USER MOD reduce.3.24.130724 H: found=0, std=0, add=1136, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1136 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: B 21 GLN : amide:sc= 1.01 K(o=0.032,f=-1.5) USER MOD Set 1.2: B 35 TYR OH : rot 180:sc= -0.974 USER MOD Set 2.1: A 25 TYR OH : rot 64:sc= 1.24 USER MOD Set 2.2: A 47 ASN : amide:sc= 0.881 K(o=2.1,f=-2.3) USER MOD Set 3.1: A 21 GLN : amide:sc= 1.24 K(o=1.4,f=-0.36) USER MOD Set 3.2: A 35 TYR OH : rot 70:sc= 0.176 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 ASN : amide:sc= -0.645 K(o=-0.65,f=-6.4!) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 ASN : amide:sc= -0.112 K(o=-0.11,f=-2.2!) USER MOD Single : A 12 HIS : no HD1:sc= -0.0241 X(o=-0.024,f=-0.024) USER MOD Single : A 14 LYS NZ :NH3+ -145:sc= -1.22 (180deg=-2.91!) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.291 USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.0528 USER MOD Single : A 30 THR OG1 : rot -37:sc= 1.02 USER MOD Single : A 51 TYR OH : rot 33:sc= 1.21 USER MOD Single : A 55 GLN : amide:sc= -3.19! K(o=-3.2!,f=-1.9) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.143 K(o=-0.14,f=-4.2!) USER MOD Single : A 64 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.29) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 160:sc= 1.19 (180deg=0.461) USER MOD Single : B 4 ASN : amide:sc= -0.0151 K(o=-0.015,f=-2.6!) USER MOD Single : B 6 MET CE :methyl 160:sc= -0.141 (180deg=-0.607) USER MOD Single : B 9 ASN : amide:sc= -0.312 X(o=-0.31,f=0) USER MOD Single : B 10 ASN : amide:sc= -0.237 K(o=-0.24,f=-1.7) USER MOD Single : B 12 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.0053) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 THR OG1 : rot 180:sc= 0.0168 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0.0606 USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 180:sc= -0.134 USER MOD Single : B 47 ASN : amide:sc= -0.0713 K(o=-0.071,f=-0.75) USER MOD Single : B 51 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= -0.0273 K(o=-0.027,f=-0.7) USER MOD Single : B 61 LYS NZ :NH3+ -117:sc= 1.15 (180deg=-0.413) USER MOD Single : B 62 ASN : amide:sc= 1.43 K(o=1.4,f=-4.8!) USER MOD Single : B 64 GLN : amide:sc= -0.925 K(o=-0.92,f=-4.9!) USER MOD Single : B 67 HIS : no HD1:sc= -1.61 X(o=-1.6,f=-1.6) USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=-0.004) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : B 70 HIS : no HD1:sc= -0.196 X(o=-0.2,f=0.029) USER MOD Single : B 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 72 HIS : no HE2:sc= 0.683 K(o=0.68,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 31.690 19.675 18.718 1.00 0.00 N ATOM 2 CA MET A 1 30.860 20.008 19.897 1.00 0.00 C ATOM 3 C MET A 1 29.620 19.124 19.938 1.00 0.00 C ATOM 4 O MET A 1 28.691 19.306 19.148 1.00 0.00 O ATOM 5 CB MET A 1 30.442 21.482 19.865 1.00 0.00 C ATOM 6 CG MET A 1 29.614 21.901 21.070 1.00 0.00 C ATOM 7 SD MET A 1 29.081 23.622 20.988 1.00 0.00 S ATOM 8 CE MET A 1 28.163 23.758 22.521 1.00 0.00 C ATOM 0 H1 MET A 1 32.532 20.285 18.703 1.00 0.00 H new ATOM 0 H2 MET A 1 31.985 18.679 18.771 1.00 0.00 H new ATOM 0 H3 MET A 1 31.137 19.826 17.850 1.00 0.00 H new ATOM 0 HA MET A 1 31.456 19.831 20.793 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.335 22.104 19.813 1.00 0.00 H new ATOM 0 HB3 MET A 1 29.869 21.670 18.957 1.00 0.00 H new ATOM 0 HG2 MET A 1 28.738 21.257 21.144 1.00 0.00 H new ATOM 0 HG3 MET A 1 30.199 21.749 21.977 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.767 24.769 22.619 1.00 0.00 H new ATOM 0 HE2 MET A 1 27.339 23.044 22.516 1.00 0.00 H new ATOM 0 HE3 MET A 1 28.824 23.544 23.361 1.00 0.00 H new ATOM 20 N VAL A 2 29.618 18.159 20.847 1.00 0.00 N ATOM 21 CA VAL A 2 28.471 17.282 21.024 1.00 0.00 C ATOM 22 C VAL A 2 27.549 17.852 22.097 1.00 0.00 C ATOM 23 O VAL A 2 26.548 18.496 21.785 1.00 0.00 O ATOM 24 CB VAL A 2 28.898 15.849 21.413 1.00 0.00 C ATOM 25 CG1 VAL A 2 27.694 14.918 21.474 1.00 0.00 C ATOM 26 CG2 VAL A 2 29.941 15.314 20.440 1.00 0.00 C ATOM 0 H VAL A 2 30.399 17.964 21.473 1.00 0.00 H new ATOM 0 HA VAL A 2 27.945 17.226 20.071 1.00 0.00 H new ATOM 0 HB VAL A 2 29.344 15.890 22.407 1.00 0.00 H new ATOM 0 HG11 VAL A 2 28.023 13.916 21.750 1.00 0.00 H new ATOM 0 HG12 VAL A 2 26.987 15.286 22.218 1.00 0.00 H new ATOM 0 HG13 VAL A 2 27.210 14.885 20.498 1.00 0.00 H new ATOM 0 HG21 VAL A 2 30.227 14.304 20.733 1.00 0.00 H new ATOM 0 HG22 VAL A 2 29.524 15.295 19.433 1.00 0.00 H new ATOM 0 HG23 VAL A 2 30.819 15.959 20.457 1.00 0.00 H new ATOM 36 N GLU A 3 27.918 17.641 23.359 1.00 0.00 N ATOM 37 CA GLU A 3 27.171 18.184 24.488 1.00 0.00 C ATOM 38 C GLU A 3 27.850 17.822 25.802 1.00 0.00 C ATOM 39 O GLU A 3 28.165 18.694 26.610 1.00 0.00 O ATOM 40 CB GLU A 3 25.728 17.666 24.510 1.00 0.00 C ATOM 41 CG GLU A 3 24.887 18.299 25.608 1.00 0.00 C ATOM 42 CD GLU A 3 23.496 17.713 25.698 1.00 0.00 C ATOM 43 OE1 GLU A 3 22.585 18.224 25.017 1.00 0.00 O ATOM 44 OE2 GLU A 3 23.303 16.743 26.457 1.00 0.00 O ATOM 0 H GLU A 3 28.736 17.093 23.625 1.00 0.00 H new ATOM 0 HA GLU A 3 27.152 19.267 24.370 1.00 0.00 H new ATOM 0 HB2 GLU A 3 25.262 17.862 23.544 1.00 0.00 H new ATOM 0 HB3 GLU A 3 25.738 16.584 24.645 1.00 0.00 H new ATOM 0 HG2 GLU A 3 25.392 18.170 26.565 1.00 0.00 H new ATOM 0 HG3 GLU A 3 24.813 19.372 25.429 1.00 0.00 H new ATOM 51 N ASN A 4 28.081 16.534 26.011 1.00 0.00 N ATOM 52 CA ASN A 4 28.610 16.066 27.283 1.00 0.00 C ATOM 53 C ASN A 4 29.966 15.386 27.108 1.00 0.00 C ATOM 54 O ASN A 4 30.318 14.950 26.010 1.00 0.00 O ATOM 55 CB ASN A 4 27.601 15.119 27.966 1.00 0.00 C ATOM 56 CG ASN A 4 27.386 13.790 27.243 1.00 0.00 C ATOM 57 OD1 ASN A 4 28.311 13.190 26.695 1.00 0.00 O ATOM 58 ND2 ASN A 4 26.152 13.324 27.236 1.00 0.00 N ATOM 0 H ASN A 4 27.912 15.800 25.323 1.00 0.00 H new ATOM 0 HA ASN A 4 28.762 16.933 27.926 1.00 0.00 H new ATOM 0 HB2 ASN A 4 27.944 14.914 28.980 1.00 0.00 H new ATOM 0 HB3 ASN A 4 26.642 15.631 28.051 1.00 0.00 H new ATOM 0 HD21 ASN A 4 25.942 12.443 26.767 1.00 0.00 H new ATOM 0 HD22 ASN A 4 25.407 13.845 27.699 1.00 0.00 H new ATOM 65 N PRO A 5 30.757 15.318 28.187 1.00 0.00 N ATOM 66 CA PRO A 5 32.004 14.569 28.213 1.00 0.00 C ATOM 67 C PRO A 5 31.790 13.140 28.711 1.00 0.00 C ATOM 68 O PRO A 5 32.706 12.506 29.240 1.00 0.00 O ATOM 69 CB PRO A 5 32.845 15.371 29.202 1.00 0.00 C ATOM 70 CG PRO A 5 31.862 15.949 30.168 1.00 0.00 C ATOM 71 CD PRO A 5 30.521 16.005 29.470 1.00 0.00 C ATOM 0 HA PRO A 5 32.463 14.461 27.230 1.00 0.00 H new ATOM 0 HB2 PRO A 5 33.570 14.735 29.710 1.00 0.00 H new ATOM 0 HB3 PRO A 5 33.408 16.155 28.696 1.00 0.00 H new ATOM 0 HG2 PRO A 5 31.801 15.336 31.067 1.00 0.00 H new ATOM 0 HG3 PRO A 5 32.173 16.945 30.482 1.00 0.00 H new ATOM 0 HD2 PRO A 5 29.747 15.507 30.053 1.00 0.00 H new ATOM 0 HD3 PRO A 5 30.193 17.033 29.318 1.00 0.00 H new ATOM 79 N MET A 6 30.568 12.645 28.539 1.00 0.00 N ATOM 80 CA MET A 6 30.203 11.307 28.988 1.00 0.00 C ATOM 81 C MET A 6 30.357 10.308 27.847 1.00 0.00 C ATOM 82 O MET A 6 30.538 9.108 28.072 1.00 0.00 O ATOM 83 CB MET A 6 28.761 11.300 29.511 1.00 0.00 C ATOM 84 CG MET A 6 28.314 9.957 30.065 1.00 0.00 C ATOM 85 SD MET A 6 29.327 9.408 31.451 1.00 0.00 S ATOM 86 CE MET A 6 28.546 7.844 31.838 1.00 0.00 C ATOM 0 H MET A 6 29.809 13.156 28.088 1.00 0.00 H new ATOM 0 HA MET A 6 30.870 11.015 29.799 1.00 0.00 H new ATOM 0 HB2 MET A 6 28.664 12.055 30.292 1.00 0.00 H new ATOM 0 HB3 MET A 6 28.090 11.590 28.702 1.00 0.00 H new ATOM 0 HG2 MET A 6 27.274 10.028 30.385 1.00 0.00 H new ATOM 0 HG3 MET A 6 28.353 9.210 29.272 1.00 0.00 H new ATOM 0 HE1 MET A 6 29.061 7.379 32.679 1.00 0.00 H new ATOM 0 HE2 MET A 6 27.502 8.014 32.101 1.00 0.00 H new ATOM 0 HE3 MET A 6 28.600 7.186 30.971 1.00 0.00 H new ATOM 96 N VAL A 7 30.274 10.808 26.621 1.00 0.00 N ATOM 97 CA VAL A 7 30.488 9.981 25.444 1.00 0.00 C ATOM 98 C VAL A 7 31.933 9.482 25.412 1.00 0.00 C ATOM 99 O VAL A 7 32.861 10.218 25.749 1.00 0.00 O ATOM 100 CB VAL A 7 30.153 10.750 24.142 1.00 0.00 C ATOM 101 CG1 VAL A 7 31.035 11.983 23.987 1.00 0.00 C ATOM 102 CG2 VAL A 7 30.276 9.841 22.926 1.00 0.00 C ATOM 0 H VAL A 7 30.060 11.784 26.417 1.00 0.00 H new ATOM 0 HA VAL A 7 29.815 9.126 25.504 1.00 0.00 H new ATOM 0 HB VAL A 7 29.118 11.086 24.212 1.00 0.00 H new ATOM 0 HG11 VAL A 7 30.776 12.502 23.064 1.00 0.00 H new ATOM 0 HG12 VAL A 7 30.879 12.651 24.834 1.00 0.00 H new ATOM 0 HG13 VAL A 7 32.081 11.680 23.952 1.00 0.00 H new ATOM 0 HG21 VAL A 7 30.036 10.405 22.025 1.00 0.00 H new ATOM 0 HG22 VAL A 7 31.296 9.463 22.856 1.00 0.00 H new ATOM 0 HG23 VAL A 7 29.585 9.004 23.026 1.00 0.00 H new ATOM 112 N ILE A 8 32.114 8.224 25.037 1.00 0.00 N ATOM 113 CA ILE A 8 33.437 7.623 25.029 1.00 0.00 C ATOM 114 C ILE A 8 34.300 8.175 23.897 1.00 0.00 C ATOM 115 O ILE A 8 33.887 8.214 22.740 1.00 0.00 O ATOM 116 CB ILE A 8 33.372 6.073 24.961 1.00 0.00 C ATOM 117 CG1 ILE A 8 32.229 5.582 24.055 1.00 0.00 C ATOM 118 CG2 ILE A 8 33.215 5.495 26.359 1.00 0.00 C ATOM 119 CD1 ILE A 8 32.567 5.544 22.580 1.00 0.00 C ATOM 0 H ILE A 8 31.363 7.603 24.735 1.00 0.00 H new ATOM 0 HA ILE A 8 33.906 7.894 25.975 1.00 0.00 H new ATOM 0 HB ILE A 8 34.308 5.725 24.525 1.00 0.00 H new ATOM 0 HG12 ILE A 8 31.935 4.582 24.373 1.00 0.00 H new ATOM 0 HG13 ILE A 8 31.364 6.230 24.200 1.00 0.00 H new ATOM 0 HG21 ILE A 8 33.170 4.408 26.300 1.00 0.00 H new ATOM 0 HG22 ILE A 8 34.066 5.791 26.973 1.00 0.00 H new ATOM 0 HG23 ILE A 8 32.296 5.872 26.808 1.00 0.00 H new ATOM 0 HD11 ILE A 8 31.704 5.186 22.018 1.00 0.00 H new ATOM 0 HD12 ILE A 8 32.831 6.546 22.241 1.00 0.00 H new ATOM 0 HD13 ILE A 8 33.410 4.872 22.417 1.00 0.00 H new ATOM 131 N ASN A 9 35.492 8.637 24.251 1.00 0.00 N ATOM 132 CA ASN A 9 36.450 9.117 23.261 1.00 0.00 C ATOM 133 C ASN A 9 37.137 7.933 22.604 1.00 0.00 C ATOM 134 O ASN A 9 37.670 8.033 21.499 1.00 0.00 O ATOM 135 CB ASN A 9 37.495 10.030 23.908 1.00 0.00 C ATOM 136 CG ASN A 9 36.881 11.251 24.563 1.00 0.00 C ATOM 137 OD1 ASN A 9 36.560 11.235 25.752 1.00 0.00 O ATOM 138 ND2 ASN A 9 36.714 12.317 23.797 1.00 0.00 N ATOM 0 H ASN A 9 35.819 8.690 25.216 1.00 0.00 H new ATOM 0 HA ASN A 9 35.912 9.694 22.509 1.00 0.00 H new ATOM 0 HB2 ASN A 9 38.053 9.465 24.654 1.00 0.00 H new ATOM 0 HB3 ASN A 9 38.210 10.350 23.150 1.00 0.00 H new ATOM 0 HD21 ASN A 9 36.306 13.167 24.187 1.00 0.00 H new ATOM 0 HD22 ASN A 9 36.993 12.289 22.816 1.00 0.00 H new ATOM 145 N ASN A 10 37.122 6.811 23.304 1.00 0.00 N ATOM 146 CA ASN A 10 37.660 5.572 22.774 1.00 0.00 C ATOM 147 C ASN A 10 36.569 4.854 21.995 1.00 0.00 C ATOM 148 O ASN A 10 35.753 4.127 22.568 1.00 0.00 O ATOM 149 CB ASN A 10 38.177 4.690 23.913 1.00 0.00 C ATOM 150 CG ASN A 10 39.072 3.557 23.440 1.00 0.00 C ATOM 151 OD1 ASN A 10 38.907 3.021 22.343 1.00 0.00 O ATOM 152 ND2 ASN A 10 40.035 3.192 24.273 1.00 0.00 N ATOM 0 H ASN A 10 36.740 6.734 24.247 1.00 0.00 H new ATOM 0 HA ASN A 10 38.496 5.789 22.109 1.00 0.00 H new ATOM 0 HB2 ASN A 10 38.730 5.309 24.620 1.00 0.00 H new ATOM 0 HB3 ASN A 10 37.328 4.271 24.453 1.00 0.00 H new ATOM 0 HD21 ASN A 10 40.675 2.441 24.015 1.00 0.00 H new ATOM 0 HD22 ASN A 10 40.137 3.662 25.172 1.00 0.00 H new ATOM 159 N TRP A 11 36.530 5.099 20.697 1.00 0.00 N ATOM 160 CA TRP A 11 35.483 4.554 19.849 1.00 0.00 C ATOM 161 C TRP A 11 35.717 3.077 19.561 1.00 0.00 C ATOM 162 O TRP A 11 36.618 2.713 18.802 1.00 0.00 O ATOM 163 CB TRP A 11 35.396 5.330 18.532 1.00 0.00 C ATOM 164 CG TRP A 11 35.089 6.785 18.711 1.00 0.00 C ATOM 165 CD1 TRP A 11 35.979 7.819 18.689 1.00 0.00 C ATOM 166 CD2 TRP A 11 33.801 7.369 18.941 1.00 0.00 C ATOM 167 NE1 TRP A 11 35.325 9.009 18.888 1.00 0.00 N ATOM 168 CE2 TRP A 11 33.988 8.759 19.047 1.00 0.00 C ATOM 169 CE3 TRP A 11 32.510 6.850 19.067 1.00 0.00 C ATOM 170 CZ2 TRP A 11 32.929 9.638 19.271 1.00 0.00 C ATOM 171 CZ3 TRP A 11 31.460 7.722 19.291 1.00 0.00 C ATOM 172 CH2 TRP A 11 31.676 9.102 19.392 1.00 0.00 C ATOM 0 H TRP A 11 37.214 5.674 20.205 1.00 0.00 H new ATOM 0 HA TRP A 11 34.540 4.656 20.386 1.00 0.00 H new ATOM 0 HB2 TRP A 11 36.341 5.230 17.998 1.00 0.00 H new ATOM 0 HB3 TRP A 11 34.627 4.880 17.905 1.00 0.00 H new ATOM 0 HD1 TRP A 11 37.043 7.716 18.537 1.00 0.00 H new ATOM 0 HE1 TRP A 11 35.763 9.930 18.913 1.00 0.00 H new ATOM 0 HE3 TRP A 11 32.335 5.787 18.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 33.092 10.703 19.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 30.458 7.332 19.390 1.00 0.00 H new ATOM 0 HH2 TRP A 11 30.836 9.757 19.569 1.00 0.00 H new ATOM 183 N HIS A 12 34.911 2.229 20.186 1.00 0.00 N ATOM 184 CA HIS A 12 34.933 0.802 19.888 1.00 0.00 C ATOM 185 C HIS A 12 34.037 0.534 18.684 1.00 0.00 C ATOM 186 O HIS A 12 34.003 -0.568 18.142 1.00 0.00 O ATOM 187 CB HIS A 12 34.471 -0.013 21.102 1.00 0.00 C ATOM 188 CG HIS A 12 34.686 -1.492 20.958 1.00 0.00 C ATOM 189 ND1 HIS A 12 35.917 -2.091 21.115 1.00 0.00 N ATOM 190 CD2 HIS A 12 33.820 -2.495 20.672 1.00 0.00 C ATOM 191 CE1 HIS A 12 35.800 -3.392 20.933 1.00 0.00 C ATOM 192 NE2 HIS A 12 34.538 -3.663 20.663 1.00 0.00 N ATOM 0 H HIS A 12 34.236 2.502 20.900 1.00 0.00 H new ATOM 0 HA HIS A 12 35.953 0.496 19.655 1.00 0.00 H new ATOM 0 HB2 HIS A 12 35.003 0.337 21.987 1.00 0.00 H new ATOM 0 HB3 HIS A 12 33.411 0.176 21.272 1.00 0.00 H new ATOM 0 HD2 HIS A 12 32.761 -2.393 20.486 1.00 0.00 H new ATOM 0 HE1 HIS A 12 36.602 -4.113 20.995 1.00 0.00 H new ATOM 0 HE2 HIS A 12 34.158 -4.591 20.478 1.00 0.00 H new ATOM 201 N ASP A 13 33.305 1.568 18.285 1.00 0.00 N ATOM 202 CA ASP A 13 32.478 1.516 17.089 1.00 0.00 C ATOM 203 C ASP A 13 33.374 1.592 15.860 1.00 0.00 C ATOM 204 O ASP A 13 34.306 2.399 15.818 1.00 0.00 O ATOM 205 CB ASP A 13 31.474 2.670 17.096 1.00 0.00 C ATOM 206 CG ASP A 13 30.459 2.563 15.981 1.00 0.00 C ATOM 207 OD1 ASP A 13 29.528 1.736 16.100 1.00 0.00 O ATOM 208 OD2 ASP A 13 30.573 3.306 14.992 1.00 0.00 O ATOM 0 H ASP A 13 33.269 2.460 18.779 1.00 0.00 H new ATOM 0 HA ASP A 13 31.920 0.580 17.067 1.00 0.00 H new ATOM 0 HB2 ASP A 13 30.955 2.690 18.054 1.00 0.00 H new ATOM 0 HB3 ASP A 13 32.011 3.614 17.005 1.00 0.00 H new ATOM 213 N LYS A 14 33.106 0.757 14.868 1.00 0.00 N ATOM 214 CA LYS A 14 34.039 0.582 13.763 1.00 0.00 C ATOM 215 C LYS A 14 33.579 1.290 12.494 1.00 0.00 C ATOM 216 O LYS A 14 34.414 1.749 11.714 1.00 0.00 O ATOM 217 CB LYS A 14 34.255 -0.907 13.487 1.00 0.00 C ATOM 218 CG LYS A 14 34.747 -1.676 14.704 1.00 0.00 C ATOM 219 CD LYS A 14 35.054 -3.131 14.381 1.00 0.00 C ATOM 220 CE LYS A 14 36.438 -3.312 13.764 1.00 0.00 C ATOM 221 NZ LYS A 14 36.536 -2.764 12.383 1.00 0.00 N ATOM 0 H LYS A 14 32.258 0.194 14.804 1.00 0.00 H new ATOM 0 HA LYS A 14 34.982 1.040 14.063 1.00 0.00 H new ATOM 0 HB2 LYS A 14 33.319 -1.346 13.142 1.00 0.00 H new ATOM 0 HB3 LYS A 14 34.977 -1.019 12.678 1.00 0.00 H new ATOM 0 HG2 LYS A 14 35.644 -1.196 15.096 1.00 0.00 H new ATOM 0 HG3 LYS A 14 33.992 -1.632 15.489 1.00 0.00 H new ATOM 0 HD2 LYS A 14 34.985 -3.725 15.293 1.00 0.00 H new ATOM 0 HD3 LYS A 14 34.300 -3.514 13.693 1.00 0.00 H new ATOM 0 HE2 LYS A 14 37.178 -2.822 14.397 1.00 0.00 H new ATOM 0 HE3 LYS A 14 36.686 -4.373 13.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 37.169 -3.363 11.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 35.592 -2.749 11.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 36.915 -1.796 12.420 1.00 0.00 H new ATOM 235 N LEU A 15 32.261 1.375 12.298 1.00 0.00 N ATOM 236 CA LEU A 15 31.675 1.988 11.097 1.00 0.00 C ATOM 237 C LEU A 15 32.060 1.219 9.831 1.00 0.00 C ATOM 238 O LEU A 15 33.173 1.351 9.321 1.00 0.00 O ATOM 239 CB LEU A 15 32.091 3.458 10.963 1.00 0.00 C ATOM 240 CG LEU A 15 31.538 4.395 12.038 1.00 0.00 C ATOM 241 CD1 LEU A 15 32.128 5.789 11.881 1.00 0.00 C ATOM 242 CD2 LEU A 15 30.020 4.452 11.964 1.00 0.00 C ATOM 0 H LEU A 15 31.571 1.024 12.962 1.00 0.00 H new ATOM 0 HA LEU A 15 30.592 1.942 11.212 1.00 0.00 H new ATOM 0 HB2 LEU A 15 33.179 3.513 10.981 1.00 0.00 H new ATOM 0 HB3 LEU A 15 31.770 3.822 9.987 1.00 0.00 H new ATOM 0 HG LEU A 15 31.823 4.005 13.015 1.00 0.00 H new ATOM 0 HD11 LEU A 15 31.725 6.444 12.653 1.00 0.00 H new ATOM 0 HD12 LEU A 15 33.212 5.738 11.978 1.00 0.00 H new ATOM 0 HD13 LEU A 15 31.870 6.185 10.899 1.00 0.00 H new ATOM 0 HD21 LEU A 15 29.643 5.123 12.736 1.00 0.00 H new ATOM 0 HD22 LEU A 15 29.717 4.820 10.984 1.00 0.00 H new ATOM 0 HD23 LEU A 15 29.610 3.454 12.119 1.00 0.00 H new ATOM 254 N THR A 16 31.132 0.418 9.329 1.00 0.00 N ATOM 255 CA THR A 16 31.384 -0.392 8.147 1.00 0.00 C ATOM 256 C THR A 16 30.995 0.347 6.862 1.00 0.00 C ATOM 257 O THR A 16 31.854 0.868 6.148 1.00 0.00 O ATOM 258 CB THR A 16 30.614 -1.724 8.229 1.00 0.00 C ATOM 259 OG1 THR A 16 29.264 -1.478 8.647 1.00 0.00 O ATOM 260 CG2 THR A 16 31.286 -2.682 9.200 1.00 0.00 C ATOM 0 H THR A 16 30.197 0.312 9.722 1.00 0.00 H new ATOM 0 HA THR A 16 32.455 -0.594 8.116 1.00 0.00 H new ATOM 0 HB THR A 16 30.613 -2.182 7.240 1.00 0.00 H new ATOM 0 HG1 THR A 16 28.777 -2.327 8.696 1.00 0.00 H new ATOM 0 HG21 THR A 16 30.723 -3.614 9.240 1.00 0.00 H new ATOM 0 HG22 THR A 16 32.303 -2.886 8.865 1.00 0.00 H new ATOM 0 HG23 THR A 16 31.315 -2.233 10.193 1.00 0.00 H new ATOM 268 N GLU A 17 29.699 0.397 6.583 1.00 0.00 N ATOM 269 CA GLU A 17 29.194 1.018 5.365 1.00 0.00 C ATOM 270 C GLU A 17 28.117 2.043 5.699 1.00 0.00 C ATOM 271 O GLU A 17 27.188 1.754 6.452 1.00 0.00 O ATOM 272 CB GLU A 17 28.626 -0.049 4.426 1.00 0.00 C ATOM 273 CG GLU A 17 29.646 -1.097 4.012 1.00 0.00 C ATOM 274 CD GLU A 17 29.032 -2.240 3.235 1.00 0.00 C ATOM 275 OE1 GLU A 17 28.930 -2.139 1.995 1.00 0.00 O ATOM 276 OE2 GLU A 17 28.665 -3.259 3.858 1.00 0.00 O ATOM 0 H GLU A 17 28.974 0.012 7.188 1.00 0.00 H new ATOM 0 HA GLU A 17 30.019 1.526 4.867 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.787 -0.543 4.916 1.00 0.00 H new ATOM 0 HB3 GLU A 17 28.233 0.436 3.533 1.00 0.00 H new ATOM 0 HG2 GLU A 17 30.419 -0.625 3.405 1.00 0.00 H new ATOM 0 HG3 GLU A 17 30.136 -1.491 4.902 1.00 0.00 H new ATOM 283 N THR A 18 28.254 3.248 5.157 1.00 0.00 N ATOM 284 CA THR A 18 27.283 4.307 5.401 1.00 0.00 C ATOM 285 C THR A 18 27.241 5.311 4.250 1.00 0.00 C ATOM 286 O THR A 18 26.173 5.612 3.718 1.00 0.00 O ATOM 287 CB THR A 18 27.602 5.055 6.711 1.00 0.00 C ATOM 288 OG1 THR A 18 27.555 4.145 7.818 1.00 0.00 O ATOM 289 CG2 THR A 18 26.620 6.194 6.947 1.00 0.00 C ATOM 0 H THR A 18 29.027 3.515 4.547 1.00 0.00 H new ATOM 0 HA THR A 18 26.308 3.828 5.483 1.00 0.00 H new ATOM 0 HB THR A 18 28.604 5.476 6.623 1.00 0.00 H new ATOM 0 HG1 THR A 18 27.760 4.627 8.646 1.00 0.00 H new ATOM 0 HG21 THR A 18 26.870 6.703 7.878 1.00 0.00 H new ATOM 0 HG22 THR A 18 26.678 6.901 6.120 1.00 0.00 H new ATOM 0 HG23 THR A 18 25.608 5.794 7.013 1.00 0.00 H new ATOM 297 N ASP A 19 28.406 5.810 3.853 1.00 0.00 N ATOM 298 CA ASP A 19 28.488 6.887 2.865 1.00 0.00 C ATOM 299 C ASP A 19 28.433 6.356 1.436 1.00 0.00 C ATOM 300 O ASP A 19 28.629 7.107 0.480 1.00 0.00 O ATOM 301 CB ASP A 19 29.775 7.698 3.064 1.00 0.00 C ATOM 302 CG ASP A 19 31.027 6.852 2.931 1.00 0.00 C ATOM 303 OD1 ASP A 19 31.414 6.201 3.927 1.00 0.00 O ATOM 304 OD2 ASP A 19 31.634 6.833 1.845 1.00 0.00 O ATOM 0 H ASP A 19 29.310 5.488 4.199 1.00 0.00 H new ATOM 0 HA ASP A 19 27.622 7.531 3.018 1.00 0.00 H new ATOM 0 HB2 ASP A 19 29.808 8.505 2.332 1.00 0.00 H new ATOM 0 HB3 ASP A 19 29.758 8.162 4.050 1.00 0.00 H new ATOM 309 N VAL A 20 28.147 5.074 1.287 1.00 0.00 N ATOM 310 CA VAL A 20 28.120 4.467 -0.031 1.00 0.00 C ATOM 311 C VAL A 20 26.695 4.394 -0.566 1.00 0.00 C ATOM 312 O VAL A 20 25.910 3.532 -0.173 1.00 0.00 O ATOM 313 CB VAL A 20 28.737 3.057 -0.032 1.00 0.00 C ATOM 314 CG1 VAL A 20 29.003 2.605 -1.458 1.00 0.00 C ATOM 315 CG2 VAL A 20 30.012 3.024 0.799 1.00 0.00 C ATOM 0 H VAL A 20 27.932 4.439 2.055 1.00 0.00 H new ATOM 0 HA VAL A 20 28.721 5.104 -0.680 1.00 0.00 H new ATOM 0 HB VAL A 20 28.028 2.365 0.422 1.00 0.00 H new ATOM 0 HG11 VAL A 20 29.440 1.606 -1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 20 28.066 2.586 -2.014 1.00 0.00 H new ATOM 0 HG13 VAL A 20 29.695 3.298 -1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 20 30.430 2.018 0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 20 30.736 3.724 0.382 1.00 0.00 H new ATOM 0 HG23 VAL A 20 29.784 3.307 1.827 1.00 0.00 H new ATOM 325 N GLN A 21 26.371 5.322 -1.449 1.00 0.00 N ATOM 326 CA GLN A 21 25.058 5.382 -2.071 1.00 0.00 C ATOM 327 C GLN A 21 25.198 5.324 -3.588 1.00 0.00 C ATOM 328 O GLN A 21 26.252 5.658 -4.133 1.00 0.00 O ATOM 329 CB GLN A 21 24.331 6.657 -1.643 1.00 0.00 C ATOM 330 CG GLN A 21 25.252 7.853 -1.512 1.00 0.00 C ATOM 331 CD GLN A 21 24.525 9.133 -1.160 1.00 0.00 C ATOM 332 OE1 GLN A 21 23.492 9.119 -0.491 1.00 0.00 O ATOM 333 NE2 GLN A 21 25.059 10.248 -1.621 1.00 0.00 N ATOM 0 H GLN A 21 27.010 6.056 -1.756 1.00 0.00 H new ATOM 0 HA GLN A 21 24.468 4.525 -1.745 1.00 0.00 H new ATOM 0 HB2 GLN A 21 23.551 6.885 -2.370 1.00 0.00 H new ATOM 0 HB3 GLN A 21 23.835 6.482 -0.688 1.00 0.00 H new ATOM 0 HG2 GLN A 21 25.999 7.645 -0.746 1.00 0.00 H new ATOM 0 HG3 GLN A 21 25.788 7.994 -2.450 1.00 0.00 H new ATOM 0 HE21 GLN A 21 25.917 10.213 -2.172 1.00 0.00 H new ATOM 0 HE22 GLN A 21 24.614 11.145 -1.427 1.00 0.00 H new ATOM 342 N ILE A 22 24.146 4.898 -4.269 1.00 0.00 N ATOM 343 CA ILE A 22 24.215 4.688 -5.707 1.00 0.00 C ATOM 344 C ILE A 22 23.127 5.469 -6.439 1.00 0.00 C ATOM 345 O ILE A 22 21.985 5.536 -5.982 1.00 0.00 O ATOM 346 CB ILE A 22 24.060 3.192 -6.069 1.00 0.00 C ATOM 347 CG1 ILE A 22 24.983 2.311 -5.232 1.00 0.00 C ATOM 348 CG2 ILE A 22 24.358 2.975 -7.540 1.00 0.00 C ATOM 349 CD1 ILE A 22 24.880 0.845 -5.598 1.00 0.00 C ATOM 0 H ILE A 22 23.238 4.692 -3.852 1.00 0.00 H new ATOM 0 HA ILE A 22 25.197 5.043 -6.021 1.00 0.00 H new ATOM 0 HB ILE A 22 23.029 2.910 -5.855 1.00 0.00 H new ATOM 0 HG12 ILE A 22 26.013 2.643 -5.363 1.00 0.00 H new ATOM 0 HG13 ILE A 22 24.740 2.436 -4.177 1.00 0.00 H new ATOM 0 HG21 ILE A 22 24.245 1.918 -7.782 1.00 0.00 H new ATOM 0 HG22 ILE A 22 23.664 3.561 -8.142 1.00 0.00 H new ATOM 0 HG23 ILE A 22 25.379 3.290 -7.755 1.00 0.00 H new ATOM 0 HD11 ILE A 22 25.558 0.265 -4.972 1.00 0.00 H new ATOM 0 HD12 ILE A 22 23.857 0.502 -5.441 1.00 0.00 H new ATOM 0 HD13 ILE A 22 25.150 0.712 -6.645 1.00 0.00 H new ATOM 361 N ASP A 23 23.498 6.070 -7.564 1.00 0.00 N ATOM 362 CA ASP A 23 22.552 6.684 -8.477 1.00 0.00 C ATOM 363 C ASP A 23 21.666 5.610 -9.136 1.00 0.00 C ATOM 364 O ASP A 23 22.002 4.423 -9.128 1.00 0.00 O ATOM 365 CB ASP A 23 23.349 7.483 -9.524 1.00 0.00 C ATOM 366 CG ASP A 23 22.688 7.563 -10.882 1.00 0.00 C ATOM 367 OD1 ASP A 23 22.885 6.637 -11.695 1.00 0.00 O ATOM 368 OD2 ASP A 23 21.989 8.555 -11.149 1.00 0.00 O ATOM 0 H ASP A 23 24.469 6.143 -7.866 1.00 0.00 H new ATOM 0 HA ASP A 23 21.885 7.359 -7.940 1.00 0.00 H new ATOM 0 HB2 ASP A 23 23.506 8.494 -9.149 1.00 0.00 H new ATOM 0 HB3 ASP A 23 24.333 7.029 -9.638 1.00 0.00 H new ATOM 373 N PHE A 24 20.545 6.047 -9.695 1.00 0.00 N ATOM 374 CA PHE A 24 19.545 5.176 -10.314 1.00 0.00 C ATOM 375 C PHE A 24 20.147 4.187 -11.319 1.00 0.00 C ATOM 376 O PHE A 24 19.692 3.046 -11.424 1.00 0.00 O ATOM 377 CB PHE A 24 18.493 6.051 -11.006 1.00 0.00 C ATOM 378 CG PHE A 24 17.506 5.293 -11.849 1.00 0.00 C ATOM 379 CD1 PHE A 24 16.466 4.592 -11.264 1.00 0.00 C ATOM 380 CD2 PHE A 24 17.615 5.295 -13.231 1.00 0.00 C ATOM 381 CE1 PHE A 24 15.554 3.906 -12.040 1.00 0.00 C ATOM 382 CE2 PHE A 24 16.707 4.610 -14.013 1.00 0.00 C ATOM 383 CZ PHE A 24 15.676 3.914 -13.417 1.00 0.00 C ATOM 0 H PHE A 24 20.297 7.036 -9.733 1.00 0.00 H new ATOM 0 HA PHE A 24 19.095 4.575 -9.524 1.00 0.00 H new ATOM 0 HB2 PHE A 24 17.948 6.611 -10.246 1.00 0.00 H new ATOM 0 HB3 PHE A 24 19.003 6.781 -11.635 1.00 0.00 H new ATOM 0 HD1 PHE A 24 16.367 4.582 -10.189 1.00 0.00 H new ATOM 0 HD2 PHE A 24 18.420 5.839 -13.702 1.00 0.00 H new ATOM 0 HE1 PHE A 24 14.746 3.363 -11.572 1.00 0.00 H new ATOM 0 HE2 PHE A 24 16.804 4.619 -15.089 1.00 0.00 H new ATOM 0 HZ PHE A 24 14.965 3.376 -14.026 1.00 0.00 H new ATOM 393 N TYR A 25 21.172 4.610 -12.042 1.00 0.00 N ATOM 394 CA TYR A 25 21.722 3.798 -13.121 1.00 0.00 C ATOM 395 C TYR A 25 22.744 2.782 -12.619 1.00 0.00 C ATOM 396 O TYR A 25 23.304 2.023 -13.413 1.00 0.00 O ATOM 397 CB TYR A 25 22.360 4.689 -14.189 1.00 0.00 C ATOM 398 CG TYR A 25 21.357 5.469 -15.008 1.00 0.00 C ATOM 399 CD1 TYR A 25 20.936 6.734 -14.616 1.00 0.00 C ATOM 400 CD2 TYR A 25 20.835 4.938 -16.179 1.00 0.00 C ATOM 401 CE1 TYR A 25 20.025 7.447 -15.370 1.00 0.00 C ATOM 402 CE2 TYR A 25 19.924 5.644 -16.939 1.00 0.00 C ATOM 403 CZ TYR A 25 19.521 6.896 -16.530 1.00 0.00 C ATOM 404 OH TYR A 25 18.619 7.606 -17.290 1.00 0.00 O ATOM 0 H TYR A 25 21.639 5.506 -11.904 1.00 0.00 H new ATOM 0 HA TYR A 25 20.891 3.243 -13.556 1.00 0.00 H new ATOM 0 HB2 TYR A 25 23.043 5.388 -13.706 1.00 0.00 H new ATOM 0 HB3 TYR A 25 22.958 4.069 -14.857 1.00 0.00 H new ATOM 0 HD1 TYR A 25 21.328 7.166 -13.707 1.00 0.00 H new ATOM 0 HD2 TYR A 25 21.147 3.956 -16.501 1.00 0.00 H new ATOM 0 HE1 TYR A 25 19.709 8.430 -15.054 1.00 0.00 H new ATOM 0 HE2 TYR A 25 19.530 5.217 -17.849 1.00 0.00 H new ATOM 0 HH TYR A 25 19.048 8.418 -17.633 1.00 0.00 H new ATOM 414 N GLY A 26 22.980 2.748 -11.314 1.00 0.00 N ATOM 415 CA GLY A 26 23.950 1.821 -10.780 1.00 0.00 C ATOM 416 C GLY A 26 25.348 2.393 -10.812 1.00 0.00 C ATOM 417 O GLY A 26 26.311 1.690 -11.120 1.00 0.00 O ATOM 0 H GLY A 26 22.520 3.341 -10.623 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.684 1.568 -9.754 1.00 0.00 H new ATOM 0 HA3 GLY A 26 23.923 0.895 -11.354 1.00 0.00 H new ATOM 421 N ASP A 27 25.458 3.677 -10.514 1.00 0.00 N ATOM 422 CA ASP A 27 26.752 4.336 -10.429 1.00 0.00 C ATOM 423 C ASP A 27 26.934 4.929 -9.041 1.00 0.00 C ATOM 424 O ASP A 27 26.064 5.650 -8.550 1.00 0.00 O ATOM 425 CB ASP A 27 26.871 5.426 -11.494 1.00 0.00 C ATOM 426 CG ASP A 27 28.236 6.081 -11.497 1.00 0.00 C ATOM 427 OD1 ASP A 27 29.241 5.371 -11.291 1.00 0.00 O ATOM 428 OD2 ASP A 27 28.312 7.306 -11.717 1.00 0.00 O ATOM 0 H ASP A 27 24.662 4.287 -10.326 1.00 0.00 H new ATOM 0 HA ASP A 27 27.536 3.600 -10.608 1.00 0.00 H new ATOM 0 HB2 ASP A 27 26.676 4.994 -12.476 1.00 0.00 H new ATOM 0 HB3 ASP A 27 26.107 6.184 -11.321 1.00 0.00 H new ATOM 433 N GLU A 28 28.050 4.606 -8.403 1.00 0.00 N ATOM 434 CA GLU A 28 28.299 5.042 -7.037 1.00 0.00 C ATOM 435 C GLU A 28 28.445 6.552 -6.950 1.00 0.00 C ATOM 436 O GLU A 28 29.261 7.157 -7.645 1.00 0.00 O ATOM 437 CB GLU A 28 29.540 4.366 -6.449 1.00 0.00 C ATOM 438 CG GLU A 28 29.273 2.985 -5.873 1.00 0.00 C ATOM 439 CD GLU A 28 29.077 1.917 -6.930 1.00 0.00 C ATOM 440 OE1 GLU A 28 27.971 1.815 -7.495 1.00 0.00 O ATOM 441 OE2 GLU A 28 30.039 1.168 -7.201 1.00 0.00 O ATOM 0 H GLU A 28 28.797 4.043 -8.810 1.00 0.00 H new ATOM 0 HA GLU A 28 27.430 4.744 -6.450 1.00 0.00 H new ATOM 0 HB2 GLU A 28 30.300 4.284 -7.226 1.00 0.00 H new ATOM 0 HB3 GLU A 28 29.952 5.002 -5.666 1.00 0.00 H new ATOM 0 HG2 GLU A 28 30.106 2.701 -5.231 1.00 0.00 H new ATOM 0 HG3 GLU A 28 28.385 3.028 -5.243 1.00 0.00 H new ATOM 448 N VAL A 29 27.647 7.145 -6.083 1.00 0.00 N ATOM 449 CA VAL A 29 27.675 8.576 -5.862 1.00 0.00 C ATOM 450 C VAL A 29 28.007 8.859 -4.408 1.00 0.00 C ATOM 451 O VAL A 29 27.156 8.729 -3.536 1.00 0.00 O ATOM 452 CB VAL A 29 26.323 9.229 -6.203 1.00 0.00 C ATOM 453 CG1 VAL A 29 26.389 10.730 -6.007 1.00 0.00 C ATOM 454 CG2 VAL A 29 25.905 8.896 -7.625 1.00 0.00 C ATOM 0 H VAL A 29 26.962 6.648 -5.513 1.00 0.00 H new ATOM 0 HA VAL A 29 28.436 9.000 -6.517 1.00 0.00 H new ATOM 0 HB VAL A 29 25.572 8.826 -5.523 1.00 0.00 H new ATOM 0 HG11 VAL A 29 25.424 11.172 -6.253 1.00 0.00 H new ATOM 0 HG12 VAL A 29 26.635 10.951 -4.968 1.00 0.00 H new ATOM 0 HG13 VAL A 29 27.156 11.149 -6.658 1.00 0.00 H new ATOM 0 HG21 VAL A 29 24.947 9.368 -7.843 1.00 0.00 H new ATOM 0 HG22 VAL A 29 26.658 9.265 -8.321 1.00 0.00 H new ATOM 0 HG23 VAL A 29 25.810 7.816 -7.733 1.00 0.00 H new ATOM 464 N THR A 30 29.244 9.230 -4.144 1.00 0.00 N ATOM 465 CA THR A 30 29.670 9.484 -2.783 1.00 0.00 C ATOM 466 C THR A 30 29.173 10.865 -2.334 1.00 0.00 C ATOM 467 O THR A 30 28.727 11.659 -3.164 1.00 0.00 O ATOM 468 CB THR A 30 31.204 9.374 -2.653 1.00 0.00 C ATOM 469 OG1 THR A 30 31.854 10.341 -3.488 1.00 0.00 O ATOM 470 CG2 THR A 30 31.667 7.971 -3.032 1.00 0.00 C ATOM 0 H THR A 30 29.968 9.362 -4.850 1.00 0.00 H new ATOM 0 HA THR A 30 29.234 8.727 -2.131 1.00 0.00 H new ATOM 0 HB THR A 30 31.473 9.571 -1.615 1.00 0.00 H new ATOM 0 HG1 THR A 30 31.356 10.437 -4.327 1.00 0.00 H new ATOM 0 HG21 THR A 30 32.751 7.907 -2.936 1.00 0.00 H new ATOM 0 HG22 THR A 30 31.200 7.242 -2.369 1.00 0.00 H new ATOM 0 HG23 THR A 30 31.381 7.759 -4.062 1.00 0.00 H new ATOM 478 N PRO A 31 29.227 11.172 -1.022 1.00 0.00 N ATOM 479 CA PRO A 31 28.662 12.418 -0.466 1.00 0.00 C ATOM 480 C PRO A 31 29.265 13.701 -1.044 1.00 0.00 C ATOM 481 O PRO A 31 28.742 14.785 -0.811 1.00 0.00 O ATOM 482 CB PRO A 31 28.970 12.320 1.034 1.00 0.00 C ATOM 483 CG PRO A 31 30.057 11.306 1.145 1.00 0.00 C ATOM 484 CD PRO A 31 29.819 10.330 0.031 1.00 0.00 C ATOM 0 HA PRO A 31 27.602 12.493 -0.708 1.00 0.00 H new ATOM 0 HB2 PRO A 31 29.287 13.283 1.434 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.088 12.015 1.598 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.038 11.772 1.054 1.00 0.00 H new ATOM 0 HG3 PRO A 31 30.030 10.808 2.114 1.00 0.00 H new ATOM 0 HD2 PRO A 31 30.745 9.861 -0.300 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.146 9.528 0.333 1.00 0.00 H new ATOM 492 N VAL A 32 30.351 13.584 -1.796 1.00 0.00 N ATOM 493 CA VAL A 32 30.997 14.759 -2.367 1.00 0.00 C ATOM 494 C VAL A 32 30.726 14.879 -3.867 1.00 0.00 C ATOM 495 O VAL A 32 31.301 15.737 -4.539 1.00 0.00 O ATOM 496 CB VAL A 32 32.522 14.751 -2.124 1.00 0.00 C ATOM 497 CG1 VAL A 32 32.829 14.788 -0.635 1.00 0.00 C ATOM 498 CG2 VAL A 32 33.162 13.536 -2.772 1.00 0.00 C ATOM 0 H VAL A 32 30.800 12.697 -2.024 1.00 0.00 H new ATOM 0 HA VAL A 32 30.565 15.621 -1.859 1.00 0.00 H new ATOM 0 HB VAL A 32 32.945 15.645 -2.582 1.00 0.00 H new ATOM 0 HG11 VAL A 32 33.909 14.782 -0.486 1.00 0.00 H new ATOM 0 HG12 VAL A 32 32.408 15.694 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 32 32.391 13.915 -0.151 1.00 0.00 H new ATOM 0 HG21 VAL A 32 34.236 13.550 -2.589 1.00 0.00 H new ATOM 0 HG22 VAL A 32 32.733 12.629 -2.347 1.00 0.00 H new ATOM 0 HG23 VAL A 32 32.977 13.556 -3.846 1.00 0.00 H new ATOM 508 N ASP A 33 29.844 14.028 -4.386 1.00 0.00 N ATOM 509 CA ASP A 33 29.498 14.061 -5.806 1.00 0.00 C ATOM 510 C ASP A 33 28.193 14.821 -6.027 1.00 0.00 C ATOM 511 O ASP A 33 27.355 14.910 -5.128 1.00 0.00 O ATOM 512 CB ASP A 33 29.375 12.645 -6.383 1.00 0.00 C ATOM 513 CG ASP A 33 30.701 11.911 -6.448 1.00 0.00 C ATOM 514 OD1 ASP A 33 31.627 12.401 -7.132 1.00 0.00 O ATOM 515 OD2 ASP A 33 30.825 10.832 -5.830 1.00 0.00 O ATOM 0 H ASP A 33 29.358 13.310 -3.848 1.00 0.00 H new ATOM 0 HA ASP A 33 30.305 14.578 -6.326 1.00 0.00 H new ATOM 0 HB2 ASP A 33 28.678 12.070 -5.773 1.00 0.00 H new ATOM 0 HB3 ASP A 33 28.949 12.703 -7.385 1.00 0.00 H new ATOM 520 N ASP A 34 28.034 15.371 -7.225 1.00 0.00 N ATOM 521 CA ASP A 34 26.840 16.138 -7.579 1.00 0.00 C ATOM 522 C ASP A 34 25.666 15.205 -7.866 1.00 0.00 C ATOM 523 O ASP A 34 25.674 14.490 -8.871 1.00 0.00 O ATOM 524 CB ASP A 34 27.095 17.003 -8.825 1.00 0.00 C ATOM 525 CG ASP A 34 28.218 18.009 -8.660 1.00 0.00 C ATOM 526 OD1 ASP A 34 29.386 17.648 -8.907 1.00 0.00 O ATOM 527 OD2 ASP A 34 27.940 19.171 -8.298 1.00 0.00 O ATOM 0 H ASP A 34 28.722 15.300 -7.975 1.00 0.00 H new ATOM 0 HA ASP A 34 26.601 16.780 -6.732 1.00 0.00 H new ATOM 0 HB2 ASP A 34 27.327 16.350 -9.666 1.00 0.00 H new ATOM 0 HB3 ASP A 34 26.178 17.536 -9.078 1.00 0.00 H new ATOM 532 N TYR A 35 24.656 15.208 -7.002 1.00 0.00 N ATOM 533 CA TYR A 35 23.476 14.389 -7.235 1.00 0.00 C ATOM 534 C TYR A 35 22.226 15.058 -6.685 1.00 0.00 C ATOM 535 O TYR A 35 22.300 16.047 -5.959 1.00 0.00 O ATOM 536 CB TYR A 35 23.639 12.998 -6.610 1.00 0.00 C ATOM 537 CG TYR A 35 23.651 12.985 -5.092 1.00 0.00 C ATOM 538 CD1 TYR A 35 24.819 13.231 -4.382 1.00 0.00 C ATOM 539 CD2 TYR A 35 22.491 12.712 -4.371 1.00 0.00 C ATOM 540 CE1 TYR A 35 24.833 13.210 -3.003 1.00 0.00 C ATOM 541 CE2 TYR A 35 22.497 12.691 -2.990 1.00 0.00 C ATOM 542 CZ TYR A 35 23.672 12.940 -2.313 1.00 0.00 C ATOM 543 OH TYR A 35 23.688 12.914 -0.939 1.00 0.00 O ATOM 0 H TYR A 35 24.632 15.761 -6.145 1.00 0.00 H new ATOM 0 HA TYR A 35 23.365 14.278 -8.314 1.00 0.00 H new ATOM 0 HB2 TYR A 35 22.827 12.360 -6.959 1.00 0.00 H new ATOM 0 HB3 TYR A 35 24.569 12.558 -6.971 1.00 0.00 H new ATOM 0 HD1 TYR A 35 25.732 13.442 -4.919 1.00 0.00 H new ATOM 0 HD2 TYR A 35 21.571 12.513 -4.901 1.00 0.00 H new ATOM 0 HE1 TYR A 35 25.750 13.404 -2.467 1.00 0.00 H new ATOM 0 HE2 TYR A 35 21.589 12.481 -2.445 1.00 0.00 H new ATOM 0 HH TYR A 35 23.815 13.823 -0.596 1.00 0.00 H new ATOM 553 N VAL A 36 21.085 14.514 -7.060 1.00 0.00 N ATOM 554 CA VAL A 36 19.800 14.950 -6.547 1.00 0.00 C ATOM 555 C VAL A 36 18.957 13.716 -6.261 1.00 0.00 C ATOM 556 O VAL A 36 19.128 12.685 -6.913 1.00 0.00 O ATOM 557 CB VAL A 36 19.080 15.882 -7.555 1.00 0.00 C ATOM 558 CG1 VAL A 36 17.651 16.181 -7.132 1.00 0.00 C ATOM 559 CG2 VAL A 36 19.847 17.182 -7.718 1.00 0.00 C ATOM 0 H VAL A 36 21.023 13.751 -7.734 1.00 0.00 H new ATOM 0 HA VAL A 36 19.949 15.523 -5.632 1.00 0.00 H new ATOM 0 HB VAL A 36 19.046 15.357 -8.510 1.00 0.00 H new ATOM 0 HG11 VAL A 36 17.184 16.837 -7.866 1.00 0.00 H new ATOM 0 HG12 VAL A 36 17.088 15.250 -7.068 1.00 0.00 H new ATOM 0 HG13 VAL A 36 17.655 16.671 -6.158 1.00 0.00 H new ATOM 0 HG21 VAL A 36 19.327 17.824 -8.429 1.00 0.00 H new ATOM 0 HG22 VAL A 36 19.915 17.688 -6.755 1.00 0.00 H new ATOM 0 HG23 VAL A 36 20.850 16.969 -8.087 1.00 0.00 H new ATOM 569 N ILE A 37 18.098 13.793 -5.261 1.00 0.00 N ATOM 570 CA ILE A 37 17.245 12.672 -4.926 1.00 0.00 C ATOM 571 C ILE A 37 15.815 12.948 -5.382 1.00 0.00 C ATOM 572 O ILE A 37 15.171 13.923 -4.943 1.00 0.00 O ATOM 573 CB ILE A 37 17.295 12.339 -3.418 1.00 0.00 C ATOM 574 CG1 ILE A 37 18.736 12.036 -2.997 1.00 0.00 C ATOM 575 CG2 ILE A 37 16.395 11.154 -3.099 1.00 0.00 C ATOM 576 CD1 ILE A 37 18.885 11.704 -1.526 1.00 0.00 C ATOM 0 H ILE A 37 17.974 14.616 -4.671 1.00 0.00 H new ATOM 0 HA ILE A 37 17.619 11.795 -5.455 1.00 0.00 H new ATOM 0 HB ILE A 37 16.935 13.203 -2.860 1.00 0.00 H new ATOM 0 HG12 ILE A 37 19.110 11.200 -3.588 1.00 0.00 H new ATOM 0 HG13 ILE A 37 19.362 12.897 -3.231 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.445 10.936 -2.032 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.367 11.393 -3.373 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.727 10.283 -3.663 1.00 0.00 H new ATOM 0 HD11 ILE A 37 19.933 11.501 -1.303 1.00 0.00 H new ATOM 0 HD12 ILE A 37 18.543 12.547 -0.926 1.00 0.00 H new ATOM 0 HD13 ILE A 37 18.287 10.824 -1.289 1.00 0.00 H new ATOM 588 N ASP A 38 15.342 12.090 -6.285 1.00 0.00 N ATOM 589 CA ASP A 38 14.026 12.242 -6.896 1.00 0.00 C ATOM 590 C ASP A 38 13.056 11.218 -6.337 1.00 0.00 C ATOM 591 O ASP A 38 12.934 10.107 -6.855 1.00 0.00 O ATOM 592 CB ASP A 38 14.087 12.082 -8.420 1.00 0.00 C ATOM 593 CG ASP A 38 14.656 13.289 -9.147 1.00 0.00 C ATOM 594 OD1 ASP A 38 15.608 13.907 -8.633 1.00 0.00 O ATOM 595 OD2 ASP A 38 14.136 13.617 -10.237 1.00 0.00 O ATOM 0 H ASP A 38 15.859 11.274 -6.611 1.00 0.00 H new ATOM 0 HA ASP A 38 13.681 13.249 -6.661 1.00 0.00 H new ATOM 0 HB2 ASP A 38 14.693 11.208 -8.659 1.00 0.00 H new ATOM 0 HB3 ASP A 38 13.082 11.886 -8.795 1.00 0.00 H new ATOM 600 N GLY A 39 12.415 11.574 -5.242 1.00 0.00 N ATOM 601 CA GLY A 39 11.347 10.753 -4.701 1.00 0.00 C ATOM 602 C GLY A 39 11.844 9.678 -3.756 1.00 0.00 C ATOM 603 O GLY A 39 11.050 9.005 -3.102 1.00 0.00 O ATOM 0 H GLY A 39 12.613 12.422 -4.710 1.00 0.00 H new ATOM 0 HA2 GLY A 39 10.637 11.391 -4.175 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.806 10.284 -5.523 1.00 0.00 H new ATOM 607 N GLY A 40 13.153 9.524 -3.670 1.00 0.00 N ATOM 608 CA GLY A 40 13.718 8.498 -2.820 1.00 0.00 C ATOM 609 C GLY A 40 14.946 7.868 -3.433 1.00 0.00 C ATOM 610 O GLY A 40 15.810 7.353 -2.724 1.00 0.00 O ATOM 0 H GLY A 40 13.836 10.090 -4.173 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.976 8.930 -1.853 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.969 7.728 -2.635 1.00 0.00 H new ATOM 614 N GLU A 41 15.028 7.905 -4.754 1.00 0.00 N ATOM 615 CA GLU A 41 16.187 7.375 -5.450 1.00 0.00 C ATOM 616 C GLU A 41 17.165 8.488 -5.795 1.00 0.00 C ATOM 617 O GLU A 41 16.788 9.653 -5.907 1.00 0.00 O ATOM 618 CB GLU A 41 15.779 6.616 -6.713 1.00 0.00 C ATOM 619 CG GLU A 41 15.041 5.323 -6.421 1.00 0.00 C ATOM 620 CD GLU A 41 14.714 4.542 -7.675 1.00 0.00 C ATOM 621 OE1 GLU A 41 13.843 4.994 -8.445 1.00 0.00 O ATOM 622 OE2 GLU A 41 15.311 3.464 -7.888 1.00 0.00 O ATOM 0 H GLU A 41 14.308 8.295 -5.362 1.00 0.00 H new ATOM 0 HA GLU A 41 16.681 6.673 -4.779 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.146 7.258 -7.326 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.671 6.394 -7.299 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.648 4.704 -5.760 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.118 5.549 -5.887 1.00 0.00 H new ATOM 629 N ILE A 42 18.416 8.106 -5.962 1.00 0.00 N ATOM 630 CA ILE A 42 19.501 9.041 -6.205 1.00 0.00 C ATOM 631 C ILE A 42 19.779 9.152 -7.692 1.00 0.00 C ATOM 632 O ILE A 42 19.763 8.154 -8.395 1.00 0.00 O ATOM 633 CB ILE A 42 20.779 8.563 -5.485 1.00 0.00 C ATOM 634 CG1 ILE A 42 20.514 8.478 -3.989 1.00 0.00 C ATOM 635 CG2 ILE A 42 21.957 9.488 -5.767 1.00 0.00 C ATOM 636 CD1 ILE A 42 21.625 7.826 -3.206 1.00 0.00 C ATOM 0 H ILE A 42 18.712 7.130 -5.933 1.00 0.00 H new ATOM 0 HA ILE A 42 19.207 10.018 -5.821 1.00 0.00 H new ATOM 0 HB ILE A 42 21.042 7.576 -5.865 1.00 0.00 H new ATOM 0 HG12 ILE A 42 20.352 9.484 -3.601 1.00 0.00 H new ATOM 0 HG13 ILE A 42 19.592 7.921 -3.825 1.00 0.00 H new ATOM 0 HG21 ILE A 42 22.841 9.122 -5.244 1.00 0.00 H new ATOM 0 HG22 ILE A 42 22.153 9.511 -6.839 1.00 0.00 H new ATOM 0 HG23 ILE A 42 21.721 10.494 -5.420 1.00 0.00 H new ATOM 0 HD11 ILE A 42 21.360 7.804 -2.149 1.00 0.00 H new ATOM 0 HD12 ILE A 42 21.774 6.807 -3.565 1.00 0.00 H new ATOM 0 HD13 ILE A 42 22.545 8.395 -3.338 1.00 0.00 H new ATOM 648 N ILE A 43 19.995 10.361 -8.176 1.00 0.00 N ATOM 649 CA ILE A 43 20.381 10.552 -9.562 1.00 0.00 C ATOM 650 C ILE A 43 21.579 11.478 -9.640 1.00 0.00 C ATOM 651 O ILE A 43 21.526 12.614 -9.159 1.00 0.00 O ATOM 652 CB ILE A 43 19.245 11.142 -10.436 1.00 0.00 C ATOM 653 CG1 ILE A 43 17.936 10.371 -10.257 1.00 0.00 C ATOM 654 CG2 ILE A 43 19.649 11.135 -11.903 1.00 0.00 C ATOM 655 CD1 ILE A 43 17.153 10.783 -9.033 1.00 0.00 C ATOM 0 H ILE A 43 19.910 11.221 -7.634 1.00 0.00 H new ATOM 0 HA ILE A 43 20.621 9.563 -9.953 1.00 0.00 H new ATOM 0 HB ILE A 43 19.080 12.169 -10.109 1.00 0.00 H new ATOM 0 HG12 ILE A 43 17.315 10.516 -11.141 1.00 0.00 H new ATOM 0 HG13 ILE A 43 18.157 9.306 -10.195 1.00 0.00 H new ATOM 0 HG21 ILE A 43 18.842 11.552 -12.505 1.00 0.00 H new ATOM 0 HG22 ILE A 43 20.548 11.736 -12.036 1.00 0.00 H new ATOM 0 HG23 ILE A 43 19.847 10.111 -12.221 1.00 0.00 H new ATOM 0 HD11 ILE A 43 16.238 10.194 -8.971 1.00 0.00 H new ATOM 0 HD12 ILE A 43 17.755 10.612 -8.141 1.00 0.00 H new ATOM 0 HD13 ILE A 43 16.900 11.841 -9.102 1.00 0.00 H new ATOM 667 N LEU A 44 22.671 10.983 -10.208 1.00 0.00 N ATOM 668 CA LEU A 44 23.820 11.823 -10.484 1.00 0.00 C ATOM 669 C LEU A 44 23.380 12.981 -11.381 1.00 0.00 C ATOM 670 O LEU A 44 22.628 12.787 -12.339 1.00 0.00 O ATOM 671 CB LEU A 44 24.930 10.994 -11.150 1.00 0.00 C ATOM 672 CG LEU A 44 26.367 11.486 -10.919 1.00 0.00 C ATOM 673 CD1 LEU A 44 27.361 10.407 -11.311 1.00 0.00 C ATOM 674 CD2 LEU A 44 26.653 12.756 -11.706 1.00 0.00 C ATOM 0 H LEU A 44 22.781 10.007 -10.484 1.00 0.00 H new ATOM 0 HA LEU A 44 24.221 12.228 -9.555 1.00 0.00 H new ATOM 0 HB2 LEU A 44 24.856 9.968 -10.790 1.00 0.00 H new ATOM 0 HB3 LEU A 44 24.743 10.969 -12.224 1.00 0.00 H new ATOM 0 HG LEU A 44 26.473 11.711 -9.858 1.00 0.00 H new ATOM 0 HD11 LEU A 44 28.375 10.768 -11.143 1.00 0.00 H new ATOM 0 HD12 LEU A 44 27.188 9.516 -10.707 1.00 0.00 H new ATOM 0 HD13 LEU A 44 27.234 10.161 -12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 44 27.678 13.077 -11.520 1.00 0.00 H new ATOM 0 HD22 LEU A 44 26.521 12.562 -12.770 1.00 0.00 H new ATOM 0 HD23 LEU A 44 25.965 13.541 -11.393 1.00 0.00 H new ATOM 686 N ARG A 45 23.856 14.180 -11.059 1.00 0.00 N ATOM 687 CA ARG A 45 23.450 15.416 -11.738 1.00 0.00 C ATOM 688 C ARG A 45 23.664 15.372 -13.249 1.00 0.00 C ATOM 689 O ARG A 45 23.132 16.213 -13.970 1.00 0.00 O ATOM 690 CB ARG A 45 24.229 16.593 -11.157 1.00 0.00 C ATOM 691 CG ARG A 45 23.569 17.260 -9.961 1.00 0.00 C ATOM 692 CD ARG A 45 22.497 18.249 -10.392 1.00 0.00 C ATOM 693 NE ARG A 45 22.934 19.087 -11.516 1.00 0.00 N ATOM 694 CZ ARG A 45 23.915 19.994 -11.457 1.00 0.00 C ATOM 695 NH1 ARG A 45 24.585 20.203 -10.327 1.00 0.00 N ATOM 696 NH2 ARG A 45 24.224 20.687 -12.542 1.00 0.00 N ATOM 0 H ARG A 45 24.539 14.327 -10.316 1.00 0.00 H new ATOM 0 HA ARG A 45 22.379 15.531 -11.569 1.00 0.00 H new ATOM 0 HB2 ARG A 45 25.219 16.246 -10.862 1.00 0.00 H new ATOM 0 HB3 ARG A 45 24.372 17.339 -11.939 1.00 0.00 H new ATOM 0 HG2 ARG A 45 23.126 16.499 -9.318 1.00 0.00 H new ATOM 0 HG3 ARG A 45 24.325 17.777 -9.369 1.00 0.00 H new ATOM 0 HD2 ARG A 45 21.596 17.705 -10.676 1.00 0.00 H new ATOM 0 HD3 ARG A 45 22.232 18.886 -9.548 1.00 0.00 H new ATOM 0 HE ARG A 45 22.454 18.968 -12.408 1.00 0.00 H new ATOM 0 HH11 ARG A 45 24.353 19.668 -9.490 1.00 0.00 H new ATOM 0 HH12 ARG A 45 25.331 20.898 -10.297 1.00 0.00 H new ATOM 0 HH21 ARG A 45 23.716 20.527 -13.412 1.00 0.00 H new ATOM 0 HH22 ARG A 45 24.970 21.381 -12.508 1.00 0.00 H new ATOM 710 N GLU A 46 24.424 14.397 -13.725 1.00 0.00 N ATOM 711 CA GLU A 46 24.709 14.299 -15.147 1.00 0.00 C ATOM 712 C GLU A 46 23.438 13.972 -15.919 1.00 0.00 C ATOM 713 O GLU A 46 23.017 14.720 -16.803 1.00 0.00 O ATOM 714 CB GLU A 46 25.754 13.221 -15.421 1.00 0.00 C ATOM 715 CG GLU A 46 26.181 13.168 -16.878 1.00 0.00 C ATOM 716 CD GLU A 46 26.574 11.779 -17.323 1.00 0.00 C ATOM 717 OE1 GLU A 46 27.719 11.362 -17.056 1.00 0.00 O ATOM 718 OE2 GLU A 46 25.738 11.097 -17.951 1.00 0.00 O ATOM 0 H GLU A 46 24.851 13.669 -13.153 1.00 0.00 H new ATOM 0 HA GLU A 46 25.099 15.262 -15.476 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.629 13.404 -14.798 1.00 0.00 H new ATOM 0 HB3 GLU A 46 25.352 12.250 -15.130 1.00 0.00 H new ATOM 0 HG2 GLU A 46 25.365 13.528 -17.504 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.022 13.845 -17.030 1.00 0.00 H new ATOM 725 N ASN A 47 22.811 12.862 -15.557 1.00 0.00 N ATOM 726 CA ASN A 47 21.663 12.368 -16.303 1.00 0.00 C ATOM 727 C ASN A 47 20.367 12.748 -15.598 1.00 0.00 C ATOM 728 O ASN A 47 19.279 12.333 -15.998 1.00 0.00 O ATOM 729 CB ASN A 47 21.757 10.852 -16.487 1.00 0.00 C ATOM 730 CG ASN A 47 20.913 10.351 -17.648 1.00 0.00 C ATOM 731 OD1 ASN A 47 19.748 9.999 -17.481 1.00 0.00 O ATOM 732 ND2 ASN A 47 21.493 10.330 -18.838 1.00 0.00 N ATOM 0 H ASN A 47 23.076 12.289 -14.756 1.00 0.00 H new ATOM 0 HA ASN A 47 21.664 12.832 -17.289 1.00 0.00 H new ATOM 0 HB2 ASN A 47 22.798 10.574 -16.652 1.00 0.00 H new ATOM 0 HB3 ASN A 47 21.437 10.358 -15.570 1.00 0.00 H new ATOM 0 HD21 ASN A 47 20.970 10.014 -19.655 1.00 0.00 H new ATOM 0 HD22 ASN A 47 22.463 10.630 -18.938 1.00 0.00 H new ATOM 739 N LEU A 48 20.495 13.568 -14.556 1.00 0.00 N ATOM 740 CA LEU A 48 19.340 14.095 -13.829 1.00 0.00 C ATOM 741 C LEU A 48 18.383 14.790 -14.791 1.00 0.00 C ATOM 742 O LEU A 48 17.174 14.834 -14.565 1.00 0.00 O ATOM 743 CB LEU A 48 19.804 15.079 -12.754 1.00 0.00 C ATOM 744 CG LEU A 48 18.688 15.696 -11.913 1.00 0.00 C ATOM 745 CD1 LEU A 48 18.046 14.647 -11.017 1.00 0.00 C ATOM 746 CD2 LEU A 48 19.224 16.854 -11.091 1.00 0.00 C ATOM 0 H LEU A 48 21.395 13.884 -14.194 1.00 0.00 H new ATOM 0 HA LEU A 48 18.818 13.266 -13.352 1.00 0.00 H new ATOM 0 HB2 LEU A 48 20.497 14.565 -12.088 1.00 0.00 H new ATOM 0 HB3 LEU A 48 20.361 15.883 -13.236 1.00 0.00 H new ATOM 0 HG LEU A 48 17.920 16.079 -12.585 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.254 15.108 -10.427 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.624 13.852 -11.632 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.799 14.229 -10.349 1.00 0.00 H new ATOM 0 HD21 LEU A 48 18.417 17.283 -10.497 1.00 0.00 H new ATOM 0 HD22 LEU A 48 20.011 16.496 -10.428 1.00 0.00 H new ATOM 0 HD23 LEU A 48 19.629 17.616 -11.757 1.00 0.00 H new ATOM 758 N GLU A 49 18.960 15.322 -15.866 1.00 0.00 N ATOM 759 CA GLU A 49 18.211 15.924 -16.970 1.00 0.00 C ATOM 760 C GLU A 49 16.981 15.087 -17.341 1.00 0.00 C ATOM 761 O GLU A 49 15.880 15.616 -17.491 1.00 0.00 O ATOM 762 CB GLU A 49 19.138 16.051 -18.186 1.00 0.00 C ATOM 763 CG GLU A 49 18.488 16.663 -19.416 1.00 0.00 C ATOM 764 CD GLU A 49 18.092 18.108 -19.211 1.00 0.00 C ATOM 765 OE1 GLU A 49 18.994 18.962 -19.072 1.00 0.00 O ATOM 766 OE2 GLU A 49 16.881 18.401 -19.205 1.00 0.00 O ATOM 0 H GLU A 49 19.971 15.348 -15.998 1.00 0.00 H new ATOM 0 HA GLU A 49 17.859 16.906 -16.655 1.00 0.00 H new ATOM 0 HB2 GLU A 49 20.000 16.657 -17.907 1.00 0.00 H new ATOM 0 HB3 GLU A 49 19.514 15.061 -18.445 1.00 0.00 H new ATOM 0 HG2 GLU A 49 19.178 16.596 -20.257 1.00 0.00 H new ATOM 0 HG3 GLU A 49 17.604 16.083 -19.681 1.00 0.00 H new ATOM 773 N ARG A 50 17.172 13.777 -17.457 1.00 0.00 N ATOM 774 CA ARG A 50 16.099 12.887 -17.886 1.00 0.00 C ATOM 775 C ARG A 50 15.071 12.688 -16.780 1.00 0.00 C ATOM 776 O ARG A 50 13.868 12.673 -17.037 1.00 0.00 O ATOM 777 CB ARG A 50 16.657 11.533 -18.343 1.00 0.00 C ATOM 778 CG ARG A 50 17.243 11.555 -19.749 1.00 0.00 C ATOM 779 CD ARG A 50 18.518 12.384 -19.832 1.00 0.00 C ATOM 780 NE ARG A 50 18.830 12.755 -21.210 1.00 0.00 N ATOM 781 CZ ARG A 50 20.059 12.961 -21.679 1.00 0.00 C ATOM 782 NH1 ARG A 50 21.121 12.778 -20.897 1.00 0.00 N ATOM 783 NH2 ARG A 50 20.222 13.347 -22.938 1.00 0.00 N ATOM 0 H ARG A 50 18.057 13.309 -17.261 1.00 0.00 H new ATOM 0 HA ARG A 50 15.601 13.360 -18.733 1.00 0.00 H new ATOM 0 HB2 ARG A 50 17.428 11.213 -17.642 1.00 0.00 H new ATOM 0 HB3 ARG A 50 15.861 10.790 -18.302 1.00 0.00 H new ATOM 0 HG2 ARG A 50 17.455 10.534 -20.068 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.504 11.959 -20.442 1.00 0.00 H new ATOM 0 HD2 ARG A 50 18.407 13.285 -19.228 1.00 0.00 H new ATOM 0 HD3 ARG A 50 19.349 11.818 -19.410 1.00 0.00 H new ATOM 0 HE ARG A 50 18.051 12.864 -21.859 1.00 0.00 H new ATOM 0 HH11 ARG A 50 20.997 12.478 -19.930 1.00 0.00 H new ATOM 0 HH12 ARG A 50 22.059 12.938 -21.265 1.00 0.00 H new ATOM 0 HH21 ARG A 50 19.409 13.484 -23.539 1.00 0.00 H new ATOM 0 HH22 ARG A 50 21.160 13.507 -23.305 1.00 0.00 H new ATOM 797 N TYR A 51 15.546 12.569 -15.547 1.00 0.00 N ATOM 798 CA TYR A 51 14.659 12.363 -14.408 1.00 0.00 C ATOM 799 C TYR A 51 13.781 13.589 -14.181 1.00 0.00 C ATOM 800 O TYR A 51 12.565 13.474 -13.990 1.00 0.00 O ATOM 801 CB TYR A 51 15.467 12.040 -13.151 1.00 0.00 C ATOM 802 CG TYR A 51 15.176 10.665 -12.593 1.00 0.00 C ATOM 803 CD1 TYR A 51 15.622 9.522 -13.240 1.00 0.00 C ATOM 804 CD2 TYR A 51 14.444 10.514 -11.423 1.00 0.00 C ATOM 805 CE1 TYR A 51 15.348 8.265 -12.736 1.00 0.00 C ATOM 806 CE2 TYR A 51 14.166 9.261 -10.911 1.00 0.00 C ATOM 807 CZ TYR A 51 14.619 8.141 -11.571 1.00 0.00 C ATOM 808 OH TYR A 51 14.343 6.890 -11.068 1.00 0.00 O ATOM 0 H TYR A 51 16.537 12.611 -15.310 1.00 0.00 H new ATOM 0 HA TYR A 51 14.011 11.515 -14.628 1.00 0.00 H new ATOM 0 HB2 TYR A 51 16.530 12.114 -13.381 1.00 0.00 H new ATOM 0 HB3 TYR A 51 15.253 12.788 -12.387 1.00 0.00 H new ATOM 0 HD1 TYR A 51 16.192 9.616 -14.152 1.00 0.00 H new ATOM 0 HD2 TYR A 51 14.086 11.391 -10.904 1.00 0.00 H new ATOM 0 HE1 TYR A 51 15.702 7.384 -13.251 1.00 0.00 H new ATOM 0 HE2 TYR A 51 13.597 9.161 -9.999 1.00 0.00 H new ATOM 0 HH TYR A 51 15.086 6.284 -11.271 1.00 0.00 H new ATOM 818 N LEU A 52 14.392 14.765 -14.241 1.00 0.00 N ATOM 819 CA LEU A 52 13.658 16.013 -14.082 1.00 0.00 C ATOM 820 C LEU A 52 12.729 16.246 -15.267 1.00 0.00 C ATOM 821 O LEU A 52 11.721 16.944 -15.156 1.00 0.00 O ATOM 822 CB LEU A 52 14.617 17.194 -13.932 1.00 0.00 C ATOM 823 CG LEU A 52 15.516 17.158 -12.696 1.00 0.00 C ATOM 824 CD1 LEU A 52 16.298 18.455 -12.573 1.00 0.00 C ATOM 825 CD2 LEU A 52 14.697 16.906 -11.440 1.00 0.00 C ATOM 0 H LEU A 52 15.393 14.881 -14.398 1.00 0.00 H new ATOM 0 HA LEU A 52 13.058 15.934 -13.175 1.00 0.00 H new ATOM 0 HB2 LEU A 52 15.249 17.241 -14.819 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.032 18.114 -13.908 1.00 0.00 H new ATOM 0 HG LEU A 52 16.223 16.336 -12.810 1.00 0.00 H new ATOM 0 HD11 LEU A 52 16.933 18.414 -11.688 1.00 0.00 H new ATOM 0 HD12 LEU A 52 16.918 18.592 -13.459 1.00 0.00 H new ATOM 0 HD13 LEU A 52 15.604 19.291 -12.483 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.357 16.884 -10.573 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.964 17.703 -11.318 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.182 15.949 -11.527 1.00 0.00 H new ATOM 837 N ARG A 53 13.063 15.653 -16.400 1.00 0.00 N ATOM 838 CA ARG A 53 12.246 15.796 -17.593 1.00 0.00 C ATOM 839 C ARG A 53 10.998 14.921 -17.507 1.00 0.00 C ATOM 840 O ARG A 53 9.969 15.229 -18.108 1.00 0.00 O ATOM 841 CB ARG A 53 13.062 15.450 -18.838 1.00 0.00 C ATOM 842 CG ARG A 53 12.340 15.738 -20.140 1.00 0.00 C ATOM 843 CD ARG A 53 13.306 15.774 -21.308 1.00 0.00 C ATOM 844 NE ARG A 53 14.373 16.746 -21.086 1.00 0.00 N ATOM 845 CZ ARG A 53 14.514 17.875 -21.775 1.00 0.00 C ATOM 846 NH1 ARG A 53 13.637 18.199 -22.721 1.00 0.00 N ATOM 847 NH2 ARG A 53 15.516 18.695 -21.492 1.00 0.00 N ATOM 0 H ARG A 53 13.891 15.070 -16.519 1.00 0.00 H new ATOM 0 HA ARG A 53 11.924 16.835 -17.666 1.00 0.00 H new ATOM 0 HB2 ARG A 53 13.995 16.013 -18.818 1.00 0.00 H new ATOM 0 HB3 ARG A 53 13.327 14.393 -18.806 1.00 0.00 H new ATOM 0 HG2 ARG A 53 11.582 14.974 -20.315 1.00 0.00 H new ATOM 0 HG3 ARG A 53 11.819 16.693 -20.066 1.00 0.00 H new ATOM 0 HD2 ARG A 53 13.738 14.784 -21.456 1.00 0.00 H new ATOM 0 HD3 ARG A 53 12.766 16.026 -22.221 1.00 0.00 H new ATOM 0 HE ARG A 53 15.055 16.546 -20.354 1.00 0.00 H new ATOM 0 HH11 ARG A 53 12.851 17.580 -22.921 1.00 0.00 H new ATOM 0 HH12 ARG A 53 13.750 19.066 -23.246 1.00 0.00 H new ATOM 0 HH21 ARG A 53 16.174 18.459 -20.749 1.00 0.00 H new ATOM 0 HH22 ARG A 53 15.629 19.562 -22.017 1.00 0.00 H new ATOM 861 N GLU A 54 11.079 13.836 -16.753 1.00 0.00 N ATOM 862 CA GLU A 54 9.950 12.926 -16.622 1.00 0.00 C ATOM 863 C GLU A 54 9.079 13.277 -15.423 1.00 0.00 C ATOM 864 O GLU A 54 7.942 13.718 -15.578 1.00 0.00 O ATOM 865 CB GLU A 54 10.421 11.486 -16.517 1.00 0.00 C ATOM 866 CG GLU A 54 11.101 10.972 -17.769 1.00 0.00 C ATOM 867 CD GLU A 54 11.078 9.465 -17.844 1.00 0.00 C ATOM 868 OE1 GLU A 54 9.976 8.898 -17.995 1.00 0.00 O ATOM 869 OE2 GLU A 54 12.152 8.841 -17.760 1.00 0.00 O ATOM 0 H GLU A 54 11.909 13.564 -16.225 1.00 0.00 H new ATOM 0 HA GLU A 54 9.346 13.035 -17.523 1.00 0.00 H new ATOM 0 HB2 GLU A 54 11.112 11.400 -15.678 1.00 0.00 H new ATOM 0 HB3 GLU A 54 9.565 10.849 -16.292 1.00 0.00 H new ATOM 0 HG2 GLU A 54 10.606 11.387 -18.647 1.00 0.00 H new ATOM 0 HG3 GLU A 54 12.133 11.321 -17.791 1.00 0.00 H new ATOM 876 N GLN A 55 9.606 13.050 -14.228 1.00 0.00 N ATOM 877 CA GLN A 55 8.843 13.278 -13.003 1.00 0.00 C ATOM 878 C GLN A 55 9.244 14.575 -12.319 1.00 0.00 C ATOM 879 O GLN A 55 8.475 15.130 -11.537 1.00 0.00 O ATOM 880 CB GLN A 55 8.984 12.100 -12.039 1.00 0.00 C ATOM 881 CG GLN A 55 10.417 11.656 -11.817 1.00 0.00 C ATOM 882 CD GLN A 55 10.893 10.675 -12.881 1.00 0.00 C ATOM 883 OE1 GLN A 55 12.062 10.653 -13.248 1.00 0.00 O ATOM 884 NE2 GLN A 55 9.985 9.853 -13.385 1.00 0.00 N ATOM 0 H GLN A 55 10.556 12.709 -14.078 1.00 0.00 H new ATOM 0 HA GLN A 55 7.796 13.366 -13.292 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.546 12.374 -11.079 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.408 11.258 -12.423 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.069 12.530 -11.815 1.00 0.00 H new ATOM 0 HG3 GLN A 55 10.503 11.192 -10.835 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.020 9.897 -13.058 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.251 9.176 -14.100 1.00 0.00 H new ATOM 893 N LEU A 56 10.462 15.038 -12.601 1.00 0.00 N ATOM 894 CA LEU A 56 10.958 16.309 -12.074 1.00 0.00 C ATOM 895 C LEU A 56 11.124 16.254 -10.552 1.00 0.00 C ATOM 896 O LEU A 56 10.766 17.187 -9.848 1.00 0.00 O ATOM 897 CB LEU A 56 10.012 17.455 -12.485 1.00 0.00 C ATOM 898 CG LEU A 56 10.476 18.875 -12.132 1.00 0.00 C ATOM 899 CD1 LEU A 56 11.777 19.213 -12.839 1.00 0.00 C ATOM 900 CD2 LEU A 56 9.399 19.888 -12.490 1.00 0.00 C ATOM 0 H LEU A 56 11.128 14.547 -13.197 1.00 0.00 H new ATOM 0 HA LEU A 56 11.943 16.497 -12.502 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.858 17.403 -13.563 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.043 17.284 -12.016 1.00 0.00 H new ATOM 0 HG LEU A 56 10.653 18.917 -11.057 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.084 20.224 -12.572 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.550 18.507 -12.536 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.632 19.151 -13.917 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.743 20.890 -12.234 1.00 0.00 H new ATOM 0 HD22 LEU A 56 9.193 19.837 -13.559 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.489 19.663 -11.934 1.00 0.00 H new ATOM 912 N GLY A 57 11.675 15.159 -10.048 1.00 0.00 N ATOM 913 CA GLY A 57 11.970 15.067 -8.625 1.00 0.00 C ATOM 914 C GLY A 57 10.819 14.539 -7.795 1.00 0.00 C ATOM 915 O GLY A 57 11.012 14.094 -6.659 1.00 0.00 O ATOM 0 H GLY A 57 11.924 14.334 -10.593 1.00 0.00 H new ATOM 0 HA2 GLY A 57 12.835 14.419 -8.484 1.00 0.00 H new ATOM 0 HA3 GLY A 57 12.248 16.054 -8.257 1.00 0.00 H new ATOM 919 N PHE A 58 9.620 14.583 -8.347 1.00 0.00 N ATOM 920 CA PHE A 58 8.438 14.165 -7.612 1.00 0.00 C ATOM 921 C PHE A 58 8.038 12.754 -7.997 1.00 0.00 C ATOM 922 O PHE A 58 8.038 12.404 -9.173 1.00 0.00 O ATOM 923 CB PHE A 58 7.254 15.088 -7.907 1.00 0.00 C ATOM 924 CG PHE A 58 7.597 16.545 -7.950 1.00 0.00 C ATOM 925 CD1 PHE A 58 7.671 17.292 -6.788 1.00 0.00 C ATOM 926 CD2 PHE A 58 7.830 17.167 -9.162 1.00 0.00 C ATOM 927 CE1 PHE A 58 7.974 18.637 -6.837 1.00 0.00 C ATOM 928 CE2 PHE A 58 8.136 18.512 -9.215 1.00 0.00 C ATOM 929 CZ PHE A 58 8.206 19.246 -8.050 1.00 0.00 C ATOM 0 H PHE A 58 9.438 14.903 -9.298 1.00 0.00 H new ATOM 0 HA PHE A 58 8.688 14.209 -6.552 1.00 0.00 H new ATOM 0 HB2 PHE A 58 6.817 14.802 -8.864 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.489 14.930 -7.147 1.00 0.00 H new ATOM 0 HD1 PHE A 58 7.490 16.818 -5.834 1.00 0.00 H new ATOM 0 HD2 PHE A 58 7.772 16.595 -10.076 1.00 0.00 H new ATOM 0 HE1 PHE A 58 8.029 19.212 -5.924 1.00 0.00 H new ATOM 0 HE2 PHE A 58 8.320 18.988 -10.167 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.443 20.299 -8.089 1.00 0.00 H new ATOM 939 N GLU A 59 7.690 11.942 -7.017 1.00 0.00 N ATOM 940 CA GLU A 59 7.046 10.686 -7.320 1.00 0.00 C ATOM 941 C GLU A 59 5.542 10.907 -7.268 1.00 0.00 C ATOM 942 O GLU A 59 4.952 11.020 -6.190 1.00 0.00 O ATOM 943 CB GLU A 59 7.464 9.564 -6.364 1.00 0.00 C ATOM 944 CG GLU A 59 7.066 8.187 -6.876 1.00 0.00 C ATOM 945 CD GLU A 59 7.498 7.051 -5.970 1.00 0.00 C ATOM 946 OE1 GLU A 59 8.690 6.975 -5.624 1.00 0.00 O ATOM 947 OE2 GLU A 59 6.646 6.200 -5.637 1.00 0.00 O ATOM 0 H GLU A 59 7.840 12.127 -6.025 1.00 0.00 H new ATOM 0 HA GLU A 59 7.355 10.362 -8.314 1.00 0.00 H new ATOM 0 HB2 GLU A 59 8.544 9.597 -6.220 1.00 0.00 H new ATOM 0 HB3 GLU A 59 7.007 9.732 -5.389 1.00 0.00 H new ATOM 0 HG2 GLU A 59 5.983 8.153 -6.996 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.501 8.037 -7.864 1.00 0.00 H new ATOM 954 N PHE A 60 4.944 11.024 -8.444 1.00 0.00 N ATOM 955 CA PHE A 60 3.526 11.302 -8.567 1.00 0.00 C ATOM 956 C PHE A 60 2.725 10.048 -8.268 1.00 0.00 C ATOM 957 O PHE A 60 2.489 9.217 -9.147 1.00 0.00 O ATOM 958 CB PHE A 60 3.213 11.819 -9.971 1.00 0.00 C ATOM 959 CG PHE A 60 2.313 13.020 -9.981 1.00 0.00 C ATOM 960 CD1 PHE A 60 2.806 14.266 -9.627 1.00 0.00 C ATOM 961 CD2 PHE A 60 0.982 12.907 -10.345 1.00 0.00 C ATOM 962 CE1 PHE A 60 1.988 15.377 -9.634 1.00 0.00 C ATOM 963 CE2 PHE A 60 0.158 14.015 -10.354 1.00 0.00 C ATOM 964 CZ PHE A 60 0.662 15.253 -10.000 1.00 0.00 C ATOM 0 H PHE A 60 5.429 10.929 -9.336 1.00 0.00 H new ATOM 0 HA PHE A 60 3.248 12.071 -7.846 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.147 12.071 -10.473 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.746 11.020 -10.548 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.843 14.368 -9.342 1.00 0.00 H new ATOM 0 HD2 PHE A 60 0.584 11.943 -10.625 1.00 0.00 H new ATOM 0 HE1 PHE A 60 2.384 16.342 -9.354 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.879 13.915 -10.637 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.020 16.121 -10.010 1.00 0.00 H new ATOM 974 N LYS A 61 2.341 9.906 -7.014 1.00 0.00 N ATOM 975 CA LYS A 61 1.653 8.718 -6.556 1.00 0.00 C ATOM 976 C LYS A 61 0.150 8.914 -6.514 1.00 0.00 C ATOM 977 O LYS A 61 -0.373 10.009 -6.744 1.00 0.00 O ATOM 978 CB LYS A 61 2.141 8.325 -5.160 1.00 0.00 C ATOM 979 CG LYS A 61 3.446 7.552 -5.144 1.00 0.00 C ATOM 980 CD LYS A 61 3.274 6.158 -5.726 1.00 0.00 C ATOM 981 CE LYS A 61 3.935 5.113 -4.842 1.00 0.00 C ATOM 982 NZ LYS A 61 3.959 3.772 -5.480 1.00 0.00 N ATOM 0 H LYS A 61 2.497 10.607 -6.289 1.00 0.00 H new ATOM 0 HA LYS A 61 1.878 7.925 -7.269 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.262 9.229 -4.563 1.00 0.00 H new ATOM 0 HB3 LYS A 61 1.371 7.724 -4.676 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.199 8.095 -5.715 1.00 0.00 H new ATOM 0 HG3 LYS A 61 3.814 7.478 -4.121 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.213 5.932 -5.831 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.708 6.121 -6.725 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.955 5.424 -4.615 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.402 5.053 -3.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.419 3.092 -4.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.985 3.462 -5.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 4.490 3.822 -6.373 1.00 0.00 H new ATOM 996 N ASN A 62 -0.522 7.822 -6.227 1.00 0.00 N ATOM 997 CA ASN A 62 -1.943 7.806 -5.974 1.00 0.00 C ATOM 998 C ASN A 62 -2.183 6.891 -4.788 1.00 0.00 C ATOM 999 O ASN A 62 -1.237 6.287 -4.281 1.00 0.00 O ATOM 1000 CB ASN A 62 -2.719 7.308 -7.204 1.00 0.00 C ATOM 1001 CG ASN A 62 -2.353 5.886 -7.613 1.00 0.00 C ATOM 1002 OD1 ASN A 62 -1.219 5.439 -7.442 1.00 0.00 O ATOM 1003 ND2 ASN A 62 -3.318 5.160 -8.156 1.00 0.00 N ATOM 0 H ASN A 62 -0.086 6.902 -6.162 1.00 0.00 H new ATOM 0 HA ASN A 62 -2.297 8.815 -5.761 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.788 7.355 -6.994 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.529 7.980 -8.041 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.132 4.200 -8.446 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -4.247 5.561 -8.284 1.00 0.00 H new ATOM 1010 N ALA A 63 -3.422 6.802 -4.336 1.00 0.00 N ATOM 1011 CA ALA A 63 -3.768 5.893 -3.253 1.00 0.00 C ATOM 1012 C ALA A 63 -3.384 4.459 -3.599 1.00 0.00 C ATOM 1013 O ALA A 63 -2.908 3.712 -2.744 1.00 0.00 O ATOM 1014 CB ALA A 63 -5.253 5.971 -2.953 1.00 0.00 C ATOM 0 H ALA A 63 -4.204 7.346 -4.700 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.208 6.196 -2.368 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.497 5.286 -2.141 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -5.512 6.988 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.819 5.695 -3.843 1.00 0.00 H new ATOM 1020 N GLN A 64 -3.578 4.101 -4.868 1.00 0.00 N ATOM 1021 CA GLN A 64 -3.350 2.742 -5.341 1.00 0.00 C ATOM 1022 C GLN A 64 -4.193 1.786 -4.507 1.00 0.00 C ATOM 1023 O GLN A 64 -3.697 0.801 -3.955 1.00 0.00 O ATOM 1024 CB GLN A 64 -1.859 2.374 -5.270 1.00 0.00 C ATOM 1025 CG GLN A 64 -1.396 1.437 -6.382 1.00 0.00 C ATOM 1026 CD GLN A 64 -2.112 0.098 -6.383 1.00 0.00 C ATOM 1027 OE1 GLN A 64 -3.151 -0.066 -7.023 1.00 0.00 O ATOM 1028 NE2 GLN A 64 -1.559 -0.870 -5.671 1.00 0.00 N ATOM 0 H GLN A 64 -3.897 4.745 -5.592 1.00 0.00 H new ATOM 0 HA GLN A 64 -3.646 2.667 -6.387 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -1.268 3.289 -5.310 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -1.657 1.906 -4.307 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -1.551 1.924 -7.345 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -0.324 1.267 -6.280 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -0.697 -0.695 -5.154 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -1.994 -1.792 -5.639 1.00 0.00 H new ATOM 1037 N LEU A 65 -5.475 2.111 -4.403 1.00 0.00 N ATOM 1038 CA LEU A 65 -6.408 1.309 -3.636 1.00 0.00 C ATOM 1039 C LEU A 65 -6.667 -0.016 -4.336 1.00 0.00 C ATOM 1040 O LEU A 65 -7.567 -0.126 -5.173 1.00 0.00 O ATOM 1041 CB LEU A 65 -7.722 2.071 -3.426 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.814 1.308 -2.670 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -8.352 0.953 -1.265 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -10.095 2.126 -2.622 1.00 0.00 C ATOM 0 H LEU A 65 -5.891 2.931 -4.845 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.969 1.104 -2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -7.505 2.992 -2.884 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.114 2.360 -4.401 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.016 0.379 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.144 0.412 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.462 0.327 -1.322 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -8.119 1.866 -0.717 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.861 1.570 -2.082 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.905 3.071 -2.113 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.438 2.324 -3.637 1.00 0.00 H new ATOM 1056 N GLU A 66 -5.848 -1.008 -4.024 1.00 0.00 N ATOM 1057 CA GLU A 66 -6.027 -2.338 -4.571 1.00 0.00 C ATOM 1058 C GLU A 66 -7.159 -3.043 -3.837 1.00 0.00 C ATOM 1059 O GLU A 66 -6.942 -3.761 -2.860 1.00 0.00 O ATOM 1060 CB GLU A 66 -4.731 -3.149 -4.478 1.00 0.00 C ATOM 1061 CG GLU A 66 -4.811 -4.508 -5.156 1.00 0.00 C ATOM 1062 CD GLU A 66 -5.186 -4.408 -6.620 1.00 0.00 C ATOM 1063 OE1 GLU A 66 -6.394 -4.414 -6.930 1.00 0.00 O ATOM 1064 OE2 GLU A 66 -4.275 -4.318 -7.468 1.00 0.00 O ATOM 0 H GLU A 66 -5.052 -0.914 -3.393 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.286 -2.252 -5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.921 -2.575 -4.928 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.476 -3.291 -3.428 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -3.849 -5.012 -5.065 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.545 -5.125 -4.638 1.00 0.00 H new ATOM 1071 N HIS A 67 -8.374 -2.786 -4.289 1.00 0.00 N ATOM 1072 CA HIS A 67 -9.553 -3.372 -3.687 1.00 0.00 C ATOM 1073 C HIS A 67 -10.452 -3.948 -4.768 1.00 0.00 C ATOM 1074 O HIS A 67 -11.107 -3.211 -5.505 1.00 0.00 O ATOM 1075 CB HIS A 67 -10.312 -2.328 -2.860 1.00 0.00 C ATOM 1076 CG HIS A 67 -11.498 -2.882 -2.128 1.00 0.00 C ATOM 1077 ND1 HIS A 67 -12.789 -2.786 -2.600 1.00 0.00 N ATOM 1078 CD2 HIS A 67 -11.581 -3.540 -0.949 1.00 0.00 C ATOM 1079 CE1 HIS A 67 -13.613 -3.360 -1.744 1.00 0.00 C ATOM 1080 NE2 HIS A 67 -12.907 -3.826 -0.732 1.00 0.00 N ATOM 0 H HIS A 67 -8.568 -2.169 -5.078 1.00 0.00 H new ATOM 0 HA HIS A 67 -9.243 -4.175 -3.019 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -9.627 -1.882 -2.139 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -10.646 -1.527 -3.520 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -10.757 -3.794 -0.298 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -14.685 -3.436 -1.854 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -13.284 -4.318 0.078 1.00 0.00 H new ATOM 1089 N HIS A 68 -10.456 -5.263 -4.874 1.00 0.00 N ATOM 1090 CA HIS A 68 -11.308 -5.947 -5.830 1.00 0.00 C ATOM 1091 C HIS A 68 -12.750 -5.929 -5.348 1.00 0.00 C ATOM 1092 O HIS A 68 -13.001 -5.912 -4.142 1.00 0.00 O ATOM 1093 CB HIS A 68 -10.836 -7.388 -6.043 1.00 0.00 C ATOM 1094 CG HIS A 68 -9.517 -7.484 -6.746 1.00 0.00 C ATOM 1095 ND1 HIS A 68 -8.308 -7.316 -6.108 1.00 0.00 N ATOM 1096 CD2 HIS A 68 -9.224 -7.725 -8.044 1.00 0.00 C ATOM 1097 CE1 HIS A 68 -7.330 -7.445 -6.983 1.00 0.00 C ATOM 1098 NE2 HIS A 68 -7.860 -7.696 -8.162 1.00 0.00 N ATOM 0 H HIS A 68 -9.876 -5.882 -4.307 1.00 0.00 H new ATOM 0 HA HIS A 68 -11.247 -5.424 -6.785 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -10.761 -7.885 -5.076 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -11.587 -7.927 -6.620 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.933 -7.906 -8.838 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -6.275 -7.359 -6.769 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -7.338 -7.845 -9.025 1.00 0.00 H new ATOM 1107 N HIS A 69 -13.677 -5.937 -6.302 1.00 0.00 N ATOM 1108 CA HIS A 69 -15.112 -5.847 -6.027 1.00 0.00 C ATOM 1109 C HIS A 69 -15.499 -4.445 -5.577 1.00 0.00 C ATOM 1110 O HIS A 69 -15.181 -4.013 -4.471 1.00 0.00 O ATOM 1111 CB HIS A 69 -15.573 -6.885 -4.995 1.00 0.00 C ATOM 1112 CG HIS A 69 -15.607 -8.283 -5.525 1.00 0.00 C ATOM 1113 ND1 HIS A 69 -16.686 -8.796 -6.213 1.00 0.00 N ATOM 1114 CD2 HIS A 69 -14.691 -9.278 -5.470 1.00 0.00 C ATOM 1115 CE1 HIS A 69 -16.431 -10.044 -6.554 1.00 0.00 C ATOM 1116 NE2 HIS A 69 -15.227 -10.362 -6.118 1.00 0.00 N ATOM 0 H HIS A 69 -13.454 -6.007 -7.295 1.00 0.00 H new ATOM 0 HA HIS A 69 -15.623 -6.067 -6.964 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -14.907 -6.848 -4.133 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -16.568 -6.616 -4.641 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -13.719 -9.228 -5.003 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -17.097 -10.697 -7.099 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -14.770 -11.265 -6.242 1.00 0.00 H new ATOM 1125 N HIS A 70 -16.196 -3.740 -6.456 1.00 0.00 N ATOM 1126 CA HIS A 70 -16.633 -2.377 -6.181 1.00 0.00 C ATOM 1127 C HIS A 70 -18.024 -2.406 -5.564 1.00 0.00 C ATOM 1128 O HIS A 70 -18.430 -1.484 -4.855 1.00 0.00 O ATOM 1129 CB HIS A 70 -16.651 -1.541 -7.466 1.00 0.00 C ATOM 1130 CG HIS A 70 -15.365 -1.584 -8.235 1.00 0.00 C ATOM 1131 ND1 HIS A 70 -15.309 -1.835 -9.586 1.00 0.00 N ATOM 1132 CD2 HIS A 70 -14.082 -1.421 -7.833 1.00 0.00 C ATOM 1133 CE1 HIS A 70 -14.053 -1.826 -9.981 1.00 0.00 C ATOM 1134 NE2 HIS A 70 -13.284 -1.579 -8.937 1.00 0.00 N ATOM 0 H HIS A 70 -16.473 -4.092 -7.372 1.00 0.00 H new ATOM 0 HA HIS A 70 -15.931 -1.919 -5.484 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -17.459 -1.895 -8.107 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -16.877 -0.505 -7.211 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -13.749 -1.206 -6.828 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -13.709 -1.993 -10.991 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -12.266 -1.516 -8.949 1.00 0.00 H new ATOM 1143 N HIS A 71 -18.745 -3.480 -5.849 1.00 0.00 N ATOM 1144 CA HIS A 71 -20.079 -3.686 -5.313 1.00 0.00 C ATOM 1145 C HIS A 71 -20.354 -5.177 -5.205 1.00 0.00 C ATOM 1146 O HIS A 71 -19.990 -5.946 -6.094 1.00 0.00 O ATOM 1147 CB HIS A 71 -21.134 -3.022 -6.211 1.00 0.00 C ATOM 1148 CG HIS A 71 -22.544 -3.178 -5.715 1.00 0.00 C ATOM 1149 ND1 HIS A 71 -23.381 -4.197 -6.123 1.00 0.00 N ATOM 1150 CD2 HIS A 71 -23.263 -2.437 -4.839 1.00 0.00 C ATOM 1151 CE1 HIS A 71 -24.550 -4.074 -5.521 1.00 0.00 C ATOM 1152 NE2 HIS A 71 -24.505 -3.014 -4.736 1.00 0.00 N ATOM 0 H HIS A 71 -18.421 -4.232 -6.458 1.00 0.00 H new ATOM 0 HA HIS A 71 -20.136 -3.230 -4.324 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -20.906 -1.960 -6.298 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -21.063 -3.446 -7.212 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -22.923 -1.555 -4.317 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -25.399 -4.729 -5.649 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -25.268 -2.678 -4.149 1.00 0.00 H new ATOM 1161 N HIS A 72 -20.974 -5.584 -4.115 1.00 0.00 N ATOM 1162 CA HIS A 72 -21.365 -6.970 -3.945 1.00 0.00 C ATOM 1163 C HIS A 72 -22.750 -7.034 -3.324 1.00 0.00 C ATOM 1164 O HIS A 72 -23.719 -7.268 -4.067 1.00 0.00 O ATOM 1165 CB HIS A 72 -20.351 -7.724 -3.080 1.00 0.00 C ATOM 1166 CG HIS A 72 -20.679 -9.176 -2.920 1.00 0.00 C ATOM 1167 ND1 HIS A 72 -21.219 -9.700 -1.770 1.00 0.00 N ATOM 1168 CD2 HIS A 72 -20.560 -10.210 -3.784 1.00 0.00 C ATOM 1169 CE1 HIS A 72 -21.418 -10.994 -1.931 1.00 0.00 C ATOM 1170 NE2 HIS A 72 -21.027 -11.332 -3.148 1.00 0.00 N ATOM 1171 OXT HIS A 72 -22.856 -6.814 -2.101 1.00 0.00 O ATOM 0 H HIS A 72 -21.218 -4.975 -3.334 1.00 0.00 H new ATOM 0 HA HIS A 72 -21.388 -7.451 -4.923 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -19.361 -7.628 -3.525 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -20.304 -7.258 -2.096 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -20.169 -10.161 -4.790 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -21.831 -11.665 -1.192 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -21.066 -12.270 -3.547 1.00 0.00 H new TER 1180 HIS A 72 ATOM 1181 N MET B 1 18.799 -26.612 -6.978 1.00 0.00 N ATOM 1182 CA MET B 1 18.593 -26.830 -5.528 1.00 0.00 C ATOM 1183 C MET B 1 18.928 -25.558 -4.764 1.00 0.00 C ATOM 1184 O MET B 1 18.061 -24.951 -4.137 1.00 0.00 O ATOM 1185 CB MET B 1 19.464 -27.985 -5.017 1.00 0.00 C ATOM 1186 CG MET B 1 19.151 -29.333 -5.650 1.00 0.00 C ATOM 1187 SD MET B 1 19.585 -29.411 -7.400 1.00 0.00 S ATOM 1188 CE MET B 1 19.123 -31.099 -7.782 1.00 0.00 C ATOM 0 H1 MET B 1 18.904 -27.530 -7.456 1.00 0.00 H new ATOM 0 H2 MET B 1 17.980 -26.108 -7.373 1.00 0.00 H new ATOM 0 H3 MET B 1 19.658 -26.045 -7.125 1.00 0.00 H new ATOM 0 HA MET B 1 17.547 -27.090 -5.366 1.00 0.00 H new ATOM 0 HB2 MET B 1 20.511 -27.744 -5.202 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.341 -28.067 -3.937 1.00 0.00 H new ATOM 0 HG2 MET B 1 19.690 -30.114 -5.113 1.00 0.00 H new ATOM 0 HG3 MET B 1 18.088 -29.543 -5.536 1.00 0.00 H new ATOM 0 HE1 MET B 1 19.331 -31.304 -8.832 1.00 0.00 H new ATOM 0 HE2 MET B 1 19.697 -31.784 -7.158 1.00 0.00 H new ATOM 0 HE3 MET B 1 18.059 -31.238 -7.589 1.00 0.00 H new ATOM 1200 N VAL B 2 20.189 -25.154 -4.826 1.00 0.00 N ATOM 1201 CA VAL B 2 20.626 -23.917 -4.206 1.00 0.00 C ATOM 1202 C VAL B 2 21.454 -23.099 -5.198 1.00 0.00 C ATOM 1203 O VAL B 2 22.653 -23.316 -5.374 1.00 0.00 O ATOM 1204 CB VAL B 2 21.415 -24.172 -2.893 1.00 0.00 C ATOM 1205 CG1 VAL B 2 22.559 -25.154 -3.107 1.00 0.00 C ATOM 1206 CG2 VAL B 2 21.927 -22.865 -2.303 1.00 0.00 C ATOM 0 H VAL B 2 20.929 -25.670 -5.303 1.00 0.00 H new ATOM 0 HA VAL B 2 19.739 -23.346 -3.933 1.00 0.00 H new ATOM 0 HB VAL B 2 20.725 -24.622 -2.180 1.00 0.00 H new ATOM 0 HG11 VAL B 2 23.088 -25.307 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL B 2 22.161 -26.106 -3.459 1.00 0.00 H new ATOM 0 HG13 VAL B 2 23.249 -24.753 -3.850 1.00 0.00 H new ATOM 0 HG21 VAL B 2 22.476 -23.071 -1.384 1.00 0.00 H new ATOM 0 HG22 VAL B 2 22.588 -22.377 -3.019 1.00 0.00 H new ATOM 0 HG23 VAL B 2 21.084 -22.210 -2.083 1.00 0.00 H new ATOM 1216 N GLU B 3 20.785 -22.193 -5.887 1.00 0.00 N ATOM 1217 CA GLU B 3 21.438 -21.345 -6.868 1.00 0.00 C ATOM 1218 C GLU B 3 21.802 -20.018 -6.230 1.00 0.00 C ATOM 1219 O GLU B 3 22.963 -19.613 -6.222 1.00 0.00 O ATOM 1220 CB GLU B 3 20.520 -21.132 -8.070 1.00 0.00 C ATOM 1221 CG GLU B 3 20.166 -22.423 -8.787 1.00 0.00 C ATOM 1222 CD GLU B 3 19.088 -22.231 -9.831 1.00 0.00 C ATOM 1223 OE1 GLU B 3 19.375 -21.634 -10.887 1.00 0.00 O ATOM 1224 OE2 GLU B 3 17.944 -22.681 -9.598 1.00 0.00 O ATOM 0 H GLU B 3 19.784 -22.025 -5.785 1.00 0.00 H new ATOM 0 HA GLU B 3 22.350 -21.829 -7.216 1.00 0.00 H new ATOM 0 HB2 GLU B 3 19.603 -20.645 -7.737 1.00 0.00 H new ATOM 0 HB3 GLU B 3 21.004 -20.454 -8.773 1.00 0.00 H new ATOM 0 HG2 GLU B 3 21.060 -22.827 -9.263 1.00 0.00 H new ATOM 0 HG3 GLU B 3 19.832 -23.160 -8.057 1.00 0.00 H new ATOM 1231 N ASN B 4 20.799 -19.353 -5.683 1.00 0.00 N ATOM 1232 CA ASN B 4 21.016 -18.128 -4.935 1.00 0.00 C ATOM 1233 C ASN B 4 20.719 -18.375 -3.464 1.00 0.00 C ATOM 1234 O ASN B 4 19.570 -18.622 -3.090 1.00 0.00 O ATOM 1235 CB ASN B 4 20.134 -16.984 -5.456 1.00 0.00 C ATOM 1236 CG ASN B 4 20.547 -16.481 -6.827 1.00 0.00 C ATOM 1237 OD1 ASN B 4 21.026 -17.239 -7.672 1.00 0.00 O ATOM 1238 ND2 ASN B 4 20.355 -15.194 -7.064 1.00 0.00 N ATOM 0 H ASN B 4 19.823 -19.643 -5.744 1.00 0.00 H new ATOM 0 HA ASN B 4 22.057 -17.832 -5.063 1.00 0.00 H new ATOM 0 HB2 ASN B 4 19.099 -17.323 -5.498 1.00 0.00 H new ATOM 0 HB3 ASN B 4 20.169 -16.156 -4.748 1.00 0.00 H new ATOM 0 HD21 ASN B 4 20.606 -14.799 -7.970 1.00 0.00 H new ATOM 0 HD22 ASN B 4 19.956 -14.596 -6.340 1.00 0.00 H new ATOM 1245 N PRO B 5 21.754 -18.348 -2.614 1.00 0.00 N ATOM 1246 CA PRO B 5 21.598 -18.557 -1.175 1.00 0.00 C ATOM 1247 C PRO B 5 20.811 -17.424 -0.530 1.00 0.00 C ATOM 1248 O PRO B 5 21.343 -16.338 -0.299 1.00 0.00 O ATOM 1249 CB PRO B 5 23.038 -18.584 -0.641 1.00 0.00 C ATOM 1250 CG PRO B 5 23.906 -18.739 -1.846 1.00 0.00 C ATOM 1251 CD PRO B 5 23.156 -18.112 -2.984 1.00 0.00 C ATOM 0 HA PRO B 5 21.045 -19.469 -0.952 1.00 0.00 H new ATOM 0 HB2 PRO B 5 23.274 -17.666 -0.102 1.00 0.00 H new ATOM 0 HB3 PRO B 5 23.183 -19.409 0.056 1.00 0.00 H new ATOM 0 HG2 PRO B 5 24.869 -18.250 -1.698 1.00 0.00 H new ATOM 0 HG3 PRO B 5 24.110 -19.791 -2.046 1.00 0.00 H new ATOM 0 HD2 PRO B 5 23.377 -17.049 -3.078 1.00 0.00 H new ATOM 0 HD3 PRO B 5 23.407 -18.575 -3.938 1.00 0.00 H new ATOM 1259 N MET B 6 19.537 -17.672 -0.258 1.00 0.00 N ATOM 1260 CA MET B 6 18.673 -16.647 0.305 1.00 0.00 C ATOM 1261 C MET B 6 18.925 -16.500 1.802 1.00 0.00 C ATOM 1262 O MET B 6 18.184 -17.034 2.627 1.00 0.00 O ATOM 1263 CB MET B 6 17.197 -16.960 0.038 1.00 0.00 C ATOM 1264 CG MET B 6 16.251 -15.847 0.468 1.00 0.00 C ATOM 1265 SD MET B 6 14.516 -16.249 0.181 1.00 0.00 S ATOM 1266 CE MET B 6 14.309 -17.659 1.267 1.00 0.00 C ATOM 0 H MET B 6 19.082 -18.571 -0.418 1.00 0.00 H new ATOM 0 HA MET B 6 18.910 -15.702 -0.183 1.00 0.00 H new ATOM 0 HB2 MET B 6 17.061 -17.150 -1.027 1.00 0.00 H new ATOM 0 HB3 MET B 6 16.928 -17.877 0.562 1.00 0.00 H new ATOM 0 HG2 MET B 6 16.400 -15.640 1.528 1.00 0.00 H new ATOM 0 HG3 MET B 6 16.502 -14.935 -0.074 1.00 0.00 H new ATOM 0 HE1 MET B 6 13.250 -17.802 1.479 1.00 0.00 H new ATOM 0 HE2 MET B 6 14.706 -18.552 0.784 1.00 0.00 H new ATOM 0 HE3 MET B 6 14.845 -17.482 2.199 1.00 0.00 H new ATOM 1276 N VAL B 7 20.001 -15.810 2.137 1.00 0.00 N ATOM 1277 CA VAL B 7 20.327 -15.523 3.521 1.00 0.00 C ATOM 1278 C VAL B 7 19.732 -14.177 3.924 1.00 0.00 C ATOM 1279 O VAL B 7 20.021 -13.144 3.316 1.00 0.00 O ATOM 1280 CB VAL B 7 21.859 -15.541 3.761 1.00 0.00 C ATOM 1281 CG1 VAL B 7 22.587 -14.625 2.786 1.00 0.00 C ATOM 1282 CG2 VAL B 7 22.187 -15.162 5.199 1.00 0.00 C ATOM 0 H VAL B 7 20.668 -15.436 1.462 1.00 0.00 H new ATOM 0 HA VAL B 7 19.893 -16.305 4.144 1.00 0.00 H new ATOM 0 HB VAL B 7 22.207 -16.559 3.585 1.00 0.00 H new ATOM 0 HG11 VAL B 7 23.658 -14.662 2.983 1.00 0.00 H new ATOM 0 HG12 VAL B 7 22.394 -14.954 1.765 1.00 0.00 H new ATOM 0 HG13 VAL B 7 22.230 -13.603 2.912 1.00 0.00 H new ATOM 0 HG21 VAL B 7 23.267 -15.182 5.343 1.00 0.00 H new ATOM 0 HG22 VAL B 7 21.811 -14.160 5.406 1.00 0.00 H new ATOM 0 HG23 VAL B 7 21.717 -15.873 5.879 1.00 0.00 H new ATOM 1292 N ILE B 8 18.870 -14.197 4.927 1.00 0.00 N ATOM 1293 CA ILE B 8 18.202 -12.986 5.376 1.00 0.00 C ATOM 1294 C ILE B 8 19.063 -12.246 6.397 1.00 0.00 C ATOM 1295 O ILE B 8 19.113 -12.611 7.572 1.00 0.00 O ATOM 1296 CB ILE B 8 16.815 -13.293 5.981 1.00 0.00 C ATOM 1297 CG1 ILE B 8 15.968 -14.094 4.984 1.00 0.00 C ATOM 1298 CG2 ILE B 8 16.105 -11.999 6.366 1.00 0.00 C ATOM 1299 CD1 ILE B 8 14.615 -14.516 5.523 1.00 0.00 C ATOM 0 H ILE B 8 18.616 -15.038 5.446 1.00 0.00 H new ATOM 0 HA ILE B 8 18.057 -12.350 4.503 1.00 0.00 H new ATOM 0 HB ILE B 8 16.951 -13.892 6.882 1.00 0.00 H new ATOM 0 HG12 ILE B 8 15.819 -13.495 4.086 1.00 0.00 H new ATOM 0 HG13 ILE B 8 16.522 -14.984 4.685 1.00 0.00 H new ATOM 0 HG21 ILE B 8 15.129 -12.232 6.791 1.00 0.00 H new ATOM 0 HG22 ILE B 8 16.702 -11.461 7.102 1.00 0.00 H new ATOM 0 HG23 ILE B 8 15.976 -11.377 5.480 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.078 -15.077 4.758 1.00 0.00 H new ATOM 0 HD12 ILE B 8 14.754 -15.143 6.403 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.040 -13.631 5.795 1.00 0.00 H new ATOM 1311 N ASN B 9 19.762 -11.227 5.925 1.00 0.00 N ATOM 1312 CA ASN B 9 20.614 -10.406 6.777 1.00 0.00 C ATOM 1313 C ASN B 9 20.357 -8.935 6.494 1.00 0.00 C ATOM 1314 O ASN B 9 21.223 -8.087 6.707 1.00 0.00 O ATOM 1315 CB ASN B 9 22.090 -10.733 6.534 1.00 0.00 C ATOM 1316 CG ASN B 9 22.760 -11.362 7.741 1.00 0.00 C ATOM 1317 OD1 ASN B 9 23.287 -10.666 8.609 1.00 0.00 O ATOM 1318 ND2 ASN B 9 22.753 -12.685 7.803 1.00 0.00 N ATOM 0 H ASN B 9 19.757 -10.944 4.945 1.00 0.00 H new ATOM 0 HA ASN B 9 20.378 -10.620 7.819 1.00 0.00 H new ATOM 0 HB2 ASN B 9 22.172 -11.411 5.684 1.00 0.00 H new ATOM 0 HB3 ASN B 9 22.620 -9.819 6.265 1.00 0.00 H new ATOM 0 HD21 ASN B 9 23.195 -13.161 8.590 1.00 0.00 H new ATOM 0 HD22 ASN B 9 22.306 -13.228 7.064 1.00 0.00 H new ATOM 1325 N ASN B 10 19.156 -8.647 6.003 1.00 0.00 N ATOM 1326 CA ASN B 10 18.760 -7.282 5.676 1.00 0.00 C ATOM 1327 C ASN B 10 18.829 -6.396 6.914 1.00 0.00 C ATOM 1328 O ASN B 10 18.359 -6.778 7.988 1.00 0.00 O ATOM 1329 CB ASN B 10 17.345 -7.267 5.086 1.00 0.00 C ATOM 1330 CG ASN B 10 16.914 -5.886 4.625 1.00 0.00 C ATOM 1331 OD1 ASN B 10 17.738 -5.059 4.243 1.00 0.00 O ATOM 1332 ND2 ASN B 10 15.613 -5.632 4.645 1.00 0.00 N ATOM 0 H ASN B 10 18.436 -9.346 5.822 1.00 0.00 H new ATOM 0 HA ASN B 10 19.452 -6.888 4.932 1.00 0.00 H new ATOM 0 HB2 ASN B 10 17.300 -7.957 4.243 1.00 0.00 H new ATOM 0 HB3 ASN B 10 16.641 -7.632 5.834 1.00 0.00 H new ATOM 0 HD21 ASN B 10 15.266 -4.724 4.336 1.00 0.00 H new ATOM 0 HD22 ASN B 10 14.959 -6.345 4.969 1.00 0.00 H new ATOM 1339 N TRP B 11 19.410 -5.213 6.754 1.00 0.00 N ATOM 1340 CA TRP B 11 19.666 -4.320 7.879 1.00 0.00 C ATOM 1341 C TRP B 11 18.394 -3.601 8.341 1.00 0.00 C ATOM 1342 O TRP B 11 18.197 -2.412 8.096 1.00 0.00 O ATOM 1343 CB TRP B 11 20.790 -3.319 7.540 1.00 0.00 C ATOM 1344 CG TRP B 11 20.539 -2.442 6.337 1.00 0.00 C ATOM 1345 CD1 TRP B 11 19.795 -2.736 5.228 1.00 0.00 C ATOM 1346 CD2 TRP B 11 21.061 -1.124 6.125 1.00 0.00 C ATOM 1347 NE1 TRP B 11 19.812 -1.681 4.352 1.00 0.00 N ATOM 1348 CE2 TRP B 11 20.584 -0.680 4.877 1.00 0.00 C ATOM 1349 CE3 TRP B 11 21.882 -0.275 6.873 1.00 0.00 C ATOM 1350 CZ2 TRP B 11 20.904 0.575 4.362 1.00 0.00 C ATOM 1351 CZ3 TRP B 11 22.199 0.969 6.361 1.00 0.00 C ATOM 1352 CH2 TRP B 11 21.709 1.384 5.117 1.00 0.00 C ATOM 0 H TRP B 11 19.714 -4.848 5.851 1.00 0.00 H new ATOM 0 HA TRP B 11 20.002 -4.934 8.715 1.00 0.00 H new ATOM 0 HB2 TRP B 11 20.956 -2.679 8.406 1.00 0.00 H new ATOM 0 HB3 TRP B 11 21.712 -3.877 7.375 1.00 0.00 H new ATOM 0 HD1 TRP B 11 19.270 -3.665 5.065 1.00 0.00 H new ATOM 0 HE1 TRP B 11 19.328 -1.648 3.455 1.00 0.00 H new ATOM 0 HE3 TRP B 11 22.262 -0.586 7.835 1.00 0.00 H new ATOM 0 HZ2 TRP B 11 20.530 0.897 3.401 1.00 0.00 H new ATOM 0 HZ3 TRP B 11 22.835 1.631 6.930 1.00 0.00 H new ATOM 0 HH2 TRP B 11 21.972 2.363 4.745 1.00 0.00 H new ATOM 1363 N HIS B 12 17.521 -4.359 8.991 1.00 0.00 N ATOM 1364 CA HIS B 12 16.310 -3.822 9.600 1.00 0.00 C ATOM 1365 C HIS B 12 15.688 -4.881 10.499 1.00 0.00 C ATOM 1366 O HIS B 12 15.018 -5.799 10.024 1.00 0.00 O ATOM 1367 CB HIS B 12 15.304 -3.365 8.537 1.00 0.00 C ATOM 1368 CG HIS B 12 14.911 -1.924 8.677 1.00 0.00 C ATOM 1369 ND1 HIS B 12 13.606 -1.485 8.608 1.00 0.00 N ATOM 1370 CD2 HIS B 12 15.665 -0.815 8.868 1.00 0.00 C ATOM 1371 CE1 HIS B 12 13.578 -0.172 8.748 1.00 0.00 C ATOM 1372 NE2 HIS B 12 14.814 0.260 8.906 1.00 0.00 N ATOM 0 H HIS B 12 17.632 -5.366 9.111 1.00 0.00 H new ATOM 0 HA HIS B 12 16.577 -2.948 10.194 1.00 0.00 H new ATOM 0 HB2 HIS B 12 15.733 -3.523 7.548 1.00 0.00 H new ATOM 0 HB3 HIS B 12 14.411 -3.986 8.600 1.00 0.00 H new ATOM 0 HD2 HIS B 12 16.740 -0.783 8.971 1.00 0.00 H new ATOM 0 HE1 HIS B 12 12.691 0.445 8.735 1.00 0.00 H new ATOM 0 HE2 HIS B 12 15.091 1.233 9.035 1.00 0.00 H new ATOM 1381 N ASP B 13 15.914 -4.742 11.797 1.00 0.00 N ATOM 1382 CA ASP B 13 15.540 -5.766 12.772 1.00 0.00 C ATOM 1383 C ASP B 13 14.070 -5.656 13.189 1.00 0.00 C ATOM 1384 O ASP B 13 13.731 -5.795 14.365 1.00 0.00 O ATOM 1385 CB ASP B 13 16.462 -5.684 13.999 1.00 0.00 C ATOM 1386 CG ASP B 13 16.432 -4.331 14.691 1.00 0.00 C ATOM 1387 OD1 ASP B 13 16.905 -3.336 14.096 1.00 0.00 O ATOM 1388 OD2 ASP B 13 15.963 -4.263 15.845 1.00 0.00 O ATOM 0 H ASP B 13 16.360 -3.921 12.207 1.00 0.00 H new ATOM 0 HA ASP B 13 15.663 -6.739 12.296 1.00 0.00 H new ATOM 0 HB2 ASP B 13 16.173 -6.455 14.713 1.00 0.00 H new ATOM 0 HB3 ASP B 13 17.484 -5.903 13.691 1.00 0.00 H new ATOM 1393 N LYS B 14 13.203 -5.456 12.195 1.00 0.00 N ATOM 1394 CA LYS B 14 11.751 -5.405 12.395 1.00 0.00 C ATOM 1395 C LYS B 14 11.354 -4.331 13.412 1.00 0.00 C ATOM 1396 O LYS B 14 12.108 -3.389 13.664 1.00 0.00 O ATOM 1397 CB LYS B 14 11.208 -6.768 12.856 1.00 0.00 C ATOM 1398 CG LYS B 14 11.557 -7.933 11.940 1.00 0.00 C ATOM 1399 CD LYS B 14 12.665 -8.790 12.531 1.00 0.00 C ATOM 1400 CE LYS B 14 12.936 -10.022 11.684 1.00 0.00 C ATOM 1401 NZ LYS B 14 13.892 -10.949 12.343 1.00 0.00 N ATOM 0 H LYS B 14 13.488 -5.324 11.224 1.00 0.00 H new ATOM 0 HA LYS B 14 11.311 -5.149 11.431 1.00 0.00 H new ATOM 0 HB2 LYS B 14 11.594 -6.979 13.853 1.00 0.00 H new ATOM 0 HB3 LYS B 14 10.123 -6.702 12.941 1.00 0.00 H new ATOM 0 HG2 LYS B 14 10.671 -8.545 11.774 1.00 0.00 H new ATOM 0 HG3 LYS B 14 11.869 -7.552 10.967 1.00 0.00 H new ATOM 0 HD2 LYS B 14 13.577 -8.199 12.615 1.00 0.00 H new ATOM 0 HD3 LYS B 14 12.389 -9.096 13.540 1.00 0.00 H new ATOM 0 HE2 LYS B 14 11.998 -10.544 11.492 1.00 0.00 H new ATOM 0 HE3 LYS B 14 13.335 -9.717 10.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 14.050 -11.776 11.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 14.795 -10.460 12.503 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 13.501 -11.261 13.255 1.00 0.00 H new ATOM 1415 N LEU B 15 10.136 -4.470 13.944 1.00 0.00 N ATOM 1416 CA LEU B 15 9.616 -3.597 15.002 1.00 0.00 C ATOM 1417 C LEU B 15 9.522 -2.141 14.547 1.00 0.00 C ATOM 1418 O LEU B 15 9.424 -1.223 15.364 1.00 0.00 O ATOM 1419 CB LEU B 15 10.469 -3.722 16.271 1.00 0.00 C ATOM 1420 CG LEU B 15 10.503 -5.129 16.878 1.00 0.00 C ATOM 1421 CD1 LEU B 15 11.332 -5.147 18.151 1.00 0.00 C ATOM 1422 CD2 LEU B 15 9.091 -5.626 17.154 1.00 0.00 C ATOM 0 H LEU B 15 9.480 -5.194 13.652 1.00 0.00 H new ATOM 0 HA LEU B 15 8.603 -3.927 15.231 1.00 0.00 H new ATOM 0 HB2 LEU B 15 11.489 -3.415 16.040 1.00 0.00 H new ATOM 0 HB3 LEU B 15 10.089 -3.026 17.019 1.00 0.00 H new ATOM 0 HG LEU B 15 10.971 -5.800 16.157 1.00 0.00 H new ATOM 0 HD11 LEU B 15 11.342 -6.156 18.564 1.00 0.00 H new ATOM 0 HD12 LEU B 15 12.352 -4.837 17.925 1.00 0.00 H new ATOM 0 HD13 LEU B 15 10.897 -4.461 18.878 1.00 0.00 H new ATOM 0 HD21 LEU B 15 9.135 -6.626 17.585 1.00 0.00 H new ATOM 0 HD22 LEU B 15 8.598 -4.951 17.854 1.00 0.00 H new ATOM 0 HD23 LEU B 15 8.527 -5.657 16.222 1.00 0.00 H new ATOM 1434 N THR B 16 9.522 -1.944 13.240 1.00 0.00 N ATOM 1435 CA THR B 16 9.346 -0.630 12.654 1.00 0.00 C ATOM 1436 C THR B 16 7.947 -0.512 12.061 1.00 0.00 C ATOM 1437 O THR B 16 7.170 -1.468 12.123 1.00 0.00 O ATOM 1438 CB THR B 16 10.410 -0.374 11.569 1.00 0.00 C ATOM 1439 OG1 THR B 16 10.688 -1.592 10.860 1.00 0.00 O ATOM 1440 CG2 THR B 16 11.694 0.161 12.184 1.00 0.00 C ATOM 0 H THR B 16 9.644 -2.691 12.557 1.00 0.00 H new ATOM 0 HA THR B 16 9.466 0.121 13.435 1.00 0.00 H new ATOM 0 HB THR B 16 10.019 0.372 10.877 1.00 0.00 H new ATOM 0 HG1 THR B 16 11.364 -1.422 10.171 1.00 0.00 H new ATOM 0 HG21 THR B 16 12.429 0.334 11.398 1.00 0.00 H new ATOM 0 HG22 THR B 16 11.487 1.099 12.700 1.00 0.00 H new ATOM 0 HG23 THR B 16 12.087 -0.565 12.895 1.00 0.00 H new ATOM 1448 N GLU B 17 7.621 0.652 11.509 1.00 0.00 N ATOM 1449 CA GLU B 17 6.317 0.866 10.892 1.00 0.00 C ATOM 1450 C GLU B 17 6.059 -0.175 9.805 1.00 0.00 C ATOM 1451 O GLU B 17 6.809 -0.272 8.831 1.00 0.00 O ATOM 1452 CB GLU B 17 6.203 2.277 10.299 1.00 0.00 C ATOM 1453 CG GLU B 17 6.266 3.400 11.327 1.00 0.00 C ATOM 1454 CD GLU B 17 7.670 3.663 11.831 1.00 0.00 C ATOM 1455 OE1 GLU B 17 8.403 4.431 11.174 1.00 0.00 O ATOM 1456 OE2 GLU B 17 8.053 3.096 12.874 1.00 0.00 O ATOM 0 H GLU B 17 8.241 1.461 11.476 1.00 0.00 H new ATOM 0 HA GLU B 17 5.564 0.761 11.673 1.00 0.00 H new ATOM 0 HB2 GLU B 17 7.005 2.419 9.574 1.00 0.00 H new ATOM 0 HB3 GLU B 17 5.263 2.353 9.753 1.00 0.00 H new ATOM 0 HG2 GLU B 17 5.868 4.313 10.884 1.00 0.00 H new ATOM 0 HG3 GLU B 17 5.624 3.149 12.171 1.00 0.00 H new ATOM 1463 N THR B 18 5.002 -0.953 9.999 1.00 0.00 N ATOM 1464 CA THR B 18 4.629 -2.017 9.076 1.00 0.00 C ATOM 1465 C THR B 18 4.455 -1.492 7.653 1.00 0.00 C ATOM 1466 O THR B 18 5.194 -1.872 6.741 1.00 0.00 O ATOM 1467 CB THR B 18 3.326 -2.693 9.539 1.00 0.00 C ATOM 1468 OG1 THR B 18 2.382 -1.690 9.944 1.00 0.00 O ATOM 1469 CG2 THR B 18 3.585 -3.647 10.695 1.00 0.00 C ATOM 0 H THR B 18 4.379 -0.864 10.801 1.00 0.00 H new ATOM 0 HA THR B 18 5.439 -2.747 9.073 1.00 0.00 H new ATOM 0 HB THR B 18 2.922 -3.267 8.705 1.00 0.00 H new ATOM 0 HG1 THR B 18 1.552 -2.121 10.237 1.00 0.00 H new ATOM 0 HG21 THR B 18 2.647 -4.110 11.002 1.00 0.00 H new ATOM 0 HG22 THR B 18 4.285 -4.420 10.379 1.00 0.00 H new ATOM 0 HG23 THR B 18 4.008 -3.095 11.534 1.00 0.00 H new ATOM 1477 N ASP B 19 3.474 -0.625 7.469 1.00 0.00 N ATOM 1478 CA ASP B 19 3.232 0.000 6.176 1.00 0.00 C ATOM 1479 C ASP B 19 2.796 1.440 6.396 1.00 0.00 C ATOM 1480 O ASP B 19 2.200 2.079 5.531 1.00 0.00 O ATOM 1481 CB ASP B 19 2.156 -0.777 5.413 1.00 0.00 C ATOM 1482 CG ASP B 19 2.254 -0.600 3.909 1.00 0.00 C ATOM 1483 OD1 ASP B 19 3.228 -1.109 3.313 1.00 0.00 O ATOM 1484 OD2 ASP B 19 1.346 0.011 3.310 1.00 0.00 O ATOM 0 H ASP B 19 2.827 -0.335 8.203 1.00 0.00 H new ATOM 0 HA ASP B 19 4.146 -0.011 5.583 1.00 0.00 H new ATOM 0 HB2 ASP B 19 2.240 -1.836 5.655 1.00 0.00 H new ATOM 0 HB3 ASP B 19 1.172 -0.450 5.749 1.00 0.00 H new ATOM 1489 N VAL B 20 3.117 1.951 7.577 1.00 0.00 N ATOM 1490 CA VAL B 20 2.702 3.284 7.973 1.00 0.00 C ATOM 1491 C VAL B 20 3.732 4.327 7.552 1.00 0.00 C ATOM 1492 O VAL B 20 4.717 4.568 8.252 1.00 0.00 O ATOM 1493 CB VAL B 20 2.471 3.377 9.496 1.00 0.00 C ATOM 1494 CG1 VAL B 20 1.965 4.757 9.884 1.00 0.00 C ATOM 1495 CG2 VAL B 20 1.501 2.298 9.957 1.00 0.00 C ATOM 0 H VAL B 20 3.667 1.456 8.279 1.00 0.00 H new ATOM 0 HA VAL B 20 1.759 3.487 7.464 1.00 0.00 H new ATOM 0 HB VAL B 20 3.426 3.215 9.995 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.810 4.798 10.962 1.00 0.00 H new ATOM 0 HG12 VAL B 20 2.700 5.509 9.595 1.00 0.00 H new ATOM 0 HG13 VAL B 20 1.022 4.956 9.374 1.00 0.00 H new ATOM 0 HG21 VAL B 20 1.351 2.380 11.033 1.00 0.00 H new ATOM 0 HG22 VAL B 20 0.546 2.425 9.447 1.00 0.00 H new ATOM 0 HG23 VAL B 20 1.911 1.316 9.721 1.00 0.00 H new ATOM 1505 N GLN B 21 3.512 4.912 6.390 1.00 0.00 N ATOM 1506 CA GLN B 21 4.320 6.026 5.924 1.00 0.00 C ATOM 1507 C GLN B 21 3.663 7.333 6.347 1.00 0.00 C ATOM 1508 O GLN B 21 2.459 7.512 6.171 1.00 0.00 O ATOM 1509 CB GLN B 21 4.481 5.969 4.400 1.00 0.00 C ATOM 1510 CG GLN B 21 3.170 5.740 3.670 1.00 0.00 C ATOM 1511 CD GLN B 21 3.311 5.726 2.165 1.00 0.00 C ATOM 1512 OE1 GLN B 21 4.363 5.400 1.620 1.00 0.00 O ATOM 1513 NE2 GLN B 21 2.228 6.056 1.482 1.00 0.00 N ATOM 0 H GLN B 21 2.773 4.632 5.745 1.00 0.00 H new ATOM 0 HA GLN B 21 5.313 5.965 6.369 1.00 0.00 H new ATOM 0 HB2 GLN B 21 4.925 6.902 4.053 1.00 0.00 H new ATOM 0 HB3 GLN B 21 5.177 5.170 4.144 1.00 0.00 H new ATOM 0 HG2 GLN B 21 2.743 4.791 3.996 1.00 0.00 H new ATOM 0 HG3 GLN B 21 2.464 6.521 3.953 1.00 0.00 H new ATOM 0 HE21 GLN B 21 1.375 6.321 1.975 1.00 0.00 H new ATOM 0 HE22 GLN B 21 2.245 6.046 0.462 1.00 0.00 H new ATOM 1522 N ILE B 22 4.436 8.228 6.929 1.00 0.00 N ATOM 1523 CA ILE B 22 3.904 9.500 7.395 1.00 0.00 C ATOM 1524 C ILE B 22 4.316 10.624 6.451 1.00 0.00 C ATOM 1525 O ILE B 22 5.430 10.620 5.926 1.00 0.00 O ATOM 1526 CB ILE B 22 4.385 9.815 8.832 1.00 0.00 C ATOM 1527 CG1 ILE B 22 3.834 8.783 9.819 1.00 0.00 C ATOM 1528 CG2 ILE B 22 3.972 11.216 9.254 1.00 0.00 C ATOM 1529 CD1 ILE B 22 4.158 9.100 11.262 1.00 0.00 C ATOM 0 H ILE B 22 5.435 8.101 7.092 1.00 0.00 H new ATOM 0 HA ILE B 22 2.817 9.423 7.408 1.00 0.00 H new ATOM 0 HB ILE B 22 5.474 9.764 8.839 1.00 0.00 H new ATOM 0 HG12 ILE B 22 2.752 8.721 9.702 1.00 0.00 H new ATOM 0 HG13 ILE B 22 4.238 7.802 9.571 1.00 0.00 H new ATOM 0 HG21 ILE B 22 4.324 11.409 10.268 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.410 11.945 8.573 1.00 0.00 H new ATOM 0 HG23 ILE B 22 2.886 11.299 9.225 1.00 0.00 H new ATOM 0 HD11 ILE B 22 3.738 8.328 11.907 1.00 0.00 H new ATOM 0 HD12 ILE B 22 5.240 9.133 11.393 1.00 0.00 H new ATOM 0 HD13 ILE B 22 3.730 10.067 11.527 1.00 0.00 H new ATOM 1541 N ASP B 23 3.411 11.570 6.216 1.00 0.00 N ATOM 1542 CA ASP B 23 3.717 12.708 5.374 1.00 0.00 C ATOM 1543 C ASP B 23 4.580 13.707 6.144 1.00 0.00 C ATOM 1544 O ASP B 23 4.803 13.556 7.346 1.00 0.00 O ATOM 1545 CB ASP B 23 2.431 13.386 4.881 1.00 0.00 C ATOM 1546 CG ASP B 23 1.909 14.439 5.838 1.00 0.00 C ATOM 1547 OD1 ASP B 23 1.485 14.085 6.954 1.00 0.00 O ATOM 1548 OD2 ASP B 23 1.919 15.629 5.469 1.00 0.00 O ATOM 0 H ASP B 23 2.465 11.566 6.598 1.00 0.00 H new ATOM 0 HA ASP B 23 4.269 12.355 4.503 1.00 0.00 H new ATOM 0 HB2 ASP B 23 2.619 13.846 3.911 1.00 0.00 H new ATOM 0 HB3 ASP B 23 1.663 12.628 4.730 1.00 0.00 H new ATOM 1553 N PHE B 24 5.038 14.731 5.447 1.00 0.00 N ATOM 1554 CA PHE B 24 5.940 15.731 6.004 1.00 0.00 C ATOM 1555 C PHE B 24 5.331 16.457 7.209 1.00 0.00 C ATOM 1556 O PHE B 24 6.056 17.011 8.036 1.00 0.00 O ATOM 1557 CB PHE B 24 6.307 16.737 4.906 1.00 0.00 C ATOM 1558 CG PHE B 24 7.289 17.791 5.333 1.00 0.00 C ATOM 1559 CD1 PHE B 24 8.627 17.478 5.508 1.00 0.00 C ATOM 1560 CD2 PHE B 24 6.875 19.095 5.549 1.00 0.00 C ATOM 1561 CE1 PHE B 24 9.533 18.447 5.892 1.00 0.00 C ATOM 1562 CE2 PHE B 24 7.776 20.066 5.933 1.00 0.00 C ATOM 1563 CZ PHE B 24 9.107 19.742 6.105 1.00 0.00 C ATOM 0 H PHE B 24 4.794 14.896 4.470 1.00 0.00 H new ATOM 0 HA PHE B 24 6.834 15.221 6.363 1.00 0.00 H new ATOM 0 HB2 PHE B 24 6.722 16.194 4.057 1.00 0.00 H new ATOM 0 HB3 PHE B 24 5.397 17.225 4.558 1.00 0.00 H new ATOM 0 HD1 PHE B 24 8.965 16.466 5.342 1.00 0.00 H new ATOM 0 HD2 PHE B 24 5.835 19.354 5.415 1.00 0.00 H new ATOM 0 HE1 PHE B 24 10.574 18.191 6.025 1.00 0.00 H new ATOM 0 HE2 PHE B 24 7.441 21.079 6.099 1.00 0.00 H new ATOM 0 HZ PHE B 24 9.814 20.501 6.406 1.00 0.00 H new ATOM 1573 N TYR B 25 4.009 16.447 7.318 1.00 0.00 N ATOM 1574 CA TYR B 25 3.339 17.210 8.360 1.00 0.00 C ATOM 1575 C TYR B 25 2.872 16.334 9.523 1.00 0.00 C ATOM 1576 O TYR B 25 2.237 16.830 10.456 1.00 0.00 O ATOM 1577 CB TYR B 25 2.179 18.002 7.758 1.00 0.00 C ATOM 1578 CG TYR B 25 2.641 18.993 6.713 1.00 0.00 C ATOM 1579 CD1 TYR B 25 3.133 20.237 7.081 1.00 0.00 C ATOM 1580 CD2 TYR B 25 2.615 18.672 5.360 1.00 0.00 C ATOM 1581 CE1 TYR B 25 3.586 21.133 6.135 1.00 0.00 C ATOM 1582 CE2 TYR B 25 3.062 19.566 4.407 1.00 0.00 C ATOM 1583 CZ TYR B 25 3.548 20.793 4.801 1.00 0.00 C ATOM 1584 OH TYR B 25 4.010 21.680 3.859 1.00 0.00 O ATOM 0 H TYR B 25 3.385 15.924 6.703 1.00 0.00 H new ATOM 0 HA TYR B 25 4.065 17.906 8.780 1.00 0.00 H new ATOM 0 HB2 TYR B 25 1.465 17.311 7.310 1.00 0.00 H new ATOM 0 HB3 TYR B 25 1.654 18.533 8.552 1.00 0.00 H new ATOM 0 HD1 TYR B 25 3.162 20.508 8.126 1.00 0.00 H new ATOM 0 HD2 TYR B 25 2.239 17.708 5.050 1.00 0.00 H new ATOM 0 HE1 TYR B 25 3.968 22.096 6.439 1.00 0.00 H new ATOM 0 HE2 TYR B 25 3.031 19.305 3.360 1.00 0.00 H new ATOM 0 HH TYR B 25 3.915 21.288 2.966 1.00 0.00 H new ATOM 1594 N GLY B 26 3.189 15.042 9.481 1.00 0.00 N ATOM 1595 CA GLY B 26 2.974 14.199 10.643 1.00 0.00 C ATOM 1596 C GLY B 26 1.637 13.481 10.658 1.00 0.00 C ATOM 1597 O GLY B 26 1.121 13.159 11.730 1.00 0.00 O ATOM 0 H GLY B 26 3.587 14.568 8.670 1.00 0.00 H new ATOM 0 HA2 GLY B 26 3.771 13.457 10.691 1.00 0.00 H new ATOM 0 HA3 GLY B 26 3.054 14.812 11.541 1.00 0.00 H new ATOM 1601 N ASP B 27 1.069 13.217 9.491 1.00 0.00 N ATOM 1602 CA ASP B 27 -0.165 12.444 9.415 1.00 0.00 C ATOM 1603 C ASP B 27 0.084 11.146 8.653 1.00 0.00 C ATOM 1604 O ASP B 27 0.903 11.107 7.730 1.00 0.00 O ATOM 1605 CB ASP B 27 -1.275 13.260 8.744 1.00 0.00 C ATOM 1606 CG ASP B 27 -2.655 12.660 8.952 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -3.121 12.616 10.113 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -3.296 12.254 7.963 1.00 0.00 O ATOM 0 H ASP B 27 1.437 13.523 8.590 1.00 0.00 H new ATOM 0 HA ASP B 27 -0.491 12.202 10.427 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -1.262 14.276 9.139 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -1.072 13.331 7.675 1.00 0.00 H new ATOM 1613 N GLU B 28 -0.596 10.080 9.058 1.00 0.00 N ATOM 1614 CA GLU B 28 -0.410 8.774 8.438 1.00 0.00 C ATOM 1615 C GLU B 28 -0.937 8.763 7.013 1.00 0.00 C ATOM 1616 O GLU B 28 -2.122 8.988 6.775 1.00 0.00 O ATOM 1617 CB GLU B 28 -1.122 7.685 9.242 1.00 0.00 C ATOM 1618 CG GLU B 28 -0.627 7.548 10.667 1.00 0.00 C ATOM 1619 CD GLU B 28 -1.341 6.448 11.422 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -0.972 5.270 11.258 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -2.293 6.753 12.170 1.00 0.00 O ATOM 0 H GLU B 28 -1.281 10.094 9.813 1.00 0.00 H new ATOM 0 HA GLU B 28 0.661 8.573 8.423 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -2.190 7.900 9.259 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -0.997 6.730 8.731 1.00 0.00 H new ATOM 0 HG2 GLU B 28 0.444 7.344 10.659 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -0.767 8.494 11.190 1.00 0.00 H new ATOM 1628 N VAL B 29 -0.055 8.495 6.070 1.00 0.00 N ATOM 1629 CA VAL B 29 -0.459 8.338 4.690 1.00 0.00 C ATOM 1630 C VAL B 29 -0.785 6.878 4.435 1.00 0.00 C ATOM 1631 O VAL B 29 0.081 6.085 4.063 1.00 0.00 O ATOM 1632 CB VAL B 29 0.628 8.801 3.703 1.00 0.00 C ATOM 1633 CG1 VAL B 29 0.077 8.831 2.287 1.00 0.00 C ATOM 1634 CG2 VAL B 29 1.172 10.161 4.101 1.00 0.00 C ATOM 0 H VAL B 29 0.945 8.382 6.236 1.00 0.00 H new ATOM 0 HA VAL B 29 -1.334 8.966 4.525 1.00 0.00 H new ATOM 0 HB VAL B 29 1.452 8.088 3.736 1.00 0.00 H new ATOM 0 HG11 VAL B 29 0.857 9.160 1.600 1.00 0.00 H new ATOM 0 HG12 VAL B 29 -0.257 7.832 2.005 1.00 0.00 H new ATOM 0 HG13 VAL B 29 -0.765 9.522 2.239 1.00 0.00 H new ATOM 0 HG21 VAL B 29 1.939 10.469 3.390 1.00 0.00 H new ATOM 0 HG22 VAL B 29 0.363 10.891 4.100 1.00 0.00 H new ATOM 0 HG23 VAL B 29 1.606 10.101 5.099 1.00 0.00 H new ATOM 1644 N THR B 30 -2.030 6.523 4.685 1.00 0.00 N ATOM 1645 CA THR B 30 -2.478 5.152 4.553 1.00 0.00 C ATOM 1646 C THR B 30 -2.479 4.718 3.085 1.00 0.00 C ATOM 1647 O THR B 30 -2.535 5.559 2.186 1.00 0.00 O ATOM 1648 CB THR B 30 -3.888 5.001 5.152 1.00 0.00 C ATOM 1649 OG1 THR B 30 -4.777 5.934 4.525 1.00 0.00 O ATOM 1650 CG2 THR B 30 -3.865 5.245 6.656 1.00 0.00 C ATOM 0 H THR B 30 -2.756 7.174 4.984 1.00 0.00 H new ATOM 0 HA THR B 30 -1.787 4.509 5.098 1.00 0.00 H new ATOM 0 HB THR B 30 -4.236 3.984 4.973 1.00 0.00 H new ATOM 0 HG1 THR B 30 -5.675 5.836 4.905 1.00 0.00 H new ATOM 0 HG21 THR B 30 -4.872 5.133 7.058 1.00 0.00 H new ATOM 0 HG22 THR B 30 -3.202 4.522 7.132 1.00 0.00 H new ATOM 0 HG23 THR B 30 -3.505 6.254 6.855 1.00 0.00 H new ATOM 1658 N PRO B 31 -2.422 3.398 2.819 1.00 0.00 N ATOM 1659 CA PRO B 31 -2.421 2.858 1.448 1.00 0.00 C ATOM 1660 C PRO B 31 -3.772 3.027 0.747 1.00 0.00 C ATOM 1661 O PRO B 31 -4.035 2.406 -0.281 1.00 0.00 O ATOM 1662 CB PRO B 31 -2.105 1.374 1.649 1.00 0.00 C ATOM 1663 CG PRO B 31 -2.565 1.071 3.033 1.00 0.00 C ATOM 1664 CD PRO B 31 -2.333 2.326 3.829 1.00 0.00 C ATOM 0 HA PRO B 31 -1.707 3.378 0.810 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -2.624 0.756 0.916 1.00 0.00 H new ATOM 0 HB3 PRO B 31 -1.039 1.178 1.535 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -3.619 0.792 3.042 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -2.010 0.233 3.454 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -3.082 2.449 4.611 1.00 0.00 H new ATOM 0 HD3 PRO B 31 -1.359 2.316 4.319 1.00 0.00 H new ATOM 1672 N VAL B 32 -4.628 3.859 1.323 1.00 0.00 N ATOM 1673 CA VAL B 32 -5.916 4.177 0.730 1.00 0.00 C ATOM 1674 C VAL B 32 -6.031 5.683 0.504 1.00 0.00 C ATOM 1675 O VAL B 32 -7.065 6.180 0.050 1.00 0.00 O ATOM 1676 CB VAL B 32 -7.090 3.698 1.614 1.00 0.00 C ATOM 1677 CG1 VAL B 32 -7.044 2.190 1.801 1.00 0.00 C ATOM 1678 CG2 VAL B 32 -7.078 4.400 2.963 1.00 0.00 C ATOM 0 H VAL B 32 -4.449 4.330 2.210 1.00 0.00 H new ATOM 0 HA VAL B 32 -5.975 3.653 -0.224 1.00 0.00 H new ATOM 0 HB VAL B 32 -8.019 3.955 1.104 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -7.879 1.875 2.426 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -7.113 1.701 0.830 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -6.106 1.911 2.281 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -7.914 4.045 3.565 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -6.142 4.183 3.478 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -7.169 5.476 2.814 1.00 0.00 H new ATOM 1688 N ASP B 33 -4.956 6.401 0.813 1.00 0.00 N ATOM 1689 CA ASP B 33 -4.944 7.852 0.693 1.00 0.00 C ATOM 1690 C ASP B 33 -3.959 8.277 -0.389 1.00 0.00 C ATOM 1691 O ASP B 33 -2.980 7.581 -0.653 1.00 0.00 O ATOM 1692 CB ASP B 33 -4.571 8.498 2.029 1.00 0.00 C ATOM 1693 CG ASP B 33 -5.224 9.854 2.226 1.00 0.00 C ATOM 1694 OD1 ASP B 33 -5.606 10.499 1.221 1.00 0.00 O ATOM 1695 OD2 ASP B 33 -5.389 10.270 3.392 1.00 0.00 O ATOM 0 H ASP B 33 -4.081 5.999 1.149 1.00 0.00 H new ATOM 0 HA ASP B 33 -5.943 8.187 0.415 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -4.866 7.836 2.843 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -3.488 8.609 2.084 1.00 0.00 H new ATOM 1700 N ASP B 34 -4.221 9.418 -1.010 1.00 0.00 N ATOM 1701 CA ASP B 34 -3.418 9.882 -2.136 1.00 0.00 C ATOM 1702 C ASP B 34 -2.315 10.820 -1.660 1.00 0.00 C ATOM 1703 O ASP B 34 -2.547 11.704 -0.828 1.00 0.00 O ATOM 1704 CB ASP B 34 -4.297 10.593 -3.172 1.00 0.00 C ATOM 1705 CG ASP B 34 -5.310 9.670 -3.826 1.00 0.00 C ATOM 1706 OD1 ASP B 34 -4.963 9.006 -4.826 1.00 0.00 O ATOM 1707 OD2 ASP B 34 -6.470 9.620 -3.359 1.00 0.00 O ATOM 0 H ASP B 34 -4.986 10.042 -0.753 1.00 0.00 H new ATOM 0 HA ASP B 34 -2.960 9.011 -2.604 1.00 0.00 H new ATOM 0 HB2 ASP B 34 -4.823 11.417 -2.690 1.00 0.00 H new ATOM 0 HB3 ASP B 34 -3.661 11.029 -3.942 1.00 0.00 H new ATOM 1712 N TYR B 35 -1.115 10.638 -2.194 1.00 0.00 N ATOM 1713 CA TYR B 35 0.027 11.435 -1.777 1.00 0.00 C ATOM 1714 C TYR B 35 1.013 11.619 -2.922 1.00 0.00 C ATOM 1715 O TYR B 35 0.934 10.935 -3.940 1.00 0.00 O ATOM 1716 CB TYR B 35 0.736 10.772 -0.592 1.00 0.00 C ATOM 1717 CG TYR B 35 1.437 9.472 -0.934 1.00 0.00 C ATOM 1718 CD1 TYR B 35 0.719 8.300 -1.150 1.00 0.00 C ATOM 1719 CD2 TYR B 35 2.820 9.419 -1.034 1.00 0.00 C ATOM 1720 CE1 TYR B 35 1.363 7.116 -1.453 1.00 0.00 C ATOM 1721 CE2 TYR B 35 3.471 8.239 -1.331 1.00 0.00 C ATOM 1722 CZ TYR B 35 2.740 7.092 -1.542 1.00 0.00 C ATOM 1723 OH TYR B 35 3.386 5.912 -1.831 1.00 0.00 O ATOM 0 H TYR B 35 -0.909 9.947 -2.915 1.00 0.00 H new ATOM 0 HA TYR B 35 -0.343 12.415 -1.475 1.00 0.00 H new ATOM 0 HB2 TYR B 35 1.468 11.470 -0.184 1.00 0.00 H new ATOM 0 HB3 TYR B 35 0.005 10.582 0.194 1.00 0.00 H new ATOM 0 HD1 TYR B 35 -0.359 8.316 -1.080 1.00 0.00 H new ATOM 0 HD2 TYR B 35 3.398 10.318 -0.876 1.00 0.00 H new ATOM 0 HE1 TYR B 35 0.792 6.214 -1.619 1.00 0.00 H new ATOM 0 HE2 TYR B 35 4.549 8.216 -1.398 1.00 0.00 H new ATOM 0 HH TYR B 35 4.353 6.067 -1.858 1.00 0.00 H new ATOM 1733 N VAL B 36 1.935 12.550 -2.741 1.00 0.00 N ATOM 1734 CA VAL B 36 3.003 12.791 -3.699 1.00 0.00 C ATOM 1735 C VAL B 36 4.318 12.966 -2.944 1.00 0.00 C ATOM 1736 O VAL B 36 4.336 13.532 -1.851 1.00 0.00 O ATOM 1737 CB VAL B 36 2.708 14.041 -4.570 1.00 0.00 C ATOM 1738 CG1 VAL B 36 3.890 14.400 -5.453 1.00 0.00 C ATOM 1739 CG2 VAL B 36 1.479 13.817 -5.435 1.00 0.00 C ATOM 0 H VAL B 36 1.965 13.161 -1.925 1.00 0.00 H new ATOM 0 HA VAL B 36 3.074 11.935 -4.370 1.00 0.00 H new ATOM 0 HB VAL B 36 2.523 14.871 -3.887 1.00 0.00 H new ATOM 0 HG11 VAL B 36 3.646 15.280 -6.048 1.00 0.00 H new ATOM 0 HG12 VAL B 36 4.758 14.613 -4.830 1.00 0.00 H new ATOM 0 HG13 VAL B 36 4.116 13.565 -6.116 1.00 0.00 H new ATOM 0 HG21 VAL B 36 1.291 14.706 -6.037 1.00 0.00 H new ATOM 0 HG22 VAL B 36 1.647 12.963 -6.091 1.00 0.00 H new ATOM 0 HG23 VAL B 36 0.616 13.621 -4.798 1.00 0.00 H new ATOM 1749 N ILE B 37 5.406 12.451 -3.497 1.00 0.00 N ATOM 1750 CA ILE B 37 6.703 12.534 -2.837 1.00 0.00 C ATOM 1751 C ILE B 37 7.589 13.580 -3.495 1.00 0.00 C ATOM 1752 O ILE B 37 7.906 13.478 -4.678 1.00 0.00 O ATOM 1753 CB ILE B 37 7.426 11.170 -2.836 1.00 0.00 C ATOM 1754 CG1 ILE B 37 6.586 10.121 -2.101 1.00 0.00 C ATOM 1755 CG2 ILE B 37 8.798 11.299 -2.191 1.00 0.00 C ATOM 1756 CD1 ILE B 37 7.266 8.774 -1.980 1.00 0.00 C ATOM 0 H ILE B 37 5.418 11.973 -4.398 1.00 0.00 H new ATOM 0 HA ILE B 37 6.515 12.829 -1.805 1.00 0.00 H new ATOM 0 HB ILE B 37 7.557 10.846 -3.868 1.00 0.00 H new ATOM 0 HG12 ILE B 37 6.351 10.491 -1.103 1.00 0.00 H new ATOM 0 HG13 ILE B 37 5.639 9.994 -2.625 1.00 0.00 H new ATOM 0 HG21 ILE B 37 9.296 10.329 -2.198 1.00 0.00 H new ATOM 0 HG22 ILE B 37 9.397 12.018 -2.750 1.00 0.00 H new ATOM 0 HG23 ILE B 37 8.686 11.642 -1.163 1.00 0.00 H new ATOM 0 HD11 ILE B 37 6.612 8.083 -1.449 1.00 0.00 H new ATOM 0 HD12 ILE B 37 7.477 8.382 -2.975 1.00 0.00 H new ATOM 0 HD13 ILE B 37 8.200 8.886 -1.429 1.00 0.00 H new ATOM 1768 N ASP B 38 7.991 14.577 -2.716 1.00 0.00 N ATOM 1769 CA ASP B 38 8.874 15.627 -3.218 1.00 0.00 C ATOM 1770 C ASP B 38 10.307 15.324 -2.823 1.00 0.00 C ATOM 1771 O ASP B 38 10.746 15.641 -1.719 1.00 0.00 O ATOM 1772 CB ASP B 38 8.461 17.013 -2.703 1.00 0.00 C ATOM 1773 CG ASP B 38 9.460 18.107 -3.075 1.00 0.00 C ATOM 1774 OD1 ASP B 38 9.547 18.469 -4.265 1.00 0.00 O ATOM 1775 OD2 ASP B 38 10.160 18.611 -2.173 1.00 0.00 O ATOM 0 H ASP B 38 7.722 14.682 -1.738 1.00 0.00 H new ATOM 0 HA ASP B 38 8.792 15.645 -4.305 1.00 0.00 H new ATOM 0 HB2 ASP B 38 7.482 17.269 -3.108 1.00 0.00 H new ATOM 0 HB3 ASP B 38 8.357 16.976 -1.619 1.00 0.00 H new ATOM 1780 N GLY B 39 11.000 14.619 -3.698 1.00 0.00 N ATOM 1781 CA GLY B 39 12.417 14.368 -3.503 1.00 0.00 C ATOM 1782 C GLY B 39 12.694 13.222 -2.548 1.00 0.00 C ATOM 1783 O GLY B 39 13.695 12.526 -2.681 1.00 0.00 O ATOM 0 H GLY B 39 10.608 14.212 -4.547 1.00 0.00 H new ATOM 0 HA2 GLY B 39 12.877 14.149 -4.467 1.00 0.00 H new ATOM 0 HA3 GLY B 39 12.891 15.273 -3.122 1.00 0.00 H new ATOM 1787 N GLY B 40 11.792 13.005 -1.613 1.00 0.00 N ATOM 1788 CA GLY B 40 11.984 11.987 -0.606 1.00 0.00 C ATOM 1789 C GLY B 40 10.977 12.144 0.503 1.00 0.00 C ATOM 1790 O GLY B 40 10.600 11.175 1.165 1.00 0.00 O ATOM 0 H GLY B 40 10.917 13.523 -1.531 1.00 0.00 H new ATOM 0 HA2 GLY B 40 11.887 10.999 -1.056 1.00 0.00 H new ATOM 0 HA3 GLY B 40 12.994 12.054 -0.200 1.00 0.00 H new ATOM 1794 N GLU B 41 10.525 13.374 0.690 1.00 0.00 N ATOM 1795 CA GLU B 41 9.487 13.666 1.657 1.00 0.00 C ATOM 1796 C GLU B 41 8.116 13.358 1.077 1.00 0.00 C ATOM 1797 O GLU B 41 7.791 13.759 -0.040 1.00 0.00 O ATOM 1798 CB GLU B 41 9.560 15.129 2.101 1.00 0.00 C ATOM 1799 CG GLU B 41 10.454 15.360 3.311 1.00 0.00 C ATOM 1800 CD GLU B 41 11.854 14.808 3.137 1.00 0.00 C ATOM 1801 OE1 GLU B 41 12.673 15.456 2.455 1.00 0.00 O ATOM 1802 OE2 GLU B 41 12.142 13.728 3.695 1.00 0.00 O ATOM 0 H GLU B 41 10.866 14.189 0.180 1.00 0.00 H new ATOM 0 HA GLU B 41 9.645 13.032 2.529 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.925 15.733 1.271 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.554 15.479 2.332 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.515 16.430 3.510 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.996 14.899 4.186 1.00 0.00 H new ATOM 1809 N ILE B 42 7.337 12.617 1.839 1.00 0.00 N ATOM 1810 CA ILE B 42 5.968 12.285 1.480 1.00 0.00 C ATOM 1811 C ILE B 42 5.051 13.438 1.858 1.00 0.00 C ATOM 1812 O ILE B 42 5.176 13.990 2.942 1.00 0.00 O ATOM 1813 CB ILE B 42 5.503 11.011 2.227 1.00 0.00 C ATOM 1814 CG1 ILE B 42 6.401 9.823 1.877 1.00 0.00 C ATOM 1815 CG2 ILE B 42 4.051 10.696 1.901 1.00 0.00 C ATOM 1816 CD1 ILE B 42 6.213 8.630 2.786 1.00 0.00 C ATOM 0 H ILE B 42 7.636 12.224 2.732 1.00 0.00 H new ATOM 0 HA ILE B 42 5.926 12.105 0.406 1.00 0.00 H new ATOM 0 HB ILE B 42 5.581 11.197 3.298 1.00 0.00 H new ATOM 0 HG12 ILE B 42 6.203 9.520 0.849 1.00 0.00 H new ATOM 0 HG13 ILE B 42 7.443 10.141 1.921 1.00 0.00 H new ATOM 0 HG21 ILE B 42 3.745 9.797 2.436 1.00 0.00 H new ATOM 0 HG22 ILE B 42 3.420 11.532 2.204 1.00 0.00 H new ATOM 0 HG23 ILE B 42 3.946 10.533 0.828 1.00 0.00 H new ATOM 0 HD11 ILE B 42 6.883 7.828 2.476 1.00 0.00 H new ATOM 0 HD12 ILE B 42 6.440 8.916 3.813 1.00 0.00 H new ATOM 0 HD13 ILE B 42 5.181 8.285 2.725 1.00 0.00 H new ATOM 1828 N ILE B 43 4.161 13.831 0.966 1.00 0.00 N ATOM 1829 CA ILE B 43 3.175 14.846 1.303 1.00 0.00 C ATOM 1830 C ILE B 43 1.787 14.372 0.909 1.00 0.00 C ATOM 1831 O ILE B 43 1.554 14.010 -0.246 1.00 0.00 O ATOM 1832 CB ILE B 43 3.438 16.212 0.620 1.00 0.00 C ATOM 1833 CG1 ILE B 43 4.898 16.650 0.765 1.00 0.00 C ATOM 1834 CG2 ILE B 43 2.521 17.277 1.207 1.00 0.00 C ATOM 1835 CD1 ILE B 43 5.791 16.153 -0.350 1.00 0.00 C ATOM 0 H ILE B 43 4.098 13.470 0.014 1.00 0.00 H new ATOM 0 HA ILE B 43 3.252 14.994 2.380 1.00 0.00 H new ATOM 0 HB ILE B 43 3.228 16.092 -0.443 1.00 0.00 H new ATOM 0 HG12 ILE B 43 4.941 17.739 0.796 1.00 0.00 H new ATOM 0 HG13 ILE B 43 5.285 16.288 1.718 1.00 0.00 H new ATOM 0 HG21 ILE B 43 2.715 18.233 0.720 1.00 0.00 H new ATOM 0 HG22 ILE B 43 1.482 16.991 1.046 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.710 17.370 2.276 1.00 0.00 H new ATOM 0 HD11 ILE B 43 6.810 16.501 -0.182 1.00 0.00 H new ATOM 0 HD12 ILE B 43 5.778 15.063 -0.368 1.00 0.00 H new ATOM 0 HD13 ILE B 43 5.429 16.536 -1.304 1.00 0.00 H new ATOM 1847 N LEU B 44 0.882 14.333 1.879 1.00 0.00 N ATOM 1848 CA LEU B 44 -0.524 14.075 1.598 1.00 0.00 C ATOM 1849 C LEU B 44 -1.060 15.070 0.581 1.00 0.00 C ATOM 1850 O LEU B 44 -0.697 16.247 0.601 1.00 0.00 O ATOM 1851 CB LEU B 44 -1.357 14.173 2.876 1.00 0.00 C ATOM 1852 CG LEU B 44 -1.237 12.985 3.823 1.00 0.00 C ATOM 1853 CD1 LEU B 44 -1.837 13.323 5.175 1.00 0.00 C ATOM 1854 CD2 LEU B 44 -1.925 11.767 3.230 1.00 0.00 C ATOM 0 H LEU B 44 1.096 14.477 2.866 1.00 0.00 H new ATOM 0 HA LEU B 44 -0.600 13.066 1.192 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.065 15.076 3.413 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.405 14.292 2.599 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.180 12.756 3.961 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.743 12.464 5.840 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.309 14.174 5.605 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.891 13.574 5.053 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -1.831 10.926 3.917 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.980 11.988 3.068 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.458 11.512 2.279 1.00 0.00 H new ATOM 1866 N ARG B 45 -1.947 14.601 -0.286 1.00 0.00 N ATOM 1867 CA ARG B 45 -2.579 15.462 -1.280 1.00 0.00 C ATOM 1868 C ARG B 45 -3.497 16.492 -0.624 1.00 0.00 C ATOM 1869 O ARG B 45 -4.131 17.292 -1.306 1.00 0.00 O ATOM 1870 CB ARG B 45 -3.366 14.622 -2.288 1.00 0.00 C ATOM 1871 CG ARG B 45 -2.599 14.320 -3.567 1.00 0.00 C ATOM 1872 CD ARG B 45 -2.414 15.573 -4.405 1.00 0.00 C ATOM 1873 NE ARG B 45 -2.022 15.255 -5.773 1.00 0.00 N ATOM 1874 CZ ARG B 45 -2.028 16.130 -6.775 1.00 0.00 C ATOM 1875 NH1 ARG B 45 -2.316 17.409 -6.563 1.00 0.00 N ATOM 1876 NH2 ARG B 45 -1.732 15.721 -8.000 1.00 0.00 N ATOM 0 H ARG B 45 -2.247 13.627 -0.322 1.00 0.00 H new ATOM 0 HA ARG B 45 -1.789 16.001 -1.803 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -3.654 13.682 -1.817 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -4.287 15.146 -2.543 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -1.625 13.898 -3.319 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -3.134 13.568 -4.146 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -3.343 16.144 -4.416 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -1.655 16.208 -3.947 1.00 0.00 H new ATOM 0 HE ARG B 45 -1.724 14.301 -5.975 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -2.537 17.733 -5.621 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -2.316 18.068 -7.342 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -1.502 14.742 -8.169 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -1.734 16.385 -8.774 1.00 0.00 H new ATOM 1890 N GLU B 46 -3.568 16.464 0.702 1.00 0.00 N ATOM 1891 CA GLU B 46 -4.361 17.427 1.447 1.00 0.00 C ATOM 1892 C GLU B 46 -3.690 18.803 1.443 1.00 0.00 C ATOM 1893 O GLU B 46 -4.362 19.832 1.398 1.00 0.00 O ATOM 1894 CB GLU B 46 -4.548 16.951 2.889 1.00 0.00 C ATOM 1895 CG GLU B 46 -5.151 15.559 3.003 1.00 0.00 C ATOM 1896 CD GLU B 46 -6.488 15.439 2.300 1.00 0.00 C ATOM 1897 OE1 GLU B 46 -7.470 16.050 2.771 1.00 0.00 O ATOM 1898 OE2 GLU B 46 -6.560 14.738 1.266 1.00 0.00 O ATOM 0 H GLU B 46 -3.083 15.780 1.283 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.335 17.512 0.964 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -3.582 16.960 3.393 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -5.189 17.659 3.415 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.457 14.832 2.581 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.275 15.307 4.056 1.00 0.00 H new ATOM 1905 N ASN B 47 -2.360 18.811 1.481 1.00 0.00 N ATOM 1906 CA ASN B 47 -1.602 20.062 1.562 1.00 0.00 C ATOM 1907 C ASN B 47 -0.521 20.099 0.476 1.00 0.00 C ATOM 1908 O ASN B 47 0.275 21.032 0.399 1.00 0.00 O ATOM 1909 CB ASN B 47 -0.963 20.180 2.956 1.00 0.00 C ATOM 1910 CG ASN B 47 -0.517 21.590 3.300 1.00 0.00 C ATOM 1911 OD1 ASN B 47 0.602 21.994 2.997 1.00 0.00 O ATOM 1912 ND2 ASN B 47 -1.385 22.339 3.965 1.00 0.00 N ATOM 0 H ASN B 47 -1.784 17.970 1.457 1.00 0.00 H new ATOM 0 HA ASN B 47 -2.276 20.904 1.403 1.00 0.00 H new ATOM 0 HB2 ASN B 47 -1.679 19.841 3.705 1.00 0.00 H new ATOM 0 HB3 ASN B 47 -0.103 19.512 3.011 1.00 0.00 H new ATOM 0 HD21 ASN B 47 -1.132 23.287 4.243 1.00 0.00 H new ATOM 0 HD22 ASN B 47 -2.306 21.967 4.198 1.00 0.00 H new ATOM 1919 N LEU B 48 -0.547 19.086 -0.386 1.00 0.00 N ATOM 1920 CA LEU B 48 0.500 18.856 -1.390 1.00 0.00 C ATOM 1921 C LEU B 48 0.785 20.110 -2.225 1.00 0.00 C ATOM 1922 O LEU B 48 1.944 20.469 -2.447 1.00 0.00 O ATOM 1923 CB LEU B 48 0.071 17.677 -2.285 1.00 0.00 C ATOM 1924 CG LEU B 48 1.111 17.132 -3.277 1.00 0.00 C ATOM 1925 CD1 LEU B 48 1.130 17.948 -4.557 1.00 0.00 C ATOM 1926 CD2 LEU B 48 2.497 17.096 -2.649 1.00 0.00 C ATOM 0 H LEU B 48 -1.297 18.395 -0.412 1.00 0.00 H new ATOM 0 HA LEU B 48 1.432 18.614 -0.879 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -0.240 16.857 -1.637 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.807 17.986 -2.852 1.00 0.00 H new ATOM 0 HG LEU B 48 0.821 16.112 -3.529 1.00 0.00 H new ATOM 0 HD11 LEU B 48 1.875 17.538 -5.239 1.00 0.00 H new ATOM 0 HD12 LEU B 48 0.148 17.909 -5.028 1.00 0.00 H new ATOM 0 HD13 LEU B 48 1.381 18.983 -4.325 1.00 0.00 H new ATOM 0 HD21 LEU B 48 3.214 16.706 -3.372 1.00 0.00 H new ATOM 0 HD22 LEU B 48 2.789 18.104 -2.355 1.00 0.00 H new ATOM 0 HD23 LEU B 48 2.482 16.452 -1.770 1.00 0.00 H new ATOM 1938 N GLU B 49 -0.272 20.780 -2.664 1.00 0.00 N ATOM 1939 CA GLU B 49 -0.148 21.946 -3.536 1.00 0.00 C ATOM 1940 C GLU B 49 0.666 23.064 -2.880 1.00 0.00 C ATOM 1941 O GLU B 49 1.347 23.830 -3.566 1.00 0.00 O ATOM 1942 CB GLU B 49 -1.530 22.479 -3.929 1.00 0.00 C ATOM 1943 CG GLU B 49 -2.362 21.522 -4.777 1.00 0.00 C ATOM 1944 CD GLU B 49 -2.775 20.267 -4.031 1.00 0.00 C ATOM 1945 OE1 GLU B 49 -2.908 20.331 -2.789 1.00 0.00 O ATOM 1946 OE2 GLU B 49 -2.951 19.215 -4.678 1.00 0.00 O ATOM 0 H GLU B 49 -1.234 20.535 -2.429 1.00 0.00 H new ATOM 0 HA GLU B 49 0.382 21.620 -4.431 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -2.085 22.716 -3.021 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -1.403 23.412 -4.477 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -3.255 22.040 -5.127 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -1.791 21.240 -5.661 1.00 0.00 H new ATOM 1953 N ARG B 50 0.608 23.149 -1.555 1.00 0.00 N ATOM 1954 CA ARG B 50 1.319 24.200 -0.835 1.00 0.00 C ATOM 1955 C ARG B 50 2.807 23.891 -0.758 1.00 0.00 C ATOM 1956 O ARG B 50 3.643 24.783 -0.898 1.00 0.00 O ATOM 1957 CB ARG B 50 0.747 24.400 0.570 1.00 0.00 C ATOM 1958 CG ARG B 50 -0.434 25.359 0.618 1.00 0.00 C ATOM 1959 CD ARG B 50 -1.723 24.663 1.015 1.00 0.00 C ATOM 1960 NE ARG B 50 -2.190 23.724 -0.001 1.00 0.00 N ATOM 1961 CZ ARG B 50 -3.317 23.021 0.106 1.00 0.00 C ATOM 1962 NH1 ARG B 50 -4.081 23.150 1.185 1.00 0.00 N ATOM 1963 NH2 ARG B 50 -3.679 22.185 -0.856 1.00 0.00 N ATOM 0 H ARG B 50 0.081 22.509 -0.962 1.00 0.00 H new ATOM 0 HA ARG B 50 1.182 25.127 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG B 50 0.436 23.434 0.967 1.00 0.00 H new ATOM 0 HB3 ARG B 50 1.535 24.774 1.224 1.00 0.00 H new ATOM 0 HG2 ARG B 50 -0.222 26.159 1.328 1.00 0.00 H new ATOM 0 HG3 ARG B 50 -0.561 25.825 -0.359 1.00 0.00 H new ATOM 0 HD2 ARG B 50 -1.570 24.130 1.954 1.00 0.00 H new ATOM 0 HD3 ARG B 50 -2.495 25.411 1.195 1.00 0.00 H new ATOM 0 HE ARG B 50 -1.622 23.599 -0.839 1.00 0.00 H new ATOM 0 HH11 ARG B 50 -3.805 23.787 1.932 1.00 0.00 H new ATOM 0 HH12 ARG B 50 -4.944 22.612 1.266 1.00 0.00 H new ATOM 0 HH21 ARG B 50 -3.094 22.077 -1.684 1.00 0.00 H new ATOM 0 HH22 ARG B 50 -4.543 21.650 -0.768 1.00 0.00 H new ATOM 1977 N TYR B 51 3.141 22.623 -0.564 1.00 0.00 N ATOM 1978 CA TYR B 51 4.536 22.217 -0.506 1.00 0.00 C ATOM 1979 C TYR B 51 5.187 22.423 -1.872 1.00 0.00 C ATOM 1980 O TYR B 51 6.367 22.757 -1.969 1.00 0.00 O ATOM 1981 CB TYR B 51 4.655 20.756 -0.058 1.00 0.00 C ATOM 1982 CG TYR B 51 6.046 20.371 0.402 1.00 0.00 C ATOM 1983 CD1 TYR B 51 6.529 20.788 1.637 1.00 0.00 C ATOM 1984 CD2 TYR B 51 6.873 19.592 -0.394 1.00 0.00 C ATOM 1985 CE1 TYR B 51 7.798 20.439 2.064 1.00 0.00 C ATOM 1986 CE2 TYR B 51 8.142 19.238 0.027 1.00 0.00 C ATOM 1987 CZ TYR B 51 8.601 19.662 1.254 1.00 0.00 C ATOM 1988 OH TYR B 51 9.867 19.311 1.672 1.00 0.00 O ATOM 0 H TYR B 51 2.470 21.864 -0.445 1.00 0.00 H new ATOM 0 HA TYR B 51 5.056 22.833 0.228 1.00 0.00 H new ATOM 0 HB2 TYR B 51 3.951 20.576 0.754 1.00 0.00 H new ATOM 0 HB3 TYR B 51 4.362 20.107 -0.884 1.00 0.00 H new ATOM 0 HD1 TYR B 51 5.903 21.395 2.274 1.00 0.00 H new ATOM 0 HD2 TYR B 51 6.520 19.257 -1.358 1.00 0.00 H new ATOM 0 HE1 TYR B 51 8.158 20.773 3.026 1.00 0.00 H new ATOM 0 HE2 TYR B 51 8.772 18.630 -0.606 1.00 0.00 H new ATOM 0 HH TYR B 51 10.298 18.762 0.984 1.00 0.00 H new ATOM 1998 N LEU B 52 4.396 22.253 -2.927 1.00 0.00 N ATOM 1999 CA LEU B 52 4.868 22.490 -4.287 1.00 0.00 C ATOM 2000 C LEU B 52 5.215 23.956 -4.509 1.00 0.00 C ATOM 2001 O LEU B 52 6.283 24.276 -5.020 1.00 0.00 O ATOM 2002 CB LEU B 52 3.820 22.066 -5.316 1.00 0.00 C ATOM 2003 CG LEU B 52 3.640 20.561 -5.490 1.00 0.00 C ATOM 2004 CD1 LEU B 52 2.654 20.278 -6.611 1.00 0.00 C ATOM 2005 CD2 LEU B 52 4.978 19.899 -5.774 1.00 0.00 C ATOM 0 H LEU B 52 3.424 21.951 -2.866 1.00 0.00 H new ATOM 0 HA LEU B 52 5.767 21.888 -4.417 1.00 0.00 H new ATOM 0 HB2 LEU B 52 2.861 22.498 -5.031 1.00 0.00 H new ATOM 0 HB3 LEU B 52 4.089 22.496 -6.281 1.00 0.00 H new ATOM 0 HG LEU B 52 3.241 20.145 -4.565 1.00 0.00 H new ATOM 0 HD11 LEU B 52 2.533 19.201 -6.726 1.00 0.00 H new ATOM 0 HD12 LEU B 52 1.691 20.727 -6.370 1.00 0.00 H new ATOM 0 HD13 LEU B 52 3.030 20.703 -7.542 1.00 0.00 H new ATOM 0 HD21 LEU B 52 4.834 18.825 -5.896 1.00 0.00 H new ATOM 0 HD22 LEU B 52 5.403 20.314 -6.688 1.00 0.00 H new ATOM 0 HD23 LEU B 52 5.658 20.082 -4.942 1.00 0.00 H new ATOM 2017 N ARG B 53 4.321 24.849 -4.113 1.00 0.00 N ATOM 2018 CA ARG B 53 4.499 26.268 -4.404 1.00 0.00 C ATOM 2019 C ARG B 53 5.660 26.858 -3.612 1.00 0.00 C ATOM 2020 O ARG B 53 6.299 27.812 -4.058 1.00 0.00 O ATOM 2021 CB ARG B 53 3.208 27.051 -4.138 1.00 0.00 C ATOM 2022 CG ARG B 53 2.768 27.058 -2.683 1.00 0.00 C ATOM 2023 CD ARG B 53 1.389 27.672 -2.530 1.00 0.00 C ATOM 2024 NE ARG B 53 0.402 26.983 -3.360 1.00 0.00 N ATOM 2025 CZ ARG B 53 -0.909 26.997 -3.138 1.00 0.00 C ATOM 2026 NH1 ARG B 53 -1.409 27.624 -2.083 1.00 0.00 N ATOM 2027 NH2 ARG B 53 -1.716 26.362 -3.975 1.00 0.00 N ATOM 0 H ARG B 53 3.472 24.622 -3.594 1.00 0.00 H new ATOM 0 HA ARG B 53 4.739 26.356 -5.464 1.00 0.00 H new ATOM 0 HB2 ARG B 53 3.347 28.080 -4.468 1.00 0.00 H new ATOM 0 HB3 ARG B 53 2.408 26.627 -4.745 1.00 0.00 H new ATOM 0 HG2 ARG B 53 2.760 26.038 -2.298 1.00 0.00 H new ATOM 0 HG3 ARG B 53 3.487 27.619 -2.086 1.00 0.00 H new ATOM 0 HD2 ARG B 53 1.083 27.626 -1.485 1.00 0.00 H new ATOM 0 HD3 ARG B 53 1.426 28.726 -2.806 1.00 0.00 H new ATOM 0 HE ARG B 53 0.742 26.456 -4.164 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -0.787 28.102 -1.432 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -2.416 27.628 -1.922 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -1.330 25.869 -4.780 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -2.723 26.366 -3.814 1.00 0.00 H new ATOM 2041 N GLU B 54 5.952 26.282 -2.453 1.00 0.00 N ATOM 2042 CA GLU B 54 7.028 26.795 -1.619 1.00 0.00 C ATOM 2043 C GLU B 54 8.352 26.077 -1.874 1.00 0.00 C ATOM 2044 O GLU B 54 9.415 26.695 -1.805 1.00 0.00 O ATOM 2045 CB GLU B 54 6.659 26.708 -0.140 1.00 0.00 C ATOM 2046 CG GLU B 54 5.536 27.652 0.254 1.00 0.00 C ATOM 2047 CD GLU B 54 5.433 27.830 1.752 1.00 0.00 C ATOM 2048 OE1 GLU B 54 6.389 28.369 2.354 1.00 0.00 O ATOM 2049 OE2 GLU B 54 4.411 27.429 2.337 1.00 0.00 O ATOM 0 H GLU B 54 5.465 25.470 -2.074 1.00 0.00 H new ATOM 0 HA GLU B 54 7.164 27.842 -1.891 1.00 0.00 H new ATOM 0 HB2 GLU B 54 6.364 25.685 0.094 1.00 0.00 H new ATOM 0 HB3 GLU B 54 7.540 26.931 0.461 1.00 0.00 H new ATOM 0 HG2 GLU B 54 5.700 28.623 -0.214 1.00 0.00 H new ATOM 0 HG3 GLU B 54 4.591 27.268 -0.130 1.00 0.00 H new ATOM 2056 N GLN B 55 8.308 24.785 -2.172 1.00 0.00 N ATOM 2057 CA GLN B 55 9.539 24.041 -2.379 1.00 0.00 C ATOM 2058 C GLN B 55 9.793 23.804 -3.861 1.00 0.00 C ATOM 2059 O GLN B 55 10.706 24.410 -4.429 1.00 0.00 O ATOM 2060 CB GLN B 55 9.476 22.705 -1.633 1.00 0.00 C ATOM 2061 CG GLN B 55 10.724 21.842 -1.776 1.00 0.00 C ATOM 2062 CD GLN B 55 11.973 22.511 -1.235 1.00 0.00 C ATOM 2063 OE1 GLN B 55 11.906 23.356 -0.338 1.00 0.00 O ATOM 2064 NE2 GLN B 55 13.123 22.121 -1.759 1.00 0.00 N ATOM 0 H GLN B 55 7.451 24.241 -2.274 1.00 0.00 H new ATOM 0 HA GLN B 55 10.365 24.632 -1.985 1.00 0.00 H new ATOM 0 HB2 GLN B 55 9.305 22.902 -0.575 1.00 0.00 H new ATOM 0 HB3 GLN B 55 8.616 22.141 -1.995 1.00 0.00 H new ATOM 0 HG2 GLN B 55 10.568 20.899 -1.253 1.00 0.00 H new ATOM 0 HG3 GLN B 55 10.874 21.602 -2.829 1.00 0.00 H new ATOM 0 HE21 GLN B 55 13.134 21.419 -2.499 1.00 0.00 H new ATOM 0 HE22 GLN B 55 13.999 22.522 -1.423 1.00 0.00 H new ATOM 2073 N LEU B 56 8.942 22.976 -4.488 1.00 0.00 N ATOM 2074 CA LEU B 56 9.134 22.534 -5.881 1.00 0.00 C ATOM 2075 C LEU B 56 10.624 22.309 -6.161 1.00 0.00 C ATOM 2076 O LEU B 56 11.136 22.656 -7.227 1.00 0.00 O ATOM 2077 CB LEU B 56 8.544 23.571 -6.850 1.00 0.00 C ATOM 2078 CG LEU B 56 7.829 23.005 -8.087 1.00 0.00 C ATOM 2079 CD1 LEU B 56 6.942 24.068 -8.716 1.00 0.00 C ATOM 2080 CD2 LEU B 56 8.826 22.494 -9.117 1.00 0.00 C ATOM 0 H LEU B 56 8.105 22.595 -4.047 1.00 0.00 H new ATOM 0 HA LEU B 56 8.611 21.589 -6.032 1.00 0.00 H new ATOM 0 HB2 LEU B 56 7.838 24.193 -6.300 1.00 0.00 H new ATOM 0 HB3 LEU B 56 9.349 24.224 -7.187 1.00 0.00 H new ATOM 0 HG LEU B 56 7.214 22.167 -7.760 1.00 0.00 H new ATOM 0 HD11 LEU B 56 6.442 23.653 -9.591 1.00 0.00 H new ATOM 0 HD12 LEU B 56 6.195 24.394 -7.992 1.00 0.00 H new ATOM 0 HD13 LEU B 56 7.552 24.920 -9.017 1.00 0.00 H new ATOM 0 HD21 LEU B 56 8.288 22.100 -9.980 1.00 0.00 H new ATOM 0 HD22 LEU B 56 9.472 23.312 -9.435 1.00 0.00 H new ATOM 0 HD23 LEU B 56 9.432 21.703 -8.675 1.00 0.00 H new ATOM 2092 N GLY B 57 11.316 21.731 -5.190 1.00 0.00 N ATOM 2093 CA GLY B 57 12.758 21.666 -5.262 1.00 0.00 C ATOM 2094 C GLY B 57 13.316 20.292 -4.989 1.00 0.00 C ATOM 2095 O GLY B 57 14.536 20.135 -4.921 1.00 0.00 O ATOM 0 H GLY B 57 10.905 21.308 -4.358 1.00 0.00 H new ATOM 0 HA2 GLY B 57 13.079 21.989 -6.253 1.00 0.00 H new ATOM 0 HA3 GLY B 57 13.181 22.370 -4.545 1.00 0.00 H new ATOM 2099 N PHE B 58 12.430 19.296 -4.846 1.00 0.00 N ATOM 2100 CA PHE B 58 12.840 17.898 -4.651 1.00 0.00 C ATOM 2101 C PHE B 58 13.858 17.803 -3.522 1.00 0.00 C ATOM 2102 O PHE B 58 13.867 18.638 -2.611 1.00 0.00 O ATOM 2103 CB PHE B 58 13.409 17.289 -5.956 1.00 0.00 C ATOM 2104 CG PHE B 58 13.391 18.204 -7.159 1.00 0.00 C ATOM 2105 CD1 PHE B 58 12.197 18.712 -7.657 1.00 0.00 C ATOM 2106 CD2 PHE B 58 14.575 18.560 -7.787 1.00 0.00 C ATOM 2107 CE1 PHE B 58 12.190 19.555 -8.752 1.00 0.00 C ATOM 2108 CE2 PHE B 58 14.570 19.402 -8.883 1.00 0.00 C ATOM 2109 CZ PHE B 58 13.377 19.900 -9.366 1.00 0.00 C ATOM 0 H PHE B 58 11.420 19.434 -4.862 1.00 0.00 H new ATOM 0 HA PHE B 58 11.957 17.320 -4.378 1.00 0.00 H new ATOM 0 HB2 PHE B 58 14.437 16.977 -5.773 1.00 0.00 H new ATOM 0 HB3 PHE B 58 12.841 16.390 -6.196 1.00 0.00 H new ATOM 0 HD1 PHE B 58 11.264 18.445 -7.183 1.00 0.00 H new ATOM 0 HD2 PHE B 58 15.513 18.174 -7.415 1.00 0.00 H new ATOM 0 HE1 PHE B 58 11.255 19.944 -9.128 1.00 0.00 H new ATOM 0 HE2 PHE B 58 15.500 19.670 -9.362 1.00 0.00 H new ATOM 0 HZ PHE B 58 13.372 20.558 -10.222 1.00 0.00 H new ATOM 2119 N GLU B 59 14.696 16.783 -3.550 1.00 0.00 N ATOM 2120 CA GLU B 59 15.787 16.719 -2.602 1.00 0.00 C ATOM 2121 C GLU B 59 17.088 17.118 -3.290 1.00 0.00 C ATOM 2122 O GLU B 59 17.691 16.329 -4.019 1.00 0.00 O ATOM 2123 CB GLU B 59 15.881 15.318 -2.003 1.00 0.00 C ATOM 2124 CG GLU B 59 17.139 15.071 -1.188 1.00 0.00 C ATOM 2125 CD GLU B 59 17.224 15.931 0.055 1.00 0.00 C ATOM 2126 OE1 GLU B 59 17.428 17.155 -0.073 1.00 0.00 O ATOM 2127 OE2 GLU B 59 17.115 15.375 1.165 1.00 0.00 O ATOM 0 H GLU B 59 14.643 16.003 -4.206 1.00 0.00 H new ATOM 0 HA GLU B 59 15.603 17.418 -1.786 1.00 0.00 H new ATOM 0 HB2 GLU B 59 15.011 15.148 -1.368 1.00 0.00 H new ATOM 0 HB3 GLU B 59 15.835 14.587 -2.810 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.176 14.021 -0.898 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.012 15.260 -1.813 1.00 0.00 H new ATOM 2134 N PHE B 60 17.517 18.350 -3.051 1.00 0.00 N ATOM 2135 CA PHE B 60 18.728 18.862 -3.665 1.00 0.00 C ATOM 2136 C PHE B 60 19.933 18.544 -2.800 1.00 0.00 C ATOM 2137 O PHE B 60 20.242 19.257 -1.844 1.00 0.00 O ATOM 2138 CB PHE B 60 18.626 20.366 -3.912 1.00 0.00 C ATOM 2139 CG PHE B 60 18.646 20.727 -5.370 1.00 0.00 C ATOM 2140 CD1 PHE B 60 19.848 20.957 -6.023 1.00 0.00 C ATOM 2141 CD2 PHE B 60 17.468 20.834 -6.088 1.00 0.00 C ATOM 2142 CE1 PHE B 60 19.871 21.285 -7.365 1.00 0.00 C ATOM 2143 CE2 PHE B 60 17.485 21.162 -7.431 1.00 0.00 C ATOM 2144 CZ PHE B 60 18.688 21.388 -8.070 1.00 0.00 C ATOM 0 H PHE B 60 17.042 19.011 -2.436 1.00 0.00 H new ATOM 0 HA PHE B 60 18.852 18.372 -4.631 1.00 0.00 H new ATOM 0 HB2 PHE B 60 17.705 20.740 -3.464 1.00 0.00 H new ATOM 0 HB3 PHE B 60 19.452 20.868 -3.408 1.00 0.00 H new ATOM 0 HD1 PHE B 60 20.776 20.879 -5.476 1.00 0.00 H new ATOM 0 HD2 PHE B 60 16.524 20.659 -5.593 1.00 0.00 H new ATOM 0 HE1 PHE B 60 20.813 21.461 -7.862 1.00 0.00 H new ATOM 0 HE2 PHE B 60 16.558 21.241 -7.980 1.00 0.00 H new ATOM 0 HZ PHE B 60 18.704 21.645 -9.119 1.00 0.00 H new ATOM 2154 N LYS B 61 20.594 17.457 -3.136 1.00 0.00 N ATOM 2155 CA LYS B 61 21.743 16.987 -2.385 1.00 0.00 C ATOM 2156 C LYS B 61 23.005 17.104 -3.219 1.00 0.00 C ATOM 2157 O LYS B 61 23.714 16.122 -3.424 1.00 0.00 O ATOM 2158 CB LYS B 61 21.529 15.533 -1.978 1.00 0.00 C ATOM 2159 CG LYS B 61 20.636 15.353 -0.763 1.00 0.00 C ATOM 2160 CD LYS B 61 21.468 15.292 0.505 1.00 0.00 C ATOM 2161 CE LYS B 61 20.623 15.441 1.758 1.00 0.00 C ATOM 2162 NZ LYS B 61 19.549 14.417 1.870 1.00 0.00 N ATOM 0 H LYS B 61 20.352 16.873 -3.937 1.00 0.00 H new ATOM 0 HA LYS B 61 21.855 17.603 -1.493 1.00 0.00 H new ATOM 0 HB2 LYS B 61 21.094 14.992 -2.818 1.00 0.00 H new ATOM 0 HB3 LYS B 61 22.498 15.078 -1.774 1.00 0.00 H new ATOM 0 HG2 LYS B 61 19.927 16.178 -0.700 1.00 0.00 H new ATOM 0 HG3 LYS B 61 20.052 14.438 -0.866 1.00 0.00 H new ATOM 0 HD2 LYS B 61 22.002 14.343 0.541 1.00 0.00 H new ATOM 0 HD3 LYS B 61 22.220 16.080 0.481 1.00 0.00 H new ATOM 0 HE2 LYS B 61 21.269 15.377 2.633 1.00 0.00 H new ATOM 0 HE3 LYS B 61 20.172 16.433 1.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 18.620 14.884 1.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 19.619 13.752 1.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 19.656 13.898 2.765 1.00 0.00 H new ATOM 2176 N ASN B 62 23.290 18.307 -3.695 1.00 0.00 N ATOM 2177 CA ASN B 62 24.426 18.515 -4.580 1.00 0.00 C ATOM 2178 C ASN B 62 25.733 18.503 -3.787 1.00 0.00 C ATOM 2179 O ASN B 62 26.320 19.552 -3.517 1.00 0.00 O ATOM 2180 CB ASN B 62 24.276 19.828 -5.348 1.00 0.00 C ATOM 2181 CG ASN B 62 25.166 19.882 -6.570 1.00 0.00 C ATOM 2182 OD1 ASN B 62 24.758 19.485 -7.663 1.00 0.00 O ATOM 2183 ND2 ASN B 62 26.382 20.368 -6.397 1.00 0.00 N ATOM 0 H ASN B 62 22.754 19.149 -3.485 1.00 0.00 H new ATOM 0 HA ASN B 62 24.454 17.698 -5.301 1.00 0.00 H new ATOM 0 HB2 ASN B 62 23.237 19.952 -5.652 1.00 0.00 H new ATOM 0 HB3 ASN B 62 24.517 20.662 -4.689 1.00 0.00 H new ATOM 0 HD21 ASN B 62 27.025 20.426 -7.187 1.00 0.00 H new ATOM 0 HD22 ASN B 62 26.678 20.685 -5.474 1.00 0.00 H new ATOM 2190 N ALA B 63 26.137 17.298 -3.377 1.00 0.00 N ATOM 2191 CA ALA B 63 27.366 17.070 -2.612 1.00 0.00 C ATOM 2192 C ALA B 63 27.334 17.757 -1.249 1.00 0.00 C ATOM 2193 O ALA B 63 28.347 17.798 -0.550 1.00 0.00 O ATOM 2194 CB ALA B 63 28.588 17.512 -3.398 1.00 0.00 C ATOM 0 H ALA B 63 25.614 16.443 -3.569 1.00 0.00 H new ATOM 0 HA ALA B 63 27.432 15.996 -2.436 1.00 0.00 H new ATOM 0 HB1 ALA B 63 29.486 17.331 -2.807 1.00 0.00 H new ATOM 0 HB2 ALA B 63 28.646 16.947 -4.328 1.00 0.00 H new ATOM 0 HB3 ALA B 63 28.510 18.575 -3.624 1.00 0.00 H new ATOM 2200 N GLN B 64 26.167 18.285 -0.882 1.00 0.00 N ATOM 2201 CA GLN B 64 25.980 18.976 0.394 1.00 0.00 C ATOM 2202 C GLN B 64 27.046 20.061 0.577 1.00 0.00 C ATOM 2203 O GLN B 64 27.594 20.243 1.666 1.00 0.00 O ATOM 2204 CB GLN B 64 26.019 17.971 1.557 1.00 0.00 C ATOM 2205 CG GLN B 64 25.599 18.562 2.898 1.00 0.00 C ATOM 2206 CD GLN B 64 24.114 18.868 2.983 1.00 0.00 C ATOM 2207 OE1 GLN B 64 23.450 19.115 1.975 1.00 0.00 O ATOM 2208 NE2 GLN B 64 23.588 18.884 4.197 1.00 0.00 N ATOM 0 H GLN B 64 25.327 18.246 -1.459 1.00 0.00 H new ATOM 0 HA GLN B 64 25.002 19.457 0.390 1.00 0.00 H new ATOM 0 HB2 GLN B 64 25.366 17.131 1.321 1.00 0.00 H new ATOM 0 HB3 GLN B 64 27.030 17.573 1.647 1.00 0.00 H new ATOM 0 HG2 GLN B 64 25.865 17.865 3.693 1.00 0.00 H new ATOM 0 HG3 GLN B 64 26.162 19.478 3.075 1.00 0.00 H new ATOM 0 HE21 GLN B 64 24.170 18.674 5.008 1.00 0.00 H new ATOM 0 HE22 GLN B 64 22.600 19.106 4.322 1.00 0.00 H new ATOM 2217 N LEU B 65 27.340 20.776 -0.505 1.00 0.00 N ATOM 2218 CA LEU B 65 28.315 21.858 -0.462 1.00 0.00 C ATOM 2219 C LEU B 65 27.890 22.903 0.561 1.00 0.00 C ATOM 2220 O LEU B 65 26.848 23.537 0.402 1.00 0.00 O ATOM 2221 CB LEU B 65 28.459 22.509 -1.840 1.00 0.00 C ATOM 2222 CG LEU B 65 28.938 21.579 -2.959 1.00 0.00 C ATOM 2223 CD1 LEU B 65 29.007 22.330 -4.279 1.00 0.00 C ATOM 2224 CD2 LEU B 65 30.292 20.979 -2.615 1.00 0.00 C ATOM 0 H LEU B 65 26.917 20.625 -1.421 1.00 0.00 H new ATOM 0 HA LEU B 65 29.279 21.442 -0.171 1.00 0.00 H new ATOM 0 HB2 LEU B 65 27.495 22.929 -2.127 1.00 0.00 H new ATOM 0 HB3 LEU B 65 29.158 23.342 -1.759 1.00 0.00 H new ATOM 0 HG LEU B 65 28.220 20.765 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU B 65 29.349 21.655 -5.064 1.00 0.00 H new ATOM 0 HD12 LEU B 65 28.018 22.711 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU B 65 29.704 23.163 -4.188 1.00 0.00 H new ATOM 0 HD21 LEU B 65 30.614 20.322 -3.422 1.00 0.00 H new ATOM 0 HD22 LEU B 65 31.022 21.778 -2.485 1.00 0.00 H new ATOM 0 HD23 LEU B 65 30.212 20.406 -1.691 1.00 0.00 H new ATOM 2236 N GLU B 66 28.694 23.053 1.615 1.00 0.00 N ATOM 2237 CA GLU B 66 28.389 23.985 2.697 1.00 0.00 C ATOM 2238 C GLU B 66 28.076 25.368 2.140 1.00 0.00 C ATOM 2239 O GLU B 66 26.934 25.829 2.227 1.00 0.00 O ATOM 2240 CB GLU B 66 29.557 24.062 3.682 1.00 0.00 C ATOM 2241 CG GLU B 66 29.941 22.718 4.280 1.00 0.00 C ATOM 2242 CD GLU B 66 31.062 22.833 5.293 1.00 0.00 C ATOM 2243 OE1 GLU B 66 32.203 23.132 4.890 1.00 0.00 O ATOM 2244 OE2 GLU B 66 30.806 22.620 6.498 1.00 0.00 O ATOM 0 H GLU B 66 29.565 22.537 1.741 1.00 0.00 H new ATOM 0 HA GLU B 66 27.510 23.618 3.227 1.00 0.00 H new ATOM 0 HB2 GLU B 66 30.423 24.484 3.173 1.00 0.00 H new ATOM 0 HB3 GLU B 66 29.296 24.747 4.488 1.00 0.00 H new ATOM 0 HG2 GLU B 66 29.068 22.274 4.758 1.00 0.00 H new ATOM 0 HG3 GLU B 66 30.246 22.042 3.481 1.00 0.00 H new ATOM 2251 N HIS B 67 29.093 26.019 1.568 1.00 0.00 N ATOM 2252 CA HIS B 67 28.902 27.294 0.878 1.00 0.00 C ATOM 2253 C HIS B 67 28.337 28.340 1.856 1.00 0.00 C ATOM 2254 O HIS B 67 28.302 28.111 3.064 1.00 0.00 O ATOM 2255 CB HIS B 67 27.967 27.061 -0.327 1.00 0.00 C ATOM 2256 CG HIS B 67 27.846 28.201 -1.289 1.00 0.00 C ATOM 2257 ND1 HIS B 67 26.648 28.820 -1.559 1.00 0.00 N ATOM 2258 CD2 HIS B 67 28.767 28.810 -2.070 1.00 0.00 C ATOM 2259 CE1 HIS B 67 26.835 29.760 -2.465 1.00 0.00 C ATOM 2260 NE2 HIS B 67 28.114 29.776 -2.795 1.00 0.00 N ATOM 0 H HIS B 67 30.056 25.683 1.570 1.00 0.00 H new ATOM 0 HA HIS B 67 29.852 27.681 0.510 1.00 0.00 H new ATOM 0 HB2 HIS B 67 28.320 26.186 -0.873 1.00 0.00 H new ATOM 0 HB3 HIS B 67 26.973 26.822 0.050 1.00 0.00 H new ATOM 0 HD2 HIS B 67 29.821 28.579 -2.115 1.00 0.00 H new ATOM 0 HE1 HIS B 67 26.071 30.408 -2.869 1.00 0.00 H new ATOM 0 HE2 HIS B 67 28.545 30.402 -3.475 1.00 0.00 H new ATOM 2269 N HIS B 68 27.946 29.498 1.353 1.00 0.00 N ATOM 2270 CA HIS B 68 27.301 30.503 2.182 1.00 0.00 C ATOM 2271 C HIS B 68 26.160 31.160 1.428 1.00 0.00 C ATOM 2272 O HIS B 68 26.332 31.607 0.293 1.00 0.00 O ATOM 2273 CB HIS B 68 28.298 31.576 2.640 1.00 0.00 C ATOM 2274 CG HIS B 68 29.267 31.098 3.676 1.00 0.00 C ATOM 2275 ND1 HIS B 68 30.628 31.050 3.469 1.00 0.00 N ATOM 2276 CD2 HIS B 68 29.065 30.652 4.938 1.00 0.00 C ATOM 2277 CE1 HIS B 68 31.218 30.594 4.556 1.00 0.00 C ATOM 2278 NE2 HIS B 68 30.295 30.344 5.465 1.00 0.00 N ATOM 0 H HIS B 68 28.063 29.766 0.376 1.00 0.00 H new ATOM 0 HA HIS B 68 26.909 29.997 3.064 1.00 0.00 H new ATOM 0 HB2 HIS B 68 28.854 31.935 1.774 1.00 0.00 H new ATOM 0 HB3 HIS B 68 27.745 32.426 3.038 1.00 0.00 H new ATOM 0 HD2 HIS B 68 28.113 30.556 5.438 1.00 0.00 H new ATOM 0 HE1 HIS B 68 32.281 30.449 4.682 1.00 0.00 H new ATOM 0 HE2 HIS B 68 30.467 29.982 6.403 1.00 0.00 H new ATOM 2287 N HIS B 69 24.990 31.182 2.044 1.00 0.00 N ATOM 2288 CA HIS B 69 23.868 31.939 1.517 1.00 0.00 C ATOM 2289 C HIS B 69 24.056 33.400 1.897 1.00 0.00 C ATOM 2290 O HIS B 69 23.683 33.823 2.992 1.00 0.00 O ATOM 2291 CB HIS B 69 22.538 31.399 2.060 1.00 0.00 C ATOM 2292 CG HIS B 69 21.326 32.102 1.517 1.00 0.00 C ATOM 2293 ND1 HIS B 69 20.564 32.973 2.265 1.00 0.00 N ATOM 2294 CD2 HIS B 69 20.743 32.050 0.296 1.00 0.00 C ATOM 2295 CE1 HIS B 69 19.566 33.424 1.528 1.00 0.00 C ATOM 2296 NE2 HIS B 69 19.652 32.882 0.330 1.00 0.00 N ATOM 0 H HIS B 69 24.793 30.683 2.911 1.00 0.00 H new ATOM 0 HA HIS B 69 23.835 31.841 0.432 1.00 0.00 H new ATOM 0 HB2 HIS B 69 22.465 30.337 1.825 1.00 0.00 H new ATOM 0 HB3 HIS B 69 22.539 31.485 3.147 1.00 0.00 H new ATOM 0 HD2 HIS B 69 21.075 31.463 -0.548 1.00 0.00 H new ATOM 0 HE1 HIS B 69 18.807 34.120 1.852 1.00 0.00 H new ATOM 0 HE2 HIS B 69 19.012 33.053 -0.446 1.00 0.00 H new ATOM 2305 N HIS B 70 24.667 34.152 0.995 1.00 0.00 N ATOM 2306 CA HIS B 70 25.089 35.512 1.289 1.00 0.00 C ATOM 2307 C HIS B 70 23.887 36.401 1.579 1.00 0.00 C ATOM 2308 O HIS B 70 22.864 36.327 0.890 1.00 0.00 O ATOM 2309 CB HIS B 70 25.902 36.073 0.118 1.00 0.00 C ATOM 2310 CG HIS B 70 26.782 37.227 0.490 1.00 0.00 C ATOM 2311 ND1 HIS B 70 28.144 37.105 0.663 1.00 0.00 N ATOM 2312 CD2 HIS B 70 26.492 38.529 0.720 1.00 0.00 C ATOM 2313 CE1 HIS B 70 28.653 38.279 0.983 1.00 0.00 C ATOM 2314 NE2 HIS B 70 27.671 39.159 1.023 1.00 0.00 N ATOM 0 H HIS B 70 24.883 33.841 0.048 1.00 0.00 H new ATOM 0 HA HIS B 70 25.718 35.495 2.179 1.00 0.00 H new ATOM 0 HB2 HIS B 70 26.519 35.277 -0.298 1.00 0.00 H new ATOM 0 HB3 HIS B 70 25.217 36.389 -0.669 1.00 0.00 H new ATOM 0 HD2 HIS B 70 25.515 38.986 0.673 1.00 0.00 H new ATOM 0 HE1 HIS B 70 29.695 38.485 1.179 1.00 0.00 H new ATOM 0 HE2 HIS B 70 27.773 40.150 1.244 1.00 0.00 H new ATOM 2323 N HIS B 71 24.013 37.218 2.619 1.00 0.00 N ATOM 2324 CA HIS B 71 22.964 38.154 3.004 1.00 0.00 C ATOM 2325 C HIS B 71 22.545 39.008 1.814 1.00 0.00 C ATOM 2326 O HIS B 71 23.386 39.568 1.109 1.00 0.00 O ATOM 2327 CB HIS B 71 23.454 39.054 4.146 1.00 0.00 C ATOM 2328 CG HIS B 71 22.421 40.015 4.658 1.00 0.00 C ATOM 2329 ND1 HIS B 71 22.382 41.345 4.296 1.00 0.00 N ATOM 2330 CD2 HIS B 71 21.396 39.833 5.524 1.00 0.00 C ATOM 2331 CE1 HIS B 71 21.379 41.939 4.917 1.00 0.00 C ATOM 2332 NE2 HIS B 71 20.765 41.042 5.665 1.00 0.00 N ATOM 0 H HIS B 71 24.840 37.250 3.215 1.00 0.00 H new ATOM 0 HA HIS B 71 22.100 37.583 3.344 1.00 0.00 H new ATOM 0 HB2 HIS B 71 23.790 38.425 4.971 1.00 0.00 H new ATOM 0 HB3 HIS B 71 24.321 39.619 3.802 1.00 0.00 H new ATOM 0 HD2 HIS B 71 21.126 38.908 6.012 1.00 0.00 H new ATOM 0 HE1 HIS B 71 21.108 42.981 4.828 1.00 0.00 H new ATOM 0 HE2 HIS B 71 19.951 41.220 6.254 1.00 0.00 H new ATOM 2341 N HIS B 72 21.248 39.073 1.576 1.00 0.00 N ATOM 2342 CA HIS B 72 20.708 39.924 0.531 1.00 0.00 C ATOM 2343 C HIS B 72 20.325 41.275 1.117 1.00 0.00 C ATOM 2344 O HIS B 72 21.231 42.112 1.319 1.00 0.00 O ATOM 2345 CB HIS B 72 19.493 39.266 -0.132 1.00 0.00 C ATOM 2346 CG HIS B 72 19.837 38.168 -1.092 1.00 0.00 C ATOM 2347 ND1 HIS B 72 20.772 37.190 -0.827 1.00 0.00 N ATOM 2348 CD2 HIS B 72 19.365 37.902 -2.334 1.00 0.00 C ATOM 2349 CE1 HIS B 72 20.858 36.373 -1.860 1.00 0.00 C ATOM 2350 NE2 HIS B 72 20.014 36.781 -2.787 1.00 0.00 N ATOM 2351 OXT HIS B 72 19.131 41.494 1.383 1.00 0.00 O ATOM 0 H HIS B 72 20.546 38.545 2.094 1.00 0.00 H new ATOM 0 HA HIS B 72 21.472 40.069 -0.233 1.00 0.00 H new ATOM 0 HB2 HIS B 72 18.843 38.864 0.645 1.00 0.00 H new ATOM 0 HB3 HIS B 72 18.923 40.030 -0.661 1.00 0.00 H new ATOM 0 HD1 HIS B 72 21.313 37.110 0.034 1.00 0.00 H new ATOM 0 HD2 HIS B 72 18.616 38.468 -2.869 1.00 0.00 H new ATOM 0 HE1 HIS B 72 21.510 35.515 -1.933 1.00 0.00 H new TER 2360 HIS B 72