USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 968 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 93 HIS : no HD1:sc= -0.365 K(o=-0.46,f=0.041) USER MOD Set 1.2: A 95 THR OG1 : rot 144:sc= -0.0988 USER MOD Set 2.1: A 14 SER OG : rot -56:sc= -0.889 USER MOD Set 2.2: A 27 ASN : amide:sc= 0.861! X(o=-0.31!,f=0.034) USER MOD Set 2.3: A 76 THR OG1 : rot 116:sc= -0.286 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -19:sc= -1.91 USER MOD Single : A 18 ASN : amide:sc= -1.1 K(o=-1.1,f=-5.9!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -173:sc= -1.71 (180deg=-1.77) USER MOD Single : A 42 MET CE :methyl -148:sc= -0.116 (180deg=-0.686) USER MOD Single : A 43 THR OG1 : rot 55:sc= -2.24! USER MOD Single : A 44 SER OG : rot 170:sc= -0.0195 USER MOD Single : A 47 TYR OH : rot 180:sc= -0.0552 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -115:sc= -0.048 (180deg=-1.25) USER MOD Single : A 51 THR OG1 : rot -29:sc= 0.321 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -1.79 K(o=-1.8,f=-4.3!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -110:sc= 0.157 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 130:sc= 0 USER MOD Single : A 84 TYR OH : rot -109:sc= -1.43! USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -2.21! C(o=-2.2!,f=-2.5!) USER MOD Single : A 88 GLN : amide:sc= -0.0134 X(o=-0.013,f=0) USER MOD Single : A 98 SER OG : rot -99:sc= -4.28! USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 44:sc= 0.0971 USER MOD Single : A 124 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0902) USER MOD Single : A 125 MET CE :methyl 172:sc= -4.96! (180deg=-5.24!) USER MOD Single : A 127 MET CE :methyl -153:sc= -2.62! (180deg=-5.46!) USER MOD Single : A 128 ASN : amide:sc= -1.11! C(o=-1.1!,f=-3.4!) USER MOD Single : A 133 SER OG : rot -60:sc= 0.21 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -13.251 -10.210 4.567 1.00 0.00 N ATOM 67 CA LEU A 8 -13.338 -8.760 4.538 1.00 0.00 C ATOM 68 C LEU A 8 -13.475 -8.290 3.089 1.00 0.00 C ATOM 69 O LEU A 8 -14.565 -7.921 2.653 1.00 0.00 O ATOM 70 CB LEU A 8 -12.151 -8.137 5.276 1.00 0.00 C ATOM 71 CG LEU A 8 -12.226 -8.158 6.805 1.00 0.00 C ATOM 72 CD1 LEU A 8 -13.638 -7.823 7.289 1.00 0.00 C ATOM 73 CD2 LEU A 8 -11.733 -9.495 7.360 1.00 0.00 C ATOM 0 HA LEU A 8 -14.228 -8.422 5.069 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.244 -8.658 4.969 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.049 -7.102 4.951 1.00 0.00 H new ATOM 0 HG LEU A 8 -11.561 -7.385 7.190 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -13.664 -7.845 8.378 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.916 -6.829 6.939 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -14.341 -8.556 6.895 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -11.797 -9.483 8.448 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -12.353 -10.302 6.969 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -10.698 -9.654 7.059 1.00 0.00 H new ATOM 85 N GLY A 9 -12.355 -8.320 2.382 1.00 0.00 N ATOM 86 CA GLY A 9 -12.337 -7.901 0.990 1.00 0.00 C ATOM 87 C GLY A 9 -10.967 -8.157 0.359 1.00 0.00 C ATOM 88 O GLY A 9 -10.145 -8.879 0.921 1.00 0.00 O ATOM 0 H GLY A 9 -11.453 -8.628 2.747 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.104 -8.440 0.434 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.580 -6.841 0.922 1.00 0.00 H new ATOM 92 N THR A 10 -10.764 -7.551 -0.802 1.00 0.00 N ATOM 93 CA THR A 10 -9.508 -7.704 -1.516 1.00 0.00 C ATOM 94 C THR A 10 -8.760 -6.370 -1.571 1.00 0.00 C ATOM 95 O THR A 10 -9.344 -5.316 -1.322 1.00 0.00 O ATOM 96 CB THR A 10 -9.817 -8.285 -2.897 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.482 -9.513 -2.616 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.554 -8.709 -3.650 1.00 0.00 C ATOM 0 H THR A 10 -11.448 -6.953 -1.266 1.00 0.00 H new ATOM 0 HA THR A 10 -8.841 -8.394 -0.999 1.00 0.00 H new ATOM 0 HB THR A 10 -10.361 -7.548 -3.487 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.720 -9.956 -3.457 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.830 -9.114 -4.624 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.905 -7.844 -3.788 1.00 0.00 H new ATOM 0 HG23 THR A 10 -8.027 -9.471 -3.076 1.00 0.00 H new ATOM 106 N LEU A 11 -7.479 -6.459 -1.899 1.00 0.00 N ATOM 107 CA LEU A 11 -6.645 -5.273 -1.990 1.00 0.00 C ATOM 108 C LEU A 11 -5.764 -5.368 -3.237 1.00 0.00 C ATOM 109 O LEU A 11 -5.039 -6.346 -3.416 1.00 0.00 O ATOM 110 CB LEU A 11 -5.858 -5.071 -0.694 1.00 0.00 C ATOM 111 CG LEU A 11 -4.627 -4.166 -0.791 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.358 -4.989 -1.021 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.818 -3.095 -1.867 1.00 0.00 C ATOM 0 H LEU A 11 -6.998 -7.335 -2.105 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.262 -4.381 -2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.531 -4.656 0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.539 -6.048 -0.330 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.507 -3.649 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.498 -4.322 -1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.218 -5.681 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.452 -5.551 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.929 -2.466 -1.916 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.977 -3.574 -2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.684 -2.481 -1.620 1.00 0.00 H new ATOM 125 N PHE A 12 -5.856 -4.340 -4.068 1.00 0.00 N ATOM 126 CA PHE A 12 -5.076 -4.296 -5.293 1.00 0.00 C ATOM 127 C PHE A 12 -3.921 -3.299 -5.172 1.00 0.00 C ATOM 128 O PHE A 12 -4.089 -2.214 -4.618 1.00 0.00 O ATOM 129 CB PHE A 12 -6.018 -3.835 -6.407 1.00 0.00 C ATOM 130 CG PHE A 12 -7.392 -4.508 -6.378 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.485 -5.860 -6.267 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.520 -3.753 -6.462 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.760 -6.484 -6.240 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.795 -4.378 -6.436 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.888 -5.730 -6.325 1.00 0.00 C ATOM 0 H PHE A 12 -6.459 -3.531 -3.917 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.652 -5.279 -5.500 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.152 -2.756 -6.332 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.548 -4.032 -7.371 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.589 -6.459 -6.199 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.446 -2.679 -6.548 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.834 -7.558 -6.152 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.691 -3.779 -6.504 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.858 -6.205 -6.304 1.00 0.00 H new ATOM 145 N PHE A 13 -2.775 -3.703 -5.701 1.00 0.00 N ATOM 146 CA PHE A 13 -1.594 -2.859 -5.659 1.00 0.00 C ATOM 147 C PHE A 13 -0.512 -3.382 -6.607 1.00 0.00 C ATOM 148 O PHE A 13 -0.561 -4.535 -7.034 1.00 0.00 O ATOM 149 CB PHE A 13 -1.063 -2.902 -4.225 1.00 0.00 C ATOM 150 CG PHE A 13 -0.446 -4.245 -3.830 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.237 -5.343 -3.693 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.893 -4.341 -3.615 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.665 -6.589 -3.327 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.466 -5.588 -3.249 1.00 0.00 C ATOM 155 CZ PHE A 13 0.675 -6.686 -3.112 1.00 0.00 C ATOM 0 H PHE A 13 -2.640 -4.603 -6.161 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.851 -1.845 -5.967 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.314 -2.120 -4.102 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.879 -2.673 -3.539 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.301 -5.266 -3.863 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.521 -3.469 -3.723 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.294 -7.461 -3.219 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.530 -5.664 -3.079 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.110 -7.634 -2.833 1.00 0.00 H new ATOM 165 N SER A 14 0.439 -2.510 -6.907 1.00 0.00 N ATOM 166 CA SER A 14 1.530 -2.870 -7.796 1.00 0.00 C ATOM 167 C SER A 14 2.856 -2.354 -7.233 1.00 0.00 C ATOM 168 O SER A 14 2.884 -1.347 -6.527 1.00 0.00 O ATOM 169 CB SER A 14 1.300 -2.316 -9.204 1.00 0.00 C ATOM 170 OG SER A 14 0.951 -0.935 -9.183 1.00 0.00 O ATOM 0 H SER A 14 0.477 -1.555 -6.550 1.00 0.00 H new ATOM 0 HA SER A 14 1.570 -3.957 -7.865 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.203 -2.453 -9.800 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.507 -2.883 -9.692 1.00 0.00 H new ATOM 0 HG SER A 14 0.159 -0.806 -8.620 1.00 0.00 H new ATOM 176 N LEU A 15 3.921 -3.068 -7.565 1.00 0.00 N ATOM 177 CA LEU A 15 5.247 -2.695 -7.101 1.00 0.00 C ATOM 178 C LEU A 15 6.094 -2.250 -8.295 1.00 0.00 C ATOM 179 O LEU A 15 5.861 -2.684 -9.422 1.00 0.00 O ATOM 180 CB LEU A 15 5.872 -3.835 -6.294 1.00 0.00 C ATOM 181 CG LEU A 15 5.142 -4.225 -5.008 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.264 -5.727 -4.742 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.634 -3.392 -3.823 1.00 0.00 C ATOM 0 H LEU A 15 3.893 -3.903 -8.150 1.00 0.00 H new ATOM 0 HA LEU A 15 5.188 -1.847 -6.418 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.934 -4.715 -6.934 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.894 -3.554 -6.038 1.00 0.00 H new ATOM 0 HG LEU A 15 4.082 -4.005 -5.138 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.736 -5.978 -3.822 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.827 -6.280 -5.573 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.316 -5.994 -4.641 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.098 -3.690 -2.922 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.702 -3.556 -3.681 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.452 -2.336 -4.021 1.00 0.00 H new ATOM 195 N GLU A 16 7.060 -1.390 -8.006 1.00 0.00 N ATOM 196 CA GLU A 16 7.943 -0.881 -9.042 1.00 0.00 C ATOM 197 C GLU A 16 9.184 -0.242 -8.415 1.00 0.00 C ATOM 198 O GLU A 16 9.070 0.648 -7.574 1.00 0.00 O ATOM 199 CB GLU A 16 7.211 0.114 -9.946 1.00 0.00 C ATOM 200 CG GLU A 16 8.204 0.970 -10.734 1.00 0.00 C ATOM 201 CD GLU A 16 7.648 1.324 -12.115 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.529 1.880 -12.151 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.354 1.030 -13.104 1.00 0.00 O ATOM 0 H GLU A 16 7.250 -1.033 -7.070 1.00 0.00 H new ATOM 0 HA GLU A 16 8.264 -1.718 -9.663 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.562 -0.425 -10.636 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.570 0.757 -9.342 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.421 1.884 -10.180 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.146 0.432 -10.844 1.00 0.00 H new ATOM 210 N TYR A 17 10.340 -0.723 -8.848 1.00 0.00 N ATOM 211 CA TYR A 17 11.601 -0.210 -8.340 1.00 0.00 C ATOM 212 C TYR A 17 12.209 0.807 -9.307 1.00 0.00 C ATOM 213 O TYR A 17 12.090 0.662 -10.523 1.00 0.00 O ATOM 214 CB TYR A 17 12.535 -1.417 -8.234 1.00 0.00 C ATOM 215 CG TYR A 17 13.735 -1.196 -7.311 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.536 -0.852 -5.990 1.00 0.00 C ATOM 217 CD2 TYR A 17 15.017 -1.340 -7.801 1.00 0.00 C ATOM 218 CE1 TYR A 17 14.666 -0.644 -5.121 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.147 -1.132 -6.932 1.00 0.00 C ATOM 220 CZ TYR A 17 15.916 -0.794 -5.636 1.00 0.00 C ATOM 221 OH TYR A 17 16.983 -0.597 -4.816 1.00 0.00 O ATOM 0 H TYR A 17 10.430 -1.462 -9.545 1.00 0.00 H new ATOM 0 HA TYR A 17 11.454 0.290 -7.383 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.965 -2.274 -7.874 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.898 -1.671 -9.230 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.533 -0.739 -5.607 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.173 -1.608 -8.835 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.524 -0.375 -4.085 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.156 -1.242 -7.302 1.00 0.00 H new ATOM 0 HH TYR A 17 16.702 -0.079 -4.033 1.00 0.00 H new ATOM 231 N ASN A 18 12.848 1.815 -8.731 1.00 0.00 N ATOM 232 CA ASN A 18 13.475 2.856 -9.527 1.00 0.00 C ATOM 233 C ASN A 18 14.964 2.541 -9.690 1.00 0.00 C ATOM 234 O ASN A 18 15.817 3.326 -9.280 1.00 0.00 O ATOM 235 CB ASN A 18 13.353 4.220 -8.845 1.00 0.00 C ATOM 236 CG ASN A 18 13.838 5.340 -9.768 1.00 0.00 C ATOM 237 OD1 ASN A 18 14.408 5.108 -10.822 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.582 6.564 -9.314 1.00 0.00 N ATOM 0 H ASN A 18 12.945 1.933 -7.722 1.00 0.00 H new ATOM 0 HA ASN A 18 12.972 2.890 -10.494 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.315 4.399 -8.565 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.937 4.224 -7.925 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.867 7.379 -9.857 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.101 6.687 -8.423 1.00 0.00 H new ATOM 245 N PHE A 19 15.230 1.390 -10.290 1.00 0.00 N ATOM 246 CA PHE A 19 16.600 0.961 -10.512 1.00 0.00 C ATOM 247 C PHE A 19 17.503 2.154 -10.831 1.00 0.00 C ATOM 248 O PHE A 19 18.576 2.299 -10.248 1.00 0.00 O ATOM 249 CB PHE A 19 16.583 0.013 -11.713 1.00 0.00 C ATOM 250 CG PHE A 19 16.337 -1.452 -11.346 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.065 -1.923 -11.246 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.390 -2.283 -11.120 1.00 0.00 C ATOM 253 CE1 PHE A 19 14.836 -3.282 -10.905 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.161 -3.642 -10.780 1.00 0.00 C ATOM 255 CZ PHE A 19 15.889 -4.113 -10.679 1.00 0.00 C ATOM 0 H PHE A 19 14.520 0.741 -10.629 1.00 0.00 H new ATOM 0 HA PHE A 19 16.988 0.476 -9.616 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.809 0.338 -12.408 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.535 0.091 -12.238 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.229 -1.263 -11.426 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.400 -1.909 -11.199 1.00 0.00 H new ATOM 0 HE1 PHE A 19 13.826 -3.656 -10.825 1.00 0.00 H new ATOM 0 HE2 PHE A 19 17.997 -4.302 -10.601 1.00 0.00 H new ATOM 0 HZ PHE A 19 15.715 -5.147 -10.419 1.00 0.00 H new ATOM 265 N GLU A 20 17.035 2.978 -11.757 1.00 0.00 N ATOM 266 CA GLU A 20 17.787 4.154 -12.161 1.00 0.00 C ATOM 267 C GLU A 20 18.359 4.866 -10.934 1.00 0.00 C ATOM 268 O GLU A 20 19.560 5.121 -10.863 1.00 0.00 O ATOM 269 CB GLU A 20 16.917 5.102 -12.990 1.00 0.00 C ATOM 270 CG GLU A 20 17.744 6.270 -13.533 1.00 0.00 C ATOM 271 CD GLU A 20 18.491 5.867 -14.806 1.00 0.00 C ATOM 272 OE1 GLU A 20 19.634 5.380 -14.663 1.00 0.00 O ATOM 273 OE2 GLU A 20 17.903 6.054 -15.893 1.00 0.00 O ATOM 0 H GLU A 20 16.145 2.855 -12.239 1.00 0.00 H new ATOM 0 HA GLU A 20 18.618 3.832 -12.789 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.464 4.556 -13.818 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.101 5.484 -12.376 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.090 7.117 -13.743 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.457 6.598 -12.777 1.00 0.00 H new ATOM 280 N ARG A 21 17.472 5.167 -9.997 1.00 0.00 N ATOM 281 CA ARG A 21 17.874 5.845 -8.776 1.00 0.00 C ATOM 282 C ARG A 21 17.767 4.894 -7.582 1.00 0.00 C ATOM 283 O ARG A 21 17.623 5.336 -6.443 1.00 0.00 O ATOM 284 CB ARG A 21 17.003 7.076 -8.517 1.00 0.00 C ATOM 285 CG ARG A 21 16.901 7.948 -9.770 1.00 0.00 C ATOM 286 CD ARG A 21 15.815 9.014 -9.609 1.00 0.00 C ATOM 287 NE ARG A 21 16.434 10.352 -9.486 1.00 0.00 N ATOM 288 CZ ARG A 21 16.916 11.055 -10.520 1.00 0.00 C ATOM 289 NH1 ARG A 21 16.854 10.551 -11.760 1.00 0.00 N ATOM 290 NH2 ARG A 21 17.461 12.262 -10.315 1.00 0.00 N ATOM 0 H ARG A 21 16.476 4.954 -10.059 1.00 0.00 H new ATOM 0 HA ARG A 21 18.909 6.165 -8.900 1.00 0.00 H new ATOM 0 HB2 ARG A 21 16.007 6.762 -8.206 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.424 7.658 -7.697 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.861 8.428 -9.963 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.677 7.323 -10.635 1.00 0.00 H new ATOM 0 HD2 ARG A 21 15.143 8.993 -10.467 1.00 0.00 H new ATOM 0 HD3 ARG A 21 15.212 8.800 -8.726 1.00 0.00 H new ATOM 0 HE ARG A 21 16.498 10.765 -8.556 1.00 0.00 H new ATOM 0 HH11 ARG A 21 16.440 9.632 -11.917 1.00 0.00 H new ATOM 0 HH12 ARG A 21 17.221 11.086 -12.547 1.00 0.00 H new ATOM 0 HH21 ARG A 21 17.509 12.646 -9.371 1.00 0.00 H new ATOM 0 HH22 ARG A 21 17.828 12.796 -11.103 1.00 0.00 H new ATOM 304 N LYS A 22 17.843 3.606 -7.883 1.00 0.00 N ATOM 305 CA LYS A 22 17.758 2.589 -6.848 1.00 0.00 C ATOM 306 C LYS A 22 16.762 3.040 -5.778 1.00 0.00 C ATOM 307 O LYS A 22 17.149 3.325 -4.646 1.00 0.00 O ATOM 308 CB LYS A 22 19.148 2.266 -6.298 1.00 0.00 C ATOM 309 CG LYS A 22 19.847 1.212 -7.158 1.00 0.00 C ATOM 310 CD LYS A 22 20.334 0.041 -6.302 1.00 0.00 C ATOM 311 CE LYS A 22 21.028 -1.016 -7.163 1.00 0.00 C ATOM 312 NZ LYS A 22 22.297 -1.446 -6.533 1.00 0.00 N ATOM 0 H LYS A 22 17.963 3.243 -8.829 1.00 0.00 H new ATOM 0 HA LYS A 22 17.380 1.654 -7.262 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.751 3.174 -6.268 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.063 1.906 -5.273 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.161 0.848 -7.922 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.692 1.664 -7.678 1.00 0.00 H new ATOM 0 HD2 LYS A 22 21.024 0.405 -5.540 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.489 -0.408 -5.779 1.00 0.00 H new ATOM 0 HE2 LYS A 22 20.371 -1.876 -7.294 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.226 -0.612 -8.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.755 -2.164 -7.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.929 -0.626 -6.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.100 -1.851 -5.596 1.00 0.00 H new ATOM 326 N ALA A 23 15.498 3.089 -6.174 1.00 0.00 N ATOM 327 CA ALA A 23 14.444 3.499 -5.262 1.00 0.00 C ATOM 328 C ALA A 23 13.289 2.499 -5.341 1.00 0.00 C ATOM 329 O ALA A 23 13.226 1.690 -6.266 1.00 0.00 O ATOM 330 CB ALA A 23 14.004 4.926 -5.599 1.00 0.00 C ATOM 0 H ALA A 23 15.181 2.852 -7.114 1.00 0.00 H new ATOM 0 HA ALA A 23 14.806 3.503 -4.234 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.213 5.234 -4.915 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.853 5.602 -5.499 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.632 4.960 -6.623 1.00 0.00 H new ATOM 336 N PHE A 24 12.403 2.588 -4.360 1.00 0.00 N ATOM 337 CA PHE A 24 11.253 1.701 -4.307 1.00 0.00 C ATOM 338 C PHE A 24 9.949 2.483 -4.471 1.00 0.00 C ATOM 339 O PHE A 24 9.747 3.505 -3.816 1.00 0.00 O ATOM 340 CB PHE A 24 11.265 1.035 -2.930 1.00 0.00 C ATOM 341 CG PHE A 24 10.253 -0.102 -2.780 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.980 -0.914 -3.837 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.625 -0.301 -1.590 1.00 0.00 C ATOM 344 CE1 PHE A 24 9.040 -1.969 -3.697 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.685 -1.357 -1.450 1.00 0.00 C ATOM 346 CZ PHE A 24 8.412 -2.168 -2.507 1.00 0.00 C ATOM 0 H PHE A 24 12.458 3.261 -3.595 1.00 0.00 H new ATOM 0 HA PHE A 24 11.310 0.970 -5.113 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.264 0.646 -2.735 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.063 1.790 -2.171 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.478 -0.756 -4.782 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.841 0.344 -0.751 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.824 -2.614 -4.536 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.187 -1.516 -0.505 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.697 -2.970 -2.402 1.00 0.00 H new ATOM 356 N VAL A 25 9.097 1.975 -5.349 1.00 0.00 N ATOM 357 CA VAL A 25 7.817 2.613 -5.607 1.00 0.00 C ATOM 358 C VAL A 25 6.688 1.642 -5.256 1.00 0.00 C ATOM 359 O VAL A 25 6.446 0.678 -5.980 1.00 0.00 O ATOM 360 CB VAL A 25 7.758 3.100 -7.056 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.616 4.099 -7.253 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.096 3.705 -7.486 1.00 0.00 C ATOM 0 H VAL A 25 9.268 1.128 -5.891 1.00 0.00 H new ATOM 0 HA VAL A 25 7.695 3.494 -4.977 1.00 0.00 H new ATOM 0 HB VAL A 25 7.561 2.237 -7.692 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.597 4.429 -8.292 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.668 3.621 -7.006 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.769 4.959 -6.601 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.027 4.043 -8.520 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.336 4.551 -6.843 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.880 2.952 -7.402 1.00 0.00 H new ATOM 372 N VAL A 26 6.026 1.931 -4.145 1.00 0.00 N ATOM 373 CA VAL A 26 4.928 1.096 -3.689 1.00 0.00 C ATOM 374 C VAL A 26 3.601 1.766 -4.049 1.00 0.00 C ATOM 375 O VAL A 26 3.094 2.595 -3.294 1.00 0.00 O ATOM 376 CB VAL A 26 5.070 0.817 -2.191 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.896 -0.017 -1.675 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.404 0.133 -1.885 1.00 0.00 C ATOM 0 H VAL A 26 6.229 2.732 -3.547 1.00 0.00 H new ATOM 0 HA VAL A 26 4.950 0.128 -4.190 1.00 0.00 H new ATOM 0 HB VAL A 26 5.056 1.774 -1.669 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.022 -0.201 -0.608 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.964 0.523 -1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.864 -0.968 -2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.480 -0.054 -0.814 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.460 -0.813 -2.423 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.224 0.778 -2.199 1.00 0.00 H new ATOM 388 N ASN A 27 3.074 1.381 -5.202 1.00 0.00 N ATOM 389 CA ASN A 27 1.815 1.934 -5.672 1.00 0.00 C ATOM 390 C ASN A 27 0.657 1.202 -4.991 1.00 0.00 C ATOM 391 O ASN A 27 0.617 -0.027 -4.976 1.00 0.00 O ATOM 392 CB ASN A 27 1.664 1.755 -7.184 1.00 0.00 C ATOM 393 CG ASN A 27 0.218 1.991 -7.622 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.444 1.120 -8.164 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.235 3.213 -7.359 1.00 0.00 N ATOM 0 H ASN A 27 3.496 0.692 -5.825 1.00 0.00 H new ATOM 0 HA ASN A 27 1.803 2.997 -5.433 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.323 2.450 -7.704 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.974 0.749 -7.468 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.189 3.469 -7.613 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.372 3.895 -6.903 1.00 0.00 H new ATOM 402 N ILE A 28 -0.258 1.989 -4.444 1.00 0.00 N ATOM 403 CA ILE A 28 -1.414 1.431 -3.763 1.00 0.00 C ATOM 404 C ILE A 28 -2.669 1.699 -4.596 1.00 0.00 C ATOM 405 O ILE A 28 -3.233 2.791 -4.543 1.00 0.00 O ATOM 406 CB ILE A 28 -1.502 1.964 -2.331 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.244 1.609 -1.536 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.775 1.472 -1.640 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.362 2.078 -0.085 1.00 0.00 C ATOM 0 H ILE A 28 -0.222 3.008 -4.459 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.316 0.349 -3.671 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.559 3.052 -2.374 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.085 0.531 -1.562 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.627 2.070 -2.001 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.813 1.865 -0.624 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.647 1.817 -2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.774 0.382 -1.608 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.545 1.813 0.458 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.496 3.159 -0.062 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.219 1.596 0.385 1.00 0.00 H new ATOM 421 N LYS A 29 -3.070 0.683 -5.347 1.00 0.00 N ATOM 422 CA LYS A 29 -4.248 0.795 -6.190 1.00 0.00 C ATOM 423 C LYS A 29 -5.474 1.059 -5.314 1.00 0.00 C ATOM 424 O LYS A 29 -5.403 1.827 -4.356 1.00 0.00 O ATOM 425 CB LYS A 29 -4.386 -0.439 -7.084 1.00 0.00 C ATOM 426 CG LYS A 29 -5.182 -0.114 -8.350 1.00 0.00 C ATOM 427 CD LYS A 29 -4.247 0.190 -9.522 1.00 0.00 C ATOM 428 CE LYS A 29 -4.651 -0.606 -10.765 1.00 0.00 C ATOM 429 NZ LYS A 29 -5.288 0.280 -11.764 1.00 0.00 N ATOM 0 H LYS A 29 -2.600 -0.221 -5.389 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.152 1.643 -6.868 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.397 -0.807 -7.357 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.883 -1.238 -6.533 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.828 -0.955 -8.604 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.831 0.742 -8.166 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.272 1.257 -9.745 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.221 -0.054 -9.247 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.772 -1.082 -11.200 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.340 -1.403 -10.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.556 -0.276 -12.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.138 0.715 -11.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.619 1.025 -12.044 1.00 0.00 H new ATOM 443 N GLU A 30 -6.570 0.408 -5.674 1.00 0.00 N ATOM 444 CA GLU A 30 -7.810 0.563 -4.932 1.00 0.00 C ATOM 445 C GLU A 30 -8.183 -0.749 -4.240 1.00 0.00 C ATOM 446 O GLU A 30 -7.578 -1.788 -4.504 1.00 0.00 O ATOM 447 CB GLU A 30 -8.940 1.041 -5.847 1.00 0.00 C ATOM 448 CG GLU A 30 -9.332 -0.048 -6.848 1.00 0.00 C ATOM 449 CD GLU A 30 -10.069 0.550 -8.048 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.165 1.106 -7.822 1.00 0.00 O ATOM 451 OE2 GLU A 30 -9.519 0.438 -9.165 1.00 0.00 O ATOM 0 H GLU A 30 -6.625 -0.228 -6.470 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.659 1.324 -4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.807 1.317 -5.247 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.625 1.936 -6.383 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.439 -0.572 -7.189 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -9.967 -0.786 -6.358 1.00 0.00 H new ATOM 458 N ALA A 31 -9.176 -0.660 -3.368 1.00 0.00 N ATOM 459 CA ALA A 31 -9.636 -1.828 -2.636 1.00 0.00 C ATOM 460 C ALA A 31 -11.129 -2.034 -2.899 1.00 0.00 C ATOM 461 O ALA A 31 -11.889 -1.069 -2.973 1.00 0.00 O ATOM 462 CB ALA A 31 -9.325 -1.653 -1.148 1.00 0.00 C ATOM 0 H ALA A 31 -9.675 0.203 -3.152 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.115 -2.723 -2.975 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.670 -2.529 -0.599 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.249 -1.540 -1.012 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.834 -0.765 -0.772 1.00 0.00 H new ATOM 468 N ARG A 32 -11.505 -3.297 -3.032 1.00 0.00 N ATOM 469 CA ARG A 32 -12.894 -3.642 -3.286 1.00 0.00 C ATOM 470 C ARG A 32 -13.353 -4.737 -2.320 1.00 0.00 C ATOM 471 O ARG A 32 -12.594 -5.653 -2.008 1.00 0.00 O ATOM 472 CB ARG A 32 -13.087 -4.126 -4.724 1.00 0.00 C ATOM 473 CG ARG A 32 -13.615 -2.999 -5.615 1.00 0.00 C ATOM 474 CD ARG A 32 -15.138 -3.071 -5.746 1.00 0.00 C ATOM 475 NE ARG A 32 -15.593 -2.197 -6.850 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.380 -2.454 -8.148 1.00 0.00 C ATOM 477 NH1 ARG A 32 -14.717 -3.560 -8.512 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.829 -1.604 -9.081 1.00 0.00 N ATOM 0 H ARG A 32 -10.872 -4.094 -2.969 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.493 -2.744 -3.134 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.139 -4.493 -5.118 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.784 -4.964 -4.739 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.328 -2.035 -5.196 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.158 -3.067 -6.602 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -15.447 -4.099 -5.934 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.607 -2.764 -4.811 1.00 0.00 H new ATOM 0 HE ARG A 32 -16.100 -1.346 -6.608 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -14.374 -4.206 -7.801 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -14.555 -3.756 -9.500 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -16.333 -0.762 -8.803 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.667 -1.799 -10.069 1.00 0.00 H new ATOM 492 N GLY A 33 -14.594 -4.605 -1.875 1.00 0.00 N ATOM 493 CA GLY A 33 -15.164 -5.572 -0.951 1.00 0.00 C ATOM 494 C GLY A 33 -14.929 -5.148 0.500 1.00 0.00 C ATOM 495 O GLY A 33 -14.536 -5.964 1.333 1.00 0.00 O ATOM 0 H GLY A 33 -15.221 -3.844 -2.137 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.234 -5.671 -1.136 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.719 -6.552 -1.124 1.00 0.00 H new ATOM 499 N LEU A 34 -15.179 -3.873 0.759 1.00 0.00 N ATOM 500 CA LEU A 34 -14.999 -3.331 2.095 1.00 0.00 C ATOM 501 C LEU A 34 -16.351 -3.295 2.812 1.00 0.00 C ATOM 502 O LEU A 34 -17.295 -2.671 2.331 1.00 0.00 O ATOM 503 CB LEU A 34 -14.300 -1.972 2.033 1.00 0.00 C ATOM 504 CG LEU A 34 -13.033 -1.908 1.177 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.020 -0.926 1.769 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.433 -3.302 0.981 1.00 0.00 C ATOM 0 H LEU A 34 -15.505 -3.199 0.066 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.343 -3.974 2.682 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.010 -1.238 1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.044 -1.671 3.049 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.306 -1.533 0.191 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.129 -0.900 1.141 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.462 0.069 1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.746 -1.247 2.774 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.534 -3.228 0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.178 -3.728 1.951 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.159 -3.944 0.483 1.00 0.00 H new ATOM 518 N PRO A 35 -16.400 -3.989 3.980 1.00 0.00 N ATOM 519 CA PRO A 35 -17.620 -4.042 4.768 1.00 0.00 C ATOM 520 C PRO A 35 -17.856 -2.721 5.503 1.00 0.00 C ATOM 521 O PRO A 35 -16.942 -2.181 6.124 1.00 0.00 O ATOM 522 CB PRO A 35 -17.429 -5.220 5.709 1.00 0.00 C ATOM 523 CG PRO A 35 -15.934 -5.494 5.737 1.00 0.00 C ATOM 524 CD PRO A 35 -15.301 -4.740 4.580 1.00 0.00 C ATOM 0 HA PRO A 35 -18.511 -4.179 4.155 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -17.802 -4.987 6.706 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -17.979 -6.093 5.358 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.504 -5.170 6.685 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -15.740 -6.563 5.648 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.510 -4.075 4.927 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -14.850 -5.424 3.861 1.00 0.00 H new ATOM 532 N ALA A 36 -19.086 -2.240 5.407 1.00 0.00 N ATOM 533 CA ALA A 36 -19.454 -0.992 6.055 1.00 0.00 C ATOM 534 C ALA A 36 -19.237 -1.123 7.564 1.00 0.00 C ATOM 535 O ALA A 36 -19.317 -2.221 8.113 1.00 0.00 O ATOM 536 CB ALA A 36 -20.900 -0.640 5.702 1.00 0.00 C ATOM 0 H ALA A 36 -19.841 -2.691 4.890 1.00 0.00 H new ATOM 0 HA ALA A 36 -18.825 -0.175 5.701 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.176 0.296 6.188 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.994 -0.529 4.622 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.562 -1.435 6.044 1.00 0.00 H new ATOM 542 N MET A 37 -18.968 0.012 8.192 1.00 0.00 N ATOM 543 CA MET A 37 -18.739 0.038 9.626 1.00 0.00 C ATOM 544 C MET A 37 -19.854 0.799 10.346 1.00 0.00 C ATOM 545 O MET A 37 -20.006 0.684 11.561 1.00 0.00 O ATOM 546 CB MET A 37 -17.394 0.707 9.917 1.00 0.00 C ATOM 547 CG MET A 37 -16.254 -0.313 9.877 1.00 0.00 C ATOM 548 SD MET A 37 -16.387 -1.431 11.262 1.00 0.00 S ATOM 549 CE MET A 37 -15.108 -2.602 10.838 1.00 0.00 C ATOM 0 H MET A 37 -18.904 0.921 7.733 1.00 0.00 H new ATOM 0 HA MET A 37 -18.731 -0.989 9.992 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.209 1.493 9.185 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.426 1.184 10.896 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.288 -0.873 8.942 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.293 0.201 9.905 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.137 -3.440 11.534 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.271 -2.967 9.824 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.135 -2.115 10.897 1.00 0.00 H new ATOM 614 N MET A 42 -25.134 2.798 4.713 1.00 0.00 N ATOM 615 CA MET A 42 -24.420 1.626 4.234 1.00 0.00 C ATOM 616 C MET A 42 -23.137 2.027 3.504 1.00 0.00 C ATOM 617 O MET A 42 -22.889 1.578 2.386 1.00 0.00 O ATOM 618 CB MET A 42 -25.321 0.832 3.286 1.00 0.00 C ATOM 619 CG MET A 42 -25.108 -0.673 3.460 1.00 0.00 C ATOM 620 SD MET A 42 -25.803 -1.212 5.014 1.00 0.00 S ATOM 621 CE MET A 42 -24.338 -1.865 5.798 1.00 0.00 C ATOM 0 HA MET A 42 -24.150 1.011 5.093 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.365 1.080 3.478 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.110 1.116 2.255 1.00 0.00 H new ATOM 0 HG2 MET A 42 -25.576 -1.212 2.636 1.00 0.00 H new ATOM 0 HG3 MET A 42 -24.043 -0.904 3.429 1.00 0.00 H new ATOM 0 HE1 MET A 42 -24.612 -2.698 6.445 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.641 -2.212 5.035 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.865 -1.084 6.393 1.00 0.00 H new ATOM 631 N THR A 43 -22.356 2.868 4.165 1.00 0.00 N ATOM 632 CA THR A 43 -21.104 3.334 3.593 1.00 0.00 C ATOM 633 C THR A 43 -20.097 3.652 4.700 1.00 0.00 C ATOM 634 O THR A 43 -20.445 3.648 5.880 1.00 0.00 O ATOM 635 CB THR A 43 -21.413 4.531 2.691 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.144 4.904 2.162 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.863 5.760 3.483 1.00 0.00 C ATOM 0 H THR A 43 -22.566 3.239 5.092 1.00 0.00 H new ATOM 0 HA THR A 43 -20.636 2.561 2.984 1.00 0.00 H new ATOM 0 HB THR A 43 -22.189 4.256 1.976 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.729 4.129 1.730 1.00 0.00 H new ATOM 0 HG21 THR A 43 -22.069 6.580 2.796 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.766 5.521 4.044 1.00 0.00 H new ATOM 0 HG23 THR A 43 -21.074 6.056 4.175 1.00 0.00 H new ATOM 645 N SER A 44 -18.869 3.919 4.280 1.00 0.00 N ATOM 646 CA SER A 44 -17.809 4.239 5.221 1.00 0.00 C ATOM 647 C SER A 44 -16.622 4.858 4.482 1.00 0.00 C ATOM 648 O SER A 44 -16.625 4.942 3.255 1.00 0.00 O ATOM 649 CB SER A 44 -17.364 2.994 5.992 1.00 0.00 C ATOM 650 OG SER A 44 -17.376 1.827 5.174 1.00 0.00 O ATOM 0 H SER A 44 -18.584 3.920 3.300 1.00 0.00 H new ATOM 0 HA SER A 44 -18.196 4.960 5.940 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.360 3.151 6.385 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.022 2.843 6.848 1.00 0.00 H new ATOM 0 HG SER A 44 -16.937 1.091 5.648 1.00 0.00 H new ATOM 656 N ASP A 45 -15.635 5.277 5.260 1.00 0.00 N ATOM 657 CA ASP A 45 -14.443 5.887 4.694 1.00 0.00 C ATOM 658 C ASP A 45 -13.212 5.091 5.131 1.00 0.00 C ATOM 659 O ASP A 45 -12.438 5.548 5.971 1.00 0.00 O ATOM 660 CB ASP A 45 -14.274 7.326 5.186 1.00 0.00 C ATOM 661 CG ASP A 45 -15.390 8.287 4.769 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.277 7.833 4.014 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.331 9.453 5.215 1.00 0.00 O ATOM 0 H ASP A 45 -15.636 5.206 6.278 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.547 5.887 3.609 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.210 7.317 6.274 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.325 7.712 4.814 1.00 0.00 H new ATOM 668 N PRO A 46 -13.064 3.882 4.525 1.00 0.00 N ATOM 669 CA PRO A 46 -11.940 3.018 4.842 1.00 0.00 C ATOM 670 C PRO A 46 -10.652 3.536 4.200 1.00 0.00 C ATOM 671 O PRO A 46 -10.697 4.354 3.281 1.00 0.00 O ATOM 672 CB PRO A 46 -12.345 1.643 4.336 1.00 0.00 C ATOM 673 CG PRO A 46 -13.473 1.880 3.344 1.00 0.00 C ATOM 674 CD PRO A 46 -13.961 3.308 3.525 1.00 0.00 C ATOM 0 HA PRO A 46 -11.722 2.986 5.910 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.504 1.139 3.859 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.674 1.006 5.157 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.123 1.723 2.324 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.286 1.174 3.515 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.917 3.863 2.588 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -14.997 3.333 3.862 1.00 0.00 H new ATOM 682 N TYR A 47 -9.534 3.039 4.708 1.00 0.00 N ATOM 683 CA TYR A 47 -8.235 3.442 4.195 1.00 0.00 C ATOM 684 C TYR A 47 -7.164 2.406 4.541 1.00 0.00 C ATOM 685 O TYR A 47 -7.186 1.822 5.624 1.00 0.00 O ATOM 686 CB TYR A 47 -7.897 4.761 4.892 1.00 0.00 C ATOM 687 CG TYR A 47 -7.822 4.657 6.417 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.981 4.653 7.165 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.596 4.569 7.043 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.911 4.556 8.600 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.525 4.472 8.478 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.687 4.470 9.186 1.00 0.00 C ATOM 693 OH TYR A 47 -7.621 4.378 10.541 1.00 0.00 O ATOM 0 H TYR A 47 -9.500 2.361 5.469 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.264 3.539 3.110 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -6.941 5.125 4.515 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.648 5.504 4.625 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.941 4.723 6.675 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.689 4.573 6.457 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.811 4.552 9.198 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.572 4.402 8.981 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.683 4.322 10.820 1.00 0.00 H new ATOM 703 N ILE A 48 -6.250 2.209 3.602 1.00 0.00 N ATOM 704 CA ILE A 48 -5.172 1.254 3.794 1.00 0.00 C ATOM 705 C ILE A 48 -3.952 1.977 4.367 1.00 0.00 C ATOM 706 O ILE A 48 -3.819 3.191 4.220 1.00 0.00 O ATOM 707 CB ILE A 48 -4.886 0.501 2.493 1.00 0.00 C ATOM 708 CG1 ILE A 48 -5.905 -0.619 2.272 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.448 -0.020 2.467 1.00 0.00 C ATOM 710 CD1 ILE A 48 -5.914 -1.071 0.811 1.00 0.00 C ATOM 0 H ILE A 48 -6.234 2.695 2.705 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.461 0.493 4.519 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.991 1.200 1.663 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.667 -1.465 2.917 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.899 -0.272 2.555 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.270 -0.551 1.532 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.756 0.818 2.545 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.292 -0.699 3.305 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.647 -1.868 0.681 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -6.177 -0.229 0.171 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.925 -1.440 0.538 1.00 0.00 H new ATOM 722 N LYS A 49 -3.092 1.201 5.009 1.00 0.00 N ATOM 723 CA LYS A 49 -1.887 1.752 5.606 1.00 0.00 C ATOM 724 C LYS A 49 -0.676 0.939 5.143 1.00 0.00 C ATOM 725 O LYS A 49 -0.661 -0.284 5.268 1.00 0.00 O ATOM 726 CB LYS A 49 -2.030 1.831 7.127 1.00 0.00 C ATOM 727 CG LYS A 49 -2.971 2.968 7.531 1.00 0.00 C ATOM 728 CD LYS A 49 -3.921 2.524 8.646 1.00 0.00 C ATOM 729 CE LYS A 49 -3.669 3.318 9.929 1.00 0.00 C ATOM 730 NZ LYS A 49 -2.394 2.902 10.554 1.00 0.00 N ATOM 0 H LYS A 49 -3.205 0.194 5.129 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.730 2.777 5.271 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.412 0.885 7.510 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.051 1.986 7.580 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.388 3.826 7.865 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.548 3.293 6.665 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.954 2.662 8.325 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.787 1.460 8.840 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.640 4.384 9.704 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.491 3.162 10.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.238 3.451 11.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.436 1.889 10.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.611 3.073 9.892 1.00 0.00 H new ATOM 744 N MET A 50 0.310 1.652 4.619 1.00 0.00 N ATOM 745 CA MET A 50 1.522 1.012 4.137 1.00 0.00 C ATOM 746 C MET A 50 2.648 1.124 5.167 1.00 0.00 C ATOM 747 O MET A 50 2.703 2.088 5.929 1.00 0.00 O ATOM 748 CB MET A 50 1.961 1.670 2.827 1.00 0.00 C ATOM 749 CG MET A 50 2.544 0.636 1.863 1.00 0.00 C ATOM 750 SD MET A 50 4.229 0.259 2.316 1.00 0.00 S ATOM 751 CE MET A 50 5.048 1.725 1.711 1.00 0.00 C ATOM 0 H MET A 50 0.294 2.667 4.518 1.00 0.00 H new ATOM 0 HA MET A 50 1.311 -0.044 3.970 1.00 0.00 H new ATOM 0 HB2 MET A 50 1.109 2.166 2.362 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.705 2.440 3.034 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.942 -0.272 1.883 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.510 1.018 0.843 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.725 1.455 0.901 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.304 2.431 1.342 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.615 2.185 2.520 1.00 0.00 H new ATOM 761 N THR A 51 3.517 0.124 5.157 1.00 0.00 N ATOM 762 CA THR A 51 4.638 0.098 6.082 1.00 0.00 C ATOM 763 C THR A 51 5.779 -0.747 5.512 1.00 0.00 C ATOM 764 O THR A 51 5.550 -1.842 5.001 1.00 0.00 O ATOM 765 CB THR A 51 4.125 -0.405 7.433 1.00 0.00 C ATOM 766 OG1 THR A 51 3.155 0.565 7.818 1.00 0.00 O ATOM 767 CG2 THR A 51 5.189 -0.325 8.529 1.00 0.00 C ATOM 0 H THR A 51 3.468 -0.674 4.524 1.00 0.00 H new ATOM 0 HA THR A 51 5.055 1.095 6.227 1.00 0.00 H new ATOM 0 HB THR A 51 3.785 -1.436 7.332 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.394 1.436 7.436 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.774 -0.694 9.467 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.048 -0.935 8.248 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.505 0.711 8.654 1.00 0.00 H new ATOM 775 N ILE A 52 6.984 -0.207 5.619 1.00 0.00 N ATOM 776 CA ILE A 52 8.161 -0.897 5.121 1.00 0.00 C ATOM 777 C ILE A 52 8.765 -1.742 6.245 1.00 0.00 C ATOM 778 O ILE A 52 9.557 -1.245 7.043 1.00 0.00 O ATOM 779 CB ILE A 52 9.145 0.099 4.504 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.536 0.786 3.281 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.478 -0.579 4.176 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.627 1.271 2.324 1.00 0.00 C ATOM 0 H ILE A 52 7.170 0.701 6.044 1.00 0.00 H new ATOM 0 HA ILE A 52 7.890 -1.581 4.317 1.00 0.00 H new ATOM 0 HB ILE A 52 9.351 0.876 5.240 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.874 0.093 2.762 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.926 1.631 3.600 1.00 0.00 H new ATOM 0 HG21 ILE A 52 11.159 0.151 3.739 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.916 -0.982 5.089 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.309 -1.389 3.466 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.167 1.756 1.463 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.273 1.983 2.839 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.220 0.421 1.987 1.00 0.00 H new ATOM 794 N LEU A 53 8.366 -3.006 6.271 1.00 0.00 N ATOM 795 CA LEU A 53 8.858 -3.925 7.283 1.00 0.00 C ATOM 796 C LEU A 53 10.166 -4.556 6.801 1.00 0.00 C ATOM 797 O LEU A 53 10.428 -4.609 5.600 1.00 0.00 O ATOM 798 CB LEU A 53 7.780 -4.947 7.647 1.00 0.00 C ATOM 799 CG LEU A 53 6.595 -4.414 8.455 1.00 0.00 C ATOM 800 CD1 LEU A 53 7.074 -3.637 9.683 1.00 0.00 C ATOM 801 CD2 LEU A 53 5.663 -3.578 7.575 1.00 0.00 C ATOM 0 H LEU A 53 7.708 -3.415 5.607 1.00 0.00 H new ATOM 0 HA LEU A 53 9.083 -3.390 8.206 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.398 -5.386 6.725 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.248 -5.752 8.214 1.00 0.00 H new ATOM 0 HG LEU A 53 6.018 -5.265 8.817 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.212 -3.269 10.240 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.665 -4.294 10.321 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.687 -2.794 9.364 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.829 -3.211 8.174 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.213 -2.732 7.163 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.282 -4.194 6.761 1.00 0.00 H new ATOM 813 N PRO A 54 10.973 -5.030 7.787 1.00 0.00 N ATOM 814 CA PRO A 54 10.587 -4.928 9.184 1.00 0.00 C ATOM 815 C PRO A 54 10.749 -3.494 9.694 1.00 0.00 C ATOM 816 O PRO A 54 10.077 -3.089 10.641 1.00 0.00 O ATOM 817 CB PRO A 54 11.477 -5.921 9.913 1.00 0.00 C ATOM 818 CG PRO A 54 12.640 -6.203 8.976 1.00 0.00 C ATOM 819 CD PRO A 54 12.269 -5.675 7.600 1.00 0.00 C ATOM 0 HA PRO A 54 9.535 -5.162 9.347 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.828 -5.509 10.859 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.932 -6.836 10.146 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.548 -5.720 9.338 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.844 -7.273 8.932 1.00 0.00 H new ATOM 0 HD2 PRO A 54 13.014 -4.968 7.233 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.208 -6.482 6.870 1.00 0.00 H new ATOM 827 N GLU A 55 11.644 -2.766 9.043 1.00 0.00 N ATOM 828 CA GLU A 55 11.903 -1.387 9.419 1.00 0.00 C ATOM 829 C GLU A 55 10.710 -0.813 10.186 1.00 0.00 C ATOM 830 O GLU A 55 10.818 -0.514 11.374 1.00 0.00 O ATOM 831 CB GLU A 55 12.225 -0.535 8.189 1.00 0.00 C ATOM 832 CG GLU A 55 13.730 -0.514 7.916 1.00 0.00 C ATOM 833 CD GLU A 55 14.038 0.194 6.595 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.219 1.057 6.209 1.00 0.00 O ATOM 835 OE2 GLU A 55 15.085 -0.142 6.001 1.00 0.00 O ATOM 0 H GLU A 55 12.199 -3.105 8.257 1.00 0.00 H new ATOM 0 HA GLU A 55 12.775 -1.367 10.073 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.700 -0.931 7.320 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.865 0.482 8.343 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.244 -0.007 8.733 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.112 -1.535 7.883 1.00 0.00 H new ATOM 842 N LYS A 56 9.601 -0.676 9.475 1.00 0.00 N ATOM 843 CA LYS A 56 8.389 -0.143 10.075 1.00 0.00 C ATOM 844 C LYS A 56 8.566 1.356 10.325 1.00 0.00 C ATOM 845 O LYS A 56 7.707 1.992 10.934 1.00 0.00 O ATOM 846 CB LYS A 56 8.018 -0.936 11.329 1.00 0.00 C ATOM 847 CG LYS A 56 6.528 -0.797 11.646 1.00 0.00 C ATOM 848 CD LYS A 56 6.202 -1.384 13.021 1.00 0.00 C ATOM 849 CE LYS A 56 4.974 -2.293 12.952 1.00 0.00 C ATOM 850 NZ LYS A 56 4.252 -2.288 14.243 1.00 0.00 N ATOM 0 H LYS A 56 9.516 -0.925 8.489 1.00 0.00 H new ATOM 0 HA LYS A 56 7.545 -0.256 9.394 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.266 -1.988 11.185 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.608 -0.582 12.175 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.244 0.255 11.619 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.941 -1.306 10.881 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.057 -1.950 13.391 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.022 -0.577 13.731 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.310 -1.957 12.156 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.280 -3.309 12.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.421 -2.910 14.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.883 -2.630 14.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.943 -1.320 14.464 1.00 0.00 H new ATOM 864 N LYS A 57 9.684 1.876 9.841 1.00 0.00 N ATOM 865 CA LYS A 57 9.984 3.289 10.005 1.00 0.00 C ATOM 866 C LYS A 57 9.102 4.106 9.059 1.00 0.00 C ATOM 867 O LYS A 57 8.280 4.905 9.506 1.00 0.00 O ATOM 868 CB LYS A 57 11.482 3.543 9.822 1.00 0.00 C ATOM 869 CG LYS A 57 11.731 4.901 9.162 1.00 0.00 C ATOM 870 CD LYS A 57 11.117 6.033 9.988 1.00 0.00 C ATOM 871 CE LYS A 57 10.457 7.076 9.084 1.00 0.00 C ATOM 872 NZ LYS A 57 10.003 8.238 9.879 1.00 0.00 N ATOM 0 H LYS A 57 10.393 1.345 9.335 1.00 0.00 H new ATOM 0 HA LYS A 57 9.750 3.613 11.019 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.981 3.508 10.790 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.917 2.752 9.211 1.00 0.00 H new ATOM 0 HG2 LYS A 57 12.803 5.065 9.053 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.305 4.905 8.159 1.00 0.00 H new ATOM 0 HD2 LYS A 57 10.378 5.625 10.678 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.890 6.507 10.592 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.163 7.404 8.321 1.00 0.00 H new ATOM 0 HE3 LYS A 57 9.609 6.630 8.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 9.557 8.936 9.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.313 7.923 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 10.819 8.672 10.356 1.00 0.00 H new ATOM 886 N HIS A 58 9.302 3.877 7.769 1.00 0.00 N ATOM 887 CA HIS A 58 8.534 4.582 6.757 1.00 0.00 C ATOM 888 C HIS A 58 7.075 4.126 6.808 1.00 0.00 C ATOM 889 O HIS A 58 6.723 3.095 6.236 1.00 0.00 O ATOM 890 CB HIS A 58 9.164 4.401 5.374 1.00 0.00 C ATOM 891 CG HIS A 58 10.603 4.850 5.291 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.118 5.867 6.076 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.630 4.409 4.509 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.398 6.023 5.772 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.713 5.119 4.800 1.00 0.00 N ATOM 0 H HIS A 58 9.984 3.214 7.402 1.00 0.00 H new ATOM 0 HA HIS A 58 8.550 5.652 6.963 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.106 3.349 5.094 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.578 4.958 4.643 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.572 3.617 3.777 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.073 6.740 6.216 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.630 5.007 4.368 1.00 0.00 H new ATOM 903 N LYS A 59 6.265 4.915 7.499 1.00 0.00 N ATOM 904 CA LYS A 59 4.852 4.605 7.632 1.00 0.00 C ATOM 905 C LYS A 59 4.035 5.607 6.815 1.00 0.00 C ATOM 906 O LYS A 59 4.130 6.815 7.031 1.00 0.00 O ATOM 907 CB LYS A 59 4.454 4.546 9.108 1.00 0.00 C ATOM 908 CG LYS A 59 4.583 3.122 9.654 1.00 0.00 C ATOM 909 CD LYS A 59 4.692 3.128 11.181 1.00 0.00 C ATOM 910 CE LYS A 59 3.422 2.568 11.823 1.00 0.00 C ATOM 911 NZ LYS A 59 3.642 2.306 13.263 1.00 0.00 N ATOM 0 H LYS A 59 6.561 5.769 7.973 1.00 0.00 H new ATOM 0 HA LYS A 59 4.639 3.615 7.228 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.086 5.220 9.686 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.427 4.893 9.226 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.718 2.532 9.350 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.463 2.642 9.225 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.552 2.534 11.490 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.864 4.145 11.533 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.602 3.275 11.697 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.129 1.646 11.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.770 1.926 13.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.411 1.615 13.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.900 3.193 13.742 1.00 0.00 H new ATOM 925 N VAL A 60 3.251 5.070 5.892 1.00 0.00 N ATOM 926 CA VAL A 60 2.417 5.902 5.041 1.00 0.00 C ATOM 927 C VAL A 60 1.017 5.292 4.951 1.00 0.00 C ATOM 928 O VAL A 60 0.862 4.074 5.021 1.00 0.00 O ATOM 929 CB VAL A 60 3.080 6.081 3.673 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.331 6.956 3.781 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.411 4.727 3.043 1.00 0.00 C ATOM 0 H VAL A 60 3.176 4.068 5.715 1.00 0.00 H new ATOM 0 HA VAL A 60 2.310 6.899 5.469 1.00 0.00 H new ATOM 0 HB VAL A 60 2.370 6.589 3.020 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.783 7.068 2.796 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.056 7.937 4.167 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.046 6.487 4.457 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.881 4.883 2.072 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.094 4.180 3.693 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.494 4.152 2.914 1.00 0.00 H new ATOM 941 N LYS A 61 0.034 6.166 4.798 1.00 0.00 N ATOM 942 CA LYS A 61 -1.348 5.729 4.698 1.00 0.00 C ATOM 943 C LYS A 61 -1.999 6.385 3.479 1.00 0.00 C ATOM 944 O LYS A 61 -1.593 7.468 3.061 1.00 0.00 O ATOM 945 CB LYS A 61 -2.090 5.994 6.009 1.00 0.00 C ATOM 946 CG LYS A 61 -2.069 7.483 6.360 1.00 0.00 C ATOM 947 CD LYS A 61 -2.377 7.701 7.843 1.00 0.00 C ATOM 948 CE LYS A 61 -1.089 7.789 8.664 1.00 0.00 C ATOM 949 NZ LYS A 61 -0.985 9.109 9.325 1.00 0.00 N ATOM 0 H LYS A 61 0.167 7.176 4.741 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.396 4.651 4.544 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.121 5.652 5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.630 5.421 6.814 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.091 7.903 6.122 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.800 8.014 5.751 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.955 8.617 7.967 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -2.994 6.882 8.214 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.074 6.998 9.414 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.226 7.631 8.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.105 9.152 9.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -0.978 9.859 8.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.799 9.245 9.958 1.00 0.00 H new ATOM 963 N THR A 62 -3.000 5.702 2.943 1.00 0.00 N ATOM 964 CA THR A 62 -3.712 6.205 1.780 1.00 0.00 C ATOM 965 C THR A 62 -4.907 7.056 2.214 1.00 0.00 C ATOM 966 O THR A 62 -5.616 6.703 3.155 1.00 0.00 O ATOM 967 CB THR A 62 -4.101 5.009 0.910 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.787 4.137 1.805 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.888 4.196 0.454 1.00 0.00 C ATOM 0 H THR A 62 -3.335 4.804 3.293 1.00 0.00 H new ATOM 0 HA THR A 62 -3.082 6.866 1.185 1.00 0.00 H new ATOM 0 HB THR A 62 -4.651 5.360 0.037 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.239 3.342 1.972 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.221 3.359 -0.160 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.222 4.832 -0.129 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.356 3.817 1.326 1.00 0.00 H new ATOM 977 N ARG A 63 -5.093 8.161 1.507 1.00 0.00 N ATOM 978 CA ARG A 63 -6.190 9.066 1.807 1.00 0.00 C ATOM 979 C ARG A 63 -7.513 8.298 1.856 1.00 0.00 C ATOM 980 O ARG A 63 -7.862 7.594 0.909 1.00 0.00 O ATOM 981 CB ARG A 63 -6.292 10.175 0.758 1.00 0.00 C ATOM 982 CG ARG A 63 -6.310 9.593 -0.656 1.00 0.00 C ATOM 983 CD ARG A 63 -7.639 9.891 -1.354 1.00 0.00 C ATOM 984 NE ARG A 63 -7.457 9.864 -2.823 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.020 10.905 -3.544 1.00 0.00 C ATOM 986 NH1 ARG A 63 -6.718 12.061 -2.938 1.00 0.00 N ATOM 987 NH2 ARG A 63 -6.885 10.790 -4.873 1.00 0.00 N ATOM 0 H ARG A 63 -4.503 8.450 0.727 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.991 9.518 2.779 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.198 10.758 0.927 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.449 10.858 0.863 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.488 10.012 -1.236 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.152 8.515 -0.612 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.387 9.156 -1.058 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.011 10.867 -1.043 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.678 8.999 -3.317 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.821 12.149 -1.927 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.385 12.853 -3.488 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.115 9.910 -5.335 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.552 11.582 -5.422 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.213 8.459 2.969 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.489 7.790 3.154 1.00 0.00 C ATOM 1003 C VAL A 64 -10.541 8.450 2.260 1.00 0.00 C ATOM 1004 O VAL A 64 -10.628 9.675 2.199 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.874 7.797 4.635 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.630 7.745 5.525 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.738 9.014 4.971 1.00 0.00 C ATOM 0 H VAL A 64 -7.920 9.043 3.752 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.418 6.744 2.855 1.00 0.00 H new ATOM 0 HB VAL A 64 -10.465 6.902 4.832 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.931 7.751 6.572 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.069 6.834 5.314 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.002 8.613 5.323 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.998 8.995 6.029 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.184 9.926 4.750 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.649 8.989 4.373 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.313 7.608 1.589 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.355 8.094 0.701 1.00 0.00 C ATOM 1019 C LEU A 65 -13.592 8.459 1.524 1.00 0.00 C ATOM 1020 O LEU A 65 -13.698 8.084 2.691 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.633 7.077 -0.407 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.611 7.028 -1.545 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.435 8.408 -2.183 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.280 6.446 -1.063 1.00 0.00 C ATOM 0 H LEU A 65 -11.238 6.592 1.643 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.029 9.002 0.194 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.693 6.086 0.043 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.612 7.293 -0.834 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.993 6.361 -2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.704 8.346 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.390 8.747 -2.585 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.086 9.115 -1.430 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.572 6.423 -1.891 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.880 7.067 -0.261 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.439 5.433 -0.693 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.496 9.186 0.885 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.721 9.606 1.544 1.00 0.00 C ATOM 1038 C ARG A 66 -16.921 8.855 0.962 1.00 0.00 C ATOM 1039 O ARG A 66 -17.125 8.847 -0.251 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.945 11.111 1.384 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.716 11.899 1.843 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.168 11.343 3.159 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.226 12.311 3.764 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.594 13.482 4.300 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -14.885 13.838 4.310 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.670 14.298 4.827 1.00 0.00 N ATOM 0 H ARG A 66 -14.405 9.495 -0.083 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.622 9.375 2.605 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.161 11.342 0.341 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.815 11.417 1.965 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.943 11.854 1.075 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.979 12.949 1.969 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.988 11.142 3.848 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.662 10.394 2.980 1.00 0.00 H new ATOM 0 HE ARG A 66 -12.235 12.071 3.773 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -15.588 13.217 3.909 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -15.165 14.730 4.718 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.687 14.027 4.820 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.950 15.190 5.235 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.683 8.240 1.855 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.857 7.488 1.446 1.00 0.00 C ATOM 1062 C LYS A 67 -18.501 6.610 0.244 1.00 0.00 C ATOM 1063 O LYS A 67 -18.705 7.008 -0.902 1.00 0.00 O ATOM 1064 CB LYS A 67 -20.035 8.430 1.192 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.869 8.620 2.461 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.380 10.058 2.570 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.694 10.419 4.024 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.452 11.688 4.091 1.00 0.00 N ATOM 0 H LYS A 67 -17.510 8.247 2.860 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.180 6.820 2.245 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.665 9.396 0.848 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.663 8.027 0.397 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -21.713 7.930 2.453 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -20.267 8.377 3.336 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.632 10.745 2.174 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.276 10.177 1.960 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.271 9.619 4.487 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.767 10.512 4.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.657 11.918 5.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -21.888 12.452 3.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.345 11.587 3.568 1.00 0.00 H new ATOM 1082 N THR A 68 -17.975 5.432 0.547 1.00 0.00 N ATOM 1083 CA THR A 68 -17.590 4.495 -0.494 1.00 0.00 C ATOM 1084 C THR A 68 -17.102 3.183 0.124 1.00 0.00 C ATOM 1085 O THR A 68 -16.339 3.193 1.089 1.00 0.00 O ATOM 1086 CB THR A 68 -16.544 5.176 -1.379 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.656 4.502 -2.630 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.112 4.882 -0.925 1.00 0.00 C ATOM 0 H THR A 68 -17.807 5.105 1.499 1.00 0.00 H new ATOM 0 HA THR A 68 -18.441 4.226 -1.120 1.00 0.00 H new ATOM 0 HB THR A 68 -16.712 6.253 -1.376 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.014 4.882 -3.265 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.409 5.389 -1.586 1.00 0.00 H new ATOM 0 HG22 THR A 68 -14.973 5.240 0.095 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.933 3.807 -0.960 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.562 2.085 -0.457 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.182 0.768 0.024 1.00 0.00 C ATOM 1098 C LEU A 69 -15.961 0.277 -0.757 1.00 0.00 C ATOM 1099 O LEU A 69 -15.406 -0.777 -0.450 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.375 -0.188 -0.034 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.451 0.017 1.033 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.254 -1.266 1.257 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -18.841 0.546 2.333 1.00 0.00 C ATOM 0 H LEU A 69 -18.195 2.080 -1.257 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.891 0.815 1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.842 -0.096 -1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.001 -1.209 0.047 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.148 0.774 0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.012 -1.092 2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.738 -1.560 0.325 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.585 -2.062 1.585 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.628 0.683 3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.109 -0.169 2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.351 1.501 2.143 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.580 1.063 -1.753 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.436 0.721 -2.581 1.00 0.00 C ATOM 1117 C ASP A 70 -13.602 1.979 -2.834 1.00 0.00 C ATOM 1118 O ASP A 70 -13.811 2.677 -3.825 1.00 0.00 O ATOM 1119 CB ASP A 70 -14.881 0.168 -3.935 1.00 0.00 C ATOM 1120 CG ASP A 70 -15.958 0.990 -4.647 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.117 0.930 -4.182 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -15.598 1.659 -5.639 1.00 0.00 O ATOM 0 H ASP A 70 -16.043 1.936 -2.005 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.855 -0.037 -2.057 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.010 0.097 -4.586 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.255 -0.846 -3.791 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.649 2.236 -1.898 1.00 0.00 N ATOM 1128 CA PRO A 71 -11.783 3.396 -2.011 1.00 0.00 C ATOM 1129 C PRO A 71 -10.716 3.182 -3.087 1.00 0.00 C ATOM 1130 O PRO A 71 -10.180 2.084 -3.224 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.195 3.585 -0.622 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.388 2.259 0.096 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.373 1.431 -0.712 1.00 0.00 C ATOM 0 HA PRO A 71 -12.319 4.291 -2.328 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.139 3.849 -0.678 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.698 4.393 -0.091 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.437 1.735 0.192 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.765 2.423 1.106 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -11.950 0.463 -0.980 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.284 1.235 -0.146 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.441 4.249 -3.823 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.449 4.192 -4.882 1.00 0.00 C ATOM 1143 C ALA A 72 -8.362 5.234 -4.614 1.00 0.00 C ATOM 1144 O ALA A 72 -8.459 6.371 -5.074 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.133 4.399 -6.235 1.00 0.00 C ATOM 0 H ALA A 72 -10.888 5.158 -3.706 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.969 3.213 -4.905 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.388 4.356 -7.030 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.875 3.616 -6.391 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.623 5.372 -6.250 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.351 4.810 -3.869 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.247 5.693 -3.534 1.00 0.00 C ATOM 1153 C PHE A 73 -5.265 5.811 -4.701 1.00 0.00 C ATOM 1154 O PHE A 73 -4.788 6.902 -5.009 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.525 5.071 -2.337 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.461 4.430 -1.310 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.319 5.205 -0.595 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.434 3.084 -1.114 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.188 4.609 0.358 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.303 2.489 -0.161 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.161 3.264 0.554 1.00 0.00 C ATOM 0 H PHE A 73 -7.274 3.867 -3.488 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.624 6.691 -3.309 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.827 4.316 -2.699 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.933 5.841 -1.843 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.340 6.273 -0.751 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.752 2.469 -1.682 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.870 5.224 0.926 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.282 1.421 -0.004 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.822 2.811 1.278 1.00 0.00 H new ATOM 1171 N ASP A 74 -4.991 4.671 -5.320 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.075 4.633 -6.447 1.00 0.00 C ATOM 1173 C ASP A 74 -2.915 5.597 -6.189 1.00 0.00 C ATOM 1174 O ASP A 74 -2.507 6.337 -7.083 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.771 5.066 -7.739 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.326 4.317 -8.996 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.121 4.407 -9.313 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -5.202 3.672 -9.612 1.00 0.00 O ATOM 0 H ASP A 74 -5.388 3.767 -5.062 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.718 3.609 -6.556 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.846 4.933 -7.617 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.596 6.131 -7.888 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.417 5.557 -4.962 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.312 6.418 -4.575 1.00 0.00 C ATOM 1185 C GLU A 75 0.023 5.723 -4.847 1.00 0.00 C ATOM 1186 O GLU A 75 0.051 4.575 -5.289 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.427 6.830 -3.106 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.349 8.041 -2.946 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.550 9.346 -2.970 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.483 9.370 -2.319 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -2.024 10.289 -3.639 1.00 0.00 O ATOM 0 H GLU A 75 -2.758 4.942 -4.223 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.356 7.325 -5.177 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.812 5.996 -2.520 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.438 7.067 -2.713 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.088 8.048 -3.747 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.897 7.963 -2.007 1.00 0.00 H new ATOM 1198 N THR A 76 1.098 6.447 -4.571 1.00 0.00 N ATOM 1199 CA THR A 76 2.434 5.914 -4.780 1.00 0.00 C ATOM 1200 C THR A 76 3.437 6.611 -3.859 1.00 0.00 C ATOM 1201 O THR A 76 3.450 7.838 -3.765 1.00 0.00 O ATOM 1202 CB THR A 76 2.772 6.056 -6.265 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.978 5.057 -6.899 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.211 5.642 -6.580 1.00 0.00 C ATOM 0 H THR A 76 1.071 7.398 -4.204 1.00 0.00 H new ATOM 0 HA THR A 76 2.483 4.857 -4.520 1.00 0.00 H new ATOM 0 HB THR A 76 2.615 7.089 -6.576 1.00 0.00 H new ATOM 0 HG1 THR A 76 1.326 5.485 -7.492 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.399 5.762 -7.647 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.902 6.270 -6.017 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.359 4.599 -6.301 1.00 0.00 H new ATOM 1212 N PHE A 77 4.252 5.799 -3.201 1.00 0.00 N ATOM 1213 CA PHE A 77 5.256 6.323 -2.291 1.00 0.00 C ATOM 1214 C PHE A 77 6.658 5.866 -2.699 1.00 0.00 C ATOM 1215 O PHE A 77 6.936 4.669 -2.746 1.00 0.00 O ATOM 1216 CB PHE A 77 4.935 5.766 -0.903 1.00 0.00 C ATOM 1217 CG PHE A 77 3.556 6.167 -0.374 1.00 0.00 C ATOM 1218 CD1 PHE A 77 3.387 7.369 0.240 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.500 5.323 -0.518 1.00 0.00 C ATOM 1220 CE1 PHE A 77 2.108 7.742 0.730 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.221 5.695 -0.028 1.00 0.00 C ATOM 1222 CZ PHE A 77 1.051 6.897 0.586 1.00 0.00 C ATOM 0 H PHE A 77 4.237 4.782 -3.280 1.00 0.00 H new ATOM 0 HA PHE A 77 5.240 7.413 -2.306 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.998 4.678 -0.936 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.695 6.108 -0.201 1.00 0.00 H new ATOM 0 HD1 PHE A 77 4.226 8.040 0.355 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.634 4.369 -1.006 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.974 8.696 1.217 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.383 5.024 -0.143 1.00 0.00 H new ATOM 0 HZ PHE A 77 0.078 7.180 0.959 1.00 0.00 H new ATOM 1232 N THR A 78 7.504 6.845 -2.985 1.00 0.00 N ATOM 1233 CA THR A 78 8.870 6.559 -3.388 1.00 0.00 C ATOM 1234 C THR A 78 9.815 6.676 -2.190 1.00 0.00 C ATOM 1235 O THR A 78 9.688 7.595 -1.382 1.00 0.00 O ATOM 1236 CB THR A 78 9.230 7.499 -4.540 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.683 6.861 -5.692 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.735 7.538 -4.816 1.00 0.00 C ATOM 0 H THR A 78 7.270 7.837 -2.946 1.00 0.00 H new ATOM 0 HA THR A 78 8.971 5.533 -3.743 1.00 0.00 H new ATOM 0 HB THR A 78 8.877 8.505 -4.312 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.869 7.404 -6.486 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.936 8.220 -5.642 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.259 7.883 -3.925 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.083 6.539 -5.077 1.00 0.00 H new ATOM 1246 N PHE A 79 10.742 5.733 -2.114 1.00 0.00 N ATOM 1247 CA PHE A 79 11.708 5.719 -1.029 1.00 0.00 C ATOM 1248 C PHE A 79 13.124 5.478 -1.558 1.00 0.00 C ATOM 1249 O PHE A 79 13.412 4.418 -2.111 1.00 0.00 O ATOM 1250 CB PHE A 79 11.321 4.567 -0.100 1.00 0.00 C ATOM 1251 CG PHE A 79 9.825 4.495 0.213 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.242 5.461 0.973 1.00 0.00 C ATOM 1253 CD2 PHE A 79 9.078 3.466 -0.270 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.854 5.395 1.263 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.690 3.400 0.020 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.107 4.366 0.780 1.00 0.00 C ATOM 0 H PHE A 79 10.845 4.973 -2.786 1.00 0.00 H new ATOM 0 HA PHE A 79 11.700 6.679 -0.512 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.632 3.627 -0.555 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.873 4.667 0.835 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.835 6.278 1.356 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.541 2.699 -0.874 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.391 6.162 1.867 1.00 0.00 H new ATOM 0 HE2 PHE A 79 7.097 2.583 -0.363 1.00 0.00 H new ATOM 0 HZ PHE A 79 6.051 4.316 1.000 1.00 0.00 H new ATOM 1266 N TYR A 80 13.970 6.480 -1.369 1.00 0.00 N ATOM 1267 CA TYR A 80 15.348 6.391 -1.820 1.00 0.00 C ATOM 1268 C TYR A 80 16.251 5.831 -0.718 1.00 0.00 C ATOM 1269 O TYR A 80 15.835 5.723 0.435 1.00 0.00 O ATOM 1270 CB TYR A 80 15.782 7.823 -2.139 1.00 0.00 C ATOM 1271 CG TYR A 80 15.170 8.387 -3.423 1.00 0.00 C ATOM 1272 CD1 TYR A 80 13.963 9.055 -3.377 1.00 0.00 C ATOM 1273 CD2 TYR A 80 15.825 8.227 -4.627 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.388 9.585 -4.585 1.00 0.00 C ATOM 1275 CE2 TYR A 80 15.249 8.757 -5.836 1.00 0.00 C ATOM 1276 CZ TYR A 80 14.059 9.410 -5.755 1.00 0.00 C ATOM 1277 OH TYR A 80 13.515 9.911 -6.897 1.00 0.00 O ATOM 0 H TYR A 80 13.727 7.358 -0.910 1.00 0.00 H new ATOM 0 HA TYR A 80 15.427 5.729 -2.682 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.509 8.469 -1.304 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.868 7.852 -2.223 1.00 0.00 H new ATOM 0 HD1 TYR A 80 13.450 9.180 -2.435 1.00 0.00 H new ATOM 0 HD2 TYR A 80 16.769 7.704 -4.663 1.00 0.00 H new ATOM 0 HE1 TYR A 80 12.445 10.110 -4.563 1.00 0.00 H new ATOM 0 HE2 TYR A 80 15.751 8.639 -6.785 1.00 0.00 H new ATOM 0 HH TYR A 80 14.188 10.437 -7.377 1.00 0.00 H new ATOM 1287 N GLY A 81 17.469 5.490 -1.111 1.00 0.00 N ATOM 1288 CA GLY A 81 18.433 4.944 -0.171 1.00 0.00 C ATOM 1289 C GLY A 81 18.269 3.429 -0.035 1.00 0.00 C ATOM 1290 O GLY A 81 19.250 2.689 -0.074 1.00 0.00 O ATOM 0 H GLY A 81 17.811 5.581 -2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.444 5.175 -0.506 1.00 0.00 H new ATOM 0 HA3 GLY A 81 18.304 5.416 0.803 1.00 0.00 H new ATOM 1294 N ILE A 82 17.021 3.013 0.123 1.00 0.00 N ATOM 1295 CA ILE A 82 16.715 1.600 0.266 1.00 0.00 C ATOM 1296 C ILE A 82 17.360 0.824 -0.884 1.00 0.00 C ATOM 1297 O ILE A 82 16.982 0.996 -2.042 1.00 0.00 O ATOM 1298 CB ILE A 82 15.204 1.388 0.380 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.689 1.840 1.748 1.00 0.00 C ATOM 1300 CG2 ILE A 82 14.831 -0.065 0.078 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.327 2.525 1.621 1.00 0.00 C ATOM 0 H ILE A 82 16.210 3.630 0.155 1.00 0.00 H new ATOM 0 HA ILE A 82 17.139 1.210 1.191 1.00 0.00 H new ATOM 0 HB ILE A 82 14.714 2.009 -0.370 1.00 0.00 H new ATOM 0 HG12 ILE A 82 14.607 0.980 2.412 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.404 2.526 2.202 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.752 -0.189 0.166 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.144 -0.318 -0.935 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.331 -0.724 0.788 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.983 2.837 2.607 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.418 3.399 0.976 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.608 1.828 1.190 1.00 0.00 H new ATOM 1313 N PRO A 83 18.348 -0.034 -0.516 1.00 0.00 N ATOM 1314 CA PRO A 83 19.049 -0.837 -1.503 1.00 0.00 C ATOM 1315 C PRO A 83 18.176 -1.996 -1.989 1.00 0.00 C ATOM 1316 O PRO A 83 17.491 -2.637 -1.193 1.00 0.00 O ATOM 1317 CB PRO A 83 20.317 -1.301 -0.805 1.00 0.00 C ATOM 1318 CG PRO A 83 20.059 -1.132 0.683 1.00 0.00 C ATOM 1319 CD PRO A 83 18.822 -0.264 0.846 1.00 0.00 C ATOM 0 HA PRO A 83 19.290 -0.276 -2.406 1.00 0.00 H new ATOM 0 HB2 PRO A 83 20.538 -2.340 -1.047 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.176 -0.710 -1.122 1.00 0.00 H new ATOM 0 HG2 PRO A 83 19.910 -2.102 1.157 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.917 -0.668 1.169 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.064 -0.764 1.450 1.00 0.00 H new ATOM 0 HD3 PRO A 83 19.060 0.675 1.346 1.00 0.00 H new ATOM 1327 N TYR A 84 18.227 -2.228 -3.292 1.00 0.00 N ATOM 1328 CA TYR A 84 17.449 -3.298 -3.893 1.00 0.00 C ATOM 1329 C TYR A 84 17.556 -4.583 -3.069 1.00 0.00 C ATOM 1330 O TYR A 84 16.546 -5.219 -2.770 1.00 0.00 O ATOM 1331 CB TYR A 84 18.061 -3.539 -5.274 1.00 0.00 C ATOM 1332 CG TYR A 84 17.429 -4.704 -6.039 1.00 0.00 C ATOM 1333 CD1 TYR A 84 16.063 -4.747 -6.226 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.227 -5.712 -6.543 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.468 -5.844 -6.946 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.632 -6.809 -7.262 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.283 -6.821 -7.428 1.00 0.00 C ATOM 1338 OH TYR A 84 15.721 -7.856 -8.108 1.00 0.00 O ATOM 0 H TYR A 84 18.795 -1.693 -3.949 1.00 0.00 H new ATOM 0 HA TYR A 84 16.395 -3.025 -3.945 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.961 -2.631 -5.868 1.00 0.00 H new ATOM 0 HB3 TYR A 84 19.128 -3.729 -5.159 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.439 -3.958 -5.833 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.297 -5.678 -6.398 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.400 -5.890 -7.100 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.244 -7.605 -7.660 1.00 0.00 H new ATOM 0 HH TYR A 84 15.772 -8.670 -7.565 1.00 0.00 H new ATOM 1348 N THR A 85 18.788 -4.927 -2.726 1.00 0.00 N ATOM 1349 CA THR A 85 19.040 -6.124 -1.942 1.00 0.00 C ATOM 1350 C THR A 85 18.222 -6.098 -0.650 1.00 0.00 C ATOM 1351 O THR A 85 17.913 -7.146 -0.085 1.00 0.00 O ATOM 1352 CB THR A 85 20.548 -6.225 -1.704 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.853 -5.080 -0.913 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.358 -6.018 -2.986 1.00 0.00 C ATOM 0 H THR A 85 19.623 -4.398 -2.977 1.00 0.00 H new ATOM 0 HA THR A 85 18.720 -7.019 -2.474 1.00 0.00 H new ATOM 0 HB THR A 85 20.783 -7.201 -1.279 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.812 -5.068 -0.711 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.422 -6.100 -2.762 1.00 0.00 H new ATOM 0 HG22 THR A 85 21.082 -6.778 -3.717 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.148 -5.029 -3.393 1.00 0.00 H new ATOM 1362 N GLN A 86 17.894 -4.889 -0.219 1.00 0.00 N ATOM 1363 CA GLN A 86 17.117 -4.712 0.996 1.00 0.00 C ATOM 1364 C GLN A 86 15.633 -4.954 0.717 1.00 0.00 C ATOM 1365 O GLN A 86 14.841 -5.115 1.645 1.00 0.00 O ATOM 1366 CB GLN A 86 17.344 -3.323 1.595 1.00 0.00 C ATOM 1367 CG GLN A 86 17.757 -3.419 3.065 1.00 0.00 C ATOM 1368 CD GLN A 86 19.186 -2.913 3.267 1.00 0.00 C ATOM 1369 OE1 GLN A 86 20.159 -3.587 2.972 1.00 0.00 O ATOM 1370 NE2 GLN A 86 19.258 -1.690 3.787 1.00 0.00 N ATOM 0 H GLN A 86 18.152 -4.022 -0.690 1.00 0.00 H new ATOM 0 HA GLN A 86 17.453 -5.446 1.729 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.117 -2.802 1.030 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.432 -2.732 1.508 1.00 0.00 H new ATOM 0 HG2 GLN A 86 17.071 -2.835 3.678 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.683 -4.453 3.400 1.00 0.00 H new ATOM 0 HE21 GLN A 86 18.404 -1.180 4.011 1.00 0.00 H new ATOM 0 HE22 GLN A 86 20.168 -1.263 3.961 1.00 0.00 H new ATOM 1379 N ILE A 87 15.299 -4.971 -0.565 1.00 0.00 N ATOM 1380 CA ILE A 87 13.924 -5.190 -0.978 1.00 0.00 C ATOM 1381 C ILE A 87 13.485 -6.592 -0.552 1.00 0.00 C ATOM 1382 O ILE A 87 12.495 -6.746 0.162 1.00 0.00 O ATOM 1383 CB ILE A 87 13.765 -4.925 -2.477 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.348 -3.562 -2.857 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.304 -5.063 -2.907 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.381 -2.432 -2.498 1.00 0.00 C ATOM 0 H ILE A 87 15.958 -4.836 -1.332 1.00 0.00 H new ATOM 0 HA ILE A 87 13.260 -4.483 -0.481 1.00 0.00 H new ATOM 0 HB ILE A 87 14.332 -5.681 -3.019 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.296 -3.412 -2.341 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.560 -3.538 -3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.220 -4.870 -3.976 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.955 -6.073 -2.692 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.694 -4.345 -2.359 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.820 -1.475 -2.779 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.443 -2.572 -3.034 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.191 -2.443 -1.425 1.00 0.00 H new ATOM 1398 N GLN A 88 14.242 -7.579 -1.008 1.00 0.00 N ATOM 1399 CA GLN A 88 13.944 -8.963 -0.683 1.00 0.00 C ATOM 1400 C GLN A 88 13.840 -9.142 0.833 1.00 0.00 C ATOM 1401 O GLN A 88 13.272 -10.123 1.308 1.00 0.00 O ATOM 1402 CB GLN A 88 14.995 -9.904 -1.275 1.00 0.00 C ATOM 1403 CG GLN A 88 15.004 -9.824 -2.803 1.00 0.00 C ATOM 1404 CD GLN A 88 16.368 -10.230 -3.366 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.909 -11.278 -3.056 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.891 -9.343 -4.207 1.00 0.00 N ATOM 0 H GLN A 88 15.062 -7.447 -1.600 1.00 0.00 H new ATOM 0 HA GLN A 88 12.982 -9.221 -1.127 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.980 -9.644 -0.888 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.789 -10.928 -0.962 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.230 -10.476 -3.209 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.764 -8.809 -3.119 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.384 -8.485 -4.423 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.799 -9.521 -4.636 1.00 0.00 H new ATOM 1415 N GLU A 89 14.398 -8.177 1.550 1.00 0.00 N ATOM 1416 CA GLU A 89 14.375 -8.216 3.002 1.00 0.00 C ATOM 1417 C GLU A 89 13.231 -7.354 3.538 1.00 0.00 C ATOM 1418 O GLU A 89 12.724 -7.598 4.632 1.00 0.00 O ATOM 1419 CB GLU A 89 15.718 -7.768 3.584 1.00 0.00 C ATOM 1420 CG GLU A 89 16.718 -8.926 3.610 1.00 0.00 C ATOM 1421 CD GLU A 89 16.643 -9.684 4.937 1.00 0.00 C ATOM 1422 OE1 GLU A 89 16.664 -9.001 5.983 1.00 0.00 O ATOM 1423 OE2 GLU A 89 16.567 -10.930 4.875 1.00 0.00 O ATOM 0 H GLU A 89 14.868 -7.364 1.152 1.00 0.00 H new ATOM 0 HA GLU A 89 14.206 -9.246 3.316 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.121 -6.948 2.989 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.571 -7.387 4.595 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.512 -9.608 2.785 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.728 -8.543 3.462 1.00 0.00 H new ATOM 1430 N LEU A 90 12.857 -6.362 2.743 1.00 0.00 N ATOM 1431 CA LEU A 90 11.781 -5.462 3.124 1.00 0.00 C ATOM 1432 C LEU A 90 10.467 -6.243 3.185 1.00 0.00 C ATOM 1433 O LEU A 90 10.466 -7.471 3.113 1.00 0.00 O ATOM 1434 CB LEU A 90 11.736 -4.254 2.186 1.00 0.00 C ATOM 1435 CG LEU A 90 12.599 -3.058 2.591 1.00 0.00 C ATOM 1436 CD1 LEU A 90 13.575 -3.439 3.707 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.319 -2.464 1.378 1.00 0.00 C ATOM 0 H LEU A 90 13.280 -6.162 1.837 1.00 0.00 H new ATOM 0 HA LEU A 90 11.958 -5.056 4.120 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.044 -4.579 1.192 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.702 -3.920 2.106 1.00 0.00 H new ATOM 0 HG LEU A 90 11.943 -2.283 2.987 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.177 -2.571 3.976 1.00 0.00 H new ATOM 0 HD12 LEU A 90 13.016 -3.778 4.579 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.228 -4.240 3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.925 -1.615 1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 90 13.961 -3.222 0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.584 -2.131 0.645 1.00 0.00 H new ATOM 1449 N ALA A 91 9.379 -5.498 3.317 1.00 0.00 N ATOM 1450 CA ALA A 91 8.061 -6.105 3.388 1.00 0.00 C ATOM 1451 C ALA A 91 7.010 -5.010 3.584 1.00 0.00 C ATOM 1452 O ALA A 91 7.193 -4.109 4.401 1.00 0.00 O ATOM 1453 CB ALA A 91 8.037 -7.144 4.511 1.00 0.00 C ATOM 0 H ALA A 91 9.384 -4.480 3.377 1.00 0.00 H new ATOM 0 HA ALA A 91 7.827 -6.624 2.459 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.048 -7.599 4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.781 -7.915 4.310 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.265 -6.659 5.460 1.00 0.00 H new ATOM 1459 N LEU A 92 5.933 -5.125 2.822 1.00 0.00 N ATOM 1460 CA LEU A 92 4.853 -4.156 2.901 1.00 0.00 C ATOM 1461 C LEU A 92 3.731 -4.720 3.775 1.00 0.00 C ATOM 1462 O LEU A 92 3.417 -5.907 3.699 1.00 0.00 O ATOM 1463 CB LEU A 92 4.395 -3.747 1.500 1.00 0.00 C ATOM 1464 CG LEU A 92 5.507 -3.457 0.489 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.934 -3.277 -0.918 1.00 0.00 C ATOM 1466 CD2 LEU A 92 6.344 -2.253 0.925 1.00 0.00 C ATOM 0 H LEU A 92 5.785 -5.875 2.146 1.00 0.00 H new ATOM 0 HA LEU A 92 5.199 -3.239 3.378 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.765 -4.541 1.099 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.771 -2.858 1.588 1.00 0.00 H new ATOM 0 HG LEU A 92 6.174 -4.318 0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.744 -3.072 -1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.416 -4.188 -1.219 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.232 -2.443 -0.921 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.127 -2.069 0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.704 -1.374 1.002 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.798 -2.458 1.895 1.00 0.00 H new ATOM 1478 N HIS A 93 3.156 -3.843 4.584 1.00 0.00 N ATOM 1479 CA HIS A 93 2.075 -4.239 5.471 1.00 0.00 C ATOM 1480 C HIS A 93 0.847 -3.366 5.205 1.00 0.00 C ATOM 1481 O HIS A 93 0.814 -2.199 5.592 1.00 0.00 O ATOM 1482 CB HIS A 93 2.528 -4.195 6.932 1.00 0.00 C ATOM 1483 CG HIS A 93 1.483 -4.672 7.913 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.890 -3.835 8.842 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.932 -5.905 8.099 1.00 0.00 C ATOM 1486 CE1 HIS A 93 0.024 -4.544 9.551 1.00 0.00 C ATOM 1487 NE2 HIS A 93 0.051 -5.827 9.089 1.00 0.00 N ATOM 0 H HIS A 93 3.418 -2.859 4.644 1.00 0.00 H new ATOM 0 HA HIS A 93 1.794 -5.273 5.269 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.423 -4.808 7.043 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.809 -3.172 7.184 1.00 0.00 H new ATOM 0 HD2 HIS A 93 1.172 -6.795 7.536 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.595 -4.171 10.354 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.513 -6.599 9.445 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.133 -3.966 4.546 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.361 -3.259 4.223 1.00 0.00 C ATOM 1497 C PHE A 94 -2.434 -3.511 5.283 1.00 0.00 C ATOM 1498 O PHE A 94 -2.846 -4.651 5.495 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.850 -3.802 2.879 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.896 -3.533 1.714 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.361 -2.293 1.545 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.581 -4.533 0.847 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.524 -2.043 0.464 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.304 -4.282 -0.234 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.839 -3.043 -0.403 1.00 0.00 C ATOM 0 H PHE A 94 -0.102 -4.934 4.227 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.173 -2.186 4.184 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.004 -4.877 2.968 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.819 -3.359 2.651 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.610 -1.499 2.234 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.004 -5.518 0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.948 -1.059 0.330 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.553 -5.076 -0.923 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.513 -2.853 -1.225 1.00 0.00 H new ATOM 1515 N THR A 95 -2.857 -2.430 5.921 1.00 0.00 N ATOM 1516 CA THR A 95 -3.875 -2.520 6.954 1.00 0.00 C ATOM 1517 C THR A 95 -5.137 -1.769 6.525 1.00 0.00 C ATOM 1518 O THR A 95 -5.105 -0.556 6.326 1.00 0.00 O ATOM 1519 CB THR A 95 -3.271 -1.998 8.259 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.038 -2.701 8.377 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.069 -2.434 9.489 1.00 0.00 C ATOM 0 H THR A 95 -2.513 -1.486 5.743 1.00 0.00 H new ATOM 0 HA THR A 95 -4.187 -3.552 7.114 1.00 0.00 H new ATOM 0 HB THR A 95 -3.222 -0.910 8.226 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.363 -2.113 8.776 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.598 -2.037 10.388 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.088 -2.054 9.415 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.091 -3.523 9.541 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.220 -2.523 6.396 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.491 -1.944 5.995 1.00 0.00 C ATOM 1531 C ILE A 96 -8.221 -1.421 7.234 1.00 0.00 C ATOM 1532 O ILE A 96 -8.839 -2.193 7.966 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.304 -2.952 5.181 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.565 -3.347 3.901 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.707 -2.415 4.889 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.285 -4.121 4.224 1.00 0.00 C ATOM 0 H ILE A 96 -6.243 -3.529 6.562 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.331 -1.091 5.335 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.422 -3.857 5.777 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.215 -3.958 3.275 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.319 -2.453 3.328 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.265 -3.150 4.309 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.226 -2.224 5.828 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.631 -1.488 4.321 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.779 -4.390 3.297 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.626 -3.499 4.830 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.537 -5.027 4.776 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.127 -0.114 7.429 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.772 0.521 8.566 1.00 0.00 C ATOM 1550 C LEU A 97 -10.166 0.999 8.154 1.00 0.00 C ATOM 1551 O LEU A 97 -10.639 0.681 7.065 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.884 1.630 9.134 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.654 1.168 9.919 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -7.008 0.893 11.381 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.000 -0.042 9.250 1.00 0.00 C ATOM 0 H LEU A 97 -7.614 0.523 6.819 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.907 -0.195 9.377 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.549 2.258 8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.492 2.257 9.786 1.00 0.00 H new ATOM 0 HG LEU A 97 -5.921 1.975 9.912 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.116 0.566 11.916 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.393 1.804 11.840 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -7.767 0.113 11.431 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.129 -0.350 9.828 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.715 -0.864 9.205 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.690 0.224 8.240 1.00 0.00 H new ATOM 1567 N SER A 98 -10.784 1.757 9.048 1.00 0.00 N ATOM 1568 CA SER A 98 -12.114 2.282 8.792 1.00 0.00 C ATOM 1569 C SER A 98 -12.298 3.618 9.516 1.00 0.00 C ATOM 1570 O SER A 98 -12.634 3.645 10.699 1.00 0.00 O ATOM 1571 CB SER A 98 -13.193 1.289 9.229 1.00 0.00 C ATOM 1572 OG SER A 98 -14.216 1.147 8.248 1.00 0.00 O ATOM 0 H SER A 98 -10.388 2.020 9.950 1.00 0.00 H new ATOM 0 HA SER A 98 -12.218 2.440 7.718 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.736 0.318 9.420 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.635 1.623 10.168 1.00 0.00 H new ATOM 0 HG SER A 98 -14.987 1.697 8.498 1.00 0.00 H new ATOM 1701 N ASP A 106 -10.400 1.483 13.239 1.00 0.00 N ATOM 1702 CA ASP A 106 -10.677 0.069 13.422 1.00 0.00 C ATOM 1703 C ASP A 106 -10.117 -0.714 12.232 1.00 0.00 C ATOM 1704 O ASP A 106 -10.642 -0.624 11.123 1.00 0.00 O ATOM 1705 CB ASP A 106 -12.182 -0.193 13.494 1.00 0.00 C ATOM 1706 CG ASP A 106 -12.727 -0.450 14.900 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -12.768 0.526 15.680 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -13.092 -1.616 15.163 1.00 0.00 O ATOM 0 HA ASP A 106 -10.211 -0.248 14.355 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -12.705 0.663 13.069 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -12.416 -1.053 12.867 1.00 0.00 H new ATOM 1713 N ILE A 107 -9.060 -1.465 12.503 1.00 0.00 N ATOM 1714 CA ILE A 107 -8.423 -2.263 11.469 1.00 0.00 C ATOM 1715 C ILE A 107 -9.399 -3.338 10.988 1.00 0.00 C ATOM 1716 O ILE A 107 -9.520 -4.394 11.607 1.00 0.00 O ATOM 1717 CB ILE A 107 -7.089 -2.822 11.968 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -6.143 -1.693 12.382 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -6.458 -3.746 10.926 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -5.023 -2.220 13.283 1.00 0.00 C ATOM 0 H ILE A 107 -8.628 -1.538 13.424 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.179 -1.644 10.606 1.00 0.00 H new ATOM 0 HB ILE A 107 -7.281 -3.423 12.857 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -5.713 -1.230 11.494 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -6.703 -0.918 12.906 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -5.511 -4.130 11.306 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -7.131 -4.579 10.723 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.281 -3.189 10.006 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -4.364 -1.398 13.563 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -5.456 -2.661 14.181 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -4.451 -2.977 12.747 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.071 -3.033 9.887 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.033 -3.960 9.316 1.00 0.00 C ATOM 1734 C ILE A 108 -10.345 -5.300 9.046 1.00 0.00 C ATOM 1735 O ILE A 108 -10.944 -6.358 9.233 1.00 0.00 O ATOM 1736 CB ILE A 108 -11.697 -3.350 8.080 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.574 -2.156 8.462 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.478 -4.408 7.298 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.985 -1.359 7.223 1.00 0.00 C ATOM 0 H ILE A 108 -9.968 -2.157 9.375 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.841 -4.152 10.021 1.00 0.00 H new ATOM 0 HB ILE A 108 -10.913 -2.976 7.421 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.464 -2.506 8.985 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.033 -1.509 9.152 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -12.940 -3.948 6.425 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.799 -5.197 6.976 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.252 -4.834 7.936 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.608 -0.516 7.523 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.094 -0.990 6.716 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.547 -2.003 6.546 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.097 -5.210 8.612 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.321 -6.402 8.314 1.00 0.00 C ATOM 1753 C GLY A 109 -6.831 -6.073 8.202 1.00 0.00 C ATOM 1754 O GLY A 109 -6.437 -4.914 8.321 1.00 0.00 O ATOM 0 H GLY A 109 -8.604 -4.330 8.459 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.475 -7.145 9.096 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.671 -6.844 7.381 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.043 -7.113 7.974 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.605 -6.949 7.844 1.00 0.00 C ATOM 1760 C GLU A 110 -4.096 -7.687 6.605 1.00 0.00 C ATOM 1761 O GLU A 110 -4.622 -8.740 6.245 1.00 0.00 O ATOM 1762 CB GLU A 110 -3.883 -7.430 9.104 1.00 0.00 C ATOM 1763 CG GLU A 110 -3.591 -6.262 10.049 1.00 0.00 C ATOM 1764 CD GLU A 110 -2.993 -6.759 11.366 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -3.781 -7.272 12.190 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -1.761 -6.615 11.520 1.00 0.00 O ATOM 0 H GLU A 110 -6.373 -8.073 7.876 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.389 -5.887 7.724 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.494 -8.173 9.616 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.950 -7.921 8.828 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.900 -5.567 9.571 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.511 -5.712 10.248 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.079 -7.106 5.985 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.494 -7.696 4.793 1.00 0.00 C ATOM 1775 C VAL A 111 -0.984 -7.444 4.793 1.00 0.00 C ATOM 1776 O VAL A 111 -0.529 -6.385 5.222 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.190 -7.153 3.544 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.267 -7.225 2.326 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.503 -7.894 3.282 1.00 0.00 C ATOM 0 H VAL A 111 -2.645 -6.233 6.286 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.644 -8.776 4.789 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.427 -6.104 3.722 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.787 -6.833 1.452 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.372 -6.632 2.512 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.984 -8.262 2.145 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.978 -7.488 2.388 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.299 -8.955 3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.169 -7.767 4.136 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.251 -8.435 4.308 1.00 0.00 N ATOM 1790 CA LEU A 112 1.197 -8.333 4.246 1.00 0.00 C ATOM 1791 C LEU A 112 1.693 -8.958 2.941 1.00 0.00 C ATOM 1792 O LEU A 112 1.101 -9.914 2.442 1.00 0.00 O ATOM 1793 CB LEU A 112 1.830 -8.942 5.499 1.00 0.00 C ATOM 1794 CG LEU A 112 3.359 -9.014 5.511 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.963 -7.732 6.087 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.843 -10.260 6.255 1.00 0.00 C ATOM 0 H LEU A 112 -0.633 -9.312 3.954 1.00 0.00 H new ATOM 0 HA LEU A 112 1.505 -7.288 4.236 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.507 -8.362 6.364 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.438 -9.951 5.627 1.00 0.00 H new ATOM 0 HG LEU A 112 3.705 -9.099 4.481 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.050 -7.809 6.084 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.658 -6.881 5.478 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.612 -7.592 7.109 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.933 -10.287 6.249 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.487 -10.230 7.285 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.455 -11.152 5.762 1.00 0.00 H new ATOM 1808 N ILE A 113 2.775 -8.393 2.425 1.00 0.00 N ATOM 1809 CA ILE A 113 3.357 -8.883 1.187 1.00 0.00 C ATOM 1810 C ILE A 113 4.879 -8.736 1.251 1.00 0.00 C ATOM 1811 O ILE A 113 5.411 -7.650 1.027 1.00 0.00 O ATOM 1812 CB ILE A 113 2.722 -8.185 -0.017 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.578 -9.149 -1.196 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.504 -6.927 -0.397 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.211 -9.836 -1.180 1.00 0.00 C ATOM 0 H ILE A 113 3.264 -7.601 2.842 1.00 0.00 H new ATOM 0 HA ILE A 113 3.144 -9.944 1.060 1.00 0.00 H new ATOM 0 HB ILE A 113 1.718 -7.867 0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.705 -8.605 -2.132 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.367 -9.900 -1.154 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.031 -6.450 -1.256 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.510 -6.234 0.445 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.529 -7.198 -0.651 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.135 -10.516 -2.029 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.097 -10.399 -0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.425 -9.084 -1.246 1.00 0.00 H new ATOM 1827 N PRO A 114 5.554 -9.873 1.567 1.00 0.00 N ATOM 1828 CA PRO A 114 7.004 -9.881 1.663 1.00 0.00 C ATOM 1829 C PRO A 114 7.645 -9.844 0.274 1.00 0.00 C ATOM 1830 O PRO A 114 7.428 -10.741 -0.538 1.00 0.00 O ATOM 1831 CB PRO A 114 7.340 -11.144 2.439 1.00 0.00 C ATOM 1832 CG PRO A 114 6.109 -12.031 2.346 1.00 0.00 C ATOM 1833 CD PRO A 114 4.957 -11.178 1.839 1.00 0.00 C ATOM 0 HA PRO A 114 7.397 -9.001 2.172 1.00 0.00 H new ATOM 0 HB2 PRO A 114 8.213 -11.642 2.016 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.577 -10.913 3.477 1.00 0.00 H new ATOM 0 HG2 PRO A 114 6.291 -12.867 1.671 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.870 -12.455 3.321 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.513 -11.606 0.940 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.163 -11.103 2.582 1.00 0.00 H new ATOM 1841 N LEU A 115 8.424 -8.796 0.045 1.00 0.00 N ATOM 1842 CA LEU A 115 9.098 -8.631 -1.231 1.00 0.00 C ATOM 1843 C LEU A 115 10.137 -9.741 -1.402 1.00 0.00 C ATOM 1844 O LEU A 115 10.712 -9.898 -2.478 1.00 0.00 O ATOM 1845 CB LEU A 115 9.680 -7.220 -1.350 1.00 0.00 C ATOM 1846 CG LEU A 115 8.709 -6.070 -1.078 1.00 0.00 C ATOM 1847 CD1 LEU A 115 9.392 -4.716 -1.285 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.443 -6.208 -1.925 1.00 0.00 C ATOM 0 H LEU A 115 8.603 -8.054 0.721 1.00 0.00 H new ATOM 0 HA LEU A 115 8.388 -8.729 -2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.517 -7.134 -0.657 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.084 -7.098 -2.355 1.00 0.00 H new ATOM 0 HG LEU A 115 8.404 -6.121 -0.033 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.680 -3.915 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.238 -4.627 -0.604 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.745 -4.640 -2.314 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.770 -5.377 -1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.709 -6.197 -2.982 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.946 -7.148 -1.686 1.00 0.00 H new ATOM 1860 N SER A 116 10.347 -10.482 -0.323 1.00 0.00 N ATOM 1861 CA SER A 116 11.307 -11.572 -0.340 1.00 0.00 C ATOM 1862 C SER A 116 10.905 -12.607 -1.393 1.00 0.00 C ATOM 1863 O SER A 116 9.977 -13.386 -1.180 1.00 0.00 O ATOM 1864 CB SER A 116 11.417 -12.231 1.037 1.00 0.00 C ATOM 1865 OG SER A 116 12.450 -13.211 1.079 1.00 0.00 O ATOM 0 H SER A 116 9.869 -10.348 0.568 1.00 0.00 H new ATOM 0 HA SER A 116 12.284 -11.163 -0.596 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.611 -11.467 1.790 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.465 -12.696 1.293 1.00 0.00 H new ATOM 0 HG SER A 116 12.489 -13.607 1.975 1.00 0.00 H new ATOM 1871 N GLY A 117 11.623 -12.582 -2.506 1.00 0.00 N ATOM 1872 CA GLY A 117 11.353 -13.508 -3.592 1.00 0.00 C ATOM 1873 C GLY A 117 10.842 -12.767 -4.830 1.00 0.00 C ATOM 1874 O GLY A 117 11.232 -13.085 -5.953 1.00 0.00 O ATOM 0 H GLY A 117 12.392 -11.935 -2.679 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.261 -14.057 -3.841 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.614 -14.243 -3.273 1.00 0.00 H new ATOM 1878 N ILE A 118 9.978 -11.793 -4.583 1.00 0.00 N ATOM 1879 CA ILE A 118 9.411 -11.005 -5.664 1.00 0.00 C ATOM 1880 C ILE A 118 10.540 -10.329 -6.444 1.00 0.00 C ATOM 1881 O ILE A 118 11.586 -10.012 -5.880 1.00 0.00 O ATOM 1882 CB ILE A 118 8.367 -10.027 -5.122 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.080 -10.757 -4.733 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.105 -8.896 -6.118 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.099 -10.801 -5.907 1.00 0.00 C ATOM 0 H ILE A 118 9.657 -11.532 -3.651 1.00 0.00 H new ATOM 0 HA ILE A 118 8.879 -11.648 -6.366 1.00 0.00 H new ATOM 0 HB ILE A 118 8.765 -9.572 -4.215 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.316 -11.772 -4.413 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.615 -10.255 -3.884 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.359 -8.215 -5.708 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.031 -8.351 -6.302 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.738 -9.314 -7.055 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.193 -11.325 -5.604 1.00 0.00 H new ATOM 0 HD12 ILE A 118 5.847 -9.784 -6.209 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.558 -11.325 -6.745 1.00 0.00 H new ATOM 1897 N GLU A 119 10.290 -10.129 -7.730 1.00 0.00 N ATOM 1898 CA GLU A 119 11.273 -9.497 -8.594 1.00 0.00 C ATOM 1899 C GLU A 119 10.656 -8.292 -9.307 1.00 0.00 C ATOM 1900 O GLU A 119 9.597 -8.406 -9.923 1.00 0.00 O ATOM 1901 CB GLU A 119 11.841 -10.498 -9.601 1.00 0.00 C ATOM 1902 CG GLU A 119 13.172 -11.072 -9.112 1.00 0.00 C ATOM 1903 CD GLU A 119 14.165 -9.955 -8.786 1.00 0.00 C ATOM 1904 OE1 GLU A 119 14.183 -8.970 -9.555 1.00 0.00 O ATOM 1905 OE2 GLU A 119 14.883 -10.111 -7.775 1.00 0.00 O ATOM 0 H GLU A 119 9.421 -10.393 -8.194 1.00 0.00 H new ATOM 0 HA GLU A 119 12.099 -9.145 -7.976 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.127 -11.307 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.984 -10.009 -10.564 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.004 -11.684 -8.226 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.593 -11.726 -9.876 1.00 0.00 H new ATOM 1912 N LEU A 120 11.344 -7.165 -9.199 1.00 0.00 N ATOM 1913 CA LEU A 120 10.877 -5.940 -9.826 1.00 0.00 C ATOM 1914 C LEU A 120 11.832 -5.555 -10.957 1.00 0.00 C ATOM 1915 O LEU A 120 11.686 -4.495 -11.563 1.00 0.00 O ATOM 1916 CB LEU A 120 10.689 -4.841 -8.778 1.00 0.00 C ATOM 1917 CG LEU A 120 9.537 -5.045 -7.791 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.622 -4.045 -6.637 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.186 -4.983 -8.506 1.00 0.00 C ATOM 0 H LEU A 120 12.221 -7.074 -8.687 1.00 0.00 H new ATOM 0 HA LEU A 120 9.896 -6.091 -10.275 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.615 -4.745 -8.211 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.534 -3.895 -9.296 1.00 0.00 H new ATOM 0 HG LEU A 120 9.627 -6.042 -7.360 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.792 -4.211 -5.950 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.565 -4.180 -6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.570 -3.030 -7.031 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.384 -5.131 -7.782 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.070 -4.009 -8.982 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.139 -5.765 -9.264 1.00 0.00 H new ATOM 1931 N SER A 121 12.789 -6.437 -11.207 1.00 0.00 N ATOM 1932 CA SER A 121 13.768 -6.202 -12.255 1.00 0.00 C ATOM 1933 C SER A 121 13.059 -5.966 -13.590 1.00 0.00 C ATOM 1934 O SER A 121 13.367 -5.010 -14.300 1.00 0.00 O ATOM 1935 CB SER A 121 14.742 -7.376 -12.371 1.00 0.00 C ATOM 1936 OG SER A 121 16.052 -6.949 -12.736 1.00 0.00 O ATOM 0 H SER A 121 12.907 -7.315 -10.702 1.00 0.00 H new ATOM 0 HA SER A 121 14.342 -5.313 -11.994 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.785 -7.906 -11.420 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.371 -8.083 -13.113 1.00 0.00 H new ATOM 0 HG SER A 121 16.292 -6.152 -12.219 1.00 0.00 H new ATOM 1942 N GLU A 122 12.123 -6.854 -13.891 1.00 0.00 N ATOM 1943 CA GLU A 122 11.368 -6.754 -15.129 1.00 0.00 C ATOM 1944 C GLU A 122 10.726 -5.371 -15.249 1.00 0.00 C ATOM 1945 O GLU A 122 10.951 -4.661 -16.229 1.00 0.00 O ATOM 1946 CB GLU A 122 10.312 -7.858 -15.217 1.00 0.00 C ATOM 1947 CG GLU A 122 10.877 -9.105 -15.901 1.00 0.00 C ATOM 1948 CD GLU A 122 9.990 -9.540 -17.069 1.00 0.00 C ATOM 1949 OE1 GLU A 122 8.758 -9.371 -16.939 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.563 -10.031 -18.065 1.00 0.00 O ATOM 0 H GLU A 122 11.870 -7.646 -13.300 1.00 0.00 H new ATOM 0 HA GLU A 122 12.056 -6.887 -15.964 1.00 0.00 H new ATOM 0 HB2 GLU A 122 9.964 -8.114 -14.216 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.447 -7.495 -15.772 1.00 0.00 H new ATOM 0 HG2 GLU A 122 11.885 -8.901 -16.262 1.00 0.00 H new ATOM 0 HG3 GLU A 122 10.956 -9.917 -15.178 1.00 0.00 H new ATOM 1957 N GLY A 123 9.940 -5.028 -14.239 1.00 0.00 N ATOM 1958 CA GLY A 123 9.264 -3.742 -14.219 1.00 0.00 C ATOM 1959 C GLY A 123 8.182 -3.708 -13.138 1.00 0.00 C ATOM 1960 O GLY A 123 8.362 -4.267 -12.057 1.00 0.00 O ATOM 0 H GLY A 123 9.756 -5.619 -13.428 1.00 0.00 H new ATOM 0 HA2 GLY A 123 9.989 -2.949 -14.038 1.00 0.00 H new ATOM 0 HA3 GLY A 123 8.816 -3.548 -15.193 1.00 0.00 H new ATOM 1964 N LYS A 124 7.083 -3.045 -13.466 1.00 0.00 N ATOM 1965 CA LYS A 124 5.972 -2.931 -12.536 1.00 0.00 C ATOM 1966 C LYS A 124 5.075 -4.163 -12.666 1.00 0.00 C ATOM 1967 O LYS A 124 4.741 -4.579 -13.774 1.00 0.00 O ATOM 1968 CB LYS A 124 5.233 -1.607 -12.745 1.00 0.00 C ATOM 1969 CG LYS A 124 4.048 -1.484 -11.785 1.00 0.00 C ATOM 1970 CD LYS A 124 3.383 -0.112 -11.909 1.00 0.00 C ATOM 1971 CE LYS A 124 3.352 0.607 -10.559 1.00 0.00 C ATOM 1972 NZ LYS A 124 2.623 1.890 -10.671 1.00 0.00 N ATOM 0 H LYS A 124 6.938 -2.581 -14.363 1.00 0.00 H new ATOM 0 HA LYS A 124 6.336 -2.908 -11.509 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.919 -0.775 -12.590 1.00 0.00 H new ATOM 0 HB3 LYS A 124 4.880 -1.542 -13.774 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.319 -2.266 -11.999 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.388 -1.636 -10.761 1.00 0.00 H new ATOM 0 HD2 LYS A 124 3.924 0.494 -12.635 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.367 -0.229 -12.286 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.872 -0.027 -9.814 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.370 0.789 -10.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 2.796 2.463 -9.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 2.956 2.406 -11.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.604 1.703 -10.761 1.00 0.00 H new ATOM 1986 N MET A 125 4.710 -4.713 -11.517 1.00 0.00 N ATOM 1987 CA MET A 125 3.858 -5.890 -11.488 1.00 0.00 C ATOM 1988 C MET A 125 2.611 -5.643 -10.637 1.00 0.00 C ATOM 1989 O MET A 125 2.680 -4.971 -9.608 1.00 0.00 O ATOM 1990 CB MET A 125 4.641 -7.073 -10.916 1.00 0.00 C ATOM 1991 CG MET A 125 4.847 -6.916 -9.408 1.00 0.00 C ATOM 1992 SD MET A 125 5.501 -8.428 -8.720 1.00 0.00 S ATOM 1993 CE MET A 125 7.032 -8.546 -9.631 1.00 0.00 C ATOM 0 H MET A 125 4.989 -4.365 -10.599 1.00 0.00 H new ATOM 0 HA MET A 125 3.541 -6.112 -12.507 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.106 -8.000 -11.119 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.608 -7.148 -11.413 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.531 -6.091 -9.210 1.00 0.00 H new ATOM 0 HG3 MET A 125 3.901 -6.668 -8.927 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.635 -9.358 -9.225 1.00 0.00 H new ATOM 0 HE2 MET A 125 6.816 -8.744 -10.681 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.580 -7.608 -9.544 1.00 0.00 H new ATOM 2003 N LEU A 126 1.500 -6.198 -11.097 1.00 0.00 N ATOM 2004 CA LEU A 126 0.239 -6.047 -10.391 1.00 0.00 C ATOM 2005 C LEU A 126 0.053 -7.223 -9.430 1.00 0.00 C ATOM 2006 O LEU A 126 0.328 -8.368 -9.785 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.913 -5.874 -11.383 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.965 -4.826 -11.013 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.272 -4.862 -9.515 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.537 -3.433 -11.477 1.00 0.00 C ATOM 0 H LEU A 126 1.447 -6.754 -11.951 1.00 0.00 H new ATOM 0 HA LEU A 126 0.247 -5.140 -9.787 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.494 -5.612 -12.354 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.413 -6.836 -11.501 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.889 -5.070 -11.537 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.022 -4.107 -9.279 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.651 -5.848 -9.245 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.362 -4.657 -8.952 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.302 -2.707 -11.202 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.594 -3.165 -11.001 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.410 -3.433 -12.560 1.00 0.00 H new ATOM 2022 N MET A 127 -0.413 -6.900 -8.233 1.00 0.00 N ATOM 2023 CA MET A 127 -0.640 -7.915 -7.219 1.00 0.00 C ATOM 2024 C MET A 127 -1.897 -7.606 -6.404 1.00 0.00 C ATOM 2025 O MET A 127 -2.255 -6.443 -6.225 1.00 0.00 O ATOM 2026 CB MET A 127 0.571 -7.983 -6.285 1.00 0.00 C ATOM 2027 CG MET A 127 1.842 -8.336 -7.060 1.00 0.00 C ATOM 2028 SD MET A 127 2.794 -9.542 -6.152 1.00 0.00 S ATOM 2029 CE MET A 127 2.814 -8.774 -4.541 1.00 0.00 C ATOM 0 H MET A 127 -0.640 -5.949 -7.942 1.00 0.00 H new ATOM 0 HA MET A 127 -0.781 -8.874 -7.717 1.00 0.00 H new ATOM 0 HB2 MET A 127 0.702 -7.025 -5.783 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.395 -8.728 -5.509 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.581 -8.731 -8.042 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.438 -7.439 -7.225 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.705 -9.090 -3.998 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.824 -7.690 -4.655 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.925 -9.072 -3.985 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.533 -8.668 -5.931 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.743 -8.524 -5.139 1.00 0.00 C ATOM 2041 C ASN A 128 -3.660 -9.442 -3.918 1.00 0.00 C ATOM 2042 O ASN A 128 -3.125 -10.546 -4.002 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.980 -8.922 -5.946 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.638 -9.998 -6.979 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.756 -9.842 -7.807 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -5.384 -11.095 -6.885 1.00 0.00 N ATOM 0 H ASN A 128 -2.233 -9.631 -6.081 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.828 -7.479 -4.840 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.754 -9.292 -5.273 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.387 -8.046 -6.450 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -5.234 -11.871 -7.530 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -6.106 -11.161 -6.168 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.197 -8.951 -2.811 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.191 -9.713 -1.574 1.00 0.00 C ATOM 2055 C ARG A 129 -5.582 -9.705 -0.938 1.00 0.00 C ATOM 2056 O ARG A 129 -6.314 -8.722 -1.050 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.179 -9.141 -0.579 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.806 -9.792 -0.758 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.819 -11.242 -0.271 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.618 -11.953 -0.763 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.479 -12.414 -2.014 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.464 -12.243 -2.905 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.647 -13.047 -2.372 1.00 0.00 N ATOM 0 H ARG A 129 -4.639 -8.034 -2.745 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.905 -10.736 -1.817 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.095 -8.063 -0.719 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.533 -9.304 0.439 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.519 -9.760 -1.809 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.056 -9.226 -0.205 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.846 -11.268 0.818 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.719 -11.745 -0.624 1.00 0.00 H new ATOM 0 HE ARG A 129 0.151 -12.101 -0.110 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.321 -11.762 -2.632 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.357 -12.594 -3.857 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.397 -13.177 -1.693 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.754 -13.398 -3.324 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.906 -10.811 -0.283 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.196 -10.942 0.371 1.00 0.00 C ATOM 2079 C GLU A 130 -7.117 -10.429 1.810 1.00 0.00 C ATOM 2080 O GLU A 130 -6.123 -10.654 2.499 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.685 -12.392 0.332 1.00 0.00 C ATOM 2082 CG GLU A 130 -7.106 -13.197 1.497 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.859 -14.651 1.089 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -6.016 -14.853 0.189 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -7.521 -15.528 1.686 1.00 0.00 O ATOM 0 H GLU A 130 -5.297 -11.624 -0.192 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.920 -10.333 -0.171 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.774 -12.414 0.376 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.395 -12.852 -0.613 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.171 -12.744 1.827 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.792 -13.164 2.343 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.177 -9.748 2.221 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.239 -9.201 3.565 1.00 0.00 C ATOM 2094 C ILE A 131 -9.011 -10.165 4.468 1.00 0.00 C ATOM 2095 O ILE A 131 -10.160 -10.501 4.185 1.00 0.00 O ATOM 2096 CB ILE A 131 -8.818 -7.785 3.541 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -7.905 -6.833 2.765 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.098 -7.282 4.959 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.669 -6.141 1.634 1.00 0.00 C ATOM 0 H ILE A 131 -8.999 -9.563 1.647 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.237 -9.104 3.983 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.773 -7.815 3.016 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.494 -6.084 3.442 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.062 -7.387 2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.509 -6.273 4.913 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -9.815 -7.944 5.445 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.170 -7.270 5.531 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -7.997 -5.470 1.098 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.058 -6.891 0.945 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.497 -5.568 2.052 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.349 -10.583 5.537 1.00 0.00 N ATOM 2112 CA ILE A 132 -8.959 -11.502 6.483 1.00 0.00 C ATOM 2113 C ILE A 132 -8.644 -11.043 7.908 1.00 0.00 C ATOM 2114 O ILE A 132 -8.090 -9.963 8.108 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.524 -12.939 6.190 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.040 -12.999 5.822 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.407 -13.571 5.113 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.161 -12.942 7.073 1.00 0.00 C ATOM 0 H ILE A 132 -7.396 -10.302 5.769 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.044 -11.494 6.377 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.654 -13.527 7.099 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.835 -13.917 5.271 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -6.792 -12.169 5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.076 -14.592 4.924 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.443 -13.582 5.452 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.332 -12.990 4.194 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.111 -12.986 6.782 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.350 -12.012 7.609 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.394 -13.787 7.720 1.00 0.00 H new ATOM 2130 N SER A 133 -9.012 -11.886 8.862 1.00 0.00 N ATOM 2131 CA SER A 133 -8.776 -11.580 10.263 1.00 0.00 C ATOM 2132 C SER A 133 -7.370 -12.030 10.667 1.00 0.00 C ATOM 2133 O SER A 133 -7.216 -12.922 11.500 1.00 0.00 O ATOM 2134 CB SER A 133 -9.824 -12.246 11.156 1.00 0.00 C ATOM 2135 OG SER A 133 -9.586 -11.993 12.538 1.00 0.00 O ATOM 0 H SER A 133 -9.472 -12.781 8.692 1.00 0.00 H new ATOM 0 HA SER A 133 -8.858 -10.501 10.396 1.00 0.00 H new ATOM 0 HB2 SER A 133 -10.815 -11.881 10.886 1.00 0.00 H new ATOM 0 HB3 SER A 133 -9.821 -13.321 10.978 1.00 0.00 H new ATOM 0 HG SER A 133 -8.706 -12.345 12.788 1.00 0.00 H new