USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1151 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 125 HIS : no HE2:sc= -1.08! C(o=-0.085!,f=-6.3!) USER MOD Set 1.2: A 127 GLN : amide:sc= 0.991 K(o=-0.085,f=-2) USER MOD Set 2.1: A 120 THR OG1 : rot -95:sc= 1.97 USER MOD Set 2.2: A 122 GLN : amide:sc= 0.658 K(o=2.6,f=1.2) USER MOD Set 3.1: A 110 TYR OH : rot -11:sc= -0.0483 USER MOD Set 3.2: A 115 TYR OH : rot 40:sc= 1.36 USER MOD Set 4.1: A 50 GLN : amide:sc= 1.93 K(o=5.2,f=-4.7!) USER MOD Set 4.2: A 57 LYS NZ :NH3+ -177:sc= 3.23 (180deg=2.18) USER MOD Set 5.1: A 35 HIS : no HE2:sc= -1.35 K(o=-2.1,f=-13!) USER MOD Set 5.2: A 92 GLN : amide:sc= -0.702 K(o=-2.1,f=-6.5!) USER MOD Set 6.1: A 22 THR OG1 : rot 63:sc= 1.2 USER MOD Set 6.2: A 25 GLN : amide:sc= 1.01 K(o=2.2,f=-5.2!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.584 K(o=-0.58,f=-0.016) USER MOD Single : A 7 MET CE :methyl 174:sc= -0.458 (180deg=-0.578) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.16) USER MOD Single : A 18 ASN : amide:sc= 0.345 K(o=0.34,f=-0.4) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 170:sc= 0 USER MOD Single : A 38 SER OG : rot -60:sc= 0.977 USER MOD Single : A 40 SER OG : rot -115:sc= 1.7 USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 CYS SG : rot 150:sc= -0.148 USER MOD Single : A 45 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.035) USER MOD Single : A 48 MET CE :methyl 155:sc= -1.68 (180deg=-3.31!) USER MOD Single : A 52 ASN : amide:sc= 0.954 K(o=0.95,f=-2.1!) USER MOD Single : A 58 TYR OH : rot 152:sc= 1.22 USER MOD Single : A 59 GLN : amide:sc= 0.53 K(o=0.53,f=-0.24) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 ASN : amide:sc= 0.575 K(o=0.58,f=0) USER MOD Single : A 68 HIS : no HE2:sc= -0.295 K(o=-0.3,f=-6.3!) USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 86:sc= 1.13 USER MOD Single : A 88 HIS : no HE2:sc= -1.61 X(o=-1.6,f=-1.6) USER MOD Single : A 91 THR OG1 : rot 160:sc= 0.888 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HE2:sc= -0.259 K(o=-0.26,f=-1.9!) USER MOD Single : A 103 THR OG1 : rot -78:sc= 1.28 USER MOD Single : A 108 ASN : amide:sc= -0.234 K(o=-0.23,f=-0.78) USER MOD Single : A 114 TYR OH : rot -103:sc= 0.423 USER MOD Single : A 119 LYS NZ :NH3+ 143:sc= 0.877 (180deg=0.209) USER MOD Single : A 131 SER OG : rot 180:sc= 0.00575 USER MOD Single : A 133 MET CE :methyl -176:sc= -0.303 (180deg=-0.402) USER MOD Single : A 134 LYS NZ :NH3+ -153:sc= 1.25 (180deg=1.2) USER MOD Single : A 135 MET CE :methyl -153:sc= -0.593 (180deg=-0.921) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 ASN : amide:sc= 0.116 X(o=0.12,f=-0.32) USER MOD Single : A 147 THR OG1 : rot 85:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 20 N LYS A 2 4.684 -1.567 -4.329 1.00 0.00 N ATOM 21 CA LYS A 2 5.914 -2.361 -4.335 1.00 0.00 C ATOM 22 C LYS A 2 7.115 -1.421 -4.381 1.00 0.00 C ATOM 23 O LYS A 2 6.966 -0.223 -4.637 1.00 0.00 O ATOM 24 CB LYS A 2 5.942 -3.312 -5.551 1.00 0.00 C ATOM 25 CG LYS A 2 4.718 -4.237 -5.641 1.00 0.00 C ATOM 26 CD LYS A 2 4.895 -5.369 -6.669 1.00 0.00 C ATOM 27 CE LYS A 2 5.090 -4.900 -8.122 1.00 0.00 C ATOM 28 NZ LYS A 2 3.863 -4.308 -8.715 1.00 0.00 N ATOM 0 HA LYS A 2 5.953 -2.965 -3.429 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.006 -2.719 -6.463 1.00 0.00 H new ATOM 0 HB3 LYS A 2 6.844 -3.922 -5.503 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.525 -4.671 -4.660 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.841 -3.646 -5.907 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.755 -5.972 -6.379 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.021 -6.019 -6.626 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.893 -4.164 -8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 2 5.408 -5.746 -8.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 4.058 -4.012 -9.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.100 -5.015 -8.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.571 -3.482 -8.155 1.00 0.00 H new ATOM 42 N LEU A 3 8.309 -1.960 -4.163 1.00 0.00 N ATOM 43 CA LEU A 3 9.550 -1.220 -4.353 1.00 0.00 C ATOM 44 C LEU A 3 9.832 -1.030 -5.843 1.00 0.00 C ATOM 45 O LEU A 3 9.241 -1.684 -6.704 1.00 0.00 O ATOM 46 CB LEU A 3 10.717 -1.916 -3.626 1.00 0.00 C ATOM 47 CG LEU A 3 10.482 -2.118 -2.114 1.00 0.00 C ATOM 48 CD1 LEU A 3 11.760 -2.637 -1.453 1.00 0.00 C ATOM 49 CD2 LEU A 3 10.014 -0.834 -1.417 1.00 0.00 C ATOM 0 H LEU A 3 8.444 -2.921 -3.850 1.00 0.00 H new ATOM 0 HA LEU A 3 9.443 -0.229 -3.911 1.00 0.00 H new ATOM 0 HB2 LEU A 3 10.893 -2.887 -4.089 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.623 -1.327 -3.767 1.00 0.00 H new ATOM 0 HG LEU A 3 9.684 -2.853 -2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 3 11.587 -2.777 -0.386 1.00 0.00 H new ATOM 0 HD12 LEU A 3 12.042 -3.589 -1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 3 12.564 -1.915 -1.598 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.863 -1.030 -0.355 1.00 0.00 H new ATOM 0 HD22 LEU A 3 10.770 -0.058 -1.539 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.076 -0.500 -1.861 1.00 0.00 H new ATOM 61 N ARG A 4 10.756 -0.108 -6.127 1.00 0.00 N ATOM 62 CA ARG A 4 11.161 0.378 -7.444 1.00 0.00 C ATOM 63 C ARG A 4 10.001 0.957 -8.263 1.00 0.00 C ATOM 64 O ARG A 4 10.151 1.157 -9.469 1.00 0.00 O ATOM 65 CB ARG A 4 11.997 -0.686 -8.188 1.00 0.00 C ATOM 66 CG ARG A 4 13.192 -1.165 -7.346 1.00 0.00 C ATOM 67 CD ARG A 4 14.094 -2.108 -8.149 1.00 0.00 C ATOM 68 NE ARG A 4 15.248 -2.561 -7.349 1.00 0.00 N ATOM 69 CZ ARG A 4 16.279 -3.283 -7.808 1.00 0.00 C ATOM 70 NH1 ARG A 4 16.329 -3.659 -9.084 1.00 0.00 N ATOM 71 NH2 ARG A 4 17.262 -3.627 -6.982 1.00 0.00 N ATOM 0 H ARG A 4 11.280 0.352 -5.382 1.00 0.00 H new ATOM 0 HA ARG A 4 11.816 1.236 -7.292 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.363 -1.537 -8.437 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.358 -0.272 -9.129 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.770 -0.305 -7.008 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.830 -1.676 -6.454 1.00 0.00 H new ATOM 0 HD2 ARG A 4 13.517 -2.972 -8.480 1.00 0.00 H new ATOM 0 HD3 ARG A 4 14.448 -1.599 -9.046 1.00 0.00 H new ATOM 0 HE ARG A 4 15.262 -2.302 -6.362 1.00 0.00 H new ATOM 0 HH11 ARG A 4 15.578 -3.398 -9.723 1.00 0.00 H new ATOM 0 HH12 ARG A 4 17.119 -4.209 -9.423 1.00 0.00 H new ATOM 0 HH21 ARG A 4 17.229 -3.341 -6.003 1.00 0.00 H new ATOM 0 HH22 ARG A 4 18.049 -4.177 -7.327 1.00 0.00 H new ATOM 85 N GLN A 5 8.861 1.258 -7.632 1.00 0.00 N ATOM 86 CA GLN A 5 7.799 2.015 -8.290 1.00 0.00 C ATOM 87 C GLN A 5 8.211 3.483 -8.305 1.00 0.00 C ATOM 88 O GLN A 5 8.844 3.916 -7.344 1.00 0.00 O ATOM 89 CB GLN A 5 6.500 1.908 -7.496 1.00 0.00 C ATOM 90 CG GLN A 5 5.877 0.510 -7.561 1.00 0.00 C ATOM 91 CD GLN A 5 4.556 0.598 -6.827 1.00 0.00 C ATOM 92 OE1 GLN A 5 3.487 0.282 -7.338 1.00 0.00 O ATOM 93 NE2 GLN A 5 4.615 1.100 -5.604 1.00 0.00 N ATOM 0 H GLN A 5 8.654 0.989 -6.670 1.00 0.00 H new ATOM 0 HA GLN A 5 7.646 1.623 -9.296 1.00 0.00 H new ATOM 0 HB2 GLN A 5 6.694 2.166 -6.455 1.00 0.00 H new ATOM 0 HB3 GLN A 5 5.785 2.637 -7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.727 0.199 -8.595 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.531 -0.229 -7.097 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.516 1.355 -5.200 1.00 0.00 H new ATOM 0 HE22 GLN A 5 3.759 1.232 -5.065 1.00 0.00 H new ATOM 102 N PRO A 6 7.833 4.282 -9.307 1.00 0.00 N ATOM 103 CA PRO A 6 8.040 5.715 -9.227 1.00 0.00 C ATOM 104 C PRO A 6 7.063 6.347 -8.224 1.00 0.00 C ATOM 105 O PRO A 6 5.907 5.930 -8.114 1.00 0.00 O ATOM 106 CB PRO A 6 7.832 6.218 -10.650 1.00 0.00 C ATOM 107 CG PRO A 6 6.818 5.233 -11.238 1.00 0.00 C ATOM 108 CD PRO A 6 7.166 3.912 -10.546 1.00 0.00 C ATOM 0 HA PRO A 6 9.032 5.982 -8.863 1.00 0.00 H new ATOM 0 HB2 PRO A 6 7.452 7.239 -10.662 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.764 6.218 -11.215 1.00 0.00 H new ATOM 0 HG2 PRO A 6 5.793 5.539 -11.029 1.00 0.00 H new ATOM 0 HG3 PRO A 6 6.913 5.157 -12.321 1.00 0.00 H new ATOM 0 HD2 PRO A 6 6.269 3.325 -10.348 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.815 3.300 -11.173 1.00 0.00 H new ATOM 116 N MET A 7 7.532 7.380 -7.519 1.00 0.00 N ATOM 117 CA MET A 7 6.738 8.267 -6.668 1.00 0.00 C ATOM 118 C MET A 7 5.492 8.713 -7.466 1.00 0.00 C ATOM 119 O MET A 7 5.658 9.253 -8.565 1.00 0.00 O ATOM 120 CB MET A 7 7.622 9.440 -6.214 1.00 0.00 C ATOM 121 CG MET A 7 7.023 10.200 -5.024 1.00 0.00 C ATOM 122 SD MET A 7 7.991 11.636 -4.472 1.00 0.00 S ATOM 123 CE MET A 7 9.532 10.855 -3.930 1.00 0.00 C ATOM 0 H MET A 7 8.521 7.631 -7.527 1.00 0.00 H new ATOM 0 HA MET A 7 6.388 7.766 -5.765 1.00 0.00 H new ATOM 0 HB2 MET A 7 8.608 9.064 -5.942 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.763 10.129 -7.047 1.00 0.00 H new ATOM 0 HG2 MET A 7 6.021 10.536 -5.292 1.00 0.00 H new ATOM 0 HG3 MET A 7 6.914 9.510 -4.188 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.257 11.625 -3.667 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.336 10.228 -3.060 1.00 0.00 H new ATOM 0 HE3 MET A 7 9.932 10.241 -4.737 1.00 0.00 H new ATOM 133 N PRO A 8 4.263 8.491 -6.961 1.00 0.00 N ATOM 134 CA PRO A 8 3.050 8.649 -7.754 1.00 0.00 C ATOM 135 C PRO A 8 2.488 10.077 -7.793 1.00 0.00 C ATOM 136 O PRO A 8 2.757 10.838 -8.721 1.00 0.00 O ATOM 137 CB PRO A 8 2.072 7.648 -7.123 1.00 0.00 C ATOM 138 CG PRO A 8 2.442 7.691 -5.634 1.00 0.00 C ATOM 139 CD PRO A 8 3.956 7.888 -5.671 1.00 0.00 C ATOM 0 HA PRO A 8 3.244 8.456 -8.809 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.035 7.939 -7.289 1.00 0.00 H new ATOM 0 HB3 PRO A 8 2.194 6.648 -7.540 1.00 0.00 H new ATOM 0 HG2 PRO A 8 1.940 8.508 -5.115 1.00 0.00 H new ATOM 0 HG3 PRO A 8 2.166 6.770 -5.121 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.284 8.531 -4.854 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.474 6.936 -5.555 1.00 0.00 H new ATOM 147 N GLU A 9 1.682 10.437 -6.796 1.00 0.00 N ATOM 148 CA GLU A 9 0.859 11.620 -6.707 1.00 0.00 C ATOM 149 C GLU A 9 0.667 11.869 -5.214 1.00 0.00 C ATOM 150 O GLU A 9 0.493 10.905 -4.469 1.00 0.00 O ATOM 151 CB GLU A 9 -0.461 11.323 -7.447 1.00 0.00 C ATOM 152 CG GLU A 9 -1.494 10.392 -6.773 1.00 0.00 C ATOM 153 CD GLU A 9 -2.677 10.130 -7.724 1.00 0.00 C ATOM 154 OE1 GLU A 9 -3.598 10.973 -7.804 1.00 0.00 O ATOM 155 OE2 GLU A 9 -2.691 9.083 -8.410 1.00 0.00 O ATOM 0 H GLU A 9 1.587 9.853 -5.965 1.00 0.00 H new ATOM 0 HA GLU A 9 1.291 12.510 -7.165 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.952 12.276 -7.642 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.208 10.891 -8.415 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.021 9.448 -6.502 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.854 10.845 -5.849 1.00 0.00 H new ATOM 162 N LEU A 10 0.757 13.122 -4.767 1.00 0.00 N ATOM 163 CA LEU A 10 0.806 13.488 -3.350 1.00 0.00 C ATOM 164 C LEU A 10 -0.021 14.775 -3.228 1.00 0.00 C ATOM 165 O LEU A 10 0.538 15.871 -3.310 1.00 0.00 O ATOM 166 CB LEU A 10 2.277 13.689 -2.898 1.00 0.00 C ATOM 167 CG LEU A 10 3.265 12.522 -3.135 1.00 0.00 C ATOM 168 CD1 LEU A 10 4.695 12.991 -2.837 1.00 0.00 C ATOM 169 CD2 LEU A 10 2.972 11.274 -2.293 1.00 0.00 C ATOM 0 H LEU A 10 0.799 13.927 -5.392 1.00 0.00 H new ATOM 0 HA LEU A 10 0.399 12.710 -2.704 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.668 14.569 -3.408 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.273 13.914 -1.832 1.00 0.00 H new ATOM 0 HG LEU A 10 3.145 12.235 -4.180 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.390 12.168 -3.004 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.950 13.821 -3.496 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.762 13.317 -1.799 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.709 10.503 -2.517 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.024 11.529 -1.234 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.975 10.903 -2.528 1.00 0.00 H new ATOM 181 N THR A 11 -1.354 14.670 -3.151 1.00 0.00 N ATOM 182 CA THR A 11 -2.230 15.837 -3.263 1.00 0.00 C ATOM 183 C THR A 11 -3.608 15.562 -2.644 1.00 0.00 C ATOM 184 O THR A 11 -3.997 14.405 -2.442 1.00 0.00 O ATOM 185 CB THR A 11 -2.294 16.271 -4.749 1.00 0.00 C ATOM 186 OG1 THR A 11 -2.936 17.525 -4.870 1.00 0.00 O ATOM 187 CG2 THR A 11 -2.994 15.250 -5.657 1.00 0.00 C ATOM 0 H THR A 11 -1.847 13.788 -3.012 1.00 0.00 H new ATOM 0 HA THR A 11 -1.823 16.670 -2.690 1.00 0.00 H new ATOM 0 HB THR A 11 -1.259 16.340 -5.085 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.967 17.787 -5.814 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.002 15.620 -6.682 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.459 14.301 -5.618 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.019 15.103 -5.317 1.00 0.00 H new ATOM 195 N GLY A 12 -4.323 16.641 -2.319 1.00 0.00 N ATOM 196 CA GLY A 12 -5.559 16.691 -1.551 1.00 0.00 C ATOM 197 C GLY A 12 -5.807 18.141 -1.116 1.00 0.00 C ATOM 198 O GLY A 12 -5.175 19.049 -1.666 1.00 0.00 O ATOM 0 H GLY A 12 -4.026 17.572 -2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -6.393 16.329 -2.152 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -5.489 16.041 -0.679 1.00 0.00 H new ATOM 202 N GLU A 13 -6.698 18.383 -0.144 1.00 0.00 N ATOM 203 CA GLU A 13 -7.161 19.731 0.190 1.00 0.00 C ATOM 204 C GLU A 13 -7.341 20.041 1.691 1.00 0.00 C ATOM 205 O GLU A 13 -7.384 21.228 2.023 1.00 0.00 O ATOM 206 CB GLU A 13 -8.460 20.010 -0.594 1.00 0.00 C ATOM 207 CG GLU A 13 -9.672 19.175 -0.148 1.00 0.00 C ATOM 208 CD GLU A 13 -10.936 19.558 -0.938 1.00 0.00 C ATOM 209 OE1 GLU A 13 -11.188 18.977 -2.020 1.00 0.00 O ATOM 210 OE2 GLU A 13 -11.704 20.436 -0.482 1.00 0.00 O ATOM 0 H GLU A 13 -7.115 17.650 0.429 1.00 0.00 H new ATOM 0 HA GLU A 13 -6.357 20.405 -0.106 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.708 21.067 -0.495 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.277 19.823 -1.652 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.459 18.116 -0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -9.847 19.325 0.917 1.00 0.00 H new ATOM 217 N LYS A 14 -7.456 19.056 2.603 1.00 0.00 N ATOM 218 CA LYS A 14 -7.836 19.340 4.006 1.00 0.00 C ATOM 219 C LYS A 14 -6.898 20.340 4.689 1.00 0.00 C ATOM 220 O LYS A 14 -7.387 21.332 5.234 1.00 0.00 O ATOM 221 CB LYS A 14 -7.949 18.058 4.847 1.00 0.00 C ATOM 222 CG LYS A 14 -8.429 18.289 6.290 1.00 0.00 C ATOM 223 CD LYS A 14 -8.771 16.947 6.953 1.00 0.00 C ATOM 224 CE LYS A 14 -9.042 17.149 8.449 1.00 0.00 C ATOM 225 NZ LYS A 14 -9.679 15.960 9.072 1.00 0.00 N ATOM 0 H LYS A 14 -7.294 18.069 2.401 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.822 19.802 3.949 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.637 17.372 4.353 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.976 17.568 4.874 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.654 18.799 6.862 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.305 18.938 6.291 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.646 16.509 6.473 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -7.948 16.245 6.817 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.104 17.365 8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.687 18.017 8.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.719 16.088 10.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.643 15.847 8.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.121 15.111 8.850 1.00 0.00 H new ATOM 239 N ALA A 15 -5.585 20.096 4.678 1.00 0.00 N ATOM 240 CA ALA A 15 -4.601 21.024 5.225 1.00 0.00 C ATOM 241 C ALA A 15 -3.246 20.776 4.577 1.00 0.00 C ATOM 242 O ALA A 15 -2.906 19.654 4.200 1.00 0.00 O ATOM 243 CB ALA A 15 -4.479 20.869 6.756 1.00 0.00 C ATOM 0 H ALA A 15 -5.177 19.246 4.288 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.934 22.039 5.009 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.739 21.573 7.135 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.444 21.072 7.220 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.168 19.852 6.995 1.00 0.00 H new ATOM 249 N TRP A 16 -2.442 21.827 4.522 1.00 0.00 N ATOM 250 CA TRP A 16 -1.043 21.773 4.156 1.00 0.00 C ATOM 251 C TRP A 16 -0.357 22.700 5.144 1.00 0.00 C ATOM 252 O TRP A 16 -0.835 23.810 5.390 1.00 0.00 O ATOM 253 CB TRP A 16 -0.814 22.192 2.702 1.00 0.00 C ATOM 254 CG TRP A 16 -1.353 23.532 2.291 1.00 0.00 C ATOM 255 CD1 TRP A 16 -2.580 23.765 1.772 1.00 0.00 C ATOM 256 CD2 TRP A 16 -0.700 24.839 2.357 1.00 0.00 C ATOM 257 NE1 TRP A 16 -2.732 25.112 1.515 1.00 0.00 N ATOM 258 CE2 TRP A 16 -1.601 25.825 1.853 1.00 0.00 C ATOM 259 CE3 TRP A 16 0.565 25.289 2.794 1.00 0.00 C ATOM 260 CZ2 TRP A 16 -1.261 27.185 1.786 1.00 0.00 C ATOM 261 CZ3 TRP A 16 0.918 26.652 2.731 1.00 0.00 C ATOM 262 CH2 TRP A 16 0.008 27.599 2.226 1.00 0.00 C ATOM 0 H TRP A 16 -2.761 22.771 4.739 1.00 0.00 H new ATOM 0 HA TRP A 16 -0.642 20.761 4.207 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.259 22.184 2.511 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -1.258 21.435 2.056 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -3.329 23.009 1.586 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -3.577 25.529 1.123 1.00 0.00 H new ATOM 0 HE3 TRP A 16 1.276 24.575 3.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -1.967 27.906 1.400 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 1.892 26.971 3.072 1.00 0.00 H new ATOM 0 HH2 TRP A 16 0.284 28.642 2.177 1.00 0.00 H new ATOM 273 N LEU A 17 0.718 22.219 5.756 1.00 0.00 N ATOM 274 CA LEU A 17 1.391 22.901 6.853 1.00 0.00 C ATOM 275 C LEU A 17 2.873 22.967 6.503 1.00 0.00 C ATOM 276 O LEU A 17 3.420 22.031 5.922 1.00 0.00 O ATOM 277 CB LEU A 17 1.161 22.174 8.196 1.00 0.00 C ATOM 278 CG LEU A 17 -0.300 21.830 8.564 1.00 0.00 C ATOM 279 CD1 LEU A 17 -0.304 20.976 9.836 1.00 0.00 C ATOM 280 CD2 LEU A 17 -1.182 23.065 8.777 1.00 0.00 C ATOM 0 H LEU A 17 1.152 21.332 5.500 1.00 0.00 H new ATOM 0 HA LEU A 17 0.986 23.905 6.980 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.735 21.247 8.183 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.574 22.793 8.992 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.724 21.286 7.720 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.331 20.728 10.104 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.257 20.058 9.660 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.159 21.534 10.650 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.194 22.750 9.032 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.774 23.668 9.588 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.206 23.657 7.862 1.00 0.00 H new ATOM 292 N ASN A 18 3.510 24.093 6.826 1.00 0.00 N ATOM 293 CA ASN A 18 4.885 24.491 6.498 1.00 0.00 C ATOM 294 C ASN A 18 5.065 24.813 5.013 1.00 0.00 C ATOM 295 O ASN A 18 5.899 25.653 4.674 1.00 0.00 O ATOM 296 CB ASN A 18 5.947 23.473 6.936 1.00 0.00 C ATOM 297 CG ASN A 18 5.955 23.199 8.432 1.00 0.00 C ATOM 298 OD1 ASN A 18 5.883 24.110 9.252 1.00 0.00 O ATOM 299 ND2 ASN A 18 6.070 21.943 8.818 1.00 0.00 N ATOM 0 H ASN A 18 3.038 24.815 7.371 1.00 0.00 H new ATOM 0 HA ASN A 18 5.044 25.400 7.078 1.00 0.00 H new ATOM 0 HB2 ASN A 18 5.779 22.536 6.405 1.00 0.00 H new ATOM 0 HB3 ASN A 18 6.930 23.837 6.637 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.100 21.716 9.812 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.129 21.199 8.123 1.00 0.00 H new ATOM 306 N GLY A 19 4.293 24.177 4.131 1.00 0.00 N ATOM 307 CA GLY A 19 4.358 24.393 2.691 1.00 0.00 C ATOM 308 C GLY A 19 3.661 23.276 1.922 1.00 0.00 C ATOM 309 O GLY A 19 3.003 22.419 2.514 1.00 0.00 O ATOM 0 H GLY A 19 3.594 23.486 4.405 1.00 0.00 H new ATOM 0 HA2 GLY A 19 3.895 25.348 2.445 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.401 24.454 2.379 1.00 0.00 H new ATOM 313 N GLU A 20 3.842 23.279 0.602 1.00 0.00 N ATOM 314 CA GLU A 20 3.412 22.239 -0.327 1.00 0.00 C ATOM 315 C GLU A 20 4.552 22.034 -1.329 1.00 0.00 C ATOM 316 O GLU A 20 5.333 22.959 -1.581 1.00 0.00 O ATOM 317 CB GLU A 20 2.160 22.673 -1.110 1.00 0.00 C ATOM 318 CG GLU A 20 0.895 22.802 -0.262 1.00 0.00 C ATOM 319 CD GLU A 20 -0.316 23.185 -1.135 1.00 0.00 C ATOM 320 OE1 GLU A 20 -0.461 24.375 -1.502 1.00 0.00 O ATOM 321 OE2 GLU A 20 -1.122 22.294 -1.488 1.00 0.00 O ATOM 0 H GLU A 20 4.317 24.048 0.129 1.00 0.00 H new ATOM 0 HA GLU A 20 3.174 21.331 0.228 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.361 23.631 -1.589 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.977 21.951 -1.906 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.697 21.859 0.248 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.045 23.557 0.510 1.00 0.00 H new ATOM 328 N VAL A 21 4.632 20.842 -1.920 1.00 0.00 N ATOM 329 CA VAL A 21 5.615 20.481 -2.934 1.00 0.00 C ATOM 330 C VAL A 21 5.080 19.249 -3.690 1.00 0.00 C ATOM 331 O VAL A 21 4.111 18.618 -3.257 1.00 0.00 O ATOM 332 CB VAL A 21 6.992 20.280 -2.247 1.00 0.00 C ATOM 333 CG1 VAL A 21 7.021 19.060 -1.319 1.00 0.00 C ATOM 334 CG2 VAL A 21 8.161 20.225 -3.238 1.00 0.00 C ATOM 0 H VAL A 21 3.993 20.079 -1.697 1.00 0.00 H new ATOM 0 HA VAL A 21 5.769 21.263 -3.678 1.00 0.00 H new ATOM 0 HB VAL A 21 7.127 21.171 -1.633 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.009 18.970 -0.867 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.273 19.181 -0.535 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.802 18.160 -1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.094 20.083 -2.693 1.00 0.00 H new ATOM 0 HG22 VAL A 21 8.014 19.394 -3.928 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.207 21.159 -3.799 1.00 0.00 H new ATOM 344 N THR A 22 5.712 18.904 -4.807 1.00 0.00 N ATOM 345 CA THR A 22 5.311 17.845 -5.729 1.00 0.00 C ATOM 346 C THR A 22 6.556 17.050 -6.106 1.00 0.00 C ATOM 347 O THR A 22 7.677 17.538 -5.924 1.00 0.00 O ATOM 348 CB THR A 22 4.582 18.446 -6.948 1.00 0.00 C ATOM 349 OG1 THR A 22 4.152 19.787 -6.758 1.00 0.00 O ATOM 350 CG2 THR A 22 3.340 17.617 -7.294 1.00 0.00 C ATOM 0 H THR A 22 6.562 19.380 -5.110 1.00 0.00 H new ATOM 0 HA THR A 22 4.600 17.163 -5.262 1.00 0.00 H new ATOM 0 HB THR A 22 5.318 18.431 -7.751 1.00 0.00 H new ATOM 0 HG1 THR A 22 4.932 20.365 -6.626 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.838 18.056 -8.156 1.00 0.00 H new ATOM 0 HG22 THR A 22 3.638 16.595 -7.529 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.659 17.610 -6.443 1.00 0.00 H new ATOM 358 N ARG A 23 6.388 15.812 -6.596 1.00 0.00 N ATOM 359 CA ARG A 23 7.531 14.932 -6.813 1.00 0.00 C ATOM 360 C ARG A 23 8.530 15.593 -7.744 1.00 0.00 C ATOM 361 O ARG A 23 9.718 15.592 -7.461 1.00 0.00 O ATOM 362 CB ARG A 23 7.137 13.491 -7.209 1.00 0.00 C ATOM 363 CG ARG A 23 6.621 13.166 -8.627 1.00 0.00 C ATOM 364 CD ARG A 23 5.094 13.049 -8.765 1.00 0.00 C ATOM 365 NE ARG A 23 4.476 14.292 -9.248 1.00 0.00 N ATOM 366 CZ ARG A 23 3.260 14.430 -9.784 1.00 0.00 C ATOM 367 NH1 ARG A 23 2.399 13.414 -9.808 1.00 0.00 N ATOM 368 NH2 ARG A 23 2.928 15.605 -10.303 1.00 0.00 N ATOM 0 H ARG A 23 5.485 15.409 -6.844 1.00 0.00 H new ATOM 0 HA ARG A 23 8.035 14.791 -5.857 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.011 12.863 -7.036 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.368 13.167 -6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 23 6.972 13.941 -9.309 1.00 0.00 H new ATOM 0 HG3 ARG A 23 7.071 12.228 -8.952 1.00 0.00 H new ATOM 0 HD2 ARG A 23 4.856 12.237 -9.453 1.00 0.00 H new ATOM 0 HD3 ARG A 23 4.664 12.785 -7.799 1.00 0.00 H new ATOM 0 HE ARG A 23 5.036 15.141 -9.165 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.664 12.512 -9.413 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.475 13.538 -10.222 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.595 16.377 -10.287 1.00 0.00 H new ATOM 0 HH22 ARG A 23 2.006 15.737 -10.718 1.00 0.00 H new ATOM 382 N GLU A 24 8.060 16.309 -8.753 1.00 0.00 N ATOM 383 CA GLU A 24 8.922 16.918 -9.767 1.00 0.00 C ATOM 384 C GLU A 24 9.772 18.080 -9.216 1.00 0.00 C ATOM 385 O GLU A 24 10.663 18.574 -9.909 1.00 0.00 O ATOM 386 CB GLU A 24 8.084 17.357 -10.987 1.00 0.00 C ATOM 387 CG GLU A 24 6.924 18.326 -10.675 1.00 0.00 C ATOM 388 CD GLU A 24 5.589 17.593 -10.472 1.00 0.00 C ATOM 389 OE1 GLU A 24 5.479 16.799 -9.515 1.00 0.00 O ATOM 390 OE2 GLU A 24 4.630 17.779 -11.254 1.00 0.00 O ATOM 0 H GLU A 24 7.066 16.488 -8.897 1.00 0.00 H new ATOM 0 HA GLU A 24 9.633 16.156 -10.086 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.747 17.831 -11.711 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.674 16.467 -11.465 1.00 0.00 H new ATOM 0 HG2 GLU A 24 7.162 18.897 -9.778 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.822 19.042 -11.491 1.00 0.00 H new ATOM 397 N GLN A 25 9.523 18.507 -7.973 1.00 0.00 N ATOM 398 CA GLN A 25 10.279 19.529 -7.257 1.00 0.00 C ATOM 399 C GLN A 25 11.126 18.885 -6.142 1.00 0.00 C ATOM 400 O GLN A 25 12.069 19.509 -5.652 1.00 0.00 O ATOM 401 CB GLN A 25 9.276 20.532 -6.662 1.00 0.00 C ATOM 402 CG GLN A 25 8.451 21.295 -7.719 1.00 0.00 C ATOM 403 CD GLN A 25 7.110 21.812 -7.186 1.00 0.00 C ATOM 404 OE1 GLN A 25 6.479 21.206 -6.322 1.00 0.00 O ATOM 405 NE2 GLN A 25 6.612 22.919 -7.705 1.00 0.00 N ATOM 0 H GLN A 25 8.754 18.130 -7.418 1.00 0.00 H new ATOM 0 HA GLN A 25 10.960 20.041 -7.937 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.594 19.999 -5.999 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.818 21.252 -6.049 1.00 0.00 H new ATOM 0 HG2 GLN A 25 9.036 22.137 -8.088 1.00 0.00 H new ATOM 0 HG3 GLN A 25 8.267 20.638 -8.569 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.132 23.425 -8.422 1.00 0.00 H new ATOM 0 HE22 GLN A 25 5.707 23.268 -7.389 1.00 0.00 H new ATOM 414 N LEU A 26 10.809 17.646 -5.742 1.00 0.00 N ATOM 415 CA LEU A 26 11.537 16.865 -4.747 1.00 0.00 C ATOM 416 C LEU A 26 12.692 16.127 -5.427 1.00 0.00 C ATOM 417 O LEU A 26 13.854 16.314 -5.064 1.00 0.00 O ATOM 418 CB LEU A 26 10.573 15.848 -4.095 1.00 0.00 C ATOM 419 CG LEU A 26 9.555 16.479 -3.128 1.00 0.00 C ATOM 420 CD1 LEU A 26 8.416 15.501 -2.812 1.00 0.00 C ATOM 421 CD2 LEU A 26 10.226 16.899 -1.819 1.00 0.00 C ATOM 0 H LEU A 26 10.005 17.145 -6.121 1.00 0.00 H new ATOM 0 HA LEU A 26 11.938 17.525 -3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 26 10.033 15.320 -4.881 1.00 0.00 H new ATOM 0 HB3 LEU A 26 11.158 15.104 -3.555 1.00 0.00 H new ATOM 0 HG LEU A 26 9.147 17.361 -3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.711 15.972 -2.127 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.901 15.232 -3.734 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.825 14.603 -2.350 1.00 0.00 H new ATOM 0 HD21 LEU A 26 9.483 17.342 -1.155 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.667 16.025 -1.339 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.007 17.630 -2.029 1.00 0.00 H new ATOM 433 N ILE A 27 12.374 15.304 -6.428 1.00 0.00 N ATOM 434 CA ILE A 27 13.329 14.460 -7.132 1.00 0.00 C ATOM 435 C ILE A 27 13.980 15.196 -8.310 1.00 0.00 C ATOM 436 O ILE A 27 13.611 16.321 -8.654 1.00 0.00 O ATOM 437 CB ILE A 27 12.686 13.122 -7.576 1.00 0.00 C ATOM 438 CG1 ILE A 27 11.191 13.173 -7.959 1.00 0.00 C ATOM 439 CG2 ILE A 27 12.936 12.061 -6.495 1.00 0.00 C ATOM 440 CD1 ILE A 27 10.661 11.874 -8.556 1.00 0.00 C ATOM 0 H ILE A 27 11.420 15.207 -6.777 1.00 0.00 H new ATOM 0 HA ILE A 27 14.126 14.219 -6.428 1.00 0.00 H new ATOM 0 HB ILE A 27 13.179 12.863 -8.513 1.00 0.00 H new ATOM 0 HG12 ILE A 27 10.607 13.418 -7.072 1.00 0.00 H new ATOM 0 HG13 ILE A 27 11.037 13.980 -8.675 1.00 0.00 H new ATOM 0 HG21 ILE A 27 12.486 11.117 -6.801 1.00 0.00 H new ATOM 0 HG22 ILE A 27 14.009 11.925 -6.360 1.00 0.00 H new ATOM 0 HG23 ILE A 27 12.491 12.387 -5.555 1.00 0.00 H new ATOM 0 HD11 ILE A 27 9.605 11.989 -8.799 1.00 0.00 H new ATOM 0 HD12 ILE A 27 11.218 11.636 -9.462 1.00 0.00 H new ATOM 0 HD13 ILE A 27 10.781 11.066 -7.834 1.00 0.00 H new ATOM 452 N GLY A 28 14.974 14.533 -8.910 1.00 0.00 N ATOM 453 CA GLY A 28 15.763 15.006 -10.037 1.00 0.00 C ATOM 454 C GLY A 28 17.208 15.280 -9.625 1.00 0.00 C ATOM 455 O GLY A 28 18.077 15.388 -10.491 1.00 0.00 O ATOM 0 H GLY A 28 15.260 13.604 -8.601 1.00 0.00 H new ATOM 0 HA2 GLY A 28 15.744 14.263 -10.834 1.00 0.00 H new ATOM 0 HA3 GLY A 28 15.318 15.916 -10.439 1.00 0.00 H new ATOM 459 N GLU A 29 17.499 15.323 -8.320 1.00 0.00 N ATOM 460 CA GLU A 29 18.783 15.803 -7.815 1.00 0.00 C ATOM 461 C GLU A 29 19.213 15.082 -6.532 1.00 0.00 C ATOM 462 O GLU A 29 20.360 14.649 -6.427 1.00 0.00 O ATOM 463 CB GLU A 29 18.598 17.308 -7.557 1.00 0.00 C ATOM 464 CG GLU A 29 19.907 18.074 -7.321 1.00 0.00 C ATOM 465 CD GLU A 29 20.774 18.163 -8.592 1.00 0.00 C ATOM 466 OE1 GLU A 29 20.560 19.080 -9.418 1.00 0.00 O ATOM 467 OE2 GLU A 29 21.694 17.334 -8.767 1.00 0.00 O ATOM 0 H GLU A 29 16.852 15.027 -7.590 1.00 0.00 H new ATOM 0 HA GLU A 29 19.573 15.605 -8.539 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.081 17.750 -8.409 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.952 17.439 -6.689 1.00 0.00 H new ATOM 0 HG2 GLU A 29 19.678 19.080 -6.970 1.00 0.00 H new ATOM 0 HG3 GLU A 29 20.475 17.583 -6.531 1.00 0.00 H new ATOM 474 N LYS A 30 18.297 14.912 -5.572 1.00 0.00 N ATOM 475 CA LYS A 30 18.566 14.318 -4.261 1.00 0.00 C ATOM 476 C LYS A 30 17.461 13.308 -3.944 1.00 0.00 C ATOM 477 O LYS A 30 16.340 13.488 -4.430 1.00 0.00 O ATOM 478 CB LYS A 30 18.596 15.424 -3.187 1.00 0.00 C ATOM 479 CG LYS A 30 19.808 16.356 -3.321 1.00 0.00 C ATOM 480 CD LYS A 30 19.693 17.526 -2.332 1.00 0.00 C ATOM 481 CE LYS A 30 20.965 18.385 -2.263 1.00 0.00 C ATOM 482 NZ LYS A 30 21.251 19.130 -3.518 1.00 0.00 N ATOM 0 H LYS A 30 17.323 15.192 -5.690 1.00 0.00 H new ATOM 0 HA LYS A 30 19.532 13.813 -4.270 1.00 0.00 H new ATOM 0 HB2 LYS A 30 17.682 16.014 -3.255 1.00 0.00 H new ATOM 0 HB3 LYS A 30 18.606 14.964 -2.199 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.726 15.800 -3.131 1.00 0.00 H new ATOM 0 HG3 LYS A 30 19.871 16.737 -4.340 1.00 0.00 H new ATOM 0 HD2 LYS A 30 18.852 18.156 -2.620 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.472 17.134 -1.339 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.869 19.096 -1.443 1.00 0.00 H new ATOM 0 HE3 LYS A 30 21.814 17.743 -2.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 22.121 19.687 -3.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 21.374 18.457 -4.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.458 19.768 -3.731 1.00 0.00 H new ATOM 496 N PRO A 31 17.749 12.258 -3.157 1.00 0.00 N ATOM 497 CA PRO A 31 16.740 11.307 -2.713 1.00 0.00 C ATOM 498 C PRO A 31 15.703 11.991 -1.817 1.00 0.00 C ATOM 499 O PRO A 31 15.868 13.144 -1.400 1.00 0.00 O ATOM 500 CB PRO A 31 17.518 10.186 -2.010 1.00 0.00 C ATOM 501 CG PRO A 31 18.804 10.858 -1.538 1.00 0.00 C ATOM 502 CD PRO A 31 19.055 11.909 -2.616 1.00 0.00 C ATOM 0 HA PRO A 31 16.157 10.895 -3.536 1.00 0.00 H new ATOM 0 HB2 PRO A 31 16.954 9.775 -1.173 1.00 0.00 H new ATOM 0 HB3 PRO A 31 17.727 9.360 -2.690 1.00 0.00 H new ATOM 0 HG2 PRO A 31 18.686 11.310 -0.553 1.00 0.00 H new ATOM 0 HG3 PRO A 31 19.628 10.148 -1.466 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.549 12.785 -2.197 1.00 0.00 H new ATOM 0 HD3 PRO A 31 19.707 11.518 -3.397 1.00 0.00 H new ATOM 510 N THR A 32 14.630 11.271 -1.504 1.00 0.00 N ATOM 511 CA THR A 32 13.498 11.795 -0.751 1.00 0.00 C ATOM 512 C THR A 32 13.067 10.788 0.316 1.00 0.00 C ATOM 513 O THR A 32 13.190 9.575 0.133 1.00 0.00 O ATOM 514 CB THR A 32 12.358 12.131 -1.733 1.00 0.00 C ATOM 515 OG1 THR A 32 12.800 13.069 -2.696 1.00 0.00 O ATOM 516 CG2 THR A 32 11.115 12.725 -1.058 1.00 0.00 C ATOM 0 H THR A 32 14.522 10.292 -1.771 1.00 0.00 H new ATOM 0 HA THR A 32 13.778 12.710 -0.229 1.00 0.00 H new ATOM 0 HB THR A 32 12.082 11.179 -2.187 1.00 0.00 H new ATOM 0 HG1 THR A 32 12.127 13.153 -3.404 1.00 0.00 H new ATOM 0 HG21 THR A 32 10.357 12.935 -1.812 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.719 12.013 -0.334 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.385 13.649 -0.547 1.00 0.00 H new ATOM 524 N LEU A 33 12.525 11.308 1.415 1.00 0.00 N ATOM 525 CA LEU A 33 11.898 10.585 2.502 1.00 0.00 C ATOM 526 C LEU A 33 10.486 11.145 2.645 1.00 0.00 C ATOM 527 O LEU A 33 10.318 12.343 2.880 1.00 0.00 O ATOM 528 CB LEU A 33 12.719 10.804 3.789 1.00 0.00 C ATOM 529 CG LEU A 33 12.002 10.387 5.091 1.00 0.00 C ATOM 530 CD1 LEU A 33 11.562 8.919 5.098 1.00 0.00 C ATOM 531 CD2 LEU A 33 12.923 10.622 6.289 1.00 0.00 C ATOM 0 H LEU A 33 12.515 12.316 1.573 1.00 0.00 H new ATOM 0 HA LEU A 33 11.856 9.512 2.313 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.651 10.245 3.709 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.985 11.859 3.859 1.00 0.00 H new ATOM 0 HG LEU A 33 11.104 11.002 5.155 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.065 8.693 6.041 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.872 8.742 4.273 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.435 8.277 4.985 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.411 10.326 7.205 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.830 10.029 6.172 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.185 11.679 6.345 1.00 0.00 H new ATOM 543 N ILE A 34 9.480 10.285 2.506 1.00 0.00 N ATOM 544 CA ILE A 34 8.095 10.599 2.833 1.00 0.00 C ATOM 545 C ILE A 34 7.833 9.812 4.114 1.00 0.00 C ATOM 546 O ILE A 34 8.211 8.637 4.188 1.00 0.00 O ATOM 547 CB ILE A 34 7.131 10.173 1.698 1.00 0.00 C ATOM 548 CG1 ILE A 34 7.571 10.752 0.333 1.00 0.00 C ATOM 549 CG2 ILE A 34 5.682 10.579 2.048 1.00 0.00 C ATOM 550 CD1 ILE A 34 6.645 10.376 -0.825 1.00 0.00 C ATOM 0 H ILE A 34 9.608 9.335 2.157 1.00 0.00 H new ATOM 0 HA ILE A 34 7.929 11.669 2.958 1.00 0.00 H new ATOM 0 HB ILE A 34 7.168 9.087 1.607 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.620 11.838 0.409 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.579 10.402 0.108 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.014 10.274 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.381 10.090 2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.628 11.660 2.175 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.019 10.819 -1.748 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.614 9.291 -0.929 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.641 10.750 -0.624 1.00 0.00 H new ATOM 562 N HIS A 35 7.171 10.411 5.103 1.00 0.00 N ATOM 563 CA HIS A 35 6.735 9.668 6.278 1.00 0.00 C ATOM 564 C HIS A 35 5.264 9.936 6.580 1.00 0.00 C ATOM 565 O HIS A 35 4.719 10.991 6.248 1.00 0.00 O ATOM 566 CB HIS A 35 7.671 9.916 7.473 1.00 0.00 C ATOM 567 CG HIS A 35 7.474 11.231 8.179 1.00 0.00 C ATOM 568 ND1 HIS A 35 6.840 11.410 9.388 1.00 0.00 N ATOM 569 CD2 HIS A 35 7.918 12.457 7.766 1.00 0.00 C ATOM 570 CE1 HIS A 35 6.894 12.715 9.691 1.00 0.00 C ATOM 571 NE2 HIS A 35 7.547 13.398 8.734 1.00 0.00 N ATOM 0 H HIS A 35 6.928 11.401 5.112 1.00 0.00 H new ATOM 0 HA HIS A 35 6.806 8.601 6.066 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.534 9.110 8.194 1.00 0.00 H new ATOM 0 HB3 HIS A 35 8.702 9.860 7.124 1.00 0.00 H new ATOM 0 HD1 HIS A 35 6.406 10.680 9.953 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.459 12.663 6.854 1.00 0.00 H new ATOM 0 HE1 HIS A 35 6.471 13.157 10.581 1.00 0.00 H new ATOM 579 N PHE A 36 4.632 8.959 7.220 1.00 0.00 N ATOM 580 CA PHE A 36 3.217 8.895 7.531 1.00 0.00 C ATOM 581 C PHE A 36 3.137 8.762 9.044 1.00 0.00 C ATOM 582 O PHE A 36 3.878 7.963 9.615 1.00 0.00 O ATOM 583 CB PHE A 36 2.572 7.684 6.845 1.00 0.00 C ATOM 584 CG PHE A 36 2.497 7.769 5.331 1.00 0.00 C ATOM 585 CD1 PHE A 36 3.631 7.491 4.541 1.00 0.00 C ATOM 586 CD2 PHE A 36 1.272 8.071 4.704 1.00 0.00 C ATOM 587 CE1 PHE A 36 3.542 7.523 3.138 1.00 0.00 C ATOM 588 CE2 PHE A 36 1.182 8.094 3.301 1.00 0.00 C ATOM 589 CZ PHE A 36 2.317 7.823 2.518 1.00 0.00 C ATOM 0 H PHE A 36 5.133 8.137 7.556 1.00 0.00 H new ATOM 0 HA PHE A 36 2.684 9.778 7.178 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.133 6.790 7.116 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.563 7.558 7.237 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.572 7.253 5.015 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.399 8.286 5.303 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.415 7.317 2.537 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.240 8.320 2.825 1.00 0.00 H new ATOM 0 HZ PHE A 36 2.248 7.845 1.440 1.00 0.00 H new ATOM 599 N TRP A 37 2.301 9.549 9.712 1.00 0.00 N ATOM 600 CA TRP A 37 2.302 9.648 11.171 1.00 0.00 C ATOM 601 C TRP A 37 0.955 10.195 11.650 1.00 0.00 C ATOM 602 O TRP A 37 0.197 10.740 10.847 1.00 0.00 O ATOM 603 CB TRP A 37 3.453 10.575 11.602 1.00 0.00 C ATOM 604 CG TRP A 37 3.365 11.946 11.006 1.00 0.00 C ATOM 605 CD1 TRP A 37 3.600 12.258 9.712 1.00 0.00 C ATOM 606 CD2 TRP A 37 2.955 13.191 11.644 1.00 0.00 C ATOM 607 NE1 TRP A 37 3.243 13.570 9.485 1.00 0.00 N ATOM 608 CE2 TRP A 37 2.860 14.202 10.645 1.00 0.00 C ATOM 609 CE3 TRP A 37 2.686 13.579 12.971 1.00 0.00 C ATOM 610 CZ2 TRP A 37 2.468 15.514 10.939 1.00 0.00 C ATOM 611 CZ3 TRP A 37 2.382 14.917 13.281 1.00 0.00 C ATOM 612 CH2 TRP A 37 2.241 15.881 12.271 1.00 0.00 C ATOM 0 H TRP A 37 1.602 10.138 9.259 1.00 0.00 H new ATOM 0 HA TRP A 37 2.449 8.664 11.617 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.455 10.658 12.689 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.402 10.122 11.315 1.00 0.00 H new ATOM 0 HD1 TRP A 37 4.005 11.584 8.971 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.261 14.017 8.569 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.713 12.841 13.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.342 16.236 10.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.255 15.207 14.314 1.00 0.00 H new ATOM 0 HH2 TRP A 37 1.961 16.894 12.518 1.00 0.00 H new ATOM 623 N SER A 38 0.667 10.079 12.946 1.00 0.00 N ATOM 624 CA SER A 38 -0.583 10.502 13.558 1.00 0.00 C ATOM 625 C SER A 38 -0.258 11.049 14.944 1.00 0.00 C ATOM 626 O SER A 38 0.500 10.411 15.674 1.00 0.00 O ATOM 627 CB SER A 38 -1.508 9.287 13.695 1.00 0.00 C ATOM 628 OG SER A 38 -1.917 8.785 12.438 1.00 0.00 O ATOM 0 H SER A 38 1.321 9.675 13.616 1.00 0.00 H new ATOM 0 HA SER A 38 -1.075 11.263 12.952 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.994 8.501 14.249 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.387 9.565 14.277 1.00 0.00 H new ATOM 0 HG SER A 38 -2.405 9.481 11.951 1.00 0.00 H new ATOM 634 N ILE A 39 -0.846 12.176 15.362 1.00 0.00 N ATOM 635 CA ILE A 39 -0.607 12.731 16.703 1.00 0.00 C ATOM 636 C ILE A 39 -1.280 11.912 17.829 1.00 0.00 C ATOM 637 O ILE A 39 -1.494 12.431 18.923 1.00 0.00 O ATOM 638 CB ILE A 39 -0.936 14.242 16.785 1.00 0.00 C ATOM 639 CG1 ILE A 39 -2.434 14.594 16.707 1.00 0.00 C ATOM 640 CG2 ILE A 39 -0.131 15.029 15.739 1.00 0.00 C ATOM 641 CD1 ILE A 39 -2.757 15.924 17.383 1.00 0.00 C ATOM 0 H ILE A 39 -1.491 12.723 14.792 1.00 0.00 H new ATOM 0 HA ILE A 39 0.465 12.640 16.876 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.634 14.543 17.788 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.740 14.637 15.662 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.015 13.801 17.177 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.376 16.088 15.813 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.935 14.890 15.920 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.380 14.668 14.741 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.825 16.125 17.300 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.478 15.874 18.436 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.199 16.724 16.897 1.00 0.00 H new ATOM 653 N SER A 40 -1.614 10.646 17.584 1.00 0.00 N ATOM 654 CA SER A 40 -2.431 9.807 18.451 1.00 0.00 C ATOM 655 C SER A 40 -1.765 8.453 18.760 1.00 0.00 C ATOM 656 O SER A 40 -2.421 7.568 19.316 1.00 0.00 O ATOM 657 CB SER A 40 -3.800 9.644 17.776 1.00 0.00 C ATOM 658 OG SER A 40 -3.659 9.176 16.443 1.00 0.00 O ATOM 0 H SER A 40 -1.309 10.160 16.741 1.00 0.00 H new ATOM 0 HA SER A 40 -2.549 10.284 19.424 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.410 8.945 18.348 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.325 10.599 17.776 1.00 0.00 H new ATOM 0 HG SER A 40 -3.976 9.863 15.820 1.00 0.00 H new ATOM 664 N CYS A 41 -0.492 8.250 18.387 1.00 0.00 N ATOM 665 CA CYS A 41 0.228 6.992 18.591 1.00 0.00 C ATOM 666 C CYS A 41 1.554 7.290 19.291 1.00 0.00 C ATOM 667 O CYS A 41 2.255 8.224 18.905 1.00 0.00 O ATOM 668 CB CYS A 41 0.442 6.328 17.221 1.00 0.00 C ATOM 669 SG CYS A 41 1.324 4.749 17.383 1.00 0.00 S ATOM 0 H CYS A 41 0.070 8.967 17.929 1.00 0.00 H new ATOM 0 HA CYS A 41 -0.339 6.307 19.221 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -0.522 6.161 16.741 1.00 0.00 H new ATOM 0 HB3 CYS A 41 1.008 6.998 16.574 1.00 0.00 H new ATOM 0 HG CYS A 41 1.483 4.218 16.207 1.00 0.00 H new ATOM 675 N HIS A 42 1.920 6.490 20.299 1.00 0.00 N ATOM 676 CA HIS A 42 3.132 6.707 21.087 1.00 0.00 C ATOM 677 C HIS A 42 4.391 6.632 20.221 1.00 0.00 C ATOM 678 O HIS A 42 5.291 7.456 20.364 1.00 0.00 O ATOM 679 CB HIS A 42 3.198 5.699 22.245 1.00 0.00 C ATOM 680 CG HIS A 42 4.396 5.905 23.140 1.00 0.00 C ATOM 681 ND1 HIS A 42 4.571 6.921 24.055 1.00 0.00 N ATOM 682 CD2 HIS A 42 5.532 5.137 23.172 1.00 0.00 C ATOM 683 CE1 HIS A 42 5.779 6.768 24.622 1.00 0.00 C ATOM 684 NE2 HIS A 42 6.407 5.687 24.119 1.00 0.00 N ATOM 0 H HIS A 42 1.381 5.674 20.589 1.00 0.00 H new ATOM 0 HA HIS A 42 3.089 7.714 21.502 1.00 0.00 H new ATOM 0 HB2 HIS A 42 2.289 5.779 22.841 1.00 0.00 H new ATOM 0 HB3 HIS A 42 3.225 4.688 21.838 1.00 0.00 H new ATOM 0 HD2 HIS A 42 5.720 4.260 22.571 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.190 7.421 25.377 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.331 5.340 24.375 1.00 0.00 H new ATOM 692 N LEU A 43 4.448 5.681 19.285 1.00 0.00 N ATOM 693 CA LEU A 43 5.594 5.563 18.384 1.00 0.00 C ATOM 694 C LEU A 43 5.697 6.812 17.508 1.00 0.00 C ATOM 695 O LEU A 43 6.810 7.273 17.255 1.00 0.00 O ATOM 696 CB LEU A 43 5.512 4.286 17.523 1.00 0.00 C ATOM 697 CG LEU A 43 6.137 3.014 18.130 1.00 0.00 C ATOM 698 CD1 LEU A 43 7.669 3.113 18.205 1.00 0.00 C ATOM 699 CD2 LEU A 43 5.568 2.664 19.509 1.00 0.00 C ATOM 0 H LEU A 43 3.717 4.986 19.133 1.00 0.00 H new ATOM 0 HA LEU A 43 6.497 5.481 18.989 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.462 4.084 17.310 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.999 4.485 16.568 1.00 0.00 H new ATOM 0 HG LEU A 43 5.868 2.205 17.451 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.072 2.198 18.638 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.074 3.249 17.202 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.949 3.963 18.828 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.048 1.759 19.882 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.756 3.486 20.200 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.494 2.497 19.428 1.00 0.00 H new ATOM 711 N CYS A 44 4.568 7.410 17.098 1.00 0.00 N ATOM 712 CA CYS A 44 4.597 8.713 16.445 1.00 0.00 C ATOM 713 C CYS A 44 5.175 9.768 17.385 1.00 0.00 C ATOM 714 O CYS A 44 6.011 10.542 16.940 1.00 0.00 O ATOM 715 CB CYS A 44 3.221 9.139 15.922 1.00 0.00 C ATOM 716 SG CYS A 44 2.637 8.002 14.635 1.00 0.00 S ATOM 0 H CYS A 44 3.636 7.011 17.209 1.00 0.00 H new ATOM 0 HA CYS A 44 5.247 8.622 15.575 1.00 0.00 H new ATOM 0 HB2 CYS A 44 2.506 9.162 16.744 1.00 0.00 H new ATOM 0 HB3 CYS A 44 3.277 10.151 15.521 1.00 0.00 H new ATOM 0 HG CYS A 44 1.338 7.952 14.657 1.00 0.00 H new ATOM 722 N LYS A 45 4.817 9.797 18.672 1.00 0.00 N ATOM 723 CA LYS A 45 5.362 10.799 19.597 1.00 0.00 C ATOM 724 C LYS A 45 6.875 10.695 19.778 1.00 0.00 C ATOM 725 O LYS A 45 7.483 11.679 20.192 1.00 0.00 O ATOM 726 CB LYS A 45 4.712 10.727 20.985 1.00 0.00 C ATOM 727 CG LYS A 45 3.179 10.833 21.024 1.00 0.00 C ATOM 728 CD LYS A 45 2.617 11.951 20.128 1.00 0.00 C ATOM 729 CE LYS A 45 1.110 12.169 20.332 1.00 0.00 C ATOM 730 NZ LYS A 45 0.767 12.736 21.661 1.00 0.00 N ATOM 0 H LYS A 45 4.158 9.144 19.096 1.00 0.00 H new ATOM 0 HA LYS A 45 5.127 11.754 19.126 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.002 9.785 21.450 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.126 11.527 21.599 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.749 9.880 20.715 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.861 11.008 22.052 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.147 12.880 20.337 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.807 11.704 19.083 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.739 12.837 19.554 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.593 11.217 20.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -0.250 12.952 21.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.999 12.046 22.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.311 13.608 21.817 1.00 0.00 H new ATOM 744 N GLU A 46 7.486 9.546 19.497 1.00 0.00 N ATOM 745 CA GLU A 46 8.934 9.356 19.593 1.00 0.00 C ATOM 746 C GLU A 46 9.594 9.699 18.248 1.00 0.00 C ATOM 747 O GLU A 46 10.614 10.402 18.169 1.00 0.00 O ATOM 748 CB GLU A 46 9.195 7.892 19.987 1.00 0.00 C ATOM 749 CG GLU A 46 8.607 7.518 21.362 1.00 0.00 C ATOM 750 CD GLU A 46 9.444 8.084 22.523 1.00 0.00 C ATOM 751 OE1 GLU A 46 10.432 7.435 22.938 1.00 0.00 O ATOM 752 OE2 GLU A 46 9.123 9.177 23.040 1.00 0.00 O ATOM 0 H GLU A 46 6.985 8.711 19.193 1.00 0.00 H new ATOM 0 HA GLU A 46 9.364 10.015 20.347 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.769 7.237 19.227 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.270 7.712 19.998 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.587 7.895 21.434 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.553 6.433 21.450 1.00 0.00 H new ATOM 759 N ALA A 47 8.963 9.255 17.154 1.00 0.00 N ATOM 760 CA ALA A 47 9.410 9.610 15.825 1.00 0.00 C ATOM 761 C ALA A 47 9.311 11.116 15.635 1.00 0.00 C ATOM 762 O ALA A 47 10.167 11.659 14.969 1.00 0.00 O ATOM 763 CB ALA A 47 8.609 8.852 14.758 1.00 0.00 C ATOM 0 H ALA A 47 8.142 8.650 17.175 1.00 0.00 H new ATOM 0 HA ALA A 47 10.454 9.318 15.710 1.00 0.00 H new ATOM 0 HB1 ALA A 47 8.963 9.136 13.767 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.742 7.779 14.897 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.552 9.102 14.851 1.00 0.00 H new ATOM 769 N MET A 48 8.348 11.810 16.237 1.00 0.00 N ATOM 770 CA MET A 48 8.152 13.244 16.084 1.00 0.00 C ATOM 771 C MET A 48 9.414 14.076 16.386 1.00 0.00 C ATOM 772 O MET A 48 9.899 14.767 15.485 1.00 0.00 O ATOM 773 CB MET A 48 6.935 13.687 16.911 1.00 0.00 C ATOM 774 CG MET A 48 5.609 13.491 16.171 1.00 0.00 C ATOM 775 SD MET A 48 5.203 14.760 14.951 1.00 0.00 S ATOM 776 CE MET A 48 6.023 14.169 13.445 1.00 0.00 C ATOM 0 H MET A 48 7.667 11.377 16.860 1.00 0.00 H new ATOM 0 HA MET A 48 7.950 13.441 15.031 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.911 13.124 17.844 1.00 0.00 H new ATOM 0 HB3 MET A 48 7.045 14.738 17.176 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.633 12.524 15.669 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.806 13.449 16.906 1.00 0.00 H new ATOM 0 HE1 MET A 48 5.514 14.575 12.571 1.00 0.00 H new ATOM 0 HE2 MET A 48 7.063 14.496 13.444 1.00 0.00 H new ATOM 0 HE3 MET A 48 5.985 13.080 13.414 1.00 0.00 H new ATOM 786 N PRO A 49 10.012 14.004 17.590 1.00 0.00 N ATOM 787 CA PRO A 49 11.276 14.671 17.849 1.00 0.00 C ATOM 788 C PRO A 49 12.384 14.129 16.952 1.00 0.00 C ATOM 789 O PRO A 49 13.224 14.923 16.512 1.00 0.00 O ATOM 790 CB PRO A 49 11.589 14.464 19.332 1.00 0.00 C ATOM 791 CG PRO A 49 10.682 13.322 19.776 1.00 0.00 C ATOM 792 CD PRO A 49 9.512 13.385 18.801 1.00 0.00 C ATOM 0 HA PRO A 49 11.208 15.735 17.622 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.639 14.214 19.482 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.392 15.369 19.906 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.194 12.361 19.724 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.351 13.452 20.806 1.00 0.00 H new ATOM 0 HD2 PRO A 49 9.126 12.387 18.594 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.689 13.964 19.220 1.00 0.00 H new ATOM 800 N GLN A 50 12.406 12.822 16.641 1.00 0.00 N ATOM 801 CA GLN A 50 13.503 12.349 15.800 1.00 0.00 C ATOM 802 C GLN A 50 13.384 12.894 14.378 1.00 0.00 C ATOM 803 O GLN A 50 14.399 13.278 13.825 1.00 0.00 O ATOM 804 CB GLN A 50 13.734 10.830 15.866 1.00 0.00 C ATOM 805 CG GLN A 50 15.245 10.502 15.960 1.00 0.00 C ATOM 806 CD GLN A 50 15.938 10.143 14.639 1.00 0.00 C ATOM 807 OE1 GLN A 50 16.713 10.914 14.075 1.00 0.00 O ATOM 808 NE2 GLN A 50 15.728 8.933 14.148 1.00 0.00 N ATOM 0 H GLN A 50 11.726 12.122 16.937 1.00 0.00 H new ATOM 0 HA GLN A 50 14.419 12.764 16.222 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.214 10.417 16.730 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.309 10.355 14.981 1.00 0.00 H new ATOM 0 HG2 GLN A 50 15.757 11.361 16.394 1.00 0.00 H new ATOM 0 HG3 GLN A 50 15.374 9.670 16.653 1.00 0.00 H new ATOM 0 HE21 GLN A 50 15.085 8.296 14.618 1.00 0.00 H new ATOM 0 HE22 GLN A 50 16.209 8.637 13.299 1.00 0.00 H new ATOM 817 N VAL A 51 12.181 13.047 13.820 1.00 0.00 N ATOM 818 CA VAL A 51 11.907 13.701 12.543 1.00 0.00 C ATOM 819 C VAL A 51 12.502 15.106 12.580 1.00 0.00 C ATOM 820 O VAL A 51 13.109 15.505 11.586 1.00 0.00 O ATOM 821 CB VAL A 51 10.383 13.700 12.239 1.00 0.00 C ATOM 822 CG1 VAL A 51 9.970 14.616 11.080 1.00 0.00 C ATOM 823 CG2 VAL A 51 9.848 12.305 11.878 1.00 0.00 C ATOM 0 H VAL A 51 11.333 12.701 14.269 1.00 0.00 H new ATOM 0 HA VAL A 51 12.376 13.152 11.726 1.00 0.00 H new ATOM 0 HB VAL A 51 9.956 14.064 13.173 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.891 14.556 10.935 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.248 15.644 11.312 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.477 14.300 10.168 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.779 12.366 11.676 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.364 11.936 10.992 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.021 11.622 12.710 1.00 0.00 H new ATOM 833 N ASN A 52 12.405 15.835 13.703 1.00 0.00 N ATOM 834 CA ASN A 52 13.033 17.152 13.796 1.00 0.00 C ATOM 835 C ASN A 52 14.543 17.068 13.545 1.00 0.00 C ATOM 836 O ASN A 52 15.063 17.808 12.701 1.00 0.00 O ATOM 837 CB ASN A 52 12.680 17.843 15.125 1.00 0.00 C ATOM 838 CG ASN A 52 13.882 18.283 15.964 1.00 0.00 C ATOM 839 OD1 ASN A 52 14.430 19.361 15.777 1.00 0.00 O ATOM 840 ND2 ASN A 52 14.331 17.455 16.893 1.00 0.00 N ATOM 0 H ASN A 52 11.907 15.538 14.542 1.00 0.00 H new ATOM 0 HA ASN A 52 12.627 17.782 13.005 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.066 18.718 14.911 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.070 17.163 15.720 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.139 17.714 17.459 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.869 16.558 17.043 1.00 0.00 H new ATOM 847 N GLU A 53 15.259 16.164 14.221 1.00 0.00 N ATOM 848 CA GLU A 53 16.705 16.107 14.015 1.00 0.00 C ATOM 849 C GLU A 53 17.035 15.431 12.683 1.00 0.00 C ATOM 850 O GLU A 53 18.039 15.770 12.073 1.00 0.00 O ATOM 851 CB GLU A 53 17.459 15.493 15.207 1.00 0.00 C ATOM 852 CG GLU A 53 17.096 14.042 15.532 1.00 0.00 C ATOM 853 CD GLU A 53 18.080 13.426 16.541 1.00 0.00 C ATOM 854 OE1 GLU A 53 17.865 13.553 17.768 1.00 0.00 O ATOM 855 OE2 GLU A 53 19.075 12.801 16.106 1.00 0.00 O ATOM 0 H GLU A 53 14.881 15.490 14.887 1.00 0.00 H new ATOM 0 HA GLU A 53 17.068 17.133 13.957 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.529 15.546 15.006 1.00 0.00 H new ATOM 0 HB3 GLU A 53 17.270 16.104 16.089 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.085 14.001 15.937 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.096 13.452 14.616 1.00 0.00 H new ATOM 862 N PHE A 54 16.201 14.519 12.182 1.00 0.00 N ATOM 863 CA PHE A 54 16.416 13.785 10.945 1.00 0.00 C ATOM 864 C PHE A 54 16.366 14.767 9.786 1.00 0.00 C ATOM 865 O PHE A 54 17.240 14.768 8.918 1.00 0.00 O ATOM 866 CB PHE A 54 15.330 12.711 10.809 1.00 0.00 C ATOM 867 CG PHE A 54 15.707 11.531 9.953 1.00 0.00 C ATOM 868 CD1 PHE A 54 15.697 11.627 8.552 1.00 0.00 C ATOM 869 CD2 PHE A 54 16.021 10.311 10.577 1.00 0.00 C ATOM 870 CE1 PHE A 54 16.009 10.497 7.781 1.00 0.00 C ATOM 871 CE2 PHE A 54 16.306 9.178 9.805 1.00 0.00 C ATOM 872 CZ PHE A 54 16.310 9.271 8.405 1.00 0.00 C ATOM 0 H PHE A 54 15.329 14.266 12.646 1.00 0.00 H new ATOM 0 HA PHE A 54 17.388 13.292 10.946 1.00 0.00 H new ATOM 0 HB2 PHE A 54 15.070 12.351 11.804 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.434 13.172 10.392 1.00 0.00 H new ATOM 0 HD1 PHE A 54 15.451 12.563 8.072 1.00 0.00 H new ATOM 0 HD2 PHE A 54 16.042 10.247 11.655 1.00 0.00 H new ATOM 0 HE1 PHE A 54 16.018 10.568 6.703 1.00 0.00 H new ATOM 0 HE2 PHE A 54 16.522 8.235 10.286 1.00 0.00 H new ATOM 0 HZ PHE A 54 16.544 8.403 7.806 1.00 0.00 H new ATOM 882 N ARG A 55 15.368 15.655 9.825 1.00 0.00 N ATOM 883 CA ARG A 55 15.258 16.760 8.900 1.00 0.00 C ATOM 884 C ARG A 55 16.539 17.574 8.944 1.00 0.00 C ATOM 885 O ARG A 55 17.117 17.802 7.891 1.00 0.00 O ATOM 886 CB ARG A 55 13.977 17.567 9.205 1.00 0.00 C ATOM 887 CG ARG A 55 13.919 18.996 8.610 1.00 0.00 C ATOM 888 CD ARG A 55 13.435 20.060 9.609 1.00 0.00 C ATOM 889 NE ARG A 55 14.154 20.000 10.895 1.00 0.00 N ATOM 890 CZ ARG A 55 13.995 20.830 11.937 1.00 0.00 C ATOM 891 NH1 ARG A 55 13.274 21.935 11.871 1.00 0.00 N ATOM 892 NH2 ARG A 55 14.555 20.544 13.099 1.00 0.00 N ATOM 0 H ARG A 55 14.613 15.617 10.510 1.00 0.00 H new ATOM 0 HA ARG A 55 15.151 16.411 7.873 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.120 17.005 8.834 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.866 17.640 10.287 1.00 0.00 H new ATOM 0 HG2 ARG A 55 14.911 19.271 8.251 1.00 0.00 H new ATOM 0 HG3 ARG A 55 13.256 18.994 7.745 1.00 0.00 H new ATOM 0 HD2 ARG A 55 13.564 21.050 9.171 1.00 0.00 H new ATOM 0 HD3 ARG A 55 12.368 19.927 9.787 1.00 0.00 H new ATOM 0 HE ARG A 55 14.840 19.253 11.003 1.00 0.00 H new ATOM 0 HH11 ARG A 55 12.808 22.189 11.000 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.183 22.534 12.691 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.108 19.693 13.203 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.435 21.174 13.892 1.00 0.00 H new ATOM 906 N ASP A 56 17.011 18.002 10.116 1.00 0.00 N ATOM 907 CA ASP A 56 18.135 18.934 10.174 1.00 0.00 C ATOM 908 C ASP A 56 19.419 18.260 9.703 1.00 0.00 C ATOM 909 O ASP A 56 20.193 18.848 8.944 1.00 0.00 O ATOM 910 CB ASP A 56 18.315 19.438 11.598 1.00 0.00 C ATOM 911 CG ASP A 56 19.536 20.367 11.704 1.00 0.00 C ATOM 912 OD1 ASP A 56 19.469 21.515 11.213 1.00 0.00 O ATOM 913 OD2 ASP A 56 20.559 19.961 12.299 1.00 0.00 O ATOM 0 H ASP A 56 16.639 17.723 11.024 1.00 0.00 H new ATOM 0 HA ASP A 56 17.920 19.775 9.514 1.00 0.00 H new ATOM 0 HB2 ASP A 56 17.419 19.972 11.915 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.438 18.592 12.274 1.00 0.00 H new ATOM 918 N LYS A 57 19.615 17.004 10.113 1.00 0.00 N ATOM 919 CA LYS A 57 20.816 16.247 9.817 1.00 0.00 C ATOM 920 C LYS A 57 20.998 16.041 8.316 1.00 0.00 C ATOM 921 O LYS A 57 22.142 16.013 7.858 1.00 0.00 O ATOM 922 CB LYS A 57 20.794 14.878 10.519 1.00 0.00 C ATOM 923 CG LYS A 57 21.138 14.948 12.018 1.00 0.00 C ATOM 924 CD LYS A 57 20.993 13.593 12.736 1.00 0.00 C ATOM 925 CE LYS A 57 19.543 13.088 12.723 1.00 0.00 C ATOM 926 NZ LYS A 57 19.350 11.867 13.532 1.00 0.00 N ATOM 0 H LYS A 57 18.932 16.486 10.665 1.00 0.00 H new ATOM 0 HA LYS A 57 21.656 16.831 10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 57 19.805 14.435 10.402 1.00 0.00 H new ATOM 0 HB3 LYS A 57 21.501 14.213 10.023 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.161 15.306 12.133 1.00 0.00 H new ATOM 0 HG3 LYS A 57 20.489 15.679 12.500 1.00 0.00 H new ATOM 0 HD2 LYS A 57 21.638 12.857 12.255 1.00 0.00 H new ATOM 0 HD3 LYS A 57 21.334 13.690 13.767 1.00 0.00 H new ATOM 0 HE2 LYS A 57 18.887 13.873 13.098 1.00 0.00 H new ATOM 0 HE3 LYS A 57 19.243 12.887 11.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 18.365 11.545 13.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 19.990 11.121 13.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 19.559 12.075 14.529 1.00 0.00 H new ATOM 940 N TYR A 58 19.902 15.919 7.555 1.00 0.00 N ATOM 941 CA TYR A 58 19.970 15.489 6.164 1.00 0.00 C ATOM 942 C TYR A 58 19.292 16.443 5.177 1.00 0.00 C ATOM 943 O TYR A 58 19.356 16.159 3.984 1.00 0.00 O ATOM 944 CB TYR A 58 19.455 14.039 6.054 1.00 0.00 C ATOM 945 CG TYR A 58 20.129 13.073 7.021 1.00 0.00 C ATOM 946 CD1 TYR A 58 21.516 12.840 6.929 1.00 0.00 C ATOM 947 CD2 TYR A 58 19.392 12.470 8.061 1.00 0.00 C ATOM 948 CE1 TYR A 58 22.171 12.065 7.901 1.00 0.00 C ATOM 949 CE2 TYR A 58 20.039 11.691 9.037 1.00 0.00 C ATOM 950 CZ TYR A 58 21.441 11.510 8.976 1.00 0.00 C ATOM 951 OH TYR A 58 22.103 10.837 9.956 1.00 0.00 O ATOM 0 H TYR A 58 18.957 16.114 7.887 1.00 0.00 H new ATOM 0 HA TYR A 58 21.017 15.517 5.861 1.00 0.00 H new ATOM 0 HB2 TYR A 58 18.380 14.030 6.236 1.00 0.00 H new ATOM 0 HB3 TYR A 58 19.609 13.685 5.035 1.00 0.00 H new ATOM 0 HD1 TYR A 58 22.078 13.259 6.108 1.00 0.00 H new ATOM 0 HD2 TYR A 58 18.322 12.607 8.108 1.00 0.00 H new ATOM 0 HE1 TYR A 58 23.235 11.893 7.826 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.468 11.232 9.830 1.00 0.00 H new ATOM 0 HH TYR A 58 21.602 10.905 10.795 1.00 0.00 H new ATOM 961 N GLN A 59 18.716 17.583 5.594 1.00 0.00 N ATOM 962 CA GLN A 59 18.043 18.506 4.659 1.00 0.00 C ATOM 963 C GLN A 59 18.906 18.970 3.471 1.00 0.00 C ATOM 964 O GLN A 59 18.373 19.355 2.430 1.00 0.00 O ATOM 965 CB GLN A 59 17.393 19.708 5.382 1.00 0.00 C ATOM 966 CG GLN A 59 18.225 20.453 6.445 1.00 0.00 C ATOM 967 CD GLN A 59 19.583 20.962 5.966 1.00 0.00 C ATOM 968 OE1 GLN A 59 19.675 21.774 5.049 1.00 0.00 O ATOM 969 NE2 GLN A 59 20.662 20.497 6.580 1.00 0.00 N ATOM 0 H GLN A 59 18.702 17.888 6.567 1.00 0.00 H new ATOM 0 HA GLN A 59 17.249 17.902 4.220 1.00 0.00 H new ATOM 0 HB2 GLN A 59 17.096 20.432 4.624 1.00 0.00 H new ATOM 0 HB3 GLN A 59 16.480 19.355 5.861 1.00 0.00 H new ATOM 0 HG2 GLN A 59 17.645 21.301 6.809 1.00 0.00 H new ATOM 0 HG3 GLN A 59 18.383 19.787 7.293 1.00 0.00 H new ATOM 0 HE21 GLN A 59 20.566 19.823 7.340 1.00 0.00 H new ATOM 0 HE22 GLN A 59 21.588 20.813 6.293 1.00 0.00 H new ATOM 978 N ASP A 60 20.232 18.920 3.607 1.00 0.00 N ATOM 979 CA ASP A 60 21.190 19.338 2.579 1.00 0.00 C ATOM 980 C ASP A 60 21.467 18.227 1.549 1.00 0.00 C ATOM 981 O ASP A 60 22.171 18.453 0.567 1.00 0.00 O ATOM 982 CB ASP A 60 22.495 19.766 3.270 1.00 0.00 C ATOM 983 CG ASP A 60 23.529 20.348 2.289 1.00 0.00 C ATOM 984 OD1 ASP A 60 23.248 21.386 1.649 1.00 0.00 O ATOM 985 OD2 ASP A 60 24.659 19.815 2.211 1.00 0.00 O ATOM 0 H ASP A 60 20.682 18.579 4.456 1.00 0.00 H new ATOM 0 HA ASP A 60 20.760 20.173 2.026 1.00 0.00 H new ATOM 0 HB2 ASP A 60 22.269 20.509 4.035 1.00 0.00 H new ATOM 0 HB3 ASP A 60 22.929 18.906 3.780 1.00 0.00 H new ATOM 990 N GLN A 61 20.919 17.023 1.754 1.00 0.00 N ATOM 991 CA GLN A 61 21.257 15.811 1.006 1.00 0.00 C ATOM 992 C GLN A 61 20.032 14.939 0.692 1.00 0.00 C ATOM 993 O GLN A 61 20.119 14.048 -0.150 1.00 0.00 O ATOM 994 CB GLN A 61 22.226 14.972 1.859 1.00 0.00 C ATOM 995 CG GLN A 61 23.520 15.686 2.283 1.00 0.00 C ATOM 996 CD GLN A 61 24.425 14.748 3.085 1.00 0.00 C ATOM 997 OE1 GLN A 61 25.128 13.909 2.529 1.00 0.00 O ATOM 998 NE2 GLN A 61 24.427 14.857 4.406 1.00 0.00 N ATOM 0 H GLN A 61 20.207 16.863 2.467 1.00 0.00 H new ATOM 0 HA GLN A 61 21.696 16.124 0.059 1.00 0.00 H new ATOM 0 HB2 GLN A 61 21.702 14.643 2.756 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.493 14.075 1.299 1.00 0.00 H new ATOM 0 HG2 GLN A 61 24.050 16.041 1.399 1.00 0.00 H new ATOM 0 HG3 GLN A 61 23.276 16.563 2.883 1.00 0.00 H new ATOM 0 HE21 GLN A 61 23.840 15.556 4.861 1.00 0.00 H new ATOM 0 HE22 GLN A 61 25.015 14.241 4.968 1.00 0.00 H new ATOM 1007 N LEU A 62 18.900 15.176 1.352 1.00 0.00 N ATOM 1008 CA LEU A 62 17.706 14.348 1.361 1.00 0.00 C ATOM 1009 C LEU A 62 16.537 15.313 1.496 1.00 0.00 C ATOM 1010 O LEU A 62 16.557 16.200 2.352 1.00 0.00 O ATOM 1011 CB LEU A 62 17.762 13.425 2.594 1.00 0.00 C ATOM 1012 CG LEU A 62 16.502 12.572 2.838 1.00 0.00 C ATOM 1013 CD1 LEU A 62 16.441 11.357 1.907 1.00 0.00 C ATOM 1014 CD2 LEU A 62 16.478 12.120 4.299 1.00 0.00 C ATOM 0 H LEU A 62 18.790 16.008 1.932 1.00 0.00 H new ATOM 0 HA LEU A 62 17.615 13.734 0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 62 18.617 12.758 2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.942 14.037 3.477 1.00 0.00 H new ATOM 0 HG LEU A 62 15.628 13.186 2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.537 10.785 2.114 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.428 11.693 0.870 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.315 10.727 2.073 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.589 11.516 4.478 1.00 0.00 H new ATOM 0 HD22 LEU A 62 17.368 11.528 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 62 16.460 12.994 4.950 1.00 0.00 H new ATOM 1026 N ASN A 63 15.517 15.140 0.664 1.00 0.00 N ATOM 1027 CA ASN A 63 14.269 15.881 0.796 1.00 0.00 C ATOM 1028 C ASN A 63 13.425 15.164 1.842 1.00 0.00 C ATOM 1029 O ASN A 63 13.398 13.935 1.855 1.00 0.00 O ATOM 1030 CB ASN A 63 13.497 15.906 -0.526 1.00 0.00 C ATOM 1031 CG ASN A 63 14.254 16.567 -1.667 1.00 0.00 C ATOM 1032 OD1 ASN A 63 14.041 17.736 -1.972 1.00 0.00 O ATOM 1033 ND2 ASN A 63 15.152 15.841 -2.311 1.00 0.00 N ATOM 0 H ASN A 63 15.531 14.485 -0.118 1.00 0.00 H new ATOM 0 HA ASN A 63 14.485 16.910 1.082 1.00 0.00 H new ATOM 0 HB2 ASN A 63 13.250 14.883 -0.811 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.554 16.432 -0.375 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.684 16.251 -3.078 1.00 0.00 H new ATOM 0 HD22 ASN A 63 15.313 14.871 -2.040 1.00 0.00 H new ATOM 1040 N VAL A 64 12.673 15.895 2.658 1.00 0.00 N ATOM 1041 CA VAL A 64 11.777 15.329 3.660 1.00 0.00 C ATOM 1042 C VAL A 64 10.410 15.953 3.391 1.00 0.00 C ATOM 1043 O VAL A 64 10.340 17.155 3.133 1.00 0.00 O ATOM 1044 CB VAL A 64 12.298 15.635 5.087 1.00 0.00 C ATOM 1045 CG1 VAL A 64 11.519 14.852 6.157 1.00 0.00 C ATOM 1046 CG2 VAL A 64 13.788 15.293 5.267 1.00 0.00 C ATOM 0 H VAL A 64 12.669 16.915 2.641 1.00 0.00 H new ATOM 0 HA VAL A 64 11.717 14.242 3.597 1.00 0.00 H new ATOM 0 HB VAL A 64 12.153 16.708 5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.914 15.093 7.144 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.465 15.124 6.111 1.00 0.00 H new ATOM 0 HG13 VAL A 64 11.626 13.783 5.975 1.00 0.00 H new ATOM 0 HG21 VAL A 64 14.095 15.529 6.286 1.00 0.00 H new ATOM 0 HG22 VAL A 64 13.943 14.231 5.078 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.383 15.877 4.565 1.00 0.00 H new ATOM 1056 N VAL A 65 9.341 15.160 3.452 1.00 0.00 N ATOM 1057 CA VAL A 65 7.950 15.612 3.434 1.00 0.00 C ATOM 1058 C VAL A 65 7.144 14.650 4.315 1.00 0.00 C ATOM 1059 O VAL A 65 7.609 13.542 4.614 1.00 0.00 O ATOM 1060 CB VAL A 65 7.375 15.683 1.999 1.00 0.00 C ATOM 1061 CG1 VAL A 65 8.074 16.725 1.126 1.00 0.00 C ATOM 1062 CG2 VAL A 65 7.437 14.339 1.261 1.00 0.00 C ATOM 0 H VAL A 65 9.423 14.145 3.518 1.00 0.00 H new ATOM 0 HA VAL A 65 7.889 16.629 3.823 1.00 0.00 H new ATOM 0 HB VAL A 65 6.334 15.970 2.148 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.626 16.727 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.962 17.711 1.576 1.00 0.00 H new ATOM 0 HG13 VAL A 65 9.133 16.481 1.046 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.019 14.454 0.261 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.474 14.013 1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.861 13.595 1.811 1.00 0.00 H new ATOM 1072 N ALA A 66 5.939 15.046 4.731 1.00 0.00 N ATOM 1073 CA ALA A 66 5.153 14.281 5.687 1.00 0.00 C ATOM 1074 C ALA A 66 3.680 14.239 5.305 1.00 0.00 C ATOM 1075 O ALA A 66 3.172 15.144 4.641 1.00 0.00 O ATOM 1076 CB ALA A 66 5.304 14.911 7.069 1.00 0.00 C ATOM 0 H ALA A 66 5.487 15.903 4.413 1.00 0.00 H new ATOM 0 HA ALA A 66 5.523 13.256 5.690 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.718 14.345 7.793 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.354 14.898 7.362 1.00 0.00 H new ATOM 0 HB3 ALA A 66 4.948 15.941 7.040 1.00 0.00 H new ATOM 1082 N VAL A 67 2.981 13.228 5.814 1.00 0.00 N ATOM 1083 CA VAL A 67 1.575 12.976 5.549 1.00 0.00 C ATOM 1084 C VAL A 67 0.963 12.635 6.904 1.00 0.00 C ATOM 1085 O VAL A 67 1.247 11.571 7.461 1.00 0.00 O ATOM 1086 CB VAL A 67 1.407 11.847 4.504 1.00 0.00 C ATOM 1087 CG1 VAL A 67 -0.074 11.680 4.130 1.00 0.00 C ATOM 1088 CG2 VAL A 67 2.207 12.107 3.216 1.00 0.00 C ATOM 0 H VAL A 67 3.396 12.541 6.443 1.00 0.00 H new ATOM 0 HA VAL A 67 1.069 13.837 5.112 1.00 0.00 H new ATOM 0 HB VAL A 67 1.792 10.940 4.970 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.176 10.882 3.394 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.648 11.427 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.450 12.612 3.709 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.052 11.283 2.519 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.869 13.037 2.759 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.267 12.185 3.456 1.00 0.00 H new ATOM 1098 N HIS A 68 0.188 13.552 7.484 1.00 0.00 N ATOM 1099 CA HIS A 68 -0.538 13.218 8.697 1.00 0.00 C ATOM 1100 C HIS A 68 -1.691 12.301 8.293 1.00 0.00 C ATOM 1101 O HIS A 68 -2.531 12.687 7.479 1.00 0.00 O ATOM 1102 CB HIS A 68 -1.059 14.457 9.422 1.00 0.00 C ATOM 1103 CG HIS A 68 -1.726 14.069 10.718 1.00 0.00 C ATOM 1104 ND1 HIS A 68 -3.018 13.614 10.855 1.00 0.00 N ATOM 1105 CD2 HIS A 68 -1.145 14.011 11.957 1.00 0.00 C ATOM 1106 CE1 HIS A 68 -3.214 13.304 12.145 1.00 0.00 C ATOM 1107 NE2 HIS A 68 -2.101 13.534 12.866 1.00 0.00 N ATOM 0 H HIS A 68 0.052 14.503 7.142 1.00 0.00 H new ATOM 0 HA HIS A 68 0.132 12.722 9.399 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.235 15.142 9.621 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.768 14.987 8.786 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -3.706 13.528 10.107 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.127 14.285 12.193 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -4.139 12.922 12.550 1.00 0.00 H new ATOM 1115 N MET A 69 -1.751 11.104 8.862 1.00 0.00 N ATOM 1116 CA MET A 69 -2.863 10.186 8.708 1.00 0.00 C ATOM 1117 C MET A 69 -3.904 10.530 9.780 1.00 0.00 C ATOM 1118 O MET A 69 -3.617 10.317 10.962 1.00 0.00 O ATOM 1119 CB MET A 69 -2.316 8.762 8.865 1.00 0.00 C ATOM 1120 CG MET A 69 -3.390 7.673 8.920 1.00 0.00 C ATOM 1121 SD MET A 69 -4.560 7.664 7.540 1.00 0.00 S ATOM 1122 CE MET A 69 -5.303 6.041 7.843 1.00 0.00 C ATOM 0 H MET A 69 -1.007 10.739 9.457 1.00 0.00 H new ATOM 0 HA MET A 69 -3.341 10.263 7.732 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.644 8.551 8.033 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.720 8.713 9.776 1.00 0.00 H new ATOM 0 HG2 MET A 69 -2.897 6.702 8.962 1.00 0.00 H new ATOM 0 HG3 MET A 69 -3.950 7.786 9.848 1.00 0.00 H new ATOM 0 HE1 MET A 69 -6.063 5.842 7.087 1.00 0.00 H new ATOM 0 HE2 MET A 69 -4.532 5.273 7.793 1.00 0.00 H new ATOM 0 HE3 MET A 69 -5.762 6.030 8.831 1.00 0.00 H new ATOM 1132 N PRO A 70 -5.087 11.074 9.427 1.00 0.00 N ATOM 1133 CA PRO A 70 -6.169 11.202 10.388 1.00 0.00 C ATOM 1134 C PRO A 70 -6.569 9.777 10.790 1.00 0.00 C ATOM 1135 O PRO A 70 -6.818 8.924 9.931 1.00 0.00 O ATOM 1136 CB PRO A 70 -7.266 12.004 9.689 1.00 0.00 C ATOM 1137 CG PRO A 70 -7.054 11.684 8.210 1.00 0.00 C ATOM 1138 CD PRO A 70 -5.544 11.465 8.102 1.00 0.00 C ATOM 0 HA PRO A 70 -5.918 11.731 11.308 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.259 11.705 10.026 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -7.170 13.072 9.886 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -7.610 10.797 7.908 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -7.387 12.502 7.571 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -5.316 10.691 7.369 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -5.043 12.375 7.772 1.00 0.00 H new ATOM 1146 N ARG A 71 -6.626 9.508 12.092 1.00 0.00 N ATOM 1147 CA ARG A 71 -6.743 8.162 12.636 1.00 0.00 C ATOM 1148 C ARG A 71 -7.718 8.087 13.811 1.00 0.00 C ATOM 1149 O ARG A 71 -8.443 7.095 13.906 1.00 0.00 O ATOM 1150 CB ARG A 71 -5.305 7.761 13.017 1.00 0.00 C ATOM 1151 CG ARG A 71 -5.185 6.435 13.775 1.00 0.00 C ATOM 1152 CD ARG A 71 -3.706 6.165 14.056 1.00 0.00 C ATOM 1153 NE ARG A 71 -3.516 5.051 15.001 1.00 0.00 N ATOM 1154 CZ ARG A 71 -3.363 5.160 16.328 1.00 0.00 C ATOM 1155 NH1 ARG A 71 -3.430 6.343 16.933 1.00 0.00 N ATOM 1156 NH2 ARG A 71 -3.131 4.072 17.056 1.00 0.00 N ATOM 0 H ARG A 71 -6.591 10.233 12.809 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.167 7.468 11.911 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.708 7.698 12.107 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.872 8.553 13.628 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.745 6.481 14.709 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.613 5.623 13.187 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.195 5.937 13.120 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.244 7.066 14.460 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.499 4.109 14.609 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -3.600 7.187 16.386 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -3.311 6.406 17.944 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -3.070 3.160 16.604 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -3.014 4.150 18.066 1.00 0.00 H new ATOM 1170 N SER A 72 -7.801 9.116 14.650 1.00 0.00 N ATOM 1171 CA SER A 72 -8.629 9.146 15.850 1.00 0.00 C ATOM 1172 C SER A 72 -9.140 10.572 16.073 1.00 0.00 C ATOM 1173 O SER A 72 -8.572 11.529 15.549 1.00 0.00 O ATOM 1174 CB SER A 72 -7.785 8.686 17.052 1.00 0.00 C ATOM 1175 OG SER A 72 -7.249 7.383 16.865 1.00 0.00 O ATOM 0 H SER A 72 -7.277 9.979 14.508 1.00 0.00 H new ATOM 0 HA SER A 72 -9.483 8.478 15.737 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.971 9.392 17.213 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.400 8.698 17.952 1.00 0.00 H new ATOM 0 HG SER A 72 -6.719 7.131 17.650 1.00 0.00 H new ATOM 1181 N GLU A 73 -10.194 10.748 16.877 1.00 0.00 N ATOM 1182 CA GLU A 73 -10.772 12.074 17.129 1.00 0.00 C ATOM 1183 C GLU A 73 -9.741 13.018 17.772 1.00 0.00 C ATOM 1184 O GLU A 73 -9.785 14.229 17.558 1.00 0.00 O ATOM 1185 CB GLU A 73 -12.041 11.976 17.987 1.00 0.00 C ATOM 1186 CG GLU A 73 -13.135 11.114 17.340 1.00 0.00 C ATOM 1187 CD GLU A 73 -14.416 11.097 18.192 1.00 0.00 C ATOM 1188 OE1 GLU A 73 -15.302 11.960 17.991 1.00 0.00 O ATOM 1189 OE2 GLU A 73 -14.566 10.208 19.061 1.00 0.00 O ATOM 0 H GLU A 73 -10.666 9.987 17.366 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.056 12.497 16.165 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -11.784 11.558 18.960 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -12.432 12.978 18.164 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -13.363 11.499 16.346 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.769 10.095 17.211 1.00 0.00 H new ATOM 1196 N ASP A 74 -8.768 12.457 18.500 1.00 0.00 N ATOM 1197 CA ASP A 74 -7.660 13.181 19.129 1.00 0.00 C ATOM 1198 C ASP A 74 -6.687 13.809 18.115 1.00 0.00 C ATOM 1199 O ASP A 74 -5.789 14.549 18.504 1.00 0.00 O ATOM 1200 CB ASP A 74 -6.906 12.227 20.067 1.00 0.00 C ATOM 1201 CG ASP A 74 -5.907 12.963 20.979 1.00 0.00 C ATOM 1202 OD1 ASP A 74 -6.317 13.894 21.709 1.00 0.00 O ATOM 1203 OD2 ASP A 74 -4.727 12.551 21.040 1.00 0.00 O ATOM 0 H ASP A 74 -8.730 11.452 18.672 1.00 0.00 H new ATOM 0 HA ASP A 74 -8.091 14.011 19.689 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.624 11.685 20.683 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -6.372 11.485 19.473 1.00 0.00 H new ATOM 1208 N ASP A 75 -6.855 13.537 16.816 1.00 0.00 N ATOM 1209 CA ASP A 75 -5.979 13.986 15.730 1.00 0.00 C ATOM 1210 C ASP A 75 -6.755 14.437 14.483 1.00 0.00 C ATOM 1211 O ASP A 75 -6.157 14.871 13.500 1.00 0.00 O ATOM 1212 CB ASP A 75 -4.985 12.870 15.371 1.00 0.00 C ATOM 1213 CG ASP A 75 -5.599 11.653 14.677 1.00 0.00 C ATOM 1214 OD1 ASP A 75 -6.192 11.778 13.589 1.00 0.00 O ATOM 1215 OD2 ASP A 75 -5.428 10.535 15.207 1.00 0.00 O ATOM 0 H ASP A 75 -7.637 12.975 16.480 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.439 14.861 16.090 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.213 13.287 14.724 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.491 12.537 16.284 1.00 0.00 H new ATOM 1220 N LEU A 76 -8.088 14.394 14.535 1.00 0.00 N ATOM 1221 CA LEU A 76 -9.019 14.561 13.436 1.00 0.00 C ATOM 1222 C LEU A 76 -9.084 15.995 12.881 1.00 0.00 C ATOM 1223 O LEU A 76 -9.765 16.227 11.881 1.00 0.00 O ATOM 1224 CB LEU A 76 -10.350 14.058 14.029 1.00 0.00 C ATOM 1225 CG LEU A 76 -11.636 14.264 13.238 1.00 0.00 C ATOM 1226 CD1 LEU A 76 -11.620 13.555 11.878 1.00 0.00 C ATOM 1227 CD2 LEU A 76 -12.822 13.744 14.064 1.00 0.00 C ATOM 0 H LEU A 76 -8.573 14.229 15.417 1.00 0.00 H new ATOM 0 HA LEU A 76 -8.720 14.004 12.548 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -10.245 12.989 14.213 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -10.480 14.538 14.999 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.730 15.332 13.044 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.562 13.738 11.361 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.796 13.939 11.277 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -11.491 12.483 12.028 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.746 13.888 13.504 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -12.684 12.683 14.270 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.878 14.292 15.005 1.00 0.00 H new ATOM 1239 N ASP A 77 -8.378 16.962 13.469 1.00 0.00 N ATOM 1240 CA ASP A 77 -8.525 18.384 13.169 1.00 0.00 C ATOM 1241 C ASP A 77 -7.159 19.007 12.873 1.00 0.00 C ATOM 1242 O ASP A 77 -6.228 18.829 13.663 1.00 0.00 O ATOM 1243 CB ASP A 77 -9.157 19.091 14.366 1.00 0.00 C ATOM 1244 CG ASP A 77 -9.409 20.571 14.062 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -8.467 21.377 14.214 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -10.543 20.927 13.672 1.00 0.00 O ATOM 0 H ASP A 77 -7.674 16.773 14.182 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.163 18.498 12.293 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -10.097 18.604 14.625 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.502 19.001 15.233 1.00 0.00 H new ATOM 1251 N PRO A 78 -7.006 19.757 11.770 1.00 0.00 N ATOM 1252 CA PRO A 78 -5.713 20.272 11.348 1.00 0.00 C ATOM 1253 C PRO A 78 -5.139 21.356 12.263 1.00 0.00 C ATOM 1254 O PRO A 78 -3.935 21.605 12.204 1.00 0.00 O ATOM 1255 CB PRO A 78 -5.914 20.771 9.923 1.00 0.00 C ATOM 1256 CG PRO A 78 -7.400 21.113 9.855 1.00 0.00 C ATOM 1257 CD PRO A 78 -8.029 20.083 10.792 1.00 0.00 C ATOM 0 HA PRO A 78 -4.964 19.482 11.403 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -5.294 21.643 9.715 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -5.647 20.008 9.192 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.596 22.133 10.186 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -7.789 21.027 8.840 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -8.918 20.487 11.277 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.341 19.195 10.243 1.00 0.00 H new ATOM 1265 N GLY A 79 -5.945 21.968 13.134 1.00 0.00 N ATOM 1266 CA GLY A 79 -5.458 22.925 14.112 1.00 0.00 C ATOM 1267 C GLY A 79 -4.713 22.189 15.218 1.00 0.00 C ATOM 1268 O GLY A 79 -3.674 22.666 15.677 1.00 0.00 O ATOM 0 H GLY A 79 -6.952 21.810 13.176 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.797 23.647 13.632 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.292 23.487 14.533 1.00 0.00 H new ATOM 1272 N LYS A 80 -5.178 20.986 15.586 1.00 0.00 N ATOM 1273 CA LYS A 80 -4.446 20.134 16.525 1.00 0.00 C ATOM 1274 C LYS A 80 -3.113 19.756 15.901 1.00 0.00 C ATOM 1275 O LYS A 80 -2.081 19.848 16.564 1.00 0.00 O ATOM 1276 CB LYS A 80 -5.197 18.834 16.846 1.00 0.00 C ATOM 1277 CG LYS A 80 -6.585 18.991 17.475 1.00 0.00 C ATOM 1278 CD LYS A 80 -7.267 17.613 17.434 1.00 0.00 C ATOM 1279 CE LYS A 80 -8.665 17.585 18.071 1.00 0.00 C ATOM 1280 NZ LYS A 80 -8.646 17.851 19.533 1.00 0.00 N ATOM 0 H LYS A 80 -6.053 20.586 15.248 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.323 20.698 17.450 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.302 18.262 15.924 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.580 18.240 17.521 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.503 19.348 18.502 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -7.174 19.727 16.927 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.346 17.290 16.396 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.632 16.890 17.946 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -9.296 18.327 17.581 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -9.120 16.611 17.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.617 17.819 19.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -8.069 17.129 20.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.239 18.792 19.709 1.00 0.00 H new ATOM 1294 N ILE A 81 -3.147 19.332 14.634 1.00 0.00 N ATOM 1295 CA ILE A 81 -1.975 18.864 13.911 1.00 0.00 C ATOM 1296 C ILE A 81 -0.962 20.011 13.867 1.00 0.00 C ATOM 1297 O ILE A 81 0.149 19.826 14.358 1.00 0.00 O ATOM 1298 CB ILE A 81 -2.385 18.317 12.523 1.00 0.00 C ATOM 1299 CG1 ILE A 81 -3.329 17.099 12.665 1.00 0.00 C ATOM 1300 CG2 ILE A 81 -1.139 17.909 11.708 1.00 0.00 C ATOM 1301 CD1 ILE A 81 -3.984 16.667 11.344 1.00 0.00 C ATOM 0 H ILE A 81 -4.003 19.306 14.080 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.496 18.024 14.413 1.00 0.00 H new ATOM 0 HB ILE A 81 -2.912 19.113 11.997 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.766 16.260 13.072 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.110 17.338 13.386 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.449 17.527 10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.495 18.777 11.568 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.591 17.134 12.244 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.631 15.808 11.523 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.576 17.491 10.945 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.210 16.395 10.626 1.00 0.00 H new ATOM 1313 N LYS A 82 -1.334 21.199 13.368 1.00 0.00 N ATOM 1314 CA LYS A 82 -0.462 22.372 13.375 1.00 0.00 C ATOM 1315 C LYS A 82 0.107 22.688 14.757 1.00 0.00 C ATOM 1316 O LYS A 82 1.321 22.847 14.873 1.00 0.00 O ATOM 1317 CB LYS A 82 -1.236 23.565 12.786 1.00 0.00 C ATOM 1318 CG LYS A 82 -0.417 24.861 12.655 1.00 0.00 C ATOM 1319 CD LYS A 82 0.927 24.647 11.941 1.00 0.00 C ATOM 1320 CE LYS A 82 1.542 25.952 11.409 1.00 0.00 C ATOM 1321 NZ LYS A 82 1.923 26.904 12.485 1.00 0.00 N ATOM 0 H LYS A 82 -2.249 21.369 12.949 1.00 0.00 H new ATOM 0 HA LYS A 82 0.409 22.157 12.755 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.611 23.287 11.801 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -2.105 23.762 13.414 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.001 25.600 12.107 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.234 25.272 13.648 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.628 24.177 12.631 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.785 23.955 11.111 1.00 0.00 H new ATOM 0 HE2 LYS A 82 2.424 25.714 10.815 1.00 0.00 H new ATOM 0 HE3 LYS A 82 0.829 26.436 10.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 2.331 27.762 12.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.080 27.158 13.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 2.626 26.459 13.110 1.00 0.00 H new ATOM 1335 N GLU A 83 -0.724 22.779 15.795 1.00 0.00 N ATOM 1336 CA GLU A 83 -0.263 23.172 17.125 1.00 0.00 C ATOM 1337 C GLU A 83 0.757 22.160 17.668 1.00 0.00 C ATOM 1338 O GLU A 83 1.760 22.539 18.269 1.00 0.00 O ATOM 1339 CB GLU A 83 -1.482 23.318 18.050 1.00 0.00 C ATOM 1340 CG GLU A 83 -1.111 23.841 19.444 1.00 0.00 C ATOM 1341 CD GLU A 83 -2.365 24.108 20.297 1.00 0.00 C ATOM 1342 OE1 GLU A 83 -2.852 23.181 20.984 1.00 0.00 O ATOM 1343 OE2 GLU A 83 -2.865 25.256 20.309 1.00 0.00 O ATOM 0 H GLU A 83 -1.724 22.585 15.739 1.00 0.00 H new ATOM 0 HA GLU A 83 0.250 24.133 17.073 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.201 23.997 17.592 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.975 22.351 18.149 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.474 23.115 19.949 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.533 24.760 19.347 1.00 0.00 H new ATOM 1350 N THR A 84 0.525 20.875 17.416 1.00 0.00 N ATOM 1351 CA THR A 84 1.384 19.786 17.845 1.00 0.00 C ATOM 1352 C THR A 84 2.702 19.800 17.051 1.00 0.00 C ATOM 1353 O THR A 84 3.790 19.810 17.630 1.00 0.00 O ATOM 1354 CB THR A 84 0.563 18.500 17.646 1.00 0.00 C ATOM 1355 OG1 THR A 84 -0.603 18.532 18.447 1.00 0.00 O ATOM 1356 CG2 THR A 84 1.345 17.242 17.969 1.00 0.00 C ATOM 0 H THR A 84 -0.291 20.558 16.892 1.00 0.00 H new ATOM 0 HA THR A 84 1.682 19.871 18.890 1.00 0.00 H new ATOM 0 HB THR A 84 0.301 18.467 16.589 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.317 19.000 17.966 1.00 0.00 H new ATOM 0 HG21 THR A 84 0.712 16.369 17.809 1.00 0.00 H new ATOM 0 HG22 THR A 84 2.219 17.180 17.320 1.00 0.00 H new ATOM 0 HG23 THR A 84 1.667 17.271 19.010 1.00 0.00 H new ATOM 1364 N ALA A 85 2.615 19.861 15.723 1.00 0.00 N ATOM 1365 CA ALA A 85 3.750 19.952 14.813 1.00 0.00 C ATOM 1366 C ALA A 85 4.685 21.108 15.178 1.00 0.00 C ATOM 1367 O ALA A 85 5.904 20.928 15.222 1.00 0.00 O ATOM 1368 CB ALA A 85 3.211 20.121 13.389 1.00 0.00 C ATOM 0 H ALA A 85 1.719 19.848 15.236 1.00 0.00 H new ATOM 0 HA ALA A 85 4.341 19.039 14.889 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.045 20.191 12.690 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.592 19.262 13.130 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.612 21.030 13.332 1.00 0.00 H new ATOM 1374 N ALA A 86 4.116 22.275 15.493 1.00 0.00 N ATOM 1375 CA ALA A 86 4.868 23.458 15.897 1.00 0.00 C ATOM 1376 C ALA A 86 5.793 23.186 17.089 1.00 0.00 C ATOM 1377 O ALA A 86 6.854 23.800 17.199 1.00 0.00 O ATOM 1378 CB ALA A 86 3.887 24.570 16.280 1.00 0.00 C ATOM 0 H ALA A 86 3.107 22.423 15.473 1.00 0.00 H new ATOM 0 HA ALA A 86 5.490 23.753 15.052 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.443 25.457 16.583 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.258 24.811 15.423 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.261 24.234 17.107 1.00 0.00 H new ATOM 1384 N GLU A 87 5.392 22.281 17.984 1.00 0.00 N ATOM 1385 CA GLU A 87 6.126 21.974 19.204 1.00 0.00 C ATOM 1386 C GLU A 87 7.192 20.906 18.925 1.00 0.00 C ATOM 1387 O GLU A 87 8.291 20.978 19.477 1.00 0.00 O ATOM 1388 CB GLU A 87 5.139 21.530 20.297 1.00 0.00 C ATOM 1389 CG GLU A 87 4.406 22.726 20.918 1.00 0.00 C ATOM 1390 CD GLU A 87 3.570 22.305 22.141 1.00 0.00 C ATOM 1391 OE1 GLU A 87 2.468 21.734 21.979 1.00 0.00 O ATOM 1392 OE2 GLU A 87 4.006 22.553 23.290 1.00 0.00 O ATOM 0 H GLU A 87 4.537 21.736 17.876 1.00 0.00 H new ATOM 0 HA GLU A 87 6.645 22.864 19.559 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.412 20.838 19.872 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.677 20.989 21.075 1.00 0.00 H new ATOM 0 HG2 GLU A 87 5.131 23.484 21.215 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.756 23.183 20.172 1.00 0.00 H new ATOM 1399 N HIS A 88 6.901 19.951 18.034 1.00 0.00 N ATOM 1400 CA HIS A 88 7.855 18.942 17.578 1.00 0.00 C ATOM 1401 C HIS A 88 8.957 19.493 16.663 1.00 0.00 C ATOM 1402 O HIS A 88 9.896 18.761 16.360 1.00 0.00 O ATOM 1403 CB HIS A 88 7.092 17.812 16.881 1.00 0.00 C ATOM 1404 CG HIS A 88 6.119 17.129 17.803 1.00 0.00 C ATOM 1405 ND1 HIS A 88 6.370 16.722 19.096 1.00 0.00 N ATOM 1406 CD2 HIS A 88 4.824 16.796 17.516 1.00 0.00 C ATOM 1407 CE1 HIS A 88 5.250 16.164 19.575 1.00 0.00 C ATOM 1408 NE2 HIS A 88 4.283 16.164 18.643 1.00 0.00 N ATOM 0 H HIS A 88 5.980 19.859 17.605 1.00 0.00 H new ATOM 0 HA HIS A 88 8.373 18.570 18.462 1.00 0.00 H new ATOM 0 HB2 HIS A 88 6.555 18.215 16.022 1.00 0.00 H new ATOM 0 HB3 HIS A 88 7.802 17.079 16.498 1.00 0.00 H new ATOM 0 HD1 HIS A 88 7.251 16.827 19.599 1.00 0.00 H new ATOM 0 HD2 HIS A 88 4.310 16.986 16.586 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.140 15.768 20.574 1.00 0.00 H new ATOM 1416 N ASP A 89 8.864 20.755 16.230 1.00 0.00 N ATOM 1417 CA ASP A 89 9.841 21.454 15.382 1.00 0.00 C ATOM 1418 C ASP A 89 9.918 20.871 13.966 1.00 0.00 C ATOM 1419 O ASP A 89 10.889 21.083 13.247 1.00 0.00 O ATOM 1420 CB ASP A 89 11.236 21.541 16.040 1.00 0.00 C ATOM 1421 CG ASP A 89 12.114 22.611 15.355 1.00 0.00 C ATOM 1422 OD1 ASP A 89 11.754 23.810 15.419 1.00 0.00 O ATOM 1423 OD2 ASP A 89 13.179 22.282 14.783 1.00 0.00 O ATOM 0 H ASP A 89 8.069 21.346 16.472 1.00 0.00 H new ATOM 0 HA ASP A 89 9.472 22.475 15.281 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.127 21.780 17.098 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.729 20.571 15.981 1.00 0.00 H new ATOM 1428 N ILE A 90 8.915 20.106 13.542 1.00 0.00 N ATOM 1429 CA ILE A 90 8.859 19.573 12.192 1.00 0.00 C ATOM 1430 C ILE A 90 8.536 20.715 11.214 1.00 0.00 C ATOM 1431 O ILE A 90 7.475 21.339 11.301 1.00 0.00 O ATOM 1432 CB ILE A 90 7.889 18.375 12.165 1.00 0.00 C ATOM 1433 CG1 ILE A 90 6.434 18.736 12.534 1.00 0.00 C ATOM 1434 CG2 ILE A 90 8.470 17.271 13.074 1.00 0.00 C ATOM 1435 CD1 ILE A 90 5.525 17.518 12.653 1.00 0.00 C ATOM 0 H ILE A 90 8.122 19.841 14.126 1.00 0.00 H new ATOM 0 HA ILE A 90 9.818 19.175 11.861 1.00 0.00 H new ATOM 0 HB ILE A 90 7.812 18.016 11.139 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.430 19.278 13.479 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.031 19.410 11.778 1.00 0.00 H new ATOM 0 HG21 ILE A 90 7.802 16.410 13.073 1.00 0.00 H new ATOM 0 HG22 ILE A 90 9.449 16.971 12.701 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.570 17.652 14.090 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.517 17.840 12.914 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.501 16.987 11.701 1.00 0.00 H new ATOM 0 HD13 ILE A 90 5.906 16.854 13.429 1.00 0.00 H new ATOM 1447 N THR A 91 9.460 21.012 10.296 1.00 0.00 N ATOM 1448 CA THR A 91 9.354 22.137 9.362 1.00 0.00 C ATOM 1449 C THR A 91 9.375 21.681 7.895 1.00 0.00 C ATOM 1450 O THR A 91 9.265 22.517 6.995 1.00 0.00 O ATOM 1451 CB THR A 91 10.417 23.204 9.669 1.00 0.00 C ATOM 1452 OG1 THR A 91 11.706 22.630 9.635 1.00 0.00 O ATOM 1453 CG2 THR A 91 10.216 23.850 11.043 1.00 0.00 C ATOM 0 H THR A 91 10.316 20.470 10.179 1.00 0.00 H new ATOM 0 HA THR A 91 8.379 22.601 9.510 1.00 0.00 H new ATOM 0 HB THR A 91 10.314 23.975 8.905 1.00 0.00 H new ATOM 0 HG1 THR A 91 12.375 23.335 9.510 1.00 0.00 H new ATOM 0 HG21 THR A 91 10.992 24.596 11.211 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.238 24.329 11.080 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.274 23.085 11.817 1.00 0.00 H new ATOM 1461 N GLN A 92 9.498 20.373 7.627 1.00 0.00 N ATOM 1462 CA GLN A 92 9.304 19.817 6.293 1.00 0.00 C ATOM 1463 C GLN A 92 7.880 20.144 5.812 1.00 0.00 C ATOM 1464 O GLN A 92 7.008 20.318 6.664 1.00 0.00 O ATOM 1465 CB GLN A 92 9.554 18.292 6.297 1.00 0.00 C ATOM 1466 CG GLN A 92 8.518 17.373 6.988 1.00 0.00 C ATOM 1467 CD GLN A 92 8.657 17.248 8.505 1.00 0.00 C ATOM 1468 OE1 GLN A 92 9.348 18.025 9.158 1.00 0.00 O ATOM 1469 NE2 GLN A 92 8.008 16.266 9.113 1.00 0.00 N ATOM 0 H GLN A 92 9.735 19.676 8.333 1.00 0.00 H new ATOM 0 HA GLN A 92 10.022 20.264 5.605 1.00 0.00 H new ATOM 0 HB2 GLN A 92 9.644 17.969 5.260 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.520 18.116 6.770 1.00 0.00 H new ATOM 0 HG2 GLN A 92 7.519 17.746 6.762 1.00 0.00 H new ATOM 0 HG3 GLN A 92 8.593 16.377 6.551 1.00 0.00 H new ATOM 0 HE21 GLN A 92 7.434 15.621 8.570 1.00 0.00 H new ATOM 0 HE22 GLN A 92 8.082 16.155 10.124 1.00 0.00 H new ATOM 1478 N PRO A 93 7.596 20.215 4.500 1.00 0.00 N ATOM 1479 CA PRO A 93 6.226 20.296 4.007 1.00 0.00 C ATOM 1480 C PRO A 93 5.403 19.127 4.565 1.00 0.00 C ATOM 1481 O PRO A 93 5.846 17.975 4.517 1.00 0.00 O ATOM 1482 CB PRO A 93 6.328 20.248 2.478 1.00 0.00 C ATOM 1483 CG PRO A 93 7.742 20.756 2.201 1.00 0.00 C ATOM 1484 CD PRO A 93 8.541 20.243 3.398 1.00 0.00 C ATOM 0 HA PRO A 93 5.721 21.208 4.325 1.00 0.00 H new ATOM 0 HB2 PRO A 93 6.183 19.237 2.097 1.00 0.00 H new ATOM 0 HB3 PRO A 93 5.575 20.878 2.005 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.132 20.367 1.261 1.00 0.00 H new ATOM 0 HG3 PRO A 93 7.773 21.843 2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 93 8.949 19.251 3.204 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.384 20.897 3.619 1.00 0.00 H new ATOM 1492 N ILE A 94 4.207 19.411 5.076 1.00 0.00 N ATOM 1493 CA ILE A 94 3.310 18.438 5.685 1.00 0.00 C ATOM 1494 C ILE A 94 1.967 18.595 4.994 1.00 0.00 C ATOM 1495 O ILE A 94 1.549 19.703 4.649 1.00 0.00 O ATOM 1496 CB ILE A 94 3.211 18.656 7.214 1.00 0.00 C ATOM 1497 CG1 ILE A 94 4.614 18.548 7.846 1.00 0.00 C ATOM 1498 CG2 ILE A 94 2.173 17.741 7.888 1.00 0.00 C ATOM 1499 CD1 ILE A 94 4.729 18.213 9.336 1.00 0.00 C ATOM 0 H ILE A 94 3.825 20.357 5.076 1.00 0.00 H new ATOM 0 HA ILE A 94 3.681 17.421 5.557 1.00 0.00 H new ATOM 0 HB ILE A 94 2.836 19.664 7.390 1.00 0.00 H new ATOM 0 HG12 ILE A 94 5.167 17.788 7.293 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.124 19.497 7.681 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.151 17.942 8.959 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.188 17.933 7.463 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.443 16.699 7.720 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.781 18.175 9.620 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.222 18.980 9.922 1.00 0.00 H new ATOM 0 HD13 ILE A 94 4.266 17.245 9.528 1.00 0.00 H new ATOM 1511 N PHE A 95 1.277 17.477 4.817 1.00 0.00 N ATOM 1512 CA PHE A 95 0.065 17.384 4.040 1.00 0.00 C ATOM 1513 C PHE A 95 -0.942 16.528 4.812 1.00 0.00 C ATOM 1514 O PHE A 95 -0.570 15.539 5.451 1.00 0.00 O ATOM 1515 CB PHE A 95 0.469 16.789 2.681 1.00 0.00 C ATOM 1516 CG PHE A 95 -0.668 16.251 1.850 1.00 0.00 C ATOM 1517 CD1 PHE A 95 -1.780 17.064 1.560 1.00 0.00 C ATOM 1518 CD2 PHE A 95 -0.627 14.919 1.397 1.00 0.00 C ATOM 1519 CE1 PHE A 95 -2.875 16.521 0.876 1.00 0.00 C ATOM 1520 CE2 PHE A 95 -1.717 14.386 0.695 1.00 0.00 C ATOM 1521 CZ PHE A 95 -2.853 15.177 0.468 1.00 0.00 C ATOM 0 H PHE A 95 1.560 16.586 5.226 1.00 0.00 H new ATOM 0 HA PHE A 95 -0.420 18.345 3.867 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.986 17.557 2.106 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.184 15.984 2.853 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.789 18.101 1.863 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.243 14.309 1.590 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -3.737 17.136 0.662 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -1.682 13.370 0.330 1.00 0.00 H new ATOM 0 HZ PHE A 95 -3.715 14.750 -0.023 1.00 0.00 H new ATOM 1531 N VAL A 96 -2.210 16.923 4.760 1.00 0.00 N ATOM 1532 CA VAL A 96 -3.351 16.187 5.292 1.00 0.00 C ATOM 1533 C VAL A 96 -4.475 16.286 4.261 1.00 0.00 C ATOM 1534 O VAL A 96 -4.690 17.357 3.684 1.00 0.00 O ATOM 1535 CB VAL A 96 -3.839 16.797 6.630 1.00 0.00 C ATOM 1536 CG1 VAL A 96 -4.618 15.737 7.426 1.00 0.00 C ATOM 1537 CG2 VAL A 96 -2.733 17.421 7.499 1.00 0.00 C ATOM 0 H VAL A 96 -2.482 17.805 4.326 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.063 15.153 5.481 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.487 17.631 6.361 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.961 16.168 8.367 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.478 15.405 6.845 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.968 14.886 7.632 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.171 17.821 8.413 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.996 16.659 7.753 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.247 18.226 6.947 1.00 0.00 H new ATOM 1547 N ASP A 97 -5.261 15.224 4.079 1.00 0.00 N ATOM 1548 CA ASP A 97 -6.478 15.291 3.285 1.00 0.00 C ATOM 1549 C ASP A 97 -7.575 14.357 3.791 1.00 0.00 C ATOM 1550 O ASP A 97 -7.297 13.343 4.429 1.00 0.00 O ATOM 1551 CB ASP A 97 -6.183 15.033 1.815 1.00 0.00 C ATOM 1552 CG ASP A 97 -7.424 15.344 0.994 1.00 0.00 C ATOM 1553 OD1 ASP A 97 -8.049 16.394 1.256 1.00 0.00 O ATOM 1554 OD2 ASP A 97 -7.777 14.516 0.136 1.00 0.00 O ATOM 0 H ASP A 97 -5.070 14.304 4.476 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.861 16.306 3.394 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -5.349 15.653 1.485 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.886 13.995 1.668 1.00 0.00 H new ATOM 1559 N SER A 98 -8.827 14.714 3.498 1.00 0.00 N ATOM 1560 CA SER A 98 -10.011 13.923 3.789 1.00 0.00 C ATOM 1561 C SER A 98 -10.112 12.703 2.862 1.00 0.00 C ATOM 1562 O SER A 98 -10.622 11.663 3.283 1.00 0.00 O ATOM 1563 CB SER A 98 -11.253 14.808 3.612 1.00 0.00 C ATOM 1564 OG SER A 98 -11.092 16.056 4.273 1.00 0.00 O ATOM 0 H SER A 98 -9.046 15.596 3.034 1.00 0.00 H new ATOM 0 HA SER A 98 -9.944 13.559 4.814 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.435 14.976 2.551 1.00 0.00 H new ATOM 0 HB3 SER A 98 -12.129 14.294 4.008 1.00 0.00 H new ATOM 0 HG SER A 98 -11.896 16.601 4.143 1.00 0.00 H new ATOM 1570 N ASP A 99 -9.631 12.810 1.614 1.00 0.00 N ATOM 1571 CA ASP A 99 -9.716 11.743 0.617 1.00 0.00 C ATOM 1572 C ASP A 99 -8.372 11.032 0.461 1.00 0.00 C ATOM 1573 O ASP A 99 -8.363 9.805 0.382 1.00 0.00 O ATOM 1574 CB ASP A 99 -10.190 12.302 -0.730 1.00 0.00 C ATOM 1575 CG ASP A 99 -10.245 11.188 -1.789 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -11.202 10.380 -1.769 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -9.352 11.135 -2.661 1.00 0.00 O ATOM 0 H ASP A 99 -9.168 13.651 1.269 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.446 11.012 0.964 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.176 12.752 -0.616 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.515 13.092 -1.060 1.00 0.00 H new ATOM 1582 N HIS A 100 -7.255 11.779 0.513 1.00 0.00 N ATOM 1583 CA HIS A 100 -5.890 11.304 0.345 1.00 0.00 C ATOM 1584 C HIS A 100 -5.789 10.541 -0.973 1.00 0.00 C ATOM 1585 O HIS A 100 -5.814 9.313 -0.986 1.00 0.00 O ATOM 1586 CB HIS A 100 -5.402 10.510 1.578 1.00 0.00 C ATOM 1587 CG HIS A 100 -4.839 11.320 2.723 1.00 0.00 C ATOM 1588 ND1 HIS A 100 -4.993 11.031 4.061 1.00 0.00 N ATOM 1589 CD2 HIS A 100 -3.950 12.363 2.645 1.00 0.00 C ATOM 1590 CE1 HIS A 100 -4.227 11.884 4.762 1.00 0.00 C ATOM 1591 NE2 HIS A 100 -3.575 12.723 3.942 1.00 0.00 N ATOM 0 H HIS A 100 -7.294 12.784 0.683 1.00 0.00 H new ATOM 0 HA HIS A 100 -5.205 12.150 0.284 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -6.237 9.920 1.956 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -4.637 9.806 1.250 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -5.585 10.298 4.451 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -3.600 12.827 1.735 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.147 11.893 5.839 1.00 0.00 H new ATOM 1599 N ALA A 101 -5.653 11.263 -2.092 1.00 0.00 N ATOM 1600 CA ALA A 101 -5.584 10.667 -3.428 1.00 0.00 C ATOM 1601 C ALA A 101 -4.460 9.628 -3.560 1.00 0.00 C ATOM 1602 O ALA A 101 -4.566 8.703 -4.364 1.00 0.00 O ATOM 1603 CB ALA A 101 -5.412 11.777 -4.471 1.00 0.00 C ATOM 0 H ALA A 101 -5.588 12.281 -2.094 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.519 10.133 -3.599 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.360 11.336 -5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -6.261 12.459 -4.420 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -4.492 12.326 -4.269 1.00 0.00 H new ATOM 1609 N LEU A 102 -3.403 9.728 -2.743 1.00 0.00 N ATOM 1610 CA LEU A 102 -2.333 8.734 -2.724 1.00 0.00 C ATOM 1611 C LEU A 102 -2.763 7.423 -2.096 1.00 0.00 C ATOM 1612 O LEU A 102 -2.016 6.462 -2.205 1.00 0.00 O ATOM 1613 CB LEU A 102 -1.024 9.215 -2.086 1.00 0.00 C ATOM 1614 CG LEU A 102 -0.913 9.232 -0.551 1.00 0.00 C ATOM 1615 CD1 LEU A 102 0.478 9.740 -0.175 1.00 0.00 C ATOM 1616 CD2 LEU A 102 -1.970 10.129 0.092 1.00 0.00 C ATOM 0 H LEU A 102 -3.270 10.495 -2.084 1.00 0.00 H new ATOM 0 HA LEU A 102 -2.123 8.567 -3.780 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -0.219 8.587 -2.469 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.835 10.228 -2.442 1.00 0.00 H new ATOM 0 HG LEU A 102 -1.076 8.219 -0.183 1.00 0.00 H new ATOM 0 HD11 LEU A 102 0.577 9.760 0.910 1.00 0.00 H new ATOM 0 HD12 LEU A 102 1.234 9.077 -0.596 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.617 10.746 -0.570 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.853 10.110 1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -1.848 11.151 -0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -2.964 9.767 -0.172 1.00 0.00 H new ATOM 1628 N THR A 103 -3.937 7.308 -1.477 1.00 0.00 N ATOM 1629 CA THR A 103 -4.434 5.996 -1.089 1.00 0.00 C ATOM 1630 C THR A 103 -4.709 5.147 -2.339 1.00 0.00 C ATOM 1631 O THR A 103 -4.836 3.932 -2.226 1.00 0.00 O ATOM 1632 CB THR A 103 -5.668 6.071 -0.184 1.00 0.00 C ATOM 1633 OG1 THR A 103 -6.720 6.821 -0.757 1.00 0.00 O ATOM 1634 CG2 THR A 103 -5.341 6.618 1.210 1.00 0.00 C ATOM 0 H THR A 103 -4.547 8.090 -1.239 1.00 0.00 H new ATOM 0 HA THR A 103 -3.656 5.515 -0.496 1.00 0.00 H new ATOM 0 HB THR A 103 -6.005 5.040 -0.077 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.531 7.778 -0.659 1.00 0.00 H new ATOM 0 HG21 THR A 103 -6.250 6.650 1.811 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.610 5.970 1.693 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.930 7.624 1.119 1.00 0.00 H new ATOM 1642 N ASP A 104 -4.723 5.735 -3.541 1.00 0.00 N ATOM 1643 CA ASP A 104 -4.794 4.947 -4.759 1.00 0.00 C ATOM 1644 C ASP A 104 -3.435 4.357 -5.113 1.00 0.00 C ATOM 1645 O ASP A 104 -3.364 3.334 -5.796 1.00 0.00 O ATOM 1646 CB ASP A 104 -5.294 5.827 -5.908 1.00 0.00 C ATOM 1647 CG ASP A 104 -5.476 5.012 -7.200 1.00 0.00 C ATOM 1648 OD1 ASP A 104 -6.412 4.184 -7.270 1.00 0.00 O ATOM 1649 OD2 ASP A 104 -4.712 5.220 -8.169 1.00 0.00 O ATOM 0 H ASP A 104 -4.686 6.744 -3.687 1.00 0.00 H new ATOM 0 HA ASP A 104 -5.488 4.123 -4.596 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -6.242 6.288 -5.630 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -4.586 6.637 -6.083 1.00 0.00 H new ATOM 1654 N ALA A 105 -2.360 4.978 -4.616 1.00 0.00 N ATOM 1655 CA ALA A 105 -1.002 4.618 -4.987 1.00 0.00 C ATOM 1656 C ALA A 105 -0.218 3.956 -3.847 1.00 0.00 C ATOM 1657 O ALA A 105 0.745 3.241 -4.113 1.00 0.00 O ATOM 1658 CB ALA A 105 -0.312 5.885 -5.471 1.00 0.00 C ATOM 0 H ALA A 105 -2.415 5.744 -3.945 1.00 0.00 H new ATOM 0 HA ALA A 105 -1.037 3.866 -5.776 1.00 0.00 H new ATOM 0 HB1 ALA A 105 0.713 5.653 -5.759 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -0.849 6.286 -6.331 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -0.306 6.624 -4.670 1.00 0.00 H new ATOM 1664 N PHE A 106 -0.645 4.153 -2.598 1.00 0.00 N ATOM 1665 CA PHE A 106 -0.019 3.633 -1.388 1.00 0.00 C ATOM 1666 C PHE A 106 -1.040 2.817 -0.594 1.00 0.00 C ATOM 1667 O PHE A 106 -0.640 1.930 0.158 1.00 0.00 O ATOM 1668 CB PHE A 106 0.454 4.781 -0.479 1.00 0.00 C ATOM 1669 CG PHE A 106 1.694 5.564 -0.879 1.00 0.00 C ATOM 1670 CD1 PHE A 106 1.627 6.506 -1.919 1.00 0.00 C ATOM 1671 CD2 PHE A 106 2.883 5.445 -0.132 1.00 0.00 C ATOM 1672 CE1 PHE A 106 2.723 7.344 -2.188 1.00 0.00 C ATOM 1673 CE2 PHE A 106 3.990 6.262 -0.421 1.00 0.00 C ATOM 1674 CZ PHE A 106 3.906 7.223 -1.442 1.00 0.00 C ATOM 0 H PHE A 106 -1.478 4.707 -2.397 1.00 0.00 H new ATOM 0 HA PHE A 106 0.831 3.021 -1.689 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.369 5.490 -0.386 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.631 4.366 0.513 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.730 6.587 -2.514 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.944 4.722 0.668 1.00 0.00 H new ATOM 0 HE1 PHE A 106 2.655 8.084 -2.972 1.00 0.00 H new ATOM 0 HE2 PHE A 106 4.905 6.151 0.142 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.748 7.866 -1.652 1.00 0.00 H new ATOM 1684 N GLU A 107 -2.343 3.108 -0.751 1.00 0.00 N ATOM 1685 CA GLU A 107 -3.408 2.523 0.078 1.00 0.00 C ATOM 1686 C GLU A 107 -3.081 2.605 1.586 1.00 0.00 C ATOM 1687 O GLU A 107 -3.207 1.630 2.329 1.00 0.00 O ATOM 1688 CB GLU A 107 -3.779 1.128 -0.463 1.00 0.00 C ATOM 1689 CG GLU A 107 -5.258 0.809 -0.215 1.00 0.00 C ATOM 1690 CD GLU A 107 -5.620 -0.606 -0.701 1.00 0.00 C ATOM 1691 OE1 GLU A 107 -5.508 -1.575 0.084 1.00 0.00 O ATOM 1692 OE2 GLU A 107 -6.043 -0.767 -1.870 1.00 0.00 O ATOM 0 H GLU A 107 -2.687 3.757 -1.459 1.00 0.00 H new ATOM 0 HA GLU A 107 -4.318 3.118 -0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -3.569 1.083 -1.532 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -3.157 0.372 0.016 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -5.476 0.896 0.849 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -5.880 1.542 -0.729 1.00 0.00 H new ATOM 1699 N ASN A 108 -2.610 3.787 2.014 1.00 0.00 N ATOM 1700 CA ASN A 108 -2.173 4.097 3.377 1.00 0.00 C ATOM 1701 C ASN A 108 -3.164 3.616 4.445 1.00 0.00 C ATOM 1702 O ASN A 108 -4.332 4.012 4.423 1.00 0.00 O ATOM 1703 CB ASN A 108 -1.912 5.606 3.516 1.00 0.00 C ATOM 1704 CG ASN A 108 -1.732 6.024 4.975 1.00 0.00 C ATOM 1705 OD1 ASN A 108 -1.146 5.315 5.783 1.00 0.00 O ATOM 1706 ND2 ASN A 108 -2.272 7.167 5.357 1.00 0.00 N ATOM 0 H ASN A 108 -2.521 4.587 1.387 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.246 3.551 3.550 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.020 5.873 2.950 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.744 6.159 3.080 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.202 7.464 6.330 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.759 7.753 4.679 1.00 0.00 H new ATOM 1713 N GLU A 109 -2.681 2.805 5.392 1.00 0.00 N ATOM 1714 CA GLU A 109 -3.442 2.289 6.529 1.00 0.00 C ATOM 1715 C GLU A 109 -2.470 1.888 7.666 1.00 0.00 C ATOM 1716 O GLU A 109 -2.649 0.864 8.328 1.00 0.00 O ATOM 1717 CB GLU A 109 -4.339 1.124 6.049 1.00 0.00 C ATOM 1718 CG GLU A 109 -5.539 0.883 6.978 1.00 0.00 C ATOM 1719 CD GLU A 109 -6.434 -0.257 6.461 1.00 0.00 C ATOM 1720 OE1 GLU A 109 -6.161 -1.443 6.760 1.00 0.00 O ATOM 1721 OE2 GLU A 109 -7.442 0.018 5.770 1.00 0.00 O ATOM 0 H GLU A 109 -1.714 2.480 5.385 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.101 3.054 6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -4.700 1.338 5.043 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -3.743 0.213 5.987 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -5.182 0.641 7.979 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.125 1.798 7.061 1.00 0.00 H new ATOM 1728 N TYR A 110 -1.385 2.646 7.863 1.00 0.00 N ATOM 1729 CA TYR A 110 -0.263 2.344 8.718 1.00 0.00 C ATOM 1730 C TYR A 110 0.268 3.677 9.251 1.00 0.00 C ATOM 1731 O TYR A 110 0.228 4.690 8.558 1.00 0.00 O ATOM 1732 CB TYR A 110 0.797 1.623 7.857 1.00 0.00 C ATOM 1733 CG TYR A 110 1.087 2.250 6.499 1.00 0.00 C ATOM 1734 CD1 TYR A 110 1.774 3.473 6.428 1.00 0.00 C ATOM 1735 CD2 TYR A 110 0.614 1.653 5.312 1.00 0.00 C ATOM 1736 CE1 TYR A 110 1.903 4.160 5.217 1.00 0.00 C ATOM 1737 CE2 TYR A 110 0.784 2.310 4.079 1.00 0.00 C ATOM 1738 CZ TYR A 110 1.389 3.589 4.036 1.00 0.00 C ATOM 1739 OH TYR A 110 1.435 4.293 2.874 1.00 0.00 O ATOM 0 H TYR A 110 -1.274 3.544 7.391 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.530 1.702 9.557 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.728 1.579 8.422 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.471 0.595 7.699 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.210 3.890 7.324 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.122 0.692 5.349 1.00 0.00 H new ATOM 0 HE1 TYR A 110 2.393 5.122 5.187 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.453 1.838 3.166 1.00 0.00 H new ATOM 0 HH TYR A 110 1.683 5.222 3.064 1.00 0.00 H new ATOM 1749 N VAL A 111 0.765 3.666 10.480 1.00 0.00 N ATOM 1750 CA VAL A 111 1.527 4.750 11.113 1.00 0.00 C ATOM 1751 C VAL A 111 2.279 4.229 12.354 1.00 0.00 C ATOM 1752 O VAL A 111 1.777 3.320 13.023 1.00 0.00 O ATOM 1753 CB VAL A 111 0.643 5.927 11.599 1.00 0.00 C ATOM 1754 CG1 VAL A 111 0.208 6.876 10.483 1.00 0.00 C ATOM 1755 CG2 VAL A 111 -0.586 5.501 12.416 1.00 0.00 C ATOM 0 H VAL A 111 0.645 2.864 11.099 1.00 0.00 H new ATOM 0 HA VAL A 111 2.205 5.107 10.338 1.00 0.00 H new ATOM 0 HB VAL A 111 1.314 6.469 12.266 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -0.407 7.673 10.902 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.089 7.309 10.009 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.369 6.324 9.741 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.148 6.385 12.716 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.221 4.856 11.809 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.262 4.959 13.304 1.00 0.00 H new ATOM 1765 N PRO A 112 3.456 4.788 12.688 1.00 0.00 N ATOM 1766 CA PRO A 112 4.231 5.695 11.847 1.00 0.00 C ATOM 1767 C PRO A 112 4.876 4.860 10.734 1.00 0.00 C ATOM 1768 O PRO A 112 5.202 3.693 10.966 1.00 0.00 O ATOM 1769 CB PRO A 112 5.301 6.316 12.747 1.00 0.00 C ATOM 1770 CG PRO A 112 5.420 5.335 13.911 1.00 0.00 C ATOM 1771 CD PRO A 112 4.027 4.714 14.021 1.00 0.00 C ATOM 0 HA PRO A 112 3.624 6.479 11.395 1.00 0.00 H new ATOM 0 HB2 PRO A 112 6.249 6.428 12.221 1.00 0.00 H new ATOM 0 HB3 PRO A 112 5.007 7.308 13.090 1.00 0.00 H new ATOM 0 HG2 PRO A 112 6.180 4.578 13.718 1.00 0.00 H new ATOM 0 HG3 PRO A 112 5.704 5.843 14.833 1.00 0.00 H new ATOM 0 HD2 PRO A 112 4.085 3.681 14.365 1.00 0.00 H new ATOM 0 HD3 PRO A 112 3.413 5.256 14.740 1.00 0.00 H new ATOM 1779 N ALA A 113 5.089 5.425 9.546 1.00 0.00 N ATOM 1780 CA ALA A 113 5.806 4.711 8.490 1.00 0.00 C ATOM 1781 C ALA A 113 6.664 5.643 7.670 1.00 0.00 C ATOM 1782 O ALA A 113 6.435 6.850 7.657 1.00 0.00 O ATOM 1783 CB ALA A 113 4.847 3.955 7.572 1.00 0.00 C ATOM 0 H ALA A 113 4.780 6.363 9.292 1.00 0.00 H new ATOM 0 HA ALA A 113 6.454 3.990 8.988 1.00 0.00 H new ATOM 0 HB1 ALA A 113 5.415 3.437 6.800 1.00 0.00 H new ATOM 0 HB2 ALA A 113 4.281 3.229 8.156 1.00 0.00 H new ATOM 0 HB3 ALA A 113 4.159 4.660 7.105 1.00 0.00 H new ATOM 1789 N TYR A 114 7.629 5.060 6.968 1.00 0.00 N ATOM 1790 CA TYR A 114 8.690 5.788 6.290 1.00 0.00 C ATOM 1791 C TYR A 114 8.963 5.105 4.952 1.00 0.00 C ATOM 1792 O TYR A 114 9.084 3.879 4.888 1.00 0.00 O ATOM 1793 CB TYR A 114 9.953 5.825 7.180 1.00 0.00 C ATOM 1794 CG TYR A 114 9.723 5.486 8.645 1.00 0.00 C ATOM 1795 CD1 TYR A 114 9.207 6.460 9.519 1.00 0.00 C ATOM 1796 CD2 TYR A 114 9.925 4.170 9.100 1.00 0.00 C ATOM 1797 CE1 TYR A 114 8.863 6.114 10.836 1.00 0.00 C ATOM 1798 CE2 TYR A 114 9.588 3.816 10.417 1.00 0.00 C ATOM 1799 CZ TYR A 114 9.044 4.787 11.287 1.00 0.00 C ATOM 1800 OH TYR A 114 8.690 4.429 12.549 1.00 0.00 O ATOM 0 H TYR A 114 7.695 4.049 6.853 1.00 0.00 H new ATOM 0 HA TYR A 114 8.392 6.820 6.105 1.00 0.00 H new ATOM 0 HB2 TYR A 114 10.685 5.128 6.773 1.00 0.00 H new ATOM 0 HB3 TYR A 114 10.392 6.821 7.119 1.00 0.00 H new ATOM 0 HD1 TYR A 114 9.075 7.476 9.177 1.00 0.00 H new ATOM 0 HD2 TYR A 114 10.341 3.429 8.434 1.00 0.00 H new ATOM 0 HE1 TYR A 114 8.460 6.861 11.504 1.00 0.00 H new ATOM 0 HE2 TYR A 114 9.744 2.805 10.763 1.00 0.00 H new ATOM 0 HH TYR A 114 9.492 4.365 13.108 1.00 0.00 H new ATOM 1810 N TYR A 115 9.073 5.901 3.891 1.00 0.00 N ATOM 1811 CA TYR A 115 9.251 5.462 2.516 1.00 0.00 C ATOM 1812 C TYR A 115 10.425 6.261 1.965 1.00 0.00 C ATOM 1813 O TYR A 115 10.422 7.493 2.052 1.00 0.00 O ATOM 1814 CB TYR A 115 7.972 5.737 1.707 1.00 0.00 C ATOM 1815 CG TYR A 115 6.818 4.785 1.962 1.00 0.00 C ATOM 1816 CD1 TYR A 115 6.042 4.879 3.134 1.00 0.00 C ATOM 1817 CD2 TYR A 115 6.514 3.797 1.007 1.00 0.00 C ATOM 1818 CE1 TYR A 115 4.998 3.966 3.365 1.00 0.00 C ATOM 1819 CE2 TYR A 115 5.491 2.867 1.242 1.00 0.00 C ATOM 1820 CZ TYR A 115 4.727 2.943 2.425 1.00 0.00 C ATOM 1821 OH TYR A 115 3.756 2.019 2.670 1.00 0.00 O ATOM 0 H TYR A 115 9.038 6.917 3.974 1.00 0.00 H new ATOM 0 HA TYR A 115 9.446 4.391 2.454 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.637 6.751 1.924 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.220 5.703 0.646 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.250 5.654 3.857 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.074 3.755 0.084 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.401 4.045 4.262 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.288 2.093 0.517 1.00 0.00 H new ATOM 0 HH TYR A 115 2.984 2.458 3.084 1.00 0.00 H new ATOM 1831 N VAL A 116 11.429 5.578 1.419 1.00 0.00 N ATOM 1832 CA VAL A 116 12.704 6.178 1.043 1.00 0.00 C ATOM 1833 C VAL A 116 12.813 6.001 -0.465 1.00 0.00 C ATOM 1834 O VAL A 116 12.621 4.891 -0.960 1.00 0.00 O ATOM 1835 CB VAL A 116 13.868 5.497 1.802 1.00 0.00 C ATOM 1836 CG1 VAL A 116 15.201 6.217 1.542 1.00 0.00 C ATOM 1837 CG2 VAL A 116 13.649 5.462 3.324 1.00 0.00 C ATOM 0 H VAL A 116 11.377 4.578 1.223 1.00 0.00 H new ATOM 0 HA VAL A 116 12.759 7.234 1.307 1.00 0.00 H new ATOM 0 HB VAL A 116 13.900 4.476 1.422 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.999 5.715 2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.424 6.196 0.475 1.00 0.00 H new ATOM 0 HG13 VAL A 116 15.127 7.252 1.877 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.497 4.973 3.803 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.557 6.480 3.702 1.00 0.00 H new ATOM 0 HG23 VAL A 116 12.737 4.908 3.548 1.00 0.00 H new ATOM 1847 N PHE A 117 13.114 7.069 -1.200 1.00 0.00 N ATOM 1848 CA PHE A 117 13.111 7.082 -2.653 1.00 0.00 C ATOM 1849 C PHE A 117 14.465 7.585 -3.122 1.00 0.00 C ATOM 1850 O PHE A 117 14.968 8.590 -2.617 1.00 0.00 O ATOM 1851 CB PHE A 117 12.012 7.997 -3.217 1.00 0.00 C ATOM 1852 CG PHE A 117 10.589 7.686 -2.785 1.00 0.00 C ATOM 1853 CD1 PHE A 117 10.152 8.005 -1.485 1.00 0.00 C ATOM 1854 CD2 PHE A 117 9.678 7.122 -3.699 1.00 0.00 C ATOM 1855 CE1 PHE A 117 8.833 7.725 -1.096 1.00 0.00 C ATOM 1856 CE2 PHE A 117 8.353 6.855 -3.312 1.00 0.00 C ATOM 1857 CZ PHE A 117 7.932 7.147 -2.005 1.00 0.00 C ATOM 0 H PHE A 117 13.372 7.966 -0.789 1.00 0.00 H new ATOM 0 HA PHE A 117 12.914 6.071 -3.010 1.00 0.00 H new ATOM 0 HB2 PHE A 117 12.240 9.023 -2.929 1.00 0.00 H new ATOM 0 HB3 PHE A 117 12.056 7.954 -4.305 1.00 0.00 H new ATOM 0 HD1 PHE A 117 10.834 8.466 -0.786 1.00 0.00 H new ATOM 0 HD2 PHE A 117 9.999 6.893 -4.704 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.509 7.955 -0.092 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.659 6.426 -4.020 1.00 0.00 H new ATOM 0 HZ PHE A 117 6.919 6.928 -1.700 1.00 0.00 H new ATOM 1867 N ASP A 118 15.038 6.887 -4.094 1.00 0.00 N ATOM 1868 CA ASP A 118 16.221 7.342 -4.823 1.00 0.00 C ATOM 1869 C ASP A 118 15.885 8.648 -5.562 1.00 0.00 C ATOM 1870 O ASP A 118 14.717 8.888 -5.875 1.00 0.00 O ATOM 1871 CB ASP A 118 16.648 6.217 -5.773 1.00 0.00 C ATOM 1872 CG ASP A 118 17.754 6.658 -6.731 1.00 0.00 C ATOM 1873 OD1 ASP A 118 17.398 7.226 -7.784 1.00 0.00 O ATOM 1874 OD2 ASP A 118 18.947 6.442 -6.432 1.00 0.00 O ATOM 0 H ASP A 118 14.693 5.979 -4.404 1.00 0.00 H new ATOM 0 HA ASP A 118 17.054 7.560 -4.154 1.00 0.00 H new ATOM 0 HB2 ASP A 118 16.994 5.363 -5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 118 15.784 5.882 -6.348 1.00 0.00 H new ATOM 1879 N LYS A 119 16.884 9.495 -5.866 1.00 0.00 N ATOM 1880 CA LYS A 119 16.704 10.773 -6.583 1.00 0.00 C ATOM 1881 C LYS A 119 15.938 10.685 -7.909 1.00 0.00 C ATOM 1882 O LYS A 119 15.573 11.725 -8.454 1.00 0.00 O ATOM 1883 CB LYS A 119 18.049 11.489 -6.796 1.00 0.00 C ATOM 1884 CG LYS A 119 19.007 10.760 -7.755 1.00 0.00 C ATOM 1885 CD LYS A 119 19.582 11.661 -8.862 1.00 0.00 C ATOM 1886 CE LYS A 119 18.574 11.863 -10.007 1.00 0.00 C ATOM 1887 NZ LYS A 119 19.109 12.726 -11.095 1.00 0.00 N ATOM 0 H LYS A 119 17.856 9.309 -5.617 1.00 0.00 H new ATOM 0 HA LYS A 119 16.068 11.359 -5.920 1.00 0.00 H new ATOM 0 HB2 LYS A 119 17.858 12.490 -7.183 1.00 0.00 H new ATOM 0 HB3 LYS A 119 18.541 11.609 -5.831 1.00 0.00 H new ATOM 0 HG2 LYS A 119 19.830 10.337 -7.179 1.00 0.00 H new ATOM 0 HG3 LYS A 119 18.479 9.925 -8.216 1.00 0.00 H new ATOM 0 HD2 LYS A 119 19.853 12.629 -8.440 1.00 0.00 H new ATOM 0 HD3 LYS A 119 20.496 11.217 -9.255 1.00 0.00 H new ATOM 0 HE2 LYS A 119 18.300 10.892 -10.420 1.00 0.00 H new ATOM 0 HE3 LYS A 119 17.663 12.309 -9.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 18.775 12.372 -12.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 18.777 13.702 -10.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 20.149 12.707 -11.074 1.00 0.00 H new ATOM 1901 N THR A 120 15.739 9.492 -8.455 1.00 0.00 N ATOM 1902 CA THR A 120 14.950 9.253 -9.658 1.00 0.00 C ATOM 1903 C THR A 120 13.450 9.313 -9.391 1.00 0.00 C ATOM 1904 O THR A 120 12.670 9.628 -10.289 1.00 0.00 O ATOM 1905 CB THR A 120 15.231 7.838 -10.177 1.00 0.00 C ATOM 1906 OG1 THR A 120 15.241 6.883 -9.128 1.00 0.00 O ATOM 1907 CG2 THR A 120 16.559 7.727 -10.910 1.00 0.00 C ATOM 0 H THR A 120 16.134 8.638 -8.061 1.00 0.00 H new ATOM 0 HA THR A 120 15.230 10.029 -10.371 1.00 0.00 H new ATOM 0 HB THR A 120 14.418 7.632 -10.873 1.00 0.00 H new ATOM 0 HG1 THR A 120 16.162 6.741 -8.823 1.00 0.00 H new ATOM 0 HG21 THR A 120 16.701 6.702 -11.253 1.00 0.00 H new ATOM 0 HG22 THR A 120 16.559 8.400 -11.767 1.00 0.00 H new ATOM 0 HG23 THR A 120 17.371 7.999 -10.235 1.00 0.00 H new ATOM 1915 N GLY A 121 13.061 8.936 -8.176 1.00 0.00 N ATOM 1916 CA GLY A 121 11.686 8.712 -7.767 1.00 0.00 C ATOM 1917 C GLY A 121 11.416 7.242 -7.517 1.00 0.00 C ATOM 1918 O GLY A 121 10.299 6.920 -7.129 1.00 0.00 O ATOM 0 H GLY A 121 13.727 8.773 -7.421 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.477 9.281 -6.861 1.00 0.00 H new ATOM 0 HA3 GLY A 121 11.011 9.081 -8.539 1.00 0.00 H new ATOM 1922 N GLN A 122 12.386 6.351 -7.738 1.00 0.00 N ATOM 1923 CA GLN A 122 12.223 4.936 -7.470 1.00 0.00 C ATOM 1924 C GLN A 122 12.070 4.762 -5.962 1.00 0.00 C ATOM 1925 O GLN A 122 12.995 5.087 -5.215 1.00 0.00 O ATOM 1926 CB GLN A 122 13.448 4.181 -8.006 1.00 0.00 C ATOM 1927 CG GLN A 122 13.392 4.034 -9.533 1.00 0.00 C ATOM 1928 CD GLN A 122 14.671 3.393 -10.070 1.00 0.00 C ATOM 1929 OE1 GLN A 122 14.707 2.212 -10.406 1.00 0.00 O ATOM 1930 NE2 GLN A 122 15.749 4.155 -10.146 1.00 0.00 N ATOM 0 H GLN A 122 13.304 6.599 -8.108 1.00 0.00 H new ATOM 0 HA GLN A 122 11.340 4.532 -7.965 1.00 0.00 H new ATOM 0 HB2 GLN A 122 14.357 4.712 -7.723 1.00 0.00 H new ATOM 0 HB3 GLN A 122 13.499 3.194 -7.546 1.00 0.00 H new ATOM 0 HG2 GLN A 122 12.532 3.426 -9.812 1.00 0.00 H new ATOM 0 HG3 GLN A 122 13.252 5.013 -9.991 1.00 0.00 H new ATOM 0 HE21 GLN A 122 15.703 5.134 -9.863 1.00 0.00 H new ATOM 0 HE22 GLN A 122 16.627 3.764 -10.488 1.00 0.00 H new ATOM 1939 N LEU A 123 10.908 4.264 -5.531 1.00 0.00 N ATOM 1940 CA LEU A 123 10.628 3.826 -4.167 1.00 0.00 C ATOM 1941 C LEU A 123 11.665 2.775 -3.782 1.00 0.00 C ATOM 1942 O LEU A 123 11.534 1.605 -4.130 1.00 0.00 O ATOM 1943 CB LEU A 123 9.185 3.317 -4.028 1.00 0.00 C ATOM 1944 CG LEU A 123 8.902 2.721 -2.634 1.00 0.00 C ATOM 1945 CD1 LEU A 123 9.381 3.592 -1.465 1.00 0.00 C ATOM 1946 CD2 LEU A 123 7.404 2.459 -2.470 1.00 0.00 C ATOM 0 H LEU A 123 10.106 4.152 -6.151 1.00 0.00 H new ATOM 0 HA LEU A 123 10.707 4.666 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.494 4.138 -4.216 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.995 2.560 -4.789 1.00 0.00 H new ATOM 0 HG LEU A 123 9.475 1.794 -2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.143 3.099 -0.522 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.459 3.736 -1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.882 4.560 -1.504 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.214 2.038 -1.483 1.00 0.00 H new ATOM 0 HD22 LEU A 123 6.857 3.396 -2.577 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.072 1.756 -3.234 1.00 0.00 H new ATOM 1958 N ARG A 124 12.729 3.194 -3.113 1.00 0.00 N ATOM 1959 CA ARG A 124 13.896 2.370 -2.871 1.00 0.00 C ATOM 1960 C ARG A 124 13.650 1.396 -1.726 1.00 0.00 C ATOM 1961 O ARG A 124 14.095 0.254 -1.826 1.00 0.00 O ATOM 1962 CB ARG A 124 15.098 3.306 -2.625 1.00 0.00 C ATOM 1963 CG ARG A 124 16.470 2.699 -2.943 1.00 0.00 C ATOM 1964 CD ARG A 124 16.630 2.316 -4.423 1.00 0.00 C ATOM 1965 NE ARG A 124 17.998 1.850 -4.705 1.00 0.00 N ATOM 1966 CZ ARG A 124 18.413 1.279 -5.843 1.00 0.00 C ATOM 1967 NH1 ARG A 124 17.596 1.165 -6.889 1.00 0.00 N ATOM 1968 NH2 ARG A 124 19.654 0.817 -5.925 1.00 0.00 N ATOM 0 H ARG A 124 12.803 4.132 -2.718 1.00 0.00 H new ATOM 0 HA ARG A 124 14.115 1.746 -3.738 1.00 0.00 H new ATOM 0 HB2 ARG A 124 14.967 4.205 -3.227 1.00 0.00 H new ATOM 0 HB3 ARG A 124 15.089 3.617 -1.580 1.00 0.00 H new ATOM 0 HG2 ARG A 124 17.248 3.413 -2.672 1.00 0.00 H new ATOM 0 HG3 ARG A 124 16.621 1.813 -2.326 1.00 0.00 H new ATOM 0 HD2 ARG A 124 15.916 1.533 -4.678 1.00 0.00 H new ATOM 0 HD3 ARG A 124 16.399 3.176 -5.051 1.00 0.00 H new ATOM 0 HE ARG A 124 18.692 1.973 -3.967 1.00 0.00 H new ATOM 0 HH11 ARG A 124 16.640 1.515 -6.830 1.00 0.00 H new ATOM 0 HH12 ARG A 124 17.927 0.728 -7.749 1.00 0.00 H new ATOM 0 HH21 ARG A 124 20.282 0.898 -5.126 1.00 0.00 H new ATOM 0 HH22 ARG A 124 19.980 0.380 -6.787 1.00 0.00 H new ATOM 1982 N HIS A 125 12.943 1.805 -0.664 1.00 0.00 N ATOM 1983 CA HIS A 125 12.658 0.957 0.485 1.00 0.00 C ATOM 1984 C HIS A 125 11.485 1.537 1.290 1.00 0.00 C ATOM 1985 O HIS A 125 11.189 2.728 1.171 1.00 0.00 O ATOM 1986 CB HIS A 125 13.928 0.885 1.343 1.00 0.00 C ATOM 1987 CG HIS A 125 13.898 -0.237 2.335 1.00 0.00 C ATOM 1988 ND1 HIS A 125 14.271 -1.544 2.114 1.00 0.00 N ATOM 1989 CD2 HIS A 125 13.494 -0.138 3.633 1.00 0.00 C ATOM 1990 CE1 HIS A 125 14.102 -2.222 3.260 1.00 0.00 C ATOM 1991 NE2 HIS A 125 13.665 -1.396 4.232 1.00 0.00 N ATOM 0 H HIS A 125 12.552 2.744 -0.585 1.00 0.00 H new ATOM 0 HA HIS A 125 12.373 -0.044 0.162 1.00 0.00 H new ATOM 0 HB2 HIS A 125 14.794 0.765 0.692 1.00 0.00 H new ATOM 0 HB3 HIS A 125 14.056 1.829 1.873 1.00 0.00 H new ATOM 0 HD1 HIS A 125 14.615 -1.929 1.234 1.00 0.00 H new ATOM 0 HD2 HIS A 125 13.111 0.750 4.115 1.00 0.00 H new ATOM 0 HE1 HIS A 125 14.289 -3.278 3.386 1.00 0.00 H new ATOM 1999 N PHE A 126 10.857 0.732 2.153 1.00 0.00 N ATOM 2000 CA PHE A 126 9.815 1.151 3.093 1.00 0.00 C ATOM 2001 C PHE A 126 9.968 0.351 4.389 1.00 0.00 C ATOM 2002 O PHE A 126 10.326 -0.827 4.340 1.00 0.00 O ATOM 2003 CB PHE A 126 8.416 0.939 2.475 1.00 0.00 C ATOM 2004 CG PHE A 126 7.334 0.418 3.416 1.00 0.00 C ATOM 2005 CD1 PHE A 126 6.690 1.284 4.322 1.00 0.00 C ATOM 2006 CD2 PHE A 126 6.987 -0.949 3.405 1.00 0.00 C ATOM 2007 CE1 PHE A 126 5.689 0.795 5.182 1.00 0.00 C ATOM 2008 CE2 PHE A 126 6.004 -1.440 4.283 1.00 0.00 C ATOM 2009 CZ PHE A 126 5.351 -0.566 5.169 1.00 0.00 C ATOM 0 H PHE A 126 11.068 -0.264 2.218 1.00 0.00 H new ATOM 0 HA PHE A 126 9.921 2.213 3.312 1.00 0.00 H new ATOM 0 HB2 PHE A 126 8.079 1.888 2.058 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.511 0.241 1.643 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.966 2.328 4.357 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.479 -1.622 2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.180 1.470 5.854 1.00 0.00 H new ATOM 0 HE2 PHE A 126 5.751 -2.490 4.276 1.00 0.00 H new ATOM 0 HZ PHE A 126 4.591 -0.942 5.838 1.00 0.00 H new ATOM 2019 N GLN A 127 9.662 0.980 5.527 1.00 0.00 N ATOM 2020 CA GLN A 127 9.531 0.357 6.842 1.00 0.00 C ATOM 2021 C GLN A 127 8.439 1.099 7.617 1.00 0.00 C ATOM 2022 O GLN A 127 8.030 2.198 7.231 1.00 0.00 O ATOM 2023 CB GLN A 127 10.859 0.424 7.624 1.00 0.00 C ATOM 2024 CG GLN A 127 11.939 -0.537 7.114 1.00 0.00 C ATOM 2025 CD GLN A 127 11.535 -2.016 7.177 1.00 0.00 C ATOM 2026 OE1 GLN A 127 10.913 -2.476 8.132 1.00 0.00 O ATOM 2027 NE2 GLN A 127 11.888 -2.795 6.170 1.00 0.00 N ATOM 0 H GLN A 127 9.491 1.985 5.555 1.00 0.00 H new ATOM 0 HA GLN A 127 9.270 -0.694 6.717 1.00 0.00 H new ATOM 0 HB2 GLN A 127 11.244 1.443 7.577 1.00 0.00 H new ATOM 0 HB3 GLN A 127 10.661 0.206 8.673 1.00 0.00 H new ATOM 0 HG2 GLN A 127 12.182 -0.281 6.083 1.00 0.00 H new ATOM 0 HG3 GLN A 127 12.846 -0.393 7.701 1.00 0.00 H new ATOM 0 HE21 GLN A 127 12.404 -2.406 5.381 1.00 0.00 H new ATOM 0 HE22 GLN A 127 11.644 -3.785 6.182 1.00 0.00 H new ATOM 2036 N ALA A 128 7.997 0.534 8.742 1.00 0.00 N ATOM 2037 CA ALA A 128 7.042 1.171 9.634 1.00 0.00 C ATOM 2038 C ALA A 128 7.333 0.785 11.084 1.00 0.00 C ATOM 2039 O ALA A 128 7.919 -0.268 11.345 1.00 0.00 O ATOM 2040 CB ALA A 128 5.619 0.749 9.246 1.00 0.00 C ATOM 0 H ALA A 128 8.298 -0.388 9.058 1.00 0.00 H new ATOM 0 HA ALA A 128 7.132 2.253 9.542 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.903 1.226 9.915 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.416 1.054 8.219 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.526 -0.334 9.328 1.00 0.00 H new ATOM 2046 N GLY A 129 6.871 1.622 12.015 1.00 0.00 N ATOM 2047 CA GLY A 129 6.857 1.344 13.448 1.00 0.00 C ATOM 2048 C GLY A 129 8.242 1.049 14.029 1.00 0.00 C ATOM 2049 O GLY A 129 8.372 0.154 14.866 1.00 0.00 O ATOM 0 H GLY A 129 6.486 2.538 11.784 1.00 0.00 H new ATOM 0 HA2 GLY A 129 6.427 2.198 13.971 1.00 0.00 H new ATOM 0 HA3 GLY A 129 6.204 0.492 13.638 1.00 0.00 H new ATOM 2053 N GLY A 130 9.276 1.762 13.574 1.00 0.00 N ATOM 2054 CA GLY A 130 10.637 1.620 14.074 1.00 0.00 C ATOM 2055 C GLY A 130 10.859 2.611 15.210 1.00 0.00 C ATOM 2056 O GLY A 130 10.501 3.785 15.084 1.00 0.00 O ATOM 0 H GLY A 130 9.185 2.462 12.838 1.00 0.00 H new ATOM 0 HA2 GLY A 130 10.804 0.602 14.426 1.00 0.00 H new ATOM 0 HA3 GLY A 130 11.353 1.801 13.272 1.00 0.00 H new ATOM 2060 N SER A 131 11.444 2.145 16.314 1.00 0.00 N ATOM 2061 CA SER A 131 11.649 2.908 17.539 1.00 0.00 C ATOM 2062 C SER A 131 12.369 4.229 17.242 1.00 0.00 C ATOM 2063 O SER A 131 13.547 4.228 16.874 1.00 0.00 O ATOM 2064 CB SER A 131 12.426 2.043 18.541 1.00 0.00 C ATOM 2065 OG SER A 131 11.832 0.755 18.654 1.00 0.00 O ATOM 0 H SER A 131 11.800 1.191 16.379 1.00 0.00 H new ATOM 0 HA SER A 131 10.686 3.168 17.979 1.00 0.00 H new ATOM 0 HB2 SER A 131 13.462 1.945 18.218 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.440 2.530 19.516 1.00 0.00 H new ATOM 0 HG SER A 131 12.340 0.216 19.295 1.00 0.00 H new ATOM 2071 N GLY A 132 11.647 5.349 17.358 1.00 0.00 N ATOM 2072 CA GLY A 132 12.151 6.693 17.094 1.00 0.00 C ATOM 2073 C GLY A 132 12.846 6.832 15.736 1.00 0.00 C ATOM 2074 O GLY A 132 13.784 7.614 15.630 1.00 0.00 O ATOM 0 H GLY A 132 10.669 5.341 17.647 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.322 7.399 17.142 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.852 6.970 17.881 1.00 0.00 H new ATOM 2078 N MET A 133 12.441 6.069 14.712 1.00 0.00 N ATOM 2079 CA MET A 133 13.103 5.991 13.400 1.00 0.00 C ATOM 2080 C MET A 133 14.616 5.698 13.465 1.00 0.00 C ATOM 2081 O MET A 133 15.341 6.031 12.525 1.00 0.00 O ATOM 2082 CB MET A 133 12.848 7.255 12.556 1.00 0.00 C ATOM 2083 CG MET A 133 11.431 7.828 12.597 1.00 0.00 C ATOM 2084 SD MET A 133 11.065 8.990 11.247 1.00 0.00 S ATOM 2085 CE MET A 133 12.515 10.083 11.304 1.00 0.00 C ATOM 0 H MET A 133 11.618 5.470 14.774 1.00 0.00 H new ATOM 0 HA MET A 133 12.643 5.131 12.914 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.539 8.031 12.886 1.00 0.00 H new ATOM 0 HB3 MET A 133 13.094 7.028 11.519 1.00 0.00 H new ATOM 0 HG2 MET A 133 10.716 7.006 12.559 1.00 0.00 H new ATOM 0 HG3 MET A 133 11.283 8.336 13.550 1.00 0.00 H new ATOM 0 HE1 MET A 133 12.393 10.887 10.578 1.00 0.00 H new ATOM 0 HE2 MET A 133 12.612 10.507 12.303 1.00 0.00 H new ATOM 0 HE3 MET A 133 13.411 9.511 11.065 1.00 0.00 H new ATOM 2095 N LYS A 134 15.137 5.108 14.549 1.00 0.00 N ATOM 2096 CA LYS A 134 16.582 4.902 14.701 1.00 0.00 C ATOM 2097 C LYS A 134 17.144 4.049 13.557 1.00 0.00 C ATOM 2098 O LYS A 134 18.234 4.332 13.065 1.00 0.00 O ATOM 2099 CB LYS A 134 16.859 4.279 16.083 1.00 0.00 C ATOM 2100 CG LYS A 134 18.335 4.005 16.435 1.00 0.00 C ATOM 2101 CD LYS A 134 19.225 5.245 16.635 1.00 0.00 C ATOM 2102 CE LYS A 134 19.766 5.835 15.323 1.00 0.00 C ATOM 2103 NZ LYS A 134 20.729 6.938 15.557 1.00 0.00 N ATOM 0 H LYS A 134 14.580 4.766 15.332 1.00 0.00 H new ATOM 0 HA LYS A 134 17.095 5.862 14.646 1.00 0.00 H new ATOM 0 HB2 LYS A 134 16.445 4.941 16.844 1.00 0.00 H new ATOM 0 HB3 LYS A 134 16.313 3.338 16.148 1.00 0.00 H new ATOM 0 HG2 LYS A 134 18.365 3.410 17.348 1.00 0.00 H new ATOM 0 HG3 LYS A 134 18.769 3.395 15.643 1.00 0.00 H new ATOM 0 HD2 LYS A 134 18.653 6.011 17.159 1.00 0.00 H new ATOM 0 HD3 LYS A 134 20.065 4.979 17.277 1.00 0.00 H new ATOM 0 HE2 LYS A 134 20.252 5.048 14.746 1.00 0.00 H new ATOM 0 HE3 LYS A 134 18.934 6.203 14.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 20.719 7.586 14.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 20.459 7.458 16.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 21.685 6.545 15.676 1.00 0.00 H new ATOM 2117 N MET A 135 16.396 3.035 13.117 1.00 0.00 N ATOM 2118 CA MET A 135 16.813 2.149 12.031 1.00 0.00 C ATOM 2119 C MET A 135 16.754 2.893 10.690 1.00 0.00 C ATOM 2120 O MET A 135 17.623 2.710 9.843 1.00 0.00 O ATOM 2121 CB MET A 135 15.928 0.888 12.054 1.00 0.00 C ATOM 2122 CG MET A 135 16.508 -0.335 11.323 1.00 0.00 C ATOM 2123 SD MET A 135 16.777 -0.248 9.526 1.00 0.00 S ATOM 2124 CE MET A 135 15.170 0.380 8.973 1.00 0.00 C ATOM 0 H MET A 135 15.481 2.806 13.506 1.00 0.00 H new ATOM 0 HA MET A 135 17.848 1.835 12.165 1.00 0.00 H new ATOM 0 HB2 MET A 135 15.740 0.615 13.092 1.00 0.00 H new ATOM 0 HB3 MET A 135 14.963 1.133 11.609 1.00 0.00 H new ATOM 0 HG2 MET A 135 17.465 -0.571 11.787 1.00 0.00 H new ATOM 0 HG3 MET A 135 15.844 -1.178 11.515 1.00 0.00 H new ATOM 0 HE1 MET A 135 14.984 0.053 7.950 1.00 0.00 H new ATOM 0 HE2 MET A 135 14.385 -0.004 9.625 1.00 0.00 H new ATOM 0 HE3 MET A 135 15.173 1.469 9.011 1.00 0.00 H new ATOM 2134 N LEU A 136 15.761 3.769 10.485 1.00 0.00 N ATOM 2135 CA LEU A 136 15.582 4.504 9.229 1.00 0.00 C ATOM 2136 C LEU A 136 16.829 5.300 8.854 1.00 0.00 C ATOM 2137 O LEU A 136 17.156 5.402 7.674 1.00 0.00 O ATOM 2138 CB LEU A 136 14.388 5.459 9.352 1.00 0.00 C ATOM 2139 CG LEU A 136 14.033 6.191 8.044 1.00 0.00 C ATOM 2140 CD1 LEU A 136 13.594 5.212 6.950 1.00 0.00 C ATOM 2141 CD2 LEU A 136 12.961 7.235 8.354 1.00 0.00 C ATOM 0 H LEU A 136 15.057 3.987 11.190 1.00 0.00 H new ATOM 0 HA LEU A 136 15.399 3.772 8.442 1.00 0.00 H new ATOM 0 HB2 LEU A 136 13.518 4.895 9.688 1.00 0.00 H new ATOM 0 HB3 LEU A 136 14.605 6.199 10.123 1.00 0.00 H new ATOM 0 HG LEU A 136 14.916 6.693 7.650 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.352 5.765 6.043 1.00 0.00 H new ATOM 0 HD12 LEU A 136 14.403 4.511 6.743 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.715 4.662 7.285 1.00 0.00 H new ATOM 0 HD21 LEU A 136 12.695 7.766 7.440 1.00 0.00 H new ATOM 0 HD22 LEU A 136 12.077 6.740 8.757 1.00 0.00 H new ATOM 0 HD23 LEU A 136 13.345 7.945 9.087 1.00 0.00 H new ATOM 2153 N GLU A 137 17.546 5.832 9.845 1.00 0.00 N ATOM 2154 CA GLU A 137 18.810 6.536 9.625 1.00 0.00 C ATOM 2155 C GLU A 137 19.854 5.648 8.929 1.00 0.00 C ATOM 2156 O GLU A 137 20.668 6.140 8.141 1.00 0.00 O ATOM 2157 CB GLU A 137 19.318 7.063 10.975 1.00 0.00 C ATOM 2158 CG GLU A 137 20.557 7.949 10.817 1.00 0.00 C ATOM 2159 CD GLU A 137 20.835 8.756 12.089 1.00 0.00 C ATOM 2160 OE1 GLU A 137 21.190 8.161 13.131 1.00 0.00 O ATOM 2161 OE2 GLU A 137 20.697 9.999 12.039 1.00 0.00 O ATOM 0 H GLU A 137 17.266 5.787 10.825 1.00 0.00 H new ATOM 0 HA GLU A 137 18.639 7.374 8.950 1.00 0.00 H new ATOM 0 HB2 GLU A 137 18.526 7.631 11.463 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.555 6.222 11.626 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.422 7.329 10.582 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.415 8.629 9.977 1.00 0.00 H new ATOM 2168 N LYS A 138 19.825 4.330 9.162 1.00 0.00 N ATOM 2169 CA LYS A 138 20.689 3.394 8.454 1.00 0.00 C ATOM 2170 C LYS A 138 20.269 3.377 6.994 1.00 0.00 C ATOM 2171 O LYS A 138 21.103 3.574 6.114 1.00 0.00 O ATOM 2172 CB LYS A 138 20.620 1.973 9.058 1.00 0.00 C ATOM 2173 CG LYS A 138 20.777 1.895 10.589 1.00 0.00 C ATOM 2174 CD LYS A 138 22.073 2.505 11.149 1.00 0.00 C ATOM 2175 CE LYS A 138 23.363 1.834 10.645 1.00 0.00 C ATOM 2176 NZ LYS A 138 23.528 0.443 11.142 1.00 0.00 N ATOM 0 H LYS A 138 19.205 3.891 9.842 1.00 0.00 H new ATOM 0 HA LYS A 138 21.724 3.721 8.550 1.00 0.00 H new ATOM 0 HB2 LYS A 138 19.664 1.527 8.785 1.00 0.00 H new ATOM 0 HB3 LYS A 138 21.398 1.364 8.599 1.00 0.00 H new ATOM 0 HG2 LYS A 138 19.928 2.400 11.051 1.00 0.00 H new ATOM 0 HG3 LYS A 138 20.728 0.848 10.890 1.00 0.00 H new ATOM 0 HD2 LYS A 138 22.103 3.563 10.889 1.00 0.00 H new ATOM 0 HD3 LYS A 138 22.048 2.444 12.237 1.00 0.00 H new ATOM 0 HE2 LYS A 138 23.360 1.826 9.555 1.00 0.00 H new ATOM 0 HE3 LYS A 138 24.221 2.429 10.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 24.413 0.044 10.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 23.560 0.447 12.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 22.726 -0.137 10.823 1.00 0.00 H new ATOM 2190 N ARG A 139 18.971 3.195 6.726 1.00 0.00 N ATOM 2191 CA ARG A 139 18.473 3.066 5.368 1.00 0.00 C ATOM 2192 C ARG A 139 18.743 4.330 4.565 1.00 0.00 C ATOM 2193 O ARG A 139 19.307 4.248 3.479 1.00 0.00 O ATOM 2194 CB ARG A 139 16.986 2.677 5.388 1.00 0.00 C ATOM 2195 CG ARG A 139 16.517 2.157 4.020 1.00 0.00 C ATOM 2196 CD ARG A 139 17.096 0.783 3.634 1.00 0.00 C ATOM 2197 NE ARG A 139 16.487 -0.300 4.428 1.00 0.00 N ATOM 2198 CZ ARG A 139 16.961 -0.927 5.509 1.00 0.00 C ATOM 2199 NH1 ARG A 139 18.194 -0.704 5.958 1.00 0.00 N ATOM 2200 NH2 ARG A 139 16.163 -1.782 6.139 1.00 0.00 N ATOM 0 H ARG A 139 18.248 3.135 7.443 1.00 0.00 H new ATOM 0 HA ARG A 139 19.011 2.264 4.862 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.820 1.911 6.145 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.387 3.542 5.674 1.00 0.00 H new ATOM 0 HG2 ARG A 139 15.429 2.093 4.022 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.792 2.883 3.254 1.00 0.00 H new ATOM 0 HD2 ARG A 139 16.924 0.599 2.573 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.175 0.785 3.787 1.00 0.00 H new ATOM 0 HE ARG A 139 15.572 -0.616 4.106 1.00 0.00 H new ATOM 0 HH11 ARG A 139 18.801 -0.042 5.475 1.00 0.00 H new ATOM 0 HH12 ARG A 139 18.532 -1.195 6.785 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.217 -1.945 5.795 1.00 0.00 H new ATOM 0 HH22 ARG A 139 16.497 -2.276 6.967 1.00 0.00 H new ATOM 2214 N VAL A 140 18.399 5.496 5.103 1.00 0.00 N ATOM 2215 CA VAL A 140 18.617 6.767 4.440 1.00 0.00 C ATOM 2216 C VAL A 140 20.102 6.979 4.158 1.00 0.00 C ATOM 2217 O VAL A 140 20.436 7.340 3.030 1.00 0.00 O ATOM 2218 CB VAL A 140 17.969 7.865 5.305 1.00 0.00 C ATOM 2219 CG1 VAL A 140 18.551 9.263 5.085 1.00 0.00 C ATOM 2220 CG2 VAL A 140 16.456 7.862 5.015 1.00 0.00 C ATOM 0 H VAL A 140 17.958 5.581 6.019 1.00 0.00 H new ATOM 0 HA VAL A 140 18.144 6.796 3.458 1.00 0.00 H new ATOM 0 HB VAL A 140 18.181 7.633 6.349 1.00 0.00 H new ATOM 0 HG11 VAL A 140 18.040 9.976 5.732 1.00 0.00 H new ATOM 0 HG12 VAL A 140 19.615 9.256 5.323 1.00 0.00 H new ATOM 0 HG13 VAL A 140 18.414 9.555 4.044 1.00 0.00 H new ATOM 0 HG21 VAL A 140 15.969 8.631 5.615 1.00 0.00 H new ATOM 0 HG22 VAL A 140 16.288 8.066 3.957 1.00 0.00 H new ATOM 0 HG23 VAL A 140 16.039 6.887 5.267 1.00 0.00 H new ATOM 2230 N ASN A 141 21.009 6.729 5.112 1.00 0.00 N ATOM 2231 CA ASN A 141 22.423 6.992 4.842 1.00 0.00 C ATOM 2232 C ASN A 141 22.978 5.977 3.842 1.00 0.00 C ATOM 2233 O ASN A 141 23.858 6.323 3.055 1.00 0.00 O ATOM 2234 CB ASN A 141 23.273 7.155 6.109 1.00 0.00 C ATOM 2235 CG ASN A 141 23.970 5.885 6.560 1.00 0.00 C ATOM 2236 OD1 ASN A 141 25.012 5.491 6.044 1.00 0.00 O ATOM 2237 ND2 ASN A 141 23.409 5.246 7.561 1.00 0.00 N ATOM 0 H ASN A 141 20.800 6.360 6.040 1.00 0.00 H new ATOM 0 HA ASN A 141 22.489 7.972 4.369 1.00 0.00 H new ATOM 0 HB2 ASN A 141 24.024 7.925 5.932 1.00 0.00 H new ATOM 0 HB3 ASN A 141 22.635 7.512 6.917 1.00 0.00 H new ATOM 0 HD21 ASN A 141 23.839 4.398 7.930 1.00 0.00 H new ATOM 0 HD22 ASN A 141 22.543 5.598 7.969 1.00 0.00 H new ATOM 2244 N ARG A 142 22.414 4.763 3.782 1.00 0.00 N ATOM 2245 CA ARG A 142 22.733 3.817 2.721 1.00 0.00 C ATOM 2246 C ARG A 142 22.285 4.365 1.374 1.00 0.00 C ATOM 2247 O ARG A 142 23.079 4.302 0.440 1.00 0.00 O ATOM 2248 CB ARG A 142 22.132 2.432 3.029 1.00 0.00 C ATOM 2249 CG ARG A 142 22.966 1.297 2.418 1.00 0.00 C ATOM 2250 CD ARG A 142 22.760 1.072 0.909 1.00 0.00 C ATOM 2251 NE ARG A 142 23.908 0.376 0.302 1.00 0.00 N ATOM 2252 CZ ARG A 142 24.921 0.957 -0.359 1.00 0.00 C ATOM 2253 NH1 ARG A 142 24.966 2.278 -0.518 1.00 0.00 N ATOM 2254 NH2 ARG A 142 25.894 0.206 -0.863 1.00 0.00 N ATOM 0 H ARG A 142 21.734 4.419 4.460 1.00 0.00 H new ATOM 0 HA ARG A 142 23.814 3.685 2.670 1.00 0.00 H new ATOM 0 HB2 ARG A 142 22.069 2.296 4.109 1.00 0.00 H new ATOM 0 HB3 ARG A 142 21.114 2.384 2.642 1.00 0.00 H new ATOM 0 HG2 ARG A 142 24.021 1.505 2.597 1.00 0.00 H new ATOM 0 HG3 ARG A 142 22.730 0.371 2.943 1.00 0.00 H new ATOM 0 HD2 ARG A 142 21.854 0.488 0.748 1.00 0.00 H new ATOM 0 HD3 ARG A 142 22.613 2.032 0.414 1.00 0.00 H new ATOM 0 HE ARG A 142 23.935 -0.640 0.392 1.00 0.00 H new ATOM 0 HH11 ARG A 142 24.224 2.863 -0.135 1.00 0.00 H new ATOM 0 HH12 ARG A 142 25.743 2.705 -1.023 1.00 0.00 H new ATOM 0 HH21 ARG A 142 25.869 -0.807 -0.747 1.00 0.00 H new ATOM 0 HH22 ARG A 142 26.666 0.642 -1.366 1.00 0.00 H new ATOM 2268 N VAL A 143 21.071 4.902 1.247 1.00 0.00 N ATOM 2269 CA VAL A 143 20.582 5.463 -0.014 1.00 0.00 C ATOM 2270 C VAL A 143 21.411 6.695 -0.407 1.00 0.00 C ATOM 2271 O VAL A 143 21.708 6.868 -1.591 1.00 0.00 O ATOM 2272 CB VAL A 143 19.061 5.718 0.067 1.00 0.00 C ATOM 2273 CG1 VAL A 143 18.506 6.449 -1.166 1.00 0.00 C ATOM 2274 CG2 VAL A 143 18.313 4.378 0.190 1.00 0.00 C ATOM 0 H VAL A 143 20.400 4.961 2.013 1.00 0.00 H new ATOM 0 HA VAL A 143 20.719 4.745 -0.823 1.00 0.00 H new ATOM 0 HB VAL A 143 18.905 6.350 0.941 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.433 6.598 -1.048 1.00 0.00 H new ATOM 0 HG12 VAL A 143 18.998 7.416 -1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.693 5.851 -2.058 1.00 0.00 H new ATOM 0 HG21 VAL A 143 17.240 4.564 0.247 1.00 0.00 H new ATOM 0 HG22 VAL A 143 18.528 3.760 -0.681 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.640 3.860 1.092 1.00 0.00 H new ATOM 2284 N LEU A 144 21.874 7.512 0.547 1.00 0.00 N ATOM 2285 CA LEU A 144 22.846 8.566 0.244 1.00 0.00 C ATOM 2286 C LEU A 144 24.098 7.927 -0.344 1.00 0.00 C ATOM 2287 O LEU A 144 24.540 8.337 -1.410 1.00 0.00 O ATOM 2288 CB LEU A 144 23.214 9.398 1.484 1.00 0.00 C ATOM 2289 CG LEU A 144 22.074 10.284 2.009 1.00 0.00 C ATOM 2290 CD1 LEU A 144 22.503 10.969 3.310 1.00 0.00 C ATOM 2291 CD2 LEU A 144 21.656 11.343 0.988 1.00 0.00 C ATOM 0 H LEU A 144 21.593 7.464 1.526 1.00 0.00 H new ATOM 0 HA LEU A 144 22.391 9.249 -0.473 1.00 0.00 H new ATOM 0 HB2 LEU A 144 23.531 8.723 2.279 1.00 0.00 H new ATOM 0 HB3 LEU A 144 24.069 10.030 1.243 1.00 0.00 H new ATOM 0 HG LEU A 144 21.215 9.638 2.192 1.00 0.00 H new ATOM 0 HD11 LEU A 144 21.690 11.596 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 144 22.744 10.213 4.057 1.00 0.00 H new ATOM 0 HD13 LEU A 144 23.381 11.587 3.123 1.00 0.00 H new ATOM 0 HD21 LEU A 144 20.848 11.947 1.400 1.00 0.00 H new ATOM 0 HD22 LEU A 144 22.507 11.984 0.759 1.00 0.00 H new ATOM 0 HD23 LEU A 144 21.314 10.854 0.076 1.00 0.00 H new ATOM 2303 N ALA A 145 24.607 6.865 0.281 1.00 0.00 N ATOM 2304 CA ALA A 145 25.720 6.071 -0.229 1.00 0.00 C ATOM 2305 C ALA A 145 25.381 5.249 -1.493 1.00 0.00 C ATOM 2306 O ALA A 145 26.224 4.466 -1.938 1.00 0.00 O ATOM 2307 CB ALA A 145 26.280 5.194 0.901 1.00 0.00 C ATOM 0 H ALA A 145 24.248 6.528 1.174 1.00 0.00 H new ATOM 0 HA ALA A 145 26.490 6.767 -0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 145 27.112 4.600 0.522 1.00 0.00 H new ATOM 0 HB2 ALA A 145 26.629 5.829 1.715 1.00 0.00 H new ATOM 0 HB3 ALA A 145 25.497 4.530 1.268 1.00 0.00 H new ATOM 2313 N GLU A 146 24.170 5.345 -2.060 1.00 0.00 N ATOM 2314 CA GLU A 146 23.835 4.791 -3.376 1.00 0.00 C ATOM 2315 C GLU A 146 23.835 5.934 -4.411 1.00 0.00 C ATOM 2316 O GLU A 146 23.748 5.684 -5.615 1.00 0.00 O ATOM 2317 CB GLU A 146 22.451 4.111 -3.406 1.00 0.00 C ATOM 2318 CG GLU A 146 22.349 2.817 -2.594 1.00 0.00 C ATOM 2319 CD GLU A 146 21.148 1.975 -3.050 1.00 0.00 C ATOM 2320 OE1 GLU A 146 19.987 2.328 -2.749 1.00 0.00 O ATOM 2321 OE2 GLU A 146 21.351 0.962 -3.755 1.00 0.00 O ATOM 0 H GLU A 146 23.386 5.817 -1.609 1.00 0.00 H new ATOM 0 HA GLU A 146 24.583 4.033 -3.607 1.00 0.00 H new ATOM 0 HB2 GLU A 146 21.708 4.816 -3.033 1.00 0.00 H new ATOM 0 HB3 GLU A 146 22.192 3.894 -4.442 1.00 0.00 H new ATOM 0 HG2 GLU A 146 23.266 2.239 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 146 22.250 3.055 -1.535 1.00 0.00 H new ATOM 2328 N THR A 147 23.961 7.184 -3.949 1.00 0.00 N ATOM 2329 CA THR A 147 23.761 8.405 -4.723 1.00 0.00 C ATOM 2330 C THR A 147 24.970 9.357 -4.668 1.00 0.00 C ATOM 2331 O THR A 147 25.027 10.403 -5.316 1.00 0.00 O ATOM 2332 CB THR A 147 22.461 9.050 -4.192 1.00 0.00 C ATOM 2333 OG1 THR A 147 21.406 8.112 -4.040 1.00 0.00 O ATOM 2334 CG2 THR A 147 21.963 10.149 -5.117 1.00 0.00 C ATOM 0 H THR A 147 24.217 7.375 -2.980 1.00 0.00 H new ATOM 0 HA THR A 147 23.667 8.173 -5.784 1.00 0.00 H new ATOM 0 HB THR A 147 22.726 9.460 -3.217 1.00 0.00 H new ATOM 0 HG1 THR A 147 21.486 7.668 -3.170 1.00 0.00 H new ATOM 0 HG21 THR A 147 21.047 10.579 -4.711 1.00 0.00 H new ATOM 0 HG22 THR A 147 22.723 10.926 -5.201 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.761 9.731 -6.103 1.00 0.00 H new ATOM 2342 N GLU A 148 25.972 8.941 -3.920 1.00 0.00 N ATOM 2343 CA GLU A 148 27.206 9.627 -3.592 1.00 0.00 C ATOM 2344 C GLU A 148 28.288 8.553 -3.484 1.00 0.00 C ATOM 2345 O GLU A 148 28.039 7.515 -2.834 1.00 0.00 O ATOM 2346 CB GLU A 148 27.018 10.407 -2.274 1.00 0.00 C ATOM 2347 CG GLU A 148 28.289 11.182 -1.907 1.00 0.00 C ATOM 2348 CD GLU A 148 28.095 12.066 -0.656 1.00 0.00 C ATOM 2349 OE1 GLU A 148 28.324 11.588 0.478 1.00 0.00 O ATOM 2350 OE2 GLU A 148 27.746 13.261 -0.797 1.00 0.00 O ATOM 2351 OXT GLU A 148 29.355 8.716 -4.112 1.00 0.00 O ATOM 0 H GLU A 148 25.939 8.020 -3.482 1.00 0.00 H new ATOM 0 HA GLU A 148 27.494 10.355 -4.350 1.00 0.00 H new ATOM 0 HB2 GLU A 148 26.182 11.099 -2.373 1.00 0.00 H new ATOM 0 HB3 GLU A 148 26.765 9.715 -1.471 1.00 0.00 H new ATOM 0 HG2 GLU A 148 29.102 10.478 -1.730 1.00 0.00 H new ATOM 0 HG3 GLU A 148 28.586 11.807 -2.749 1.00 0.00 H new