 66 1.186 -0.150 7.223 1.00 0.00 H new ATOM 0 HE3 MET A 66 1.782 -1.501 8.217 1.00 0.00 H new ATOM 948 N TYR A 67 1.519 1.257 2.617 1.00 0.00 N ATOM 949 CA TYR A 67 2.118 1.810 1.411 1.00 0.00 C ATOM 950 C TYR A 67 3.596 1.452 1.320 1.00 0.00 C ATOM 951 O TYR A 67 4.415 1.933 2.104 1.00 0.00 O ATOM 952 CB TYR A 67 1.941 3.328 1.363 1.00 0.00 C ATOM 953 CG TYR A 67 1.691 3.845 -0.034 1.00 0.00 C ATOM 954 CD1 TYR A 67 0.441 3.718 -0.626 1.00 0.00 C ATOM 955 CD2 TYR A 67 2.706 4.446 -0.766 1.00 0.00 C ATOM 956 CE1 TYR A 67 0.213 4.176 -1.910 1.00 0.00 C ATOM 957 CE2 TYR A 67 2.487 4.904 -2.046 1.00 0.00 C ATOM 958 CZ TYR A 67 1.239 4.766 -2.617 1.00 0.00 C ATOM 959 OH TYR A 67 1.017 5.216 -3.898 1.00 0.00 O ATOM 0 H TYR A 67 1.521 1.886 3.420 1.00 0.00 H new ATOM 0 HA TYR A 67 1.604 1.372 0.556 1.00 0.00 H new ATOM 0 HB2 TYR A 67 1.107 3.612 2.005 1.00 0.00 H new ATOM 0 HB3 TYR A 67 2.833 3.806 1.768 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.364 3.255 -0.075 1.00 0.00 H new ATOM 0 HD2 TYR A 67 3.685 4.556 -0.324 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.764 4.072 -2.357 1.00 0.00 H new ATOM 0 HE2 TYR A 67 3.289 5.369 -2.600 1.00 0.00 H new ATOM 0 HH TYR A 67 1.823 5.663 -4.232 1.00 0.00 H new ATOM 969 N LEU A 68 3.926 0.601 0.356 1.00 0.00 N ATOM 970 CA LEU A 68 5.301 0.168 0.149 1.00 0.00 C ATOM 971 C LEU A 68 5.988 1.022 -0.912 1.00 0.00 C ATOM 972 O LEU A 68 5.653 0.947 -2.094 1.00 0.00 O ATOM 973 CB LEU A 68 5.330 -1.306 -0.267 1.00 0.00 C ATOM 974 CG LEU A 68 6.688 -1.823 -0.745 1.00 0.00 C ATOM 975 CD1 LEU A 68 6.872 -3.281 -0.352 1.00 0.00 C ATOM 976 CD2 LEU A 68 6.828 -1.651 -2.252 1.00 0.00 C ATOM 0 H LEU A 68 3.256 0.196 -0.297 1.00 0.00 H new ATOM 0 HA LEU A 68 5.841 0.288 1.088 1.00 0.00 H new ATOM 0 HB2 LEU A 68 5.006 -1.912 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.601 -1.456 -1.064 1.00 0.00 H new ATOM 0 HG LEU A 68 7.469 -1.236 -0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 68 7.843 -3.632 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 68 6.820 -3.375 0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.085 -3.882 -0.807 1.00 0.00 H new ATOM 0 HD21 LEU A 68 7.801 -2.025 -2.572 1.00 0.00 H new ATOM 0 HD22 LEU A 68 6.040 -2.210 -2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 68 6.743 -0.595 -2.507 1.00 0.00 H new ATOM 988 N ASN A 69 6.957 1.825 -0.485 1.00 0.00 N ATOM 989 CA ASN A 69 7.696 2.683 -1.406 1.00 0.00 C ATOM 990 C ASN A 69 9.181 2.677 -1.075 1.00 0.00 C ATOM 991 O ASN A 69 9.620 3.330 -0.128 1.00 0.00 O ATOM 992 CB ASN A 69 7.159 4.119 -1.371 1.00 0.00 C ATOM 993 CG ASN A 69 6.647 4.534 -0.002 1.00 0.00 C ATOM 994 OD1 ASN A 69 5.667 5.269 0.107 1.00 0.00 O ATOM 995 ND2 ASN A 69 7.314 4.074 1.052 1.00 0.00 N ATOM 0 H ASN A 69 7.249 1.900 0.490 1.00 0.00 H new ATOM 0 HA ASN A 69 7.558 2.285 -2.411 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.950 4.803 -1.679 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.353 4.216 -2.098 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.017 4.329 1.994 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.122 3.466 0.919 1.00 0.00 H new ATOM 1002 N ALA A 70 9.950 1.933 -1.859 1.00 0.00 N ATOM 1003 CA ALA A 70 11.387 1.844 -1.640 1.00 0.00 C ATOM 1004 C ALA A 70 12.087 1.162 -2.810 1.00 0.00 C ATOM 1005 O ALA A 70 11.446 0.749 -3.777 1.00 0.00 O ATOM 1006 CB ALA A 70 11.673 1.112 -0.338 1.00 0.00 C ATOM 0 H ALA A 70 9.605 1.386 -2.648 1.00 0.00 H new ATOM 0 HA ALA A 70 11.783 2.857 -1.568 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.750 1.051 -0.184 1.00 0.00 H new ATOM 0 HB2 ALA A 70 11.218 1.653 0.491 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.256 0.106 -0.387 1.00 0.00 H new ATOM 1012 N LYS A 71 13.408 1.049 -2.711 1.00 0.00 N ATOM 1013 CA LYS A 71 14.206 0.415 -3.754 1.00 0.00 C ATOM 1014 C LYS A 71 15.010 -0.752 -3.186 1.00 0.00 C ATOM 1015 O LYS A 71 15.603 -0.644 -2.113 1.00 0.00 O ATOM 1016 CB LYS A 71 15.149 1.438 -4.393 1.00 0.00 C ATOM 1017 CG LYS A 71 16.236 1.936 -3.453 1.00 0.00 C ATOM 1018 CD LYS A 71 16.534 3.410 -3.678 1.00 0.00 C ATOM 1019 CE LYS A 71 15.728 4.291 -2.738 1.00 0.00 C ATOM 1020 NZ LYS A 71 14.287 4.332 -3.114 1.00 0.00 N ATOM 0 H LYS A 71 13.949 1.389 -1.916 1.00 0.00 H new ATOM 0 HA LYS A 71 13.529 0.030 -4.516 1.00 0.00 H new ATOM 0 HB2 LYS A 71 15.616 0.990 -5.270 1.00 0.00 H new ATOM 0 HB3 LYS A 71 14.565 2.289 -4.742 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.925 1.780 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.144 1.353 -3.604 1.00 0.00 H new ATOM 0 HD2 LYS A 71 17.598 3.594 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS A 71 16.307 3.675 -4.711 1.00 0.00 H new ATOM 0 HE2 LYS A 71 15.827 3.919 -1.718 1.00 0.00 H new ATOM 0 HE3 LYS A 71 16.135 5.302 -2.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 13.870 5.229 -2.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 14.196 4.258 -4.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 13.788 3.538 -2.665 1.00 0.00 H new ATOM 1034 N VAL A 72 15.028 -1.866 -3.912 1.00 0.00 N ATOM 1035 CA VAL A 72 15.763 -3.048 -3.475 1.00 0.00 C ATOM 1036 C VAL A 72 17.124 -3.131 -4.158 1.00 0.00 C ATOM 1037 O VAL A 72 17.261 -2.790 -5.333 1.00 0.00 O ATOM 1038 CB VAL A 72 14.979 -4.344 -3.759 1.00 0.00 C ATOM 1039 CG1 VAL A 72 13.683 -4.373 -2.963 1.00 0.00 C ATOM 1040 CG2 VAL A 72 14.702 -4.489 -5.248 1.00 0.00 C ATOM 0 H VAL A 72 14.543 -1.975 -4.803 1.00 0.00 H new ATOM 0 HA VAL A 72 15.902 -2.950 -2.398 1.00 0.00 H new ATOM 0 HB VAL A 72 15.590 -5.190 -3.444 1.00 0.00 H new ATOM 0 HG11 VAL A 72 13.145 -5.296 -3.178 1.00 0.00 H new ATOM 0 HG12 VAL A 72 13.909 -4.324 -1.898 1.00 0.00 H new ATOM 0 HG13 VAL A 72 13.065 -3.519 -3.242 1.00 0.00 H new ATOM 0 HG21 VAL A 72 14.148 -5.410 -5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 72 14.114 -3.639 -5.593 1.00 0.00 H new ATOM 0 HG23 VAL A 72 15.646 -4.522 -5.792 1.00 0.00 H new ATOM 1050 N GLY A 73 18.127 -3.587 -3.415 1.00 0.00 N ATOM 1051 CA GLY A 73 19.464 -3.707 -3.966 1.00 0.00 C ATOM 1052 C GLY A 73 20.428 -2.699 -3.373 1.00 0.00 C ATOM 1053 O GLY A 73 21.615 -2.984 -3.213 1.00 0.00 O ATOM 0 H GLY A 73 18.038 -3.876 -2.441 1.00 0.00 H new ATOM 0 HA2 GLY A 73 19.839 -4.714 -3.785 1.00 0.00 H new ATOM 0 HA3 GLY A 73 19.422 -3.572 -5.047 1.00 0.00 H new ATOM 1562 N MET A 109 -6.789 1.291 -4.660 1.00 0.00 N ATOM 1563 CA MET A 109 -6.458 2.455 -3.854 1.00 0.00 C ATOM 1564 C MET A 109 -4.954 2.693 -3.843 1.00 0.00 C ATOM 1565 O MET A 109 -4.164 1.754 -3.737 1.00 0.00 O ATOM 1566 CB MET A 109 -6.980 2.260 -2.426 1.00 0.00 C ATOM 1567 CG MET A 109 -5.958 2.542 -1.337 1.00 0.00 C ATOM 1568 SD MET A 109 -6.706 2.709 0.294 1.00 0.00 S ATOM 1569 CE MET A 109 -6.836 4.490 0.419 1.00 0.00 C ATOM 0 HA MET A 109 -6.935 3.332 -4.291 1.00 0.00 H new ATOM 0 HB2 MET A 109 -7.841 2.911 -2.276 1.00 0.00 H new ATOM 0 HB3 MET A 109 -7.333 1.234 -2.319 1.00 0.00 H new ATOM 0 HG2 MET A 109 -5.225 1.736 -1.315 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.418 3.457 -1.580 1.00 0.00 H new ATOM 0 HE1 MET A 109 -6.400 4.821 1.362 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.302 4.953 -0.411 1.00 0.00 H new ATOM 0 HE3 MET A 109 -7.886 4.782 0.382 1.00 0.00 H new ATOM 1579 N SER A 110 -4.568 3.955 -3.937 1.00 0.00 N ATOM 1580 CA SER A 110 -3.163 4.325 -3.920 1.00 0.00 C ATOM 1581 C SER A 110 -3.008 5.786 -3.510 1.00 0.00 C ATOM 1582 O SER A 110 -4.000 6.497 -3.337 1.00 0.00 O ATOM 1583 CB SER A 110 -2.526 4.102 -5.291 1.00 0.00 C ATOM 1584 OG SER A 110 -3.511 4.020 -6.306 1.00 0.00 O ATOM 0 H SER A 110 -5.210 4.742 -4.026 1.00 0.00 H new ATOM 0 HA SER A 110 -2.654 3.692 -3.193 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.839 4.918 -5.513 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.937 3.185 -5.277 1.00 0.00 H new ATOM 0 HG SER A 110 -3.076 3.879 -7.173 1.00 0.00 H new ATOM 1590 N VAL A 111 -1.765 6.239 -3.368 1.00 0.00 N ATOM 1591 CA VAL A 111 -1.507 7.624 -2.994 1.00 0.00 C ATOM 1592 C VAL A 111 -0.934 8.409 -4.173 1.00 0.00 C ATOM 1593 O VAL A 111 -0.051 7.931 -4.885 1.00 0.00 O ATOM 1594 CB VAL A 111 -0.561 7.739 -1.771 1.00 0.00 C ATOM 1595 CG1 VAL A 111 -0.879 6.672 -0.728 1.00 0.00 C ATOM 1596 CG2 VAL A 111 0.905 7.668 -2.184 1.00 0.00 C ATOM 0 H VAL A 111 -0.928 5.672 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.467 8.054 -2.710 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.732 8.718 -1.322 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.200 6.777 0.118 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.907 6.793 -0.386 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.758 5.683 -1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.537 7.752 -1.300 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.098 6.716 -2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.130 8.485 -2.869 1.00 0.00 H new ATOM 1606 N LYS A 112 -1.455 9.612 -4.375 1.00 0.00 N ATOM 1607 CA LYS A 112 -1.012 10.468 -5.466 1.00 0.00 C ATOM 1608 C LYS A 112 -0.009 11.506 -4.975 1.00 0.00 C ATOM 1609 O LYS A 112 0.097 11.762 -3.776 1.00 0.00 O ATOM 1610 CB LYS A 112 -2.214 11.169 -6.101 1.00 0.00 C ATOM 1611 CG LYS A 112 -2.108 11.317 -7.610 1.00 0.00 C ATOM 1612 CD LYS A 112 -2.751 12.608 -8.089 1.00 0.00 C ATOM 1613 CE LYS A 112 -2.136 13.085 -9.395 1.00 0.00 C ATOM 1614 NZ LYS A 112 -2.754 14.354 -9.869 1.00 0.00 N ATOM 0 H LYS A 112 -2.188 10.018 -3.794 1.00 0.00 H new ATOM 0 HA LYS A 112 -0.521 9.842 -6.211 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.118 10.609 -5.862 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.325 12.157 -5.655 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -1.059 11.300 -7.906 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -2.589 10.468 -8.095 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -3.822 12.454 -8.224 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -2.634 13.379 -7.327 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -1.064 13.232 -9.259 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -2.259 12.315 -10.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -2.307 14.646 -10.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -3.772 14.208 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -2.615 15.096 -9.154 1.00 0.00 H new ATOM 1628 N GLU A 113 0.719 12.104 -5.911 1.00 0.00 N ATOM 1629 CA GLU A 113 1.708 13.120 -5.575 1.00 0.00 C ATOM 1630 C GLU A 113 1.470 14.388 -6.382 1.00 0.00 C ATOM 1631 O GLU A 113 1.650 14.412 -7.599 1.00 0.00 O ATOM 1632 CB GLU A 113 3.123 12.592 -5.815 1.00 0.00 C ATOM 1633 CG GLU A 113 3.772 12.019 -4.566 1.00 0.00 C ATOM 1634 CD GLU A 113 5.280 11.916 -4.687 1.00 0.00 C ATOM 1635 OE1 GLU A 113 5.873 12.729 -5.427 1.00 0.00 O ATOM 1636 OE2 GLU A 113 5.868 11.023 -4.041 1.00 0.00 O ATOM 0 H GLU A 113 0.643 11.903 -6.908 1.00 0.00 H new ATOM 0 HA GLU A 113 1.604 13.361 -4.517 1.00 0.00 H new ATOM 0 HB2 GLU A 113 3.090 11.821 -6.585 1.00 0.00 H new ATOM 0 HB3 GLU A 113 3.744 13.400 -6.200 1.00 0.00 H new ATOM 0 HG2 GLU A 113 3.522 12.647 -3.711 1.00 0.00 H new ATOM 0 HG3 GLU A 113 3.359 11.030 -4.367 1.00 0.00 H new ATOM 1643 N VAL A 114 1.051 15.435 -5.686 1.00 0.00 N ATOM 1644 CA VAL A 114 0.765 16.718 -6.313 1.00 0.00 C ATOM 1645 C VAL A 114 1.650 17.813 -5.731 1.00 0.00 C ATOM 1646 O VAL A 114 2.504 17.548 -4.888 1.00 0.00 O ATOM 1647 CB VAL A 114 -0.715 17.123 -6.145 1.00 0.00 C ATOM 1648 CG1 VAL A 114 -1.172 18.002 -7.301 1.00 0.00 C ATOM 1649 CG2 VAL A 114 -1.609 15.900 -6.029 1.00 0.00 C ATOM 0 H VAL A 114 0.900 15.420 -4.677 1.00 0.00 H new ATOM 0 HA VAL A 114 0.975 16.602 -7.376 1.00 0.00 H new ATOM 0 HB VAL A 114 -0.797 17.695 -5.221 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.218 18.274 -7.160 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -0.563 18.906 -7.334 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -1.062 17.456 -8.238 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.645 16.217 -5.912 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -1.515 15.294 -6.930 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -1.309 15.311 -5.162 1.00 0.00 H new ATOM 1659 N SER A 115 1.439 19.036 -6.207 1.00 0.00 N ATOM 1660 CA SER A 115 2.196 20.213 -5.778 1.00 0.00 C ATOM 1661 C SER A 115 2.662 20.133 -4.322 1.00 0.00 C ATOM 1662 O SER A 115 2.004 20.649 -3.418 1.00 0.00 O ATOM 1663 CB SER A 115 1.315 21.445 -5.952 1.00 0.00 C ATOM 1664 OG SER A 115 2.065 22.556 -6.410 1.00 0.00 O ATOM 0 H SER A 115 0.730 19.243 -6.910 1.00 0.00 H new ATOM 0 HA SER A 115 3.093 20.268 -6.395 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.516 21.226 -6.661 1.00 0.00 H new ATOM 0 HB3 SER A 115 0.840 21.691 -5.003 1.00 0.00 H new ATOM 0 HG SER A 115 1.473 23.330 -6.514 1.00 0.00 H new ATOM 1670 N GLY A 116 3.813 19.503 -4.110 1.00 0.00 N ATOM 1671 CA GLY A 116 4.365 19.388 -2.772 1.00 0.00 C ATOM 1672 C GLY A 116 3.414 18.715 -1.807 1.00 0.00 C ATOM 1673 O GLY A 116 3.465 18.960 -0.602 1.00 0.00 O ATOM 0 H GLY A 116 4.375 19.069 -4.843 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.295 18.822 -2.814 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.613 20.382 -2.399 1.00 0.00 H new ATOM 1677 N LYS A 117 2.525 17.888 -2.338 1.00 0.00 N ATOM 1678 CA LYS A 117 1.540 17.207 -1.513 1.00 0.00 C ATOM 1679 C LYS A 117 1.430 15.727 -1.859 1.00 0.00 C ATOM 1680 O LYS A 117 2.031 15.249 -2.821 1.00 0.00 O ATOM 1681 CB LYS A 117 0.181 17.874 -1.701 1.00 0.00 C ATOM 1682 CG LYS A 117 0.080 19.255 -1.077 1.00 0.00 C ATOM 1683 CD LYS A 117 -1.145 20.002 -1.582 1.00 0.00 C ATOM 1684 CE LYS A 117 -1.082 20.237 -3.086 1.00 0.00 C ATOM 1685 NZ LYS A 117 -2.386 20.707 -3.633 1.00 0.00 N ATOM 0 H LYS A 117 2.466 17.673 -3.333 1.00 0.00 H new ATOM 0 HA LYS A 117 1.863 17.281 -0.475 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -0.030 17.952 -2.768 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -0.589 17.234 -1.270 1.00 0.00 H new ATOM 0 HG2 LYS A 117 0.031 19.163 0.008 1.00 0.00 H new ATOM 0 HG3 LYS A 117 0.978 19.827 -1.308 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.043 19.434 -1.340 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.225 20.959 -1.067 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -0.310 20.974 -3.306 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -0.791 19.313 -3.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -2.629 20.151 -4.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.128 20.586 -2.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -2.313 21.712 -3.889 1.00 0.00 H new ATOM 1699 N VAL A 118 0.637 15.015 -1.065 1.00 0.00 N ATOM 1700 CA VAL A 118 0.408 13.592 -1.268 1.00 0.00 C ATOM 1701 C VAL A 118 -1.042 13.243 -0.949 1.00 0.00 C ATOM 1702 O VAL A 118 -1.467 13.297 0.206 1.00 0.00 O ATOM 1703 CB VAL A 118 1.346 12.732 -0.399 1.00 0.00 C ATOM 1704 CG1 VAL A 118 2.800 12.997 -0.760 1.00 0.00 C ATOM 1705 CG2 VAL A 118 1.101 12.996 1.077 1.00 0.00 C ATOM 0 H VAL A 118 0.138 15.407 -0.267 1.00 0.00 H new ATOM 0 HA VAL A 118 0.620 13.373 -2.315 1.00 0.00 H new ATOM 0 HB VAL A 118 1.131 11.682 -0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 118 3.448 12.381 -0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 118 2.965 12.751 -1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.030 14.049 -0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.773 12.379 1.673 1.00 0.00 H new ATOM 0 HG22 VAL A 118 1.286 14.048 1.294 1.00 0.00 H new ATOM 0 HG23 VAL A 118 0.068 12.750 1.324 1.00 0.00 H new ATOM 1715 N PHE A 119 -1.800 12.906 -1.982 1.00 0.00 N ATOM 1716 CA PHE A 119 -3.211 12.569 -1.826 1.00 0.00 C ATOM 1717 C PHE A 119 -3.433 11.071 -1.959 1.00 0.00 C ATOM 1718 O PHE A 119 -2.498 10.316 -2.216 1.00 0.00 O ATOM 1719 CB PHE A 119 -4.047 13.332 -2.854 1.00 0.00 C ATOM 1720 CG PHE A 119 -3.783 14.813 -2.844 1.00 0.00 C ATOM 1721 CD1 PHE A 119 -2.559 15.309 -3.257 1.00 0.00 C ATOM 1722 CD2 PHE A 119 -4.752 15.708 -2.415 1.00 0.00 C ATOM 1723 CE1 PHE A 119 -2.303 16.665 -3.246 1.00 0.00 C ATOM 1724 CE2 PHE A 119 -4.501 17.070 -2.401 1.00 0.00 C ATOM 1725 CZ PHE A 119 -3.271 17.549 -2.819 1.00 0.00 C ATOM 0 H PHE A 119 -1.461 12.858 -2.943 1.00 0.00 H new ATOM 0 HA PHE A 119 -3.528 12.864 -0.826 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -3.838 12.938 -3.849 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.104 13.156 -2.657 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -1.793 14.625 -3.593 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -5.713 15.339 -2.088 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -1.342 17.035 -3.573 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -5.263 17.757 -2.065 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.071 18.610 -2.811 1.00 0.00 H new ATOM 1735 N LEU A 120 -4.671 10.642 -1.757 1.00 0.00 N ATOM 1736 CA LEU A 120 -5.001 9.227 -1.835 1.00 0.00 C ATOM 1737 C LEU A 120 -6.366 9.002 -2.476 1.00 0.00 C ATOM 1738 O LEU A 120 -7.121 9.947 -2.713 1.00 0.00 O ATOM 1739 CB LEU A 120 -4.975 8.617 -0.434 1.00 0.00 C ATOM 1740 CG LEU A 120 -3.627 8.040 -0.004 1.00 0.00 C ATOM 1741 CD1 LEU A 120 -2.789 9.104 0.690 1.00 0.00 C ATOM 1742 CD2 LEU A 120 -3.828 6.836 0.905 1.00 0.00 C ATOM 0 H LEU A 120 -5.460 11.251 -1.539 1.00 0.00 H new ATOM 0 HA LEU A 120 -4.256 8.740 -2.464 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -5.271 9.382 0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.724 7.826 -0.385 1.00 0.00 H new ATOM 0 HG LEU A 120 -3.092 7.710 -0.895 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.832 8.676 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -2.616 9.935 0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.317 9.465 1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -2.858 6.438 1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -4.383 7.139 1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.388 6.067 0.372 1.00 0.00 H new ATOM 1754 N GLN A 121 -6.674 7.737 -2.750 1.00 0.00 N ATOM 1755 CA GLN A 121 -7.947 7.368 -3.356 1.00 0.00 C ATOM 1756 C GLN A 121 -8.681 6.358 -2.479 1.00 0.00 C ATOM 1757 O GLN A 121 -8.125 5.858 -1.503 1.00 0.00 O ATOM 1758 CB GLN A 121 -7.725 6.786 -4.753 1.00 0.00 C ATOM 1759 CG GLN A 121 -7.208 7.801 -5.759 1.00 0.00 C ATOM 1760 CD GLN A 121 -6.852 7.172 -7.092 1.00 0.00 C ATOM 1761 OE1 GLN A 121 -5.737 6.686 -7.284 1.00 0.00 O ATOM 1762 NE2 GLN A 121 -7.800 7.180 -8.022 1.00 0.00 N ATOM 0 H GLN A 121 -6.055 6.948 -2.560 1.00 0.00 H new ATOM 0 HA GLN A 121 -8.559 8.266 -3.444 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -7.016 5.960 -4.685 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -8.664 6.371 -5.118 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -7.964 8.570 -5.915 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -6.328 8.297 -5.349 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -8.710 7.594 -7.819 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -7.618 6.772 -8.939 1.00 0.00 H new ATOM 1771 N CYS A 122 -9.931 6.063 -2.823 1.00 0.00 N ATOM 1772 CA CYS A 122 -10.725 5.112 -2.050 1.00 0.00 C ATOM 1773 C CYS A 122 -11.847 4.515 -2.897 1.00 0.00 C ATOM 1774 O CYS A 122 -12.004 4.859 -4.069 1.00 0.00 O ATOM 1775 CB CYS A 122 -11.304 5.804 -0.809 1.00 0.00 C ATOM 1776 SG CYS A 122 -11.662 4.696 0.598 1.00 0.00 S ATOM 0 H CYS A 122 -10.414 6.465 -3.626 1.00 0.00 H new ATOM 0 HA CYS A 122 -10.074 4.297 -1.735 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -10.603 6.570 -0.479 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -12.224 6.315 -1.093 1.00 0.00 H new ATOM 1781 N GLN A 123 -12.622 3.615 -2.297 1.00 0.00 N ATOM 1782 CA GLN A 123 -13.726 2.964 -2.991 1.00 0.00 C ATOM 1783 C GLN A 123 -15.052 3.641 -2.657 1.00 0.00 C ATOM 1784 O GLN A 123 -15.383 3.839 -1.488 1.00 0.00 O ATOM 1785 CB GLN A 123 -13.783 1.482 -2.609 1.00 0.00 C ATOM 1786 CG GLN A 123 -14.233 1.235 -1.177 1.00 0.00 C ATOM 1787 CD GLN A 123 -14.264 -0.239 -0.823 1.00 0.00 C ATOM 1788 OE1 GLN A 123 -15.282 -0.910 -0.996 1.00 0.00 O ATOM 1789 NE2 GLN A 123 -13.146 -0.751 -0.323 1.00 0.00 N ATOM 0 H GLN A 123 -12.504 3.320 -1.328 1.00 0.00 H new ATOM 0 HA GLN A 123 -13.557 3.052 -4.064 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -14.463 0.967 -3.288 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -12.796 1.041 -2.751 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -13.561 1.755 -0.494 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -15.226 1.661 -1.033 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -12.326 -0.158 -0.197 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -13.107 -1.737 -0.065 1.00 0.00 H new ATOM 1919 N TYR A 132 -14.971 9.283 -1.458 1.00 0.00 N ATOM 1920 CA TYR A 132 -13.989 8.394 -0.847 1.00 0.00 C ATOM 1921 C TYR A 132 -14.148 8.374 0.670 1.00 0.00 C ATOM 1922 O TYR A 132 -14.462 9.394 1.284 1.00 0.00 O ATOM 1923 CB TYR A 132 -12.570 8.830 -1.225 1.00 0.00 C ATOM 1924 CG TYR A 132 -12.250 8.692 -2.703 1.00 0.00 C ATOM 1925 CD1 TYR A 132 -13.223 8.312 -3.624 1.00 0.00 C ATOM 1926 CD2 TYR A 132 -10.969 8.947 -3.177 1.00 0.00 C ATOM 1927 CE1 TYR A 132 -12.927 8.191 -4.968 1.00 0.00 C ATOM 1928 CE2 TYR A 132 -10.667 8.830 -4.522 1.00 0.00 C ATOM 1929 CZ TYR A 132 -11.649 8.451 -5.412 1.00 0.00 C ATOM 1930 OH TYR A 132 -11.351 8.333 -6.750 1.00 0.00 O ATOM 0 HA TYR A 132 -14.160 7.385 -1.224 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -12.431 9.870 -0.930 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -11.855 8.238 -0.653 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -14.227 8.108 -3.282 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -10.196 9.242 -2.483 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -13.694 7.894 -5.668 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -9.666 9.035 -4.873 1.00 0.00 H new ATOM 0 HH TYR A 132 -10.407 8.553 -6.896 1.00 0.00 H new ATOM 1940 N LEU A 133 -13.941 7.206 1.267 1.00 0.00 N ATOM 1941 CA LEU A 133 -14.073 7.052 2.711 1.00 0.00 C ATOM 1942 C LEU A 133 -12.709 6.928 3.385 1.00 0.00 C ATOM 1943 O LEU A 133 -11.984 5.958 3.168 1.00 0.00 O ATOM 1944 CB LEU A 133 -14.920 5.821 3.033 1.00 0.00 C ATOM 1945 CG LEU A 133 -16.319 5.815 2.415 1.00 0.00 C ATOM 1946 CD1 LEU A 133 -17.043 7.120 2.711 1.00 0.00 C ATOM 1947 CD2 LEU A 133 -16.238 5.576 0.915 1.00 0.00 C ATOM 0 H LEU A 133 -13.681 6.352 0.774 1.00 0.00 H new ATOM 0 HA LEU A 133 -14.565 7.945 3.098 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -14.386 4.933 2.694 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -15.018 5.740 4.116 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.888 5.000 2.863 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -18.036 7.095 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -17.135 7.249 3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -16.477 7.953 2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.243 5.575 0.492 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -15.650 6.368 0.452 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -15.763 4.613 0.725 1.00 0.00 H new ATOM 1959 N TRP A 134 -12.371 7.910 4.214 1.00 0.00 N ATOM 1960 CA TRP A 134 -11.100 7.902 4.928 1.00 0.00 C ATOM 1961 C TRP A 134 -11.331 7.961 6.436 1.00 0.00 C ATOM 1962 O TRP A 134 -11.765 8.983 6.968 1.00 0.00 O ATOM 1963 CB TRP A 134 -10.224 9.080 4.478 1.00 0.00 C ATOM 1964 CG TRP A 134 -9.280 9.575 5.530 1.00 0.00 C ATOM 1965 CD1 TRP A 134 -8.081 9.027 5.876 1.00 0.00 C ATOM 1966 CD2 TRP A 134 -9.459 10.718 6.371 1.00 0.00 C ATOM 1967 NE1 TRP A 134 -7.502 9.757 6.885 1.00 0.00 N ATOM 1968 CE2 TRP A 134 -8.328 10.803 7.205 1.00 0.00 C ATOM 1969 CE3 TRP A 134 -10.465 11.678 6.499 1.00 0.00 C ATOM 1970 CZ2 TRP A 134 -8.176 11.810 8.153 1.00 0.00 C ATOM 1971 CZ3 TRP A 134 -10.313 12.679 7.440 1.00 0.00 C ATOM 1972 CH2 TRP A 134 -9.175 12.738 8.256 1.00 0.00 C ATOM 0 H TRP A 134 -12.959 8.721 4.408 1.00 0.00 H new ATOM 0 HA TRP A 134 -10.581 6.972 4.693 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -9.650 8.778 3.602 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -10.870 9.902 4.168 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -7.649 8.147 5.423 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -6.604 9.554 7.324 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -11.345 11.639 5.874 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -7.301 11.857 8.784 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -11.084 13.428 7.548 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -9.085 13.533 8.981 1.00 0.00 H new ATOM 1983 N LYS A 135 -11.025 6.865 7.118 1.00 0.00 N ATOM 1984 CA LYS A 135 -11.186 6.795 8.565 1.00 0.00 C ATOM 1985 C LYS A 135 -9.813 6.638 9.214 1.00 0.00 C ATOM 1986 O LYS A 135 -9.126 5.641 9.000 1.00 0.00 O ATOM 1987 CB LYS A 135 -12.106 5.623 8.927 1.00 0.00 C ATOM 1988 CG LYS A 135 -12.844 5.790 10.243 1.00 0.00 C ATOM 1989 CD LYS A 135 -13.806 4.633 10.478 1.00 0.00 C ATOM 1990 CE LYS A 135 -13.764 4.118 11.908 1.00 0.00 C ATOM 1991 NZ LYS A 135 -12.403 4.205 12.508 1.00 0.00 N ATOM 0 H LYS A 135 -10.664 6.011 6.692 1.00 0.00 H new ATOM 0 HA LYS A 135 -11.644 7.712 8.936 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -12.836 5.490 8.129 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -11.512 4.710 8.971 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -12.127 5.844 11.062 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -13.395 6.731 10.239 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -14.820 4.955 10.241 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -13.563 3.819 9.795 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -14.463 4.691 12.517 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -14.100 3.081 11.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -12.294 3.464 13.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -11.687 4.073 11.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -12.277 5.138 12.949 1.00 0.00 H new ATOM 2005 N LYS A 136 -9.406 7.643 9.984 1.00 0.00 N ATOM 2006 CA LYS A 136 -8.098 7.630 10.634 1.00 0.00 C ATOM 2007 C LYS A 136 -8.181 7.123 12.067 1.00 0.00 C ATOM 2008 O LYS A 136 -9.202 7.273 12.736 1.00 0.00 O ATOM 2009 CB LYS A 136 -7.487 9.034 10.612 1.00 0.00 C ATOM 2010 CG LYS A 136 -6.023 9.054 10.205 1.00 0.00 C ATOM 2011 CD LYS A 136 -5.270 10.179 10.895 1.00 0.00 C ATOM 2012 CE LYS A 136 -3.949 10.472 10.202 1.00 0.00 C ATOM 2013 NZ LYS A 136 -4.125 11.376 9.031 1.00 0.00 N ATOM 0 H LYS A 136 -9.962 8.477 10.173 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.460 6.944 10.076 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -8.056 9.658 9.922 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -7.587 9.480 11.602 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -5.561 8.099 10.455 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -5.946 9.172 9.124 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -5.885 11.079 10.903 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -5.085 9.910 11.935 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -3.260 10.928 10.912 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -3.496 9.537 9.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -3.862 10.872 8.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -5.119 11.676 8.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.517 12.212 9.144 1.00 0.00 H new ATOM 2027 N GLY A 137 -7.087 6.527 12.535 1.00 0.00 N ATOM 2028 CA GLY A 137 -7.044 6.004 13.891 1.00 0.00 C ATOM 2029 C GLY A 137 -7.544 6.997 14.928 1.00 0.00 C ATOM 2030 O GLY A 137 -7.987 6.602 16.006 1.00 0.00 O ATOM 0 H GLY A 137 -6.229 6.397 11.999 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.647 5.098 13.944 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -6.020 5.720 14.132 1.00 0.00 H new ATOM 2034 N LYS A 138 -7.471 8.286 14.607 1.00 0.00 N ATOM 2035 CA LYS A 138 -7.918 9.329 15.526 1.00 0.00 C ATOM 2036 C LYS A 138 -9.168 10.035 15.004 1.00 0.00 C ATOM 2037 O LYS A 138 -9.910 10.647 15.772 1.00 0.00 O ATOM 2038 CB LYS A 138 -6.801 10.349 15.750 1.00 0.00 C ATOM 2039 CG LYS A 138 -5.747 9.889 16.744 1.00 0.00 C ATOM 2040 CD LYS A 138 -6.073 10.353 18.155 1.00 0.00 C ATOM 2041 CE LYS A 138 -5.295 11.605 18.524 1.00 0.00 C ATOM 2042 NZ LYS A 138 -4.078 11.288 19.321 1.00 0.00 N ATOM 0 H LYS A 138 -7.107 8.633 13.719 1.00 0.00 H new ATOM 0 HA LYS A 138 -8.169 8.852 16.474 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.320 10.563 14.796 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.239 11.283 16.103 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -5.677 8.801 16.724 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.772 10.277 16.448 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -7.142 10.551 18.236 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -5.841 9.558 18.863 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -5.006 12.134 17.616 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -5.937 12.277 19.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -3.575 12.169 19.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -4.355 10.806 20.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -3.453 10.668 18.768 1.00 0.00 H new ATOM 2056 N GLU A 139 -9.397 9.951 13.697 1.00 0.00 N ATOM 2057 CA GLU A 139 -10.552 10.582 13.078 1.00 0.00 C ATOM 2058 C GLU A 139 -11.429 9.532 12.415 1.00 0.00 C ATOM 2059 O GLU A 139 -10.931 8.642 11.730 1.00 0.00 O ATOM 2060 CB GLU A 139 -10.081 11.619 12.053 1.00 0.00 C ATOM 2061 CG GLU A 139 -11.067 11.894 10.922 1.00 0.00 C ATOM 2062 CD GLU A 139 -11.418 13.364 10.798 1.00 0.00 C ATOM 2063 OE1 GLU A 139 -11.942 13.934 11.778 1.00 0.00 O ATOM 2064 OE2 GLU A 139 -11.169 13.946 9.721 1.00 0.00 O ATOM 0 H GLU A 139 -8.793 9.449 13.046 1.00 0.00 H new ATOM 0 HA GLU A 139 -11.143 11.086 13.843 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.875 12.555 12.572 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.139 11.280 11.621 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.641 11.545 9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -11.978 11.320 11.092 1.00 0.00 H new ATOM 2071 N GLU A 140 -12.736 9.636 12.612 1.00 0.00 N ATOM 2072 CA GLU A 140 -13.645 8.680 12.011 1.00 0.00 C ATOM 2073 C GLU A 140 -13.778 8.929 10.511 1.00 0.00 C ATOM 2074 O GLU A 140 -12.793 9.249 9.847 1.00 0.00 O ATOM 2075 CB GLU A 140 -15.008 8.694 12.699 1.00 0.00 C ATOM 2076 CG GLU A 140 -15.700 7.342 12.628 1.00 0.00 C ATOM 2077 CD GLU A 140 -16.576 7.066 13.834 1.00 0.00 C ATOM 2078 OE1 GLU A 140 -16.099 7.261 14.972 1.00 0.00 O ATOM 2079 OE2 GLU A 140 -17.739 6.653 13.641 1.00 0.00 O ATOM 0 H GLU A 140 -13.182 10.361 13.174 1.00 0.00 H new ATOM 0 HA GLU A 140 -13.223 7.685 12.152 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -14.883 8.982 13.743 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -15.641 9.449 12.233 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -16.309 7.298 11.725 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -14.948 6.558 12.544 1.00 0.00 H new ATOM 2086 N LEU A 141 -14.976 8.745 9.965 1.00 0.00 N ATOM 2087 CA LEU A 141 -15.183 8.911 8.542 1.00 0.00 C ATOM 2088 C LEU A 141 -15.739 10.278 8.181 1.00 0.00 C ATOM 2089 O LEU A 141 -16.658 10.793 8.819 1.00 0.00 O ATOM 2090 CB LEU A 141 -16.127 7.816 8.018 1.00 0.00 C ATOM 2091 CG LEU A 141 -15.570 6.884 6.926 1.00 0.00 C ATOM 2092 CD1 LEU A 141 -14.243 7.385 6.383 1.00 0.00 C ATOM 2093 CD2 LEU A 141 -15.418 5.469 7.462 1.00 0.00 C ATOM 0 H LEU A 141 -15.811 8.482 10.489 1.00 0.00 H new ATOM 0 HA LEU A 141 -14.205 8.826 8.069 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -16.437 7.202 8.863 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -17.024 8.298 7.628 1.00 0.00 H new ATOM 0 HG LEU A 141 -16.285 6.879 6.103 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -13.883 6.701 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -14.378 8.377 5.951 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -13.515 7.438 7.193 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -15.023 4.823 6.678 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -14.732 5.472 8.309 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -16.390 5.096 7.784 1.00 0.00 H new ATOM 2105 N GLY A 142 -15.183 10.827 7.115 1.00 0.00 N ATOM 2106 CA GLY A 142 -15.619 12.104 6.599 1.00 0.00 C ATOM 2107 C GLY A 142 -16.047 11.960 5.156 1.00 0.00 C ATOM 2108 O GLY A 142 -16.708 10.984 4.802 1.00 0.00 O ATOM 0 H GLY A 142 -14.421 10.400 6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -16.448 12.483 7.197 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.811 12.832 6.676 1.00 0.00 H new ATOM 2112 N ASN A 143 -15.661 12.903 4.311 1.00 0.00 N ATOM 2113 CA ASN A 143 -16.012 12.821 2.901 1.00 0.00 C ATOM 2114 C ASN A 143 -15.135 13.741 2.055 1.00 0.00 C ATOM 2115 O ASN A 143 -15.016 14.932 2.340 1.00 0.00 O ATOM 2116 CB ASN A 143 -17.486 13.170 2.696 1.00 0.00 C ATOM 2117 CG ASN A 143 -18.388 11.956 2.802 1.00 0.00 C ATOM 2118 OD1 ASN A 143 -18.497 11.166 1.864 1.00 0.00 O ATOM 2119 ND2 ASN A 143 -19.041 11.802 3.947 1.00 0.00 N ATOM 0 H ASN A 143 -15.113 13.723 4.571 1.00 0.00 H new ATOM 0 HA ASN A 143 -15.840 11.795 2.576 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.788 13.909 3.438 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.615 13.630 1.716 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -19.663 11.004 4.076 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -18.921 12.482 4.698 1.00 0.00 H new ATOM 2126 N MET A 144 -14.530 13.186 1.008 1.00 0.00 N ATOM 2127 CA MET A 144 -13.675 13.967 0.120 1.00 0.00 C ATOM 2128 C MET A 144 -13.410 13.223 -1.186 1.00 0.00 C ATOM 2129 O MET A 144 -13.197 12.011 -1.188 1.00 0.00 O ATOM 2130 CB MET A 144 -12.348 14.298 0.806 1.00 0.00 C ATOM 2131 CG MET A 144 -11.744 13.128 1.564 1.00 0.00 C ATOM 2132 SD MET A 144 -12.214 13.110 3.304 1.00 0.00 S ATOM 2133 CE MET A 144 -12.956 11.486 3.433 1.00 0.00 C ATOM 0 H MET A 144 -14.616 12.202 0.755 1.00 0.00 H new ATOM 0 HA MET A 144 -14.198 14.895 -0.111 1.00 0.00 H new ATOM 0 HB2 MET A 144 -11.636 14.639 0.055 1.00 0.00 H new ATOM 0 HB3 MET A 144 -12.503 15.126 1.497 1.00 0.00 H new ATOM 0 HG2 MET A 144 -12.060 12.195 1.097 1.00 0.00 H new ATOM 0 HG3 MET A 144 -10.658 13.171 1.486 1.00 0.00 H new ATOM 0 HE1 MET A 144 -13.299 11.323 4.455 1.00 0.00 H new ATOM 0 HE2 MET A 144 -13.803 11.418 2.751 1.00 0.00 H new ATOM 0 HE3 MET A 144 -12.218 10.727 3.172 1.00 0.00 H new ATOM 2143 N ARG A 145 -13.412 13.960 -2.293 1.00 0.00 N ATOM 2144 CA ARG A 145 -13.157 13.368 -3.602 1.00 0.00 C ATOM 2145 C ARG A 145 -11.700 12.932 -3.703 1.00 0.00 C ATOM 2146 O ARG A 145 -11.399 11.822 -4.141 1.00 0.00 O ATOM 2147 CB ARG A 145 -13.485 14.367 -4.713 1.00 0.00 C ATOM 2148 CG ARG A 145 -14.867 14.988 -4.584 1.00 0.00 C ATOM 2149 CD ARG A 145 -15.022 16.202 -5.488 1.00 0.00 C ATOM 2150 NE ARG A 145 -15.980 15.963 -6.566 1.00 0.00 N ATOM 2151 CZ ARG A 145 -17.300 16.012 -6.408 1.00 0.00 C ATOM 2152 NH1 ARG A 145 -17.824 16.292 -5.221 1.00 0.00 N ATOM 2153 NH2 ARG A 145 -18.100 15.782 -7.441 1.00 0.00 N ATOM 0 H ARG A 145 -13.587 14.965 -2.310 1.00 0.00 H new ATOM 0 HA ARG A 145 -13.798 12.494 -3.720 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -12.737 15.160 -4.709 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -13.411 13.863 -5.677 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -15.625 14.246 -4.837 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -15.040 15.280 -3.548 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -15.349 17.056 -4.895 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -14.053 16.462 -5.915 1.00 0.00 H new ATOM 0 HE ARG A 145 -15.615 15.746 -7.493 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -17.214 16.471 -4.424 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -18.837 16.328 -5.106 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -17.703 15.568 -8.356 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -19.112 15.819 -7.320 1.00 0.00 H new ATOM 2167 N GLN A 146 -10.804 13.814 -3.275 1.00 0.00 N ATOM 2168 CA GLN A 146 -9.375 13.531 -3.289 1.00 0.00 C ATOM 2169 C GLN A 146 -8.851 13.477 -1.860 1.00 0.00 C ATOM 2170 O GLN A 146 -8.798 14.497 -1.172 1.00 0.00 O ATOM 2171 CB GLN A 146 -8.624 14.600 -4.087 1.00 0.00 C ATOM 2172 CG GLN A 146 -8.792 14.466 -5.591 1.00 0.00 C ATOM 2173 CD GLN A 146 -9.687 15.541 -6.177 1.00 0.00 C ATOM 2174 OE1 GLN A 146 -9.217 16.609 -6.570 1.00 0.00 O ATOM 2175 NE2 GLN A 146 -10.984 15.265 -6.236 1.00 0.00 N ATOM 0 H GLN A 146 -11.045 14.736 -2.912 1.00 0.00 H new ATOM 0 HA GLN A 146 -9.210 12.566 -3.769 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -8.973 15.585 -3.777 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -7.563 14.546 -3.842 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -7.813 14.514 -6.068 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -9.210 13.486 -5.820 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -11.330 14.367 -5.899 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -11.635 15.951 -6.619 1.00 0.00 H new ATOM 2184 N LEU A 147 -8.489 12.283 -1.408 1.00 0.00 N ATOM 2185 CA LEU A 147 -8.000 12.110 -0.047 1.00 0.00 C ATOM 2186 C LEU A 147 -6.726 12.909 0.204 1.00 0.00 C ATOM 2187 O LEU A 147 -5.662 12.587 -0.324 1.00 0.00 O ATOM 2188 CB LEU A 147 -7.744 10.629 0.252 1.00 0.00 C ATOM 2189 CG LEU A 147 -8.745 9.959 1.199 1.00 0.00 C ATOM 2190 CD1 LEU A 147 -8.238 8.585 1.606 1.00 0.00 C ATOM 2191 CD2 LEU A 147 -8.993 10.816 2.433 1.00 0.00 C ATOM 0 H LEU A 147 -8.524 11.426 -1.960 1.00 0.00 H new ATOM 0 HA LEU A 147 -8.775 12.486 0.621 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.742 10.082 -0.691 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -6.746 10.531 0.679 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.692 9.849 0.670 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.956 8.117 2.279 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.115 7.965 0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -7.279 8.687 2.113 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -9.707 10.315 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.055 10.965 2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -9.395 11.783 2.130 1.00 0.00 H new ATOM 2203 N ASP A 148 -6.841 13.941 1.033 1.00 0.00 N ATOM 2204 CA ASP A 148 -5.699 14.775 1.381 1.00 0.00 C ATOM 2205 C ASP A 148 -5.618 14.956 2.894 1.00 0.00 C ATOM 2206 O ASP A 148 -6.228 15.868 3.452 1.00 0.00 O ATOM 2207 CB ASP A 148 -5.807 16.139 0.697 1.00 0.00 C ATOM 2208 CG ASP A 148 -4.466 16.838 0.585 1.00 0.00 C ATOM 2209 OD1 ASP A 148 -3.430 16.142 0.624 1.00 0.00 O ATOM 2210 OD2 ASP A 148 -4.452 18.080 0.459 1.00 0.00 O ATOM 0 H ASP A 148 -7.716 14.219 1.477 1.00 0.00 H new ATOM 0 HA ASP A 148 -4.792 14.280 1.035 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -6.231 16.010 -0.299 1.00 0.00 H new ATOM 0 HB3 ASP A 148 -6.497 16.770 1.258 1.00 0.00 H new ATOM 2215 N LEU A 149 -4.860 14.083 3.553 1.00 0.00 N ATOM 2216 CA LEU A 149 -4.702 14.152 5.005 1.00 0.00 C ATOM 2217 C LEU A 149 -3.225 14.243 5.375 1.00 0.00 C ATOM 2218 O LEU A 149 -2.811 13.784 6.440 1.00 0.00 O ATOM 2219 CB LEU A 149 -5.345 12.937 5.706 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.128 11.969 4.807 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -7.187 12.712 4.009 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -5.176 11.212 3.891 1.00 0.00 C ATOM 0 H LEU A 149 -4.347 13.322 3.108 1.00 0.00 H new ATOM 0 HA LEU A 149 -5.216 15.050 5.348 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -4.557 12.376 6.209 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -6.018 13.305 6.480 1.00 0.00 H new ATOM 0 HG LEU A 149 -6.640 11.243 5.439 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -7.729 12.007 3.379 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -7.883 13.198 4.692 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -6.709 13.465 3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -5.745 10.529 3.259 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -4.634 11.920 3.264 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -4.467 10.644 4.493 1.00 0.00 H new ATOM 2234 N GLY A 150 -2.436 14.838 4.487 1.00 0.00 N ATOM 2235 CA GLY A 150 -1.014 14.981 4.734 1.00 0.00 C ATOM 2236 C GLY A 150 -0.297 15.685 3.600 1.00 0.00 C ATOM 2237 O GLY A 150 -0.865 15.888 2.527 1.00 0.00 O ATOM 0 H GLY A 150 -2.757 15.224 3.599 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -0.863 15.540 5.658 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -0.573 13.995 4.882 1.00 0.00 H new ATOM 2241 N ALA A 151 0.953 16.060 3.841 1.00 0.00 N ATOM 2242 CA ALA A 151 1.755 16.748 2.837 1.00 0.00 C ATOM 2243 C ALA A 151 2.961 15.911 2.433 1.00 0.00 C ATOM 2244 O ALA A 151 3.285 14.922 3.087 1.00 0.00 O ATOM 2245 CB ALA A 151 2.210 18.095 3.368 1.00 0.00 C ATOM 0 H ALA A 151 1.435 15.899 4.726 1.00 0.00 H new ATOM 0 HA ALA A 151 1.136 16.901 1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 151 2.808 18.601 2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 151 1.339 18.704 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 151 2.810 17.948 4.266 1.00 0.00 H new ATOM 2251 N ILE A 152 3.630 16.318 1.361 1.00 0.00 N ATOM 2252 CA ILE A 152 4.806 15.602 0.891 1.00 0.00 C ATOM 2253 C ILE A 152 5.960 15.772 1.875 1.00 0.00 C ATOM 2254 O ILE A 152 6.631 14.806 2.237 1.00 0.00 O ATOM 2255 CB ILE A 152 5.237 16.074 -0.515 1.00 0.00 C ATOM 2256 CG1 ILE A 152 6.091 15.001 -1.186 1.00 0.00 C ATOM 2257 CG2 ILE A 152 5.991 17.396 -0.449 1.00 0.00 C ATOM 2258 CD1 ILE A 152 5.989 15.008 -2.693 1.00 0.00 C ATOM 0 H ILE A 152 3.379 17.135 0.805 1.00 0.00 H new ATOM 0 HA ILE A 152 4.543 14.546 0.824 1.00 0.00 H new ATOM 0 HB ILE A 152 4.339 16.237 -1.111 1.00 0.00 H new ATOM 0 HG12 ILE A 152 7.133 15.144 -0.899 1.00 0.00 H new ATOM 0 HG13 ILE A 152 5.790 14.022 -0.813 1.00 0.00 H new ATOM 0 HG21 ILE A 152 6.280 17.700 -1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 152 5.349 18.159 -0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 152 6.884 17.275 0.164 1.00 0.00 H new ATOM 0 HD11 ILE A 152 6.621 14.221 -3.104 1.00 0.00 H new ATOM 0 HD12 ILE A 152 4.954 14.834 -2.988 1.00 0.00 H new ATOM 0 HD13 ILE A 152 6.318 15.974 -3.075 1.00 0.00 H new ATOM 2270 N TYR A 153 6.166 17.008 2.318 1.00 0.00 N ATOM 2271 CA TYR A 153 7.216 17.313 3.278 1.00 0.00 C ATOM 2272 C TYR A 153 6.675 17.147 4.692 1.00 0.00 C ATOM 2273 O TYR A 153 7.369 16.669 5.589 1.00 0.00 O ATOM 2274 CB TYR A 153 7.736 18.736 3.066 1.00 0.00 C ATOM 2275 CG TYR A 153 6.710 19.808 3.362 1.00 0.00 C ATOM 2276 CD1 TYR A 153 5.832 20.246 2.378 1.00 0.00 C ATOM 2277 CD2 TYR A 153 6.621 20.382 4.624 1.00 0.00 C ATOM 2278 CE1 TYR A 153 4.894 21.226 2.644 1.00 0.00 C ATOM 2279 CE2 TYR A 153 5.685 21.361 4.898 1.00 0.00 C ATOM 2280 CZ TYR A 153 4.825 21.780 3.905 1.00 0.00 C ATOM 2281 OH TYR A 153 3.892 22.755 4.174 1.00 0.00 O ATOM 0 H TYR A 153 5.617 17.816 2.025 1.00 0.00 H new ATOM 0 HA TYR A 153 8.047 16.623 3.131 1.00 0.00 H new ATOM 0 HB2 TYR A 153 8.607 18.894 3.702 1.00 0.00 H new ATOM 0 HB3 TYR A 153 8.071 18.841 2.034 1.00 0.00 H new ATOM 0 HD1 TYR A 153 5.883 19.814 1.390 1.00 0.00 H new ATOM 0 HD2 TYR A 153 7.294 20.058 5.404 1.00 0.00 H new ATOM 0 HE1 TYR A 153 4.219 21.556 1.868 1.00 0.00 H new ATOM 0 HE2 TYR A 153 5.627 21.796 5.885 1.00 0.00 H new ATOM 0 HH TYR A 153 3.975 23.038 5.108 1.00 0.00 H new ATOM 2291 N ASP A 154 5.413 17.526 4.867 1.00 0.00 N ATOM 2292 CA ASP A 154 4.740 17.403 6.153 1.00 0.00 C ATOM 2293 C ASP A 154 3.849 16.167 6.144 1.00 0.00 C ATOM 2294 O ASP A 154 2.632 16.258 6.310 1.00 0.00 O ATOM 2295 CB ASP A 154 3.910 18.655 6.446 1.00 0.00 C ATOM 2296 CG ASP A 154 3.832 18.963 7.928 1.00 0.00 C ATOM 2297 OD1 ASP A 154 4.721 19.682 8.433 1.00 0.00 O ATOM 2298 OD2 ASP A 154 2.883 18.487 8.585 1.00 0.00 O ATOM 0 H ASP A 154 4.833 17.923 4.128 1.00 0.00 H new ATOM 0 HA ASP A 154 5.489 17.300 6.938 1.00 0.00 H new ATOM 0 HB2 ASP A 154 4.345 19.507 5.923 1.00 0.00 H new ATOM 0 HB3 ASP A 154 2.903 18.520 6.052 1.00 0.00 H new ATOM 2303 N ASP A 155 4.477 15.014 5.923 1.00 0.00 N ATOM 2304 CA ASP A 155 3.780 13.729 5.858 1.00 0.00 C ATOM 2305 C ASP A 155 2.631 13.636 6.861 1.00 0.00 C ATOM 2306 O ASP A 155 2.602 14.355 7.859 1.00 0.00 O ATOM 2307 CB ASP A 155 4.775 12.595 6.098 1.00 0.00 C ATOM 2308 CG ASP A 155 5.578 12.789 7.370 1.00 0.00 C ATOM 2309 OD1 ASP A 155 6.198 13.863 7.522 1.00 0.00 O ATOM 2310 OD2 ASP A 155 5.587 11.868 8.213 1.00 0.00 O ATOM 0 H ASP A 155 5.485 14.943 5.784 1.00 0.00 H new ATOM 0 HA ASP A 155 3.344 13.642 4.863 1.00 0.00 H new ATOM 0 HB2 ASP A 155 4.237 11.649 6.152 1.00 0.00 H new ATOM 0 HB3 ASP A 155 5.455 12.527 5.249 1.00 0.00 H new ATOM 2315 N PRO A 156 1.669 12.731 6.603 1.00 0.00 N ATOM 2316 CA PRO A 156 0.510 12.525 7.478 1.00 0.00 C ATOM 2317 C PRO A 156 0.924 12.296 8.927 1.00 0.00 C ATOM 2318 O PRO A 156 2.093 12.035 9.213 1.00 0.00 O ATOM 2319 CB PRO A 156 -0.169 11.273 6.894 1.00 0.00 C ATOM 2320 CG PRO A 156 0.849 10.670 5.984 1.00 0.00 C ATOM 2321 CD PRO A 156 1.633 11.826 5.448 1.00 0.00 C ATOM 0 HA PRO A 156 -0.146 13.395 7.505 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -0.456 10.576 7.682 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -1.078 11.534 6.352 1.00 0.00 H new ATOM 0 HG2 PRO A 156 1.493 9.973 6.521 1.00 0.00 H new ATOM 0 HG3 PRO A 156 0.374 10.110 5.179 1.00 0.00 H new ATOM 0 HD2 PRO A 156 2.633 11.529 5.131 1.00 0.00 H new ATOM 0 HD3 PRO A 156 1.148 12.284 4.586 1.00 0.00 H new ATOM 2329 N ARG A 157 -0.034 12.409 9.839 1.00 0.00 N ATOM 2330 CA ARG A 157 0.245 12.228 11.259 1.00 0.00 C ATOM 2331 C ARG A 157 -0.336 10.919 11.784 1.00 0.00 C ATOM 2332 O ARG A 157 -0.694 10.823 12.959 1.00 0.00 O ATOM 2333 CB ARG A 157 -0.317 13.403 12.060 1.00 0.00 C ATOM 2334 CG ARG A 157 0.091 14.762 11.516 1.00 0.00 C ATOM 2335 CD ARG A 157 0.158 15.806 12.618 1.00 0.00 C ATOM 2336 NE ARG A 157 -0.138 17.148 12.120 1.00 0.00 N ATOM 2337 CZ ARG A 157 -1.369 17.597 11.885 1.00 0.00 C ATOM 2338 NH1 ARG A 157 -2.420 16.816 12.100 1.00 0.00 N ATOM 2339 NH2 ARG A 157 -1.549 18.830 11.432 1.00 0.00 N ATOM 0 H ARG A 157 -1.007 12.624 9.622 1.00 0.00 H new ATOM 0 HA ARG A 157 1.327 12.188 11.381 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -1.405 13.337 12.071 1.00 0.00 H new ATOM 0 HB3 ARG A 157 0.017 13.320 13.094 1.00 0.00 H new ATOM 0 HG2 ARG A 157 1.063 14.683 11.029 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -0.622 15.080 10.755 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -0.550 15.547 13.406 1.00 0.00 H new ATOM 0 HD3 ARG A 157 1.152 15.797 13.066 1.00 0.00 H new ATOM 0 HE ARG A 157 0.645 17.777 11.942 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -2.287 15.866 12.447 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -3.361 17.166 11.918 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -0.744 19.434 11.264 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -2.492 19.175 11.252 1.00 0.00 H new ATOM 2353 N GLY A 158 -0.424 9.910 10.921 1.00 0.00 N ATOM 2354 CA GLY A 158 -0.959 8.631 11.352 1.00 0.00 C ATOM 2355 C GLY A 158 -1.450 7.771 10.205 1.00 0.00 C ATOM 2356 O GLY A 158 -1.365 8.162 9.041 1.00 0.00 O ATOM 0 H GLY A 158 -0.138 9.954 9.943 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -0.189 8.089 11.900 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -1.782 8.804 12.046 1.00 0.00 H new ATOM 2360 N THR A 159 -1.964 6.592 10.542 1.00 0.00 N ATOM 2361 CA THR A 159 -2.476 5.660 9.545 1.00 0.00 C ATOM 2362 C THR A 159 -3.987 5.802 9.396 1.00 0.00 C ATOM 2363 O THR A 159 -4.699 6.066 10.372 1.00 0.00 O ATOM 2364 CB THR A 159 -2.123 4.224 9.937 1.00 0.00 C ATOM 2365 OG1 THR A 159 -0.721 4.070 10.067 1.00 0.00 O ATOM 2366 CG2 THR A 159 -2.607 3.192 8.941 1.00 0.00 C ATOM 0 H THR A 159 -2.037 6.259 11.503 1.00 0.00 H new ATOM 0 HA THR A 159 -2.011 5.894 8.587 1.00 0.00 H new ATOM 0 HB THR A 159 -2.630 4.053 10.887 1.00 0.00 H new ATOM 0 HG1 THR A 159 -0.515 3.146 10.319 1.00 0.00 H new ATOM 0 HG21 THR A 159 -2.323 2.196 9.281 1.00 0.00 H new ATOM 0 HG22 THR A 159 -3.692 3.250 8.855 1.00 0.00 H new ATOM 0 HG23 THR A 159 -2.155 3.386 7.968 1.00 0.00 H new ATOM 2374 N TYR A 160 -4.477 5.620 8.172 1.00 0.00 N ATOM 2375 CA TYR A 160 -5.905 5.726 7.908 1.00 0.00 C ATOM 2376 C TYR A 160 -6.463 4.425 7.352 1.00 0.00 C ATOM 2377 O TYR A 160 -5.718 3.515 6.997 1.00 0.00 O ATOM 2378 CB TYR A 160 -6.226 6.877 6.947 1.00 0.00 C ATOM 2379 CG TYR A 160 -5.026 7.659 6.462 1.00 0.00 C ATOM 2380 CD1 TYR A 160 -4.180 8.302 7.355 1.00 0.00 C ATOM 2381 CD2 TYR A 160 -4.752 7.763 5.105 1.00 0.00 C ATOM 2382 CE1 TYR A 160 -3.092 9.028 6.909 1.00 0.00 C ATOM 2383 CE2 TYR A 160 -3.666 8.484 4.651 1.00 0.00 C ATOM 2384 CZ TYR A 160 -2.840 9.115 5.556 1.00 0.00 C ATOM 2385 OH TYR A 160 -1.761 9.837 5.107 1.00 0.00 O ATOM 0 H TYR A 160 -3.909 5.400 7.354 1.00 0.00 H new ATOM 0 HA TYR A 160 -6.382 5.936 8.865 1.00 0.00 H new ATOM 0 HB2 TYR A 160 -6.751 6.472 6.082 1.00 0.00 H new ATOM 0 HB3 TYR A 160 -6.912 7.564 7.443 1.00 0.00 H new ATOM 0 HD1 TYR A 160 -4.375 8.234 8.415 1.00 0.00 H new ATOM 0 HD2 TYR A 160 -5.399 7.272 4.393 1.00 0.00 H new ATOM 0 HE1 TYR A 160 -2.443 9.524 7.616 1.00 0.00 H new ATOM 0 HE2 TYR A 160 -3.465 8.553 3.592 1.00 0.00 H new ATOM 0 HH TYR A 160 -2.050 10.452 4.401 1.00 0.00 H new ATOM 2395 N THR A 161 -7.784 4.356 7.288 1.00 0.00 N ATOM 2396 CA THR A 161 -8.477 3.181 6.782 1.00 0.00 C ATOM 2397 C THR A 161 -9.408 3.576 5.639 1.00 0.00 C ATOM 2398 O THR A 161 -10.095 4.595 5.714 1.00 0.00 O ATOM 2399 CB THR A 161 -9.263 2.526 7.919 1.00 0.00 C ATOM 2400 OG1 THR A 161 -8.437 2.344 9.055 1.00 0.00 O ATOM 2401 CG2 THR A 161 -9.844 1.178 7.559 1.00 0.00 C ATOM 0 H THR A 161 -8.404 5.110 7.584 1.00 0.00 H new ATOM 0 HA THR A 161 -7.750 2.465 6.398 1.00 0.00 H new ATOM 0 HB THR A 161 -10.086 3.210 8.126 1.00 0.00 H new ATOM 0 HG1 THR A 161 -8.956 1.926 9.773 1.00 0.00 H new ATOM 0 HG21 THR A 161 -10.387 0.776 8.414 1.00 0.00 H new ATOM 0 HG22 THR A 161 -10.526 1.289 6.716 1.00 0.00 H new ATOM 0 HG23 THR A 161 -9.039 0.496 7.287 1.00 0.00 H new ATOM 2409 N CYS A 162 -9.417 2.781 4.574 1.00 0.00 N ATOM 2410 CA CYS A 162 -10.258 3.073 3.417 1.00 0.00 C ATOM 2411 C CYS A 162 -11.094 1.856 3.022 1.00 0.00 C ATOM 2412 O CYS A 162 -10.571 0.757 2.837 1.00 0.00 O ATOM 2413 CB CYS A 162 -9.385 3.543 2.247 1.00 0.00 C ATOM 2414 SG CYS A 162 -10.138 3.355 0.595 1.00 0.00 S ATOM 0 H CYS A 162 -8.855 1.934 4.487 1.00 0.00 H new ATOM 0 HA CYS A 162 -10.951 3.872 3.682 1.00 0.00 H new ATOM 0 HB2 CYS A 162 -9.136 4.593 2.398 1.00 0.00 H new ATOM 0 HB3 CYS A 162 -8.447 2.987 2.267 1.00 0.00 H new ATOM 2419 N GLN A 163 -12.398 2.075 2.896 1.00 0.00 N ATOM 2420 CA GLN A 163 -13.336 1.021 2.525 1.00 0.00 C ATOM 2421 C GLN A 163 -14.713 1.619 2.250 1.00 0.00 C ATOM 2422 O GLN A 163 -14.966 2.780 2.572 1.00 0.00 O ATOM 2423 CB GLN A 163 -13.427 -0.036 3.628 1.00 0.00 C ATOM 2424 CG GLN A 163 -13.571 -1.454 3.100 1.00 0.00 C ATOM 2425 CD GLN A 163 -12.250 -2.196 3.052 1.00 0.00 C ATOM 2426 OE1 GLN A 163 -11.447 -1.998 2.140 1.00 0.00 O ATOM 2427 NE2 GLN A 163 -12.018 -3.056 4.036 1.00 0.00 N ATOM 0 H GLN A 163 -12.834 2.985 3.047 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.972 0.538 1.618 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.534 0.022 4.250 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -14.278 0.192 4.269 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -14.269 -2.004 3.731 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -14.002 -1.423 2.100 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -12.712 -3.189 4.772 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -11.146 -3.584 4.056 1.00 0.00 H new ATOM 2436 N ARG A 164 -15.599 0.831 1.654 1.00 0.00 N ATOM 2437 CA ARG A 164 -16.945 1.300 1.339 1.00 0.00 C ATOM 2438 C ARG A 164 -17.882 1.208 2.549 1.00 0.00 C ATOM 2439 O ARG A 164 -19.047 0.835 2.407 1.00 0.00 O ATOM 2440 CB ARG A 164 -17.525 0.497 0.173 1.00 0.00 C ATOM 2441 CG ARG A 164 -17.652 -0.990 0.462 1.00 0.00 C ATOM 2442 CD ARG A 164 -18.189 -1.748 -0.741 1.00 0.00 C ATOM 2443 NE ARG A 164 -18.336 -3.175 -0.469 1.00 0.00 N ATOM 2444 CZ ARG A 164 -19.355 -3.700 0.208 1.00 0.00 C ATOM 2445 NH1 ARG A 164 -20.317 -2.920 0.684 1.00 0.00 N ATOM 2446 NH2 ARG A 164 -19.412 -5.009 0.410 1.00 0.00 N ATOM 0 H ARG A 164 -15.412 -0.133 1.379 1.00 0.00 H new ATOM 0 HA ARG A 164 -16.866 2.350 1.058 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -18.508 0.895 -0.078 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -16.892 0.636 -0.703 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -16.678 -1.392 0.741 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -18.315 -1.141 1.314 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -19.155 -1.333 -1.029 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -17.516 -1.608 -1.587 1.00 0.00 H new ATOM 0 HE ARG A 164 -17.615 -3.807 -0.818 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -20.278 -1.912 0.532 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -21.095 -3.328 1.202 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -18.675 -5.614 0.047 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -20.193 -5.411 0.929 1.00 0.00 H new ATOM 2460 N ASP A 165 -17.379 1.553 3.734 1.00 0.00 N ATOM 2461 CA ASP A 165 -18.192 1.508 4.947 1.00 0.00 C ATOM 2462 C ASP A 165 -17.949 2.744 5.811 1.00 0.00 C ATOM 2463 O ASP A 165 -16.942 3.432 5.650 1.00 0.00 O ATOM 2464 CB ASP A 165 -17.882 0.244 5.752 1.00 0.00 C ATOM 2465 CG ASP A 165 -17.794 -0.993 4.879 1.00 0.00 C ATOM 2466 OD1 ASP A 165 -16.731 -1.208 4.259 1.00 0.00 O ATOM 2467 OD2 ASP A 165 -18.788 -1.746 4.814 1.00 0.00 O ATOM 0 H ASP A 165 -16.419 1.865 3.879 1.00 0.00 H new ATOM 0 HA ASP A 165 -19.240 1.492 4.649 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -16.940 0.378 6.284 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -18.656 0.098 6.506 1.00 0.00 H new ATOM 2472 N GLU A 166 -18.874 3.015 6.731 1.00 0.00 N ATOM 2473 CA GLU A 166 -18.754 4.166 7.626 1.00 0.00 C ATOM 2474 C GLU A 166 -17.720 3.904 8.723 1.00 0.00 C ATOM 2475 O GLU A 166 -17.362 4.803 9.483 1.00 0.00 O ATOM 2476 CB GLU A 166 -20.110 4.491 8.256 1.00 0.00 C ATOM 2477 CG GLU A 166 -20.355 5.981 8.435 1.00 0.00 C ATOM 2478 CD GLU A 166 -21.786 6.377 8.125 1.00 0.00 C ATOM 2479 OE1 GLU A 166 -22.707 5.809 8.748 1.00 0.00 O ATOM 2480 OE2 GLU A 166 -21.984 7.255 7.260 1.00 0.00 O ATOM 0 H GLU A 166 -19.714 2.454 6.876 1.00 0.00 H new ATOM 0 HA GLU A 166 -18.420 5.019 7.035 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -20.901 4.073 7.633 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -20.177 4.001 9.227 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -20.117 6.264 9.460 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -19.679 6.537 7.786 1.00 0.00 H new ATOM 2487 N ASN A 167 -17.241 2.667 8.785 1.00 0.00 N ATOM 2488 CA ASN A 167 -16.242 2.261 9.767 1.00 0.00 C ATOM 2489 C ASN A 167 -15.220 1.359 9.101 1.00 0.00 C ATOM 2490 O ASN A 167 -14.835 0.323 9.642 1.00 0.00 O ATOM 2491 CB ASN A 167 -16.888 1.541 10.945 1.00 0.00 C ATOM 2492 CG ASN A 167 -18.014 0.617 10.522 1.00 0.00 C ATOM 2493 OD1 ASN A 167 -17.838 -0.599 10.441 1.00 0.00 O ATOM 2494 ND2 ASN A 167 -19.180 1.191 10.250 1.00 0.00 N ATOM 0 H ASN A 167 -17.533 1.918 8.157 1.00 0.00 H new ATOM 0 HA ASN A 167 -15.749 3.154 10.151 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -16.129 0.964 11.473 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -17.274 2.279 11.649 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -19.974 0.620 9.961 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -19.281 2.203 10.330 1.00 0.00 H new ATOM 2501 N VAL A 168 -14.815 1.779 7.908 1.00 0.00 N ATOM 2502 CA VAL A 168 -13.843 1.070 7.073 1.00 0.00 C ATOM 2503 C VAL A 168 -12.970 0.099 7.864 1.00 0.00 C ATOM 2504 O VAL A 168 -12.653 0.331 9.031 1.00 0.00 O ATOM 2505 CB VAL A 168 -12.938 2.085 6.372 1.00 0.00 C ATOM 2506 CG1 VAL A 168 -13.718 2.826 5.304 1.00 0.00 C ATOM 2507 CG2 VAL A 168 -12.372 3.056 7.391 1.00 0.00 C ATOM 0 H VAL A 168 -15.158 2.640 7.482 1.00 0.00 H new ATOM 0 HA VAL A 168 -14.414 0.485 6.352 1.00 0.00 H new ATOM 0 HB VAL A 168 -12.112 1.560 5.892 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -13.065 3.546 4.811 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -14.095 2.115 4.569 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -14.556 3.351 5.763 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -11.728 3.777 6.888 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -13.189 3.582 7.885 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -11.792 2.508 8.133 1.00 0.00 H new ATOM 2517 N ASN A 169 -12.597 -0.997 7.216 1.00 0.00 N ATOM 2518 CA ASN A 169 -11.784 -2.022 7.852 1.00 0.00 C ATOM 2519 C ASN A 169 -10.356 -2.056 7.306 1.00 0.00 C ATOM 2520 O ASN A 169 -9.415 -2.359 8.041 1.00 0.00 O ATOM 2521 CB ASN A 169 -12.451 -3.378 7.650 1.00 0.00 C ATOM 2522 CG ASN A 169 -12.013 -4.403 8.678 1.00 0.00 C ATOM 2523 OD1 ASN A 169 -11.046 -5.135 8.470 1.00 0.00 O ATOM 2524 ND2 ASN A 169 -12.725 -4.458 9.798 1.00 0.00 N ATOM 0 H ASN A 169 -12.846 -1.198 6.248 1.00 0.00 H new ATOM 0 HA ASN A 169 -11.712 -1.785 8.913 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -13.533 -3.258 7.701 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -12.218 -3.748 6.652 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -12.477 -5.126 10.528 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -13.519 -3.832 9.929 1.00 0.00 H new ATOM 2531 N SER A 170 -10.193 -1.756 6.021 1.00 0.00 N ATOM 2532 CA SER A 170 -8.870 -1.771 5.403 1.00 0.00 C ATOM 2533 C SER A 170 -8.027 -0.597 5.893 1.00 0.00 C ATOM 2534 O SER A 170 -8.229 0.541 5.473 1.00 0.00 O ATOM 2535 CB SER A 170 -8.996 -1.723 3.879 1.00 0.00 C ATOM 2536 OG SER A 170 -8.978 -3.026 3.324 1.00 0.00 O ATOM 0 H SER A 170 -10.954 -1.501 5.391 1.00 0.00 H new ATOM 0 HA SER A 170 -8.372 -2.697 5.691 1.00 0.00 H new ATOM 0 HB2 SER A 170 -9.923 -1.220 3.603 1.00 0.00 H new ATOM 0 HB3 SER A 170 -8.178 -1.135 3.462 1.00 0.00 H new ATOM 0 HG SER A 170 -9.739 -3.133 2.715 1.00 0.00 H new ATOM 2542 N THR A 171 -7.082 -0.884 6.783 1.00 0.00 N ATOM 2543 CA THR A 171 -6.209 0.148 7.334 1.00 0.00 C ATOM 2544 C THR A 171 -4.986 0.359 6.449 1.00 0.00 C ATOM 2545 O THR A 171 -4.107 -0.497 6.377 1.00 0.00 O ATOM 2546 CB THR A 171 -5.768 -0.229 8.749 1.00 0.00 C ATOM 2547 OG1 THR A 171 -6.830 -0.842 9.458 1.00 0.00 O ATOM 2548 CG2 THR A 171 -5.294 0.954 9.564 1.00 0.00 C ATOM 0 H THR A 171 -6.901 -1.823 7.138 1.00 0.00 H new ATOM 0 HA THR A 171 -6.772 1.080 7.372 1.00 0.00 H new ATOM 0 HB THR A 171 -4.932 -0.916 8.617 1.00 0.00 H new ATOM 0 HG1 THR A 171 -6.528 -1.077 10.360 1.00 0.00 H new ATOM 0 HG21 THR A 171 -4.996 0.616 10.557 1.00 0.00 H new ATOM 0 HG22 THR A 171 -4.442 1.419 9.068 1.00 0.00 H new ATOM 0 HG23 THR A 171 -6.102 1.680 9.655 1.00 0.00 H new ATOM 2556 N LEU A 172 -4.938 1.505 5.777 1.00 0.00 N ATOM 2557 CA LEU A 172 -3.825 1.833 4.894 1.00 0.00 C ATOM 2558 C LEU A 172 -2.853 2.792 5.576 1.00 0.00 C ATOM 2559 O LEU A 172 -3.223 3.906 5.947 1.00 0.00 O ATOM 2560 CB LEU A 172 -4.355 2.450 3.592 1.00 0.00 C ATOM 2561 CG LEU A 172 -3.297 3.050 2.657 1.00 0.00 C ATOM 2562 CD1 LEU A 172 -2.845 4.411 3.162 1.00 0.00 C ATOM 2563 CD2 LEU A 172 -2.109 2.109 2.511 1.00 0.00 C ATOM 0 H LEU A 172 -5.660 2.224 5.828 1.00 0.00 H new ATOM 0 HA LEU A 172 -3.287 0.914 4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 172 -4.902 1.682 3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 172 -5.071 3.231 3.848 1.00 0.00 H new ATOM 0 HG LEU A 172 -3.748 3.183 1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 172 -2.095 4.819 2.485 1.00 0.00 H new ATOM 0 HD12 LEU A 172 -3.700 5.085 3.205 1.00 0.00 H new ATOM 0 HD13 LEU A 172 -2.416 4.305 4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 172 -1.371 2.555 1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 172 -1.658 1.938 3.488 1.00 0.00 H new ATOM 0 HD23 LEU A 172 -2.446 1.159 2.096 1.00 0.00 H new ATOM 2575 N HIS A 173 -1.607 2.355 5.730 1.00 0.00 N ATOM 2576 CA HIS A 173 -0.580 3.177 6.359 1.00 0.00 C ATOM 2577 C HIS A 173 0.163 4.002 5.312 1.00 0.00 C ATOM 2578 O HIS A 173 0.399 3.539 4.197 1.00 0.00 O ATOM 2579 CB HIS A 173 0.409 2.300 7.129 1.00 0.00 C ATOM 2580 CG HIS A 173 1.483 3.077 7.826 1.00 0.00 C ATOM 2581 ND1 HIS A 173 2.773 2.612 7.974 1.00 0.00 N ATOM 2582 CD2 HIS A 173 1.454 4.295 8.416 1.00 0.00 C ATOM 2583 CE1 HIS A 173 3.490 3.511 8.626 1.00 0.00 C ATOM 2584 NE2 HIS A 173 2.714 4.541 8.905 1.00 0.00 N ATOM 0 H HIS A 173 -1.284 1.436 5.428 1.00 0.00 H new ATOM 0 HA HIS A 173 -1.068 3.856 7.058 1.00 0.00 H new ATOM 0 HB2 HIS A 173 -0.138 1.711 7.865 1.00 0.00 H new ATOM 0 HB3 HIS A 173 0.872 1.596 6.438 1.00 0.00 H new ATOM 0 HD2 HIS A 173 0.599 4.951 8.489 1.00 0.00 H new ATOM 0 HE1 HIS A 173 4.534 3.418 8.886 1.00 0.00 H new ATOM 0 HE2 HIS A 173 3.003 5.383 9.403 1.00 0.00 H new ATOM 2592 N VAL A 174 0.529 5.226 5.678 1.00 0.00 N ATOM 2593 CA VAL A 174 1.244 6.112 4.767 1.00 0.00 C ATOM 2594 C VAL A 174 2.662 6.382 5.258 1.00 0.00 C ATOM 2595 O VAL A 174 2.890 7.275 6.074 1.00 0.00 O ATOM 2596 CB VAL A 174 0.507 7.453 4.593 1.00 0.00 C ATOM 2597 CG1 VAL A 174 1.185 8.306 3.532 1.00 0.00 C ATOM 2598 CG2 VAL A 174 -0.954 7.215 4.242 1.00 0.00 C ATOM 0 H VAL A 174 0.343 5.626 6.597 1.00 0.00 H new ATOM 0 HA VAL A 174 1.289 5.604 3.804 1.00 0.00 H new ATOM 0 HB VAL A 174 0.549 7.994 5.538 1.00 0.00 H new ATOM 0 HG11 VAL A 174 0.648 9.249 3.425 1.00 0.00 H new ATOM 0 HG12 VAL A 174 2.214 8.506 3.829 1.00 0.00 H new ATOM 0 HG13 VAL A 174 1.179 7.775 2.580 1.00 0.00 H new ATOM 0 HG21 VAL A 174 -1.460 8.173 4.123 1.00 0.00 H new ATOM 0 HG22 VAL A 174 -1.017 6.652 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 174 -1.433 6.649 5.041 1.00 0.00 H new ATOM 2608 N HIS A 175 3.613 5.605 4.750 1.00 0.00 N ATOM 2609 CA HIS A 175 5.013 5.759 5.130 1.00 0.00 C ATOM 2610 C HIS A 175 5.903 5.801 3.892 1.00 0.00 C ATOM 2611 O HIS A 175 5.991 4.825 3.148 1.00 0.00 O ATOM 2612 CB HIS A 175 5.444 4.612 6.047 1.00 0.00 C ATOM 2613 CG HIS A 175 6.309 5.052 7.188 1.00 0.00 C ATOM 2614 ND1 HIS A 175 6.039 6.169 7.951 1.00 0.00 N ATOM 2615 CD2 HIS A 175 7.444 4.517 7.696 1.00 0.00 C ATOM 2616 CE1 HIS A 175 6.971 6.303 8.877 1.00 0.00 C ATOM 2617 NE2 HIS A 175 7.835 5.313 8.745 1.00 0.00 N ATOM 0 H HIS A 175 3.440 4.862 4.073 1.00 0.00 H new ATOM 0 HA HIS A 175 5.121 6.701 5.668 1.00 0.00 H new ATOM 0 HB2 HIS A 175 4.555 4.121 6.443 1.00 0.00 H new ATOM 0 HB3 HIS A 175 5.983 3.870 5.458 1.00 0.00 H new ATOM 0 HD2 HIS A 175 7.948 3.630 7.342 1.00 0.00 H new ATOM 0 HE1 HIS A 175 7.019 7.089 9.617 1.00 0.00 H new ATOM 0 HE2 HIS A 175 8.659 5.164 9.327 1.00 0.00 H new ATOM 2625 N TYR A 176 6.556 6.938 3.676 1.00 0.00 N ATOM 2626 CA TYR A 176 7.434 7.106 2.523 1.00 0.00 C ATOM 2627 C TYR A 176 8.725 7.800 2.913 1.00 0.00 C ATOM 2628 O TYR A 176 8.772 8.546 3.891 1.00 0.00 O ATOM 2629 CB TYR A 176 6.738 7.916 1.431 1.00 0.00 C ATOM 2630 CG TYR A 176 6.189 9.247 1.904 1.00 0.00 C ATOM 2631 CD1 TYR A 176 5.205 9.312 2.887 1.00 0.00 C ATOM 2632 CD2 TYR A 176 6.655 10.441 1.364 1.00 0.00 C ATOM 2633 CE1 TYR A 176 4.707 10.527 3.317 1.00 0.00 C ATOM 2634 CE2 TYR A 176 6.160 11.658 1.791 1.00 0.00 C ATOM 2635 CZ TYR A 176 5.187 11.696 2.766 1.00 0.00 C ATOM 2636 OH TYR A 176 4.693 12.906 3.193 1.00 0.00 O ATOM 0 H TYR A 176 6.494 7.756 4.283 1.00 0.00 H new ATOM 0 HA TYR A 176 7.669 6.111 2.144 1.00 0.00 H new ATOM 0 HB2 TYR A 176 7.444 8.094 0.620 1.00 0.00 H new ATOM 0 HB3 TYR A 176 5.921 7.324 1.019 1.00 0.00 H new ATOM 0 HD1 TYR A 176 4.825 8.398 3.320 1.00 0.00 H new ATOM 0 HD2 TYR A 176 7.416 10.416 0.598 1.00 0.00 H new ATOM 0 HE1 TYR A 176 3.945 10.561 4.082 1.00 0.00 H new ATOM 0 HE2 TYR A 176 6.534 12.576 1.362 1.00 0.00 H new ATOM 0 HH TYR A 176 3.871 13.115 2.703 1.00 0.00 H new ATOM 2646 N ARG A 177 9.770 7.560 2.133 1.00 0.00 N ATOM 2647 CA ARG A 177 11.057 8.177 2.392 1.00 0.00 C ATOM 2648 C ARG A 177 11.863 8.320 1.106 1.00 0.00 C ATOM 2649 O ARG A 177 12.009 7.366 0.342 1.00 0.00 O ATOM 2650 CB ARG A 177 11.846 7.361 3.418 1.00 0.00 C ATOM 2651 CG ARG A 177 11.263 7.413 4.821 1.00 0.00 C ATOM 2652 CD ARG A 177 12.010 6.489 5.770 1.00 0.00 C ATOM 2653 NE ARG A 177 13.459 6.605 5.623 1.00 0.00 N ATOM 2654 CZ ARG A 177 14.323 5.682 6.038 1.00 0.00 C ATOM 2655 NH1 ARG A 177 13.890 4.574 6.628 1.00 0.00 N ATOM 2656 NH2 ARG A 177 15.624 5.865 5.862 1.00 0.00 N ATOM 0 H ARG A 177 9.749 6.945 1.320 1.00 0.00 H new ATOM 0 HA ARG A 177 10.876 9.173 2.797 1.00 0.00 H new ATOM 0 HB2 ARG A 177 11.886 6.322 3.089 1.00 0.00 H new ATOM 0 HB3 ARG A 177 12.873 7.726 3.447 1.00 0.00 H new ATOM 0 HG2 ARG A 177 11.307 8.435 5.197 1.00 0.00 H new ATOM 0 HG3 ARG A 177 10.211 7.130 4.790 1.00 0.00 H new ATOM 0 HD2 ARG A 177 11.730 6.722 6.797 1.00 0.00 H new ATOM 0 HD3 ARG A 177 11.709 5.458 5.584 1.00 0.00 H new ATOM 0 HE ARG A 177 13.830 7.443 5.176 1.00 0.00 H new ATOM 0 HH11 ARG A 177 12.890 4.427 6.765 1.00 0.00 H new ATOM 0 HH12 ARG A 177 14.557 3.870 6.944 1.00 0.00 H new ATOM 0 HH21 ARG A 177 15.963 6.713 5.408 1.00 0.00 H new ATOM 0 HH22 ARG A 177 16.286 5.157 6.180 1.00 0.00 H new