USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 896 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 9 ASN : amide:sc= -9.8! C(o=-11!,f=-8.4!) USER MOD Set 1.2: A 130 MET CE :methyl -142:sc= -1.21 (180deg=-3.65!) USER MOD Set 2.1: A 103 THR OG1 : rot -75:sc= 1.25 USER MOD Set 2.2: A 127 CYS SG : rot 129:sc= -2.75! USER MOD Set 3.1: A 105 THR OG1 : rot -126:sc= 0.891 USER MOD Set 3.2: A 108 THR OG1 : rot 88:sc= -1.27! USER MOD Set 4.1: A 6 TYR OH : rot -22:sc= -2.75! USER MOD Set 4.2: A 133 HIS : no HD1:sc= -6.92! C(o=-9.7!,f=-11!) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl -160:sc=-0.00373 (180deg=-0.0772) USER MOD Single : A 15 THR OG1 : rot 82:sc= 0.0901 USER MOD Single : A 16 CYS SG : rot -102:sc= -4.4! USER MOD Single : A 17 GLN : amide:sc= -0.631 X(o=-0.63,f=-0.68) USER MOD Single : A 24 TYR OH : rot 180:sc=-0.00397 USER MOD Single : A 25 LYS NZ :NH3+ -140:sc= -0.063 (180deg=-1.79!) USER MOD Single : A 27 SER OG : rot 36:sc= 0.189 USER MOD Single : A 29 SER OG : rot 93:sc= 0.183 USER MOD Single : A 37 LYS NZ :NH3+ 154:sc= -0.1 (180deg=-0.551) USER MOD Single : A 38 THR OG1 : rot 32:sc= 0.55 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.22 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -6! C(o=-6!,f=-10!) USER MOD Single : A 64 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 68 GLN : amide:sc= -3.64 K(o=-3.6,f=-2.7) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot -62:sc= -2.67 USER MOD Single : A 71 SER OG : rot 60:sc= -4.02! USER MOD Single : A 76 SER OG : rot 140:sc= -2.14 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -131:sc= -2.87! (180deg=-5.99!) USER MOD Single : A 89 THR OG1 : rot -8:sc= 0.846 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -2.01! C(o=-2!,f=-0.096!) USER MOD Single : A 101 THR OG1 : rot -90:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 140:sc= -3.8! (180deg=-6.95!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 168:sc= -0.0192 (180deg=-0.183) USER MOD Single : A 124 ASN : amide:sc= -1.99 K(o=-2,f=-9.7!) USER MOD Single : A 125 LYS NZ :NH3+ -171:sc= -0.138 (180deg=-0.279) USER MOD Single : A 126 LYS NZ :NH3+ -137:sc= -0.453 (180deg=-4.46!) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 38:sc= 0.285 USER MOD Single : A 137 SER OG : rot -34:sc= -0.761 USER MOD Single : A 138 GLN : amide:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.625 14.285 0.987 1.00 0.00 N ATOM 21 CA TRP A 3 -17.247 13.127 0.098 1.00 0.00 C ATOM 22 C TRP A 3 -17.723 13.363 -1.355 1.00 0.00 C ATOM 23 O TRP A 3 -16.959 13.191 -2.299 1.00 0.00 O ATOM 24 CB TRP A 3 -17.886 11.887 0.610 1.00 0.00 C ATOM 25 CG TRP A 3 -17.005 11.170 1.612 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.395 10.045 2.205 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.636 11.462 2.151 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.417 9.606 3.071 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.322 10.431 3.079 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.639 12.487 1.959 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.118 10.400 3.770 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.430 12.430 2.667 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.179 11.393 3.568 1.00 0.00 C ATOM 0 HA TRP A 3 -16.161 13.033 0.104 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.839 12.136 1.077 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -18.104 11.220 -0.224 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.339 9.549 2.033 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.498 8.764 3.641 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.824 13.298 1.270 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.915 9.599 4.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.685 13.197 2.514 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.245 11.367 4.110 1.00 0.00 H new ATOM 44 N ASN A 4 -18.994 13.726 -1.534 1.00 0.00 N ATOM 45 CA ASN A 4 -19.550 13.947 -2.923 1.00 0.00 C ATOM 46 C ASN A 4 -18.766 15.038 -3.657 1.00 0.00 C ATOM 47 O ASN A 4 -18.797 15.107 -4.868 1.00 0.00 O ATOM 48 CB ASN A 4 -21.024 14.352 -2.839 1.00 0.00 C ATOM 49 CG ASN A 4 -21.872 13.132 -2.491 1.00 0.00 C ATOM 50 OD1 ASN A 4 -22.304 12.977 -1.367 1.00 0.00 O ATOM 51 ND2 ASN A 4 -22.134 12.249 -3.420 1.00 0.00 N ATOM 0 H ASN A 4 -19.662 13.876 -0.778 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.457 13.013 -3.478 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.156 15.127 -2.084 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.350 14.775 -3.789 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.701 11.430 -3.200 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.771 12.379 -4.364 1.00 0.00 H new ATOM 58 N ALA A 5 -18.065 15.874 -2.924 1.00 0.00 N ATOM 59 CA ALA A 5 -17.231 16.973 -3.548 1.00 0.00 C ATOM 60 C ALA A 5 -15.970 16.324 -4.112 1.00 0.00 C ATOM 61 O ALA A 5 -15.530 16.642 -5.210 1.00 0.00 O ATOM 62 CB ALA A 5 -16.857 18.013 -2.486 1.00 0.00 C ATOM 0 H ALA A 5 -18.031 15.846 -1.905 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.788 17.480 -4.336 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.257 18.800 -2.943 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.765 18.446 -2.066 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.283 17.533 -1.693 1.00 0.00 H new ATOM 68 N TYR A 6 -15.408 15.360 -3.385 1.00 0.00 N ATOM 69 CA TYR A 6 -14.193 14.620 -3.910 1.00 0.00 C ATOM 70 C TYR A 6 -14.664 13.670 -5.018 1.00 0.00 C ATOM 71 O TYR A 6 -13.887 13.169 -5.780 1.00 0.00 O ATOM 72 CB TYR A 6 -13.468 13.917 -2.767 1.00 0.00 C ATOM 73 CG TYR A 6 -13.359 14.933 -1.690 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.478 16.003 -1.821 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.215 14.862 -0.635 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.476 17.013 -0.865 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.212 15.849 0.340 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.348 16.933 0.225 1.00 0.00 C ATOM 79 OH TYR A 6 -13.379 17.945 1.165 1.00 0.00 O ATOM 0 H TYR A 6 -15.734 15.060 -2.466 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.462 15.304 -4.341 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -14.023 13.042 -2.428 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.484 13.569 -3.080 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.800 16.048 -2.660 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.901 14.032 -0.556 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.805 17.854 -0.964 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.879 15.776 1.186 1.00 0.00 H new ATOM 0 HH TYR A 6 -12.535 18.443 1.137 1.00 0.00 H new ATOM 89 N ILE A 7 -15.977 13.519 -5.150 1.00 0.00 N ATOM 90 CA ILE A 7 -16.560 12.747 -6.279 1.00 0.00 C ATOM 91 C ILE A 7 -16.792 13.818 -7.420 1.00 0.00 C ATOM 92 O ILE A 7 -16.670 13.551 -8.634 1.00 0.00 O ATOM 93 CB ILE A 7 -17.844 12.065 -5.817 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.413 10.797 -5.048 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.743 11.708 -7.011 1.00 0.00 C ATOM 96 CD1 ILE A 7 -17.015 9.674 -6.011 1.00 0.00 C ATOM 0 H ILE A 7 -16.664 13.910 -4.506 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.921 11.944 -6.645 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.430 12.728 -5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.574 11.033 -4.394 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.230 10.460 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.651 11.223 -6.651 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -19.007 12.617 -7.552 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.210 11.030 -7.678 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.716 8.794 -5.441 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.863 9.423 -6.648 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -16.182 10.005 -6.631 1.00 0.00 H new ATOM 108 N ASP A 8 -17.041 15.065 -6.994 1.00 0.00 N ATOM 109 CA ASP A 8 -17.190 16.189 -7.936 1.00 0.00 C ATOM 110 C ASP A 8 -15.830 16.438 -8.605 1.00 0.00 C ATOM 111 O ASP A 8 -15.750 17.051 -9.627 1.00 0.00 O ATOM 112 CB ASP A 8 -17.686 17.405 -7.169 1.00 0.00 C ATOM 113 CG ASP A 8 -19.220 17.424 -7.181 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.807 16.425 -6.797 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.780 18.433 -7.581 1.00 0.00 O ATOM 0 H ASP A 8 -17.143 15.322 -6.012 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.918 15.969 -8.717 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.320 17.376 -6.143 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.296 18.317 -7.621 1.00 0.00 H new ATOM 120 N ASN A 9 -14.767 15.895 -8.015 1.00 0.00 N ATOM 121 CA ASN A 9 -13.395 15.972 -8.567 1.00 0.00 C ATOM 122 C ASN A 9 -13.369 15.394 -9.944 1.00 0.00 C ATOM 123 O ASN A 9 -12.648 15.825 -10.798 1.00 0.00 O ATOM 124 CB ASN A 9 -12.517 15.098 -7.585 1.00 0.00 C ATOM 125 CG ASN A 9 -11.688 13.874 -8.276 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.875 14.108 -9.148 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.902 12.553 -7.878 1.00 0.00 N ATOM 0 H ASN A 9 -14.822 15.384 -7.134 1.00 0.00 H new ATOM 0 HA ASN A 9 -13.030 16.996 -8.641 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.807 15.754 -7.081 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.169 14.683 -6.817 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.378 11.797 -8.318 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.582 12.344 -7.147 1.00 0.00 H new ATOM 134 N LEU A 10 -14.143 14.418 -10.096 1.00 0.00 N ATOM 135 CA LEU A 10 -14.280 13.657 -11.347 1.00 0.00 C ATOM 136 C LEU A 10 -15.125 14.343 -12.284 1.00 0.00 C ATOM 137 O LEU A 10 -14.952 14.271 -13.497 1.00 0.00 O ATOM 138 CB LEU A 10 -15.000 12.392 -11.020 1.00 0.00 C ATOM 139 CG LEU A 10 -14.193 11.508 -10.123 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.663 11.590 -10.387 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.518 11.833 -8.614 1.00 0.00 C ATOM 0 H LEU A 10 -14.746 14.074 -9.349 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.287 13.508 -11.771 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.949 12.628 -10.539 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.234 11.858 -11.941 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.481 10.481 -10.349 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.139 10.924 -9.701 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.454 11.291 -11.414 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.321 12.613 -10.231 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -13.927 11.185 -7.967 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.274 12.875 -8.405 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.578 11.664 -8.426 1.00 0.00 H new ATOM 153 N MET A 11 -16.077 14.954 -11.770 1.00 0.00 N ATOM 154 CA MET A 11 -17.020 15.621 -12.612 1.00 0.00 C ATOM 155 C MET A 11 -16.339 16.936 -13.140 1.00 0.00 C ATOM 156 O MET A 11 -16.631 17.417 -14.219 1.00 0.00 O ATOM 157 CB MET A 11 -18.278 15.778 -11.757 1.00 0.00 C ATOM 158 CG MET A 11 -18.682 14.306 -11.195 1.00 0.00 C ATOM 159 SD MET A 11 -19.695 13.460 -12.436 1.00 0.00 S ATOM 160 CE MET A 11 -18.421 12.304 -13.015 1.00 0.00 C ATOM 0 H MET A 11 -16.255 15.027 -10.768 1.00 0.00 H new ATOM 0 HA MET A 11 -17.321 15.094 -13.518 1.00 0.00 H new ATOM 0 HB2 MET A 11 -18.096 16.466 -10.931 1.00 0.00 H new ATOM 0 HB3 MET A 11 -19.092 16.198 -12.348 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.785 13.725 -10.981 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.232 14.398 -10.259 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.692 11.928 -14.001 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.462 12.819 -13.074 1.00 0.00 H new ATOM 0 HE3 MET A 11 -18.343 11.470 -12.318 1.00 0.00 H new ATOM 170 N ALA A 12 -15.385 17.456 -12.371 1.00 0.00 N ATOM 171 CA ALA A 12 -14.578 18.674 -12.745 1.00 0.00 C ATOM 172 C ALA A 12 -13.331 18.377 -13.672 1.00 0.00 C ATOM 173 O ALA A 12 -12.919 19.210 -14.462 1.00 0.00 O ATOM 174 CB ALA A 12 -14.069 19.309 -11.444 1.00 0.00 C ATOM 0 H ALA A 12 -15.130 17.063 -11.465 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.236 19.328 -13.318 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.479 20.195 -11.678 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.917 19.592 -10.821 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.448 18.592 -10.908 1.00 0.00 H new ATOM 180 N ASP A 13 -12.666 17.259 -13.431 1.00 0.00 N ATOM 181 CA ASP A 13 -11.306 16.928 -14.137 1.00 0.00 C ATOM 182 C ASP A 13 -11.354 16.592 -15.631 1.00 0.00 C ATOM 183 O ASP A 13 -10.293 16.420 -16.203 1.00 0.00 O ATOM 184 CB ASP A 13 -10.633 15.707 -13.416 1.00 0.00 C ATOM 185 CG ASP A 13 -11.625 14.697 -12.962 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.624 14.549 -13.612 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.351 14.056 -11.959 1.00 0.00 O ATOM 0 H ASP A 13 -12.983 16.542 -12.779 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.748 17.861 -14.059 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.923 15.235 -14.095 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.064 16.064 -12.558 1.00 0.00 H new ATOM 192 N GLY A 14 -12.513 16.541 -16.285 1.00 0.00 N ATOM 193 CA GLY A 14 -12.572 16.220 -17.814 1.00 0.00 C ATOM 194 C GLY A 14 -11.405 15.267 -18.271 1.00 0.00 C ATOM 195 O GLY A 14 -10.891 15.375 -19.370 1.00 0.00 O ATOM 0 H GLY A 14 -13.422 16.703 -15.851 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.530 15.756 -18.049 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.521 17.150 -18.380 1.00 0.00 H new ATOM 199 N THR A 15 -11.006 14.372 -17.398 1.00 0.00 N ATOM 200 CA THR A 15 -9.892 13.399 -17.658 1.00 0.00 C ATOM 201 C THR A 15 -10.289 12.077 -17.049 1.00 0.00 C ATOM 202 O THR A 15 -10.045 11.011 -17.610 1.00 0.00 O ATOM 203 CB THR A 15 -8.619 13.912 -16.985 1.00 0.00 C ATOM 204 OG1 THR A 15 -8.091 15.001 -17.728 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.613 12.783 -16.935 1.00 0.00 C ATOM 0 H THR A 15 -11.426 14.272 -16.474 1.00 0.00 H new ATOM 0 HA THR A 15 -9.711 13.286 -18.727 1.00 0.00 H new ATOM 0 HB THR A 15 -8.841 14.254 -15.974 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.570 15.822 -17.490 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.698 13.132 -16.457 1.00 0.00 H new ATOM 0 HG22 THR A 15 -8.027 11.952 -16.363 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.389 12.450 -17.948 1.00 0.00 H new ATOM 213 N CYS A 16 -10.865 12.154 -15.895 1.00 0.00 N ATOM 214 CA CYS A 16 -11.271 10.973 -15.168 1.00 0.00 C ATOM 215 C CYS A 16 -12.458 10.318 -15.932 1.00 0.00 C ATOM 216 O CYS A 16 -12.862 10.767 -17.001 1.00 0.00 O ATOM 217 CB CYS A 16 -11.729 11.470 -13.758 1.00 0.00 C ATOM 218 SG CYS A 16 -13.505 11.820 -13.772 1.00 0.00 S ATOM 0 H CYS A 16 -11.072 13.033 -15.420 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.473 10.237 -15.073 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.505 10.713 -13.006 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.175 12.367 -13.482 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.694 13.103 -13.856 1.00 0.00 H new ATOM 224 N GLN A 17 -13.037 9.329 -15.328 1.00 0.00 N ATOM 225 CA GLN A 17 -14.236 8.655 -15.873 1.00 0.00 C ATOM 226 C GLN A 17 -15.024 8.121 -14.683 1.00 0.00 C ATOM 227 O GLN A 17 -16.238 8.264 -14.607 1.00 0.00 O ATOM 228 CB GLN A 17 -13.853 7.567 -16.821 1.00 0.00 C ATOM 229 CG GLN A 17 -15.003 7.356 -17.809 1.00 0.00 C ATOM 230 CD GLN A 17 -15.204 8.612 -18.689 1.00 0.00 C ATOM 231 OE1 GLN A 17 -14.274 9.118 -19.285 1.00 0.00 O ATOM 232 NE2 GLN A 17 -16.398 9.139 -18.779 1.00 0.00 N ATOM 0 H GLN A 17 -12.713 8.945 -14.440 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.849 9.350 -16.446 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -12.940 7.833 -17.354 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.647 6.645 -16.277 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.793 6.493 -18.441 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.921 7.136 -17.265 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.181 8.717 -18.280 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.546 9.972 -19.348 1.00 0.00 H new ATOM 241 N ASP A 18 -14.309 7.558 -13.708 1.00 0.00 N ATOM 242 CA ASP A 18 -14.954 7.066 -12.455 1.00 0.00 C ATOM 243 C ASP A 18 -14.120 7.551 -11.264 1.00 0.00 C ATOM 244 O ASP A 18 -13.201 8.348 -11.429 1.00 0.00 O ATOM 245 CB ASP A 18 -15.093 5.543 -12.466 1.00 0.00 C ATOM 246 CG ASP A 18 -16.329 5.136 -11.656 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.394 5.661 -11.934 1.00 0.00 O ATOM 248 OD2 ASP A 18 -16.186 4.313 -10.767 1.00 0.00 O ATOM 0 H ASP A 18 -13.298 7.425 -13.744 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.965 7.465 -12.376 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.182 5.183 -13.491 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.200 5.083 -12.043 1.00 0.00 H new ATOM 253 N ALA A 19 -14.476 7.145 -10.071 1.00 0.00 N ATOM 254 CA ALA A 19 -13.767 7.624 -8.845 1.00 0.00 C ATOM 255 C ALA A 19 -14.236 6.831 -7.677 1.00 0.00 C ATOM 256 O ALA A 19 -15.442 6.681 -7.526 1.00 0.00 O ATOM 257 CB ALA A 19 -14.185 9.007 -8.646 1.00 0.00 C ATOM 0 H ALA A 19 -15.239 6.492 -9.892 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.686 7.529 -8.947 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -13.696 9.411 -7.760 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -13.906 9.600 -9.517 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.266 9.045 -8.513 1.00 0.00 H new ATOM 263 N ALA A 20 -13.360 6.324 -6.813 1.00 0.00 N ATOM 264 CA ALA A 20 -13.934 5.561 -5.639 1.00 0.00 C ATOM 265 C ALA A 20 -13.208 5.742 -4.338 1.00 0.00 C ATOM 266 O ALA A 20 -12.150 5.175 -4.102 1.00 0.00 O ATOM 267 CB ALA A 20 -14.020 4.100 -5.940 1.00 0.00 C ATOM 0 H ALA A 20 -12.344 6.398 -6.863 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.925 5.995 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.436 3.575 -5.080 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.663 3.944 -6.806 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -13.024 3.713 -6.154 1.00 0.00 H new ATOM 273 N ILE A 21 -13.870 6.427 -3.434 1.00 0.00 N ATOM 274 CA ILE A 21 -13.363 6.555 -2.057 1.00 0.00 C ATOM 275 C ILE A 21 -13.932 5.305 -1.404 1.00 0.00 C ATOM 276 O ILE A 21 -15.126 5.053 -1.525 1.00 0.00 O ATOM 277 CB ILE A 21 -13.906 7.815 -1.396 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.528 9.020 -2.285 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.285 7.956 0.018 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.746 10.330 -1.537 1.00 0.00 C ATOM 0 H ILE A 21 -14.754 6.906 -3.609 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.279 6.637 -1.985 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.990 7.768 -1.290 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.485 8.939 -2.591 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.129 9.010 -3.194 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.670 8.857 0.496 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.547 7.085 0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.200 8.025 -0.066 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.474 11.166 -2.181 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.795 10.417 -1.253 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.125 10.345 -0.641 1.00 0.00 H new ATOM 292 N VAL A 22 -13.120 4.468 -0.805 1.00 0.00 N ATOM 293 CA VAL A 22 -13.668 3.184 -0.264 1.00 0.00 C ATOM 294 C VAL A 22 -13.222 2.924 1.175 1.00 0.00 C ATOM 295 O VAL A 22 -12.063 2.677 1.398 1.00 0.00 O ATOM 296 CB VAL A 22 -13.128 2.021 -1.142 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.790 0.696 -0.733 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.406 2.304 -2.632 1.00 0.00 C ATOM 0 H VAL A 22 -12.120 4.613 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.756 3.250 -0.280 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.051 1.943 -0.990 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.404 -0.111 -1.355 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.568 0.486 0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.869 0.772 -0.866 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.023 1.482 -3.236 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.480 2.400 -2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.912 3.230 -2.925 1.00 0.00 H new ATOM 308 N GLY A 23 -14.154 2.920 2.146 1.00 0.00 N ATOM 309 CA GLY A 23 -13.778 2.588 3.582 1.00 0.00 C ATOM 310 C GLY A 23 -13.268 1.132 3.581 1.00 0.00 C ATOM 311 O GLY A 23 -14.016 0.200 3.750 1.00 0.00 O ATOM 0 H GLY A 23 -15.141 3.130 1.999 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.008 3.268 3.948 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.638 2.696 4.242 1.00 0.00 H new ATOM 315 N TYR A 24 -12.000 0.980 3.312 1.00 0.00 N ATOM 316 CA TYR A 24 -11.327 -0.357 3.176 1.00 0.00 C ATOM 317 C TYR A 24 -10.840 -0.926 4.540 1.00 0.00 C ATOM 318 O TYR A 24 -9.817 -1.607 4.599 1.00 0.00 O ATOM 319 CB TYR A 24 -10.134 -0.139 2.199 1.00 0.00 C ATOM 320 CG TYR A 24 -8.900 0.375 2.942 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.977 1.474 3.813 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.700 -0.272 2.754 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.829 1.912 4.477 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.554 0.153 3.409 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.610 1.253 4.275 1.00 0.00 C ATOM 326 OH TYR A 24 -5.469 1.684 4.929 1.00 0.00 O ATOM 0 H TYR A 24 -11.367 1.767 3.173 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.031 -1.098 2.797 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.895 -1.076 1.697 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.419 0.574 1.425 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.919 1.978 3.969 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.650 -1.121 2.088 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.881 2.758 5.146 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.619 -0.364 3.252 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.712 1.115 4.676 1.00 0.00 H new ATOM 336 N LYS A 25 -11.564 -0.679 5.605 1.00 0.00 N ATOM 337 CA LYS A 25 -11.163 -1.226 6.937 1.00 0.00 C ATOM 338 C LYS A 25 -11.366 -2.741 6.886 1.00 0.00 C ATOM 339 O LYS A 25 -11.375 -3.331 5.807 1.00 0.00 O ATOM 340 CB LYS A 25 -12.017 -0.590 8.032 1.00 0.00 C ATOM 341 CG LYS A 25 -11.583 0.857 8.237 1.00 0.00 C ATOM 342 CD LYS A 25 -12.067 1.686 7.075 1.00 0.00 C ATOM 343 CE LYS A 25 -12.293 3.111 7.529 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.308 3.143 8.621 1.00 0.00 N ATOM 0 H LYS A 25 -12.417 -0.120 5.608 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.121 -1.000 7.162 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.071 -0.629 7.756 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.910 -1.148 8.962 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.992 1.243 9.171 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.497 0.917 8.315 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.335 1.662 6.268 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.992 1.269 6.678 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.356 3.543 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.630 3.720 6.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.936 3.961 8.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.870 2.268 8.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.827 3.222 9.540 1.00 0.00 H new ATOM 358 N ASP A 26 -11.550 -3.383 8.025 1.00 0.00 N ATOM 359 CA ASP A 26 -11.790 -4.897 8.051 1.00 0.00 C ATOM 360 C ASP A 26 -12.871 -5.229 7.021 1.00 0.00 C ATOM 361 O ASP A 26 -12.648 -5.983 6.083 1.00 0.00 O ATOM 362 CB ASP A 26 -12.259 -5.366 9.437 1.00 0.00 C ATOM 363 CG ASP A 26 -13.098 -4.290 10.153 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.508 -3.410 10.760 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.313 -4.377 10.091 1.00 0.00 O ATOM 0 H ASP A 26 -11.547 -2.937 8.942 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.854 -5.406 7.819 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -12.849 -6.276 9.332 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.392 -5.617 10.048 1.00 0.00 H new ATOM 370 N SER A 27 -14.014 -4.607 7.177 1.00 0.00 N ATOM 371 CA SER A 27 -15.128 -4.763 6.228 1.00 0.00 C ATOM 372 C SER A 27 -15.072 -3.535 5.296 1.00 0.00 C ATOM 373 O SER A 27 -15.155 -2.415 5.781 1.00 0.00 O ATOM 374 CB SER A 27 -16.442 -4.785 6.987 1.00 0.00 C ATOM 375 OG SER A 27 -16.418 -3.811 8.026 1.00 0.00 O ATOM 0 H SER A 27 -14.214 -3.978 7.955 1.00 0.00 H new ATOM 0 HA SER A 27 -15.052 -5.692 5.662 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.269 -4.583 6.306 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.612 -5.776 7.409 1.00 0.00 H new ATOM 0 HG SER A 27 -15.928 -3.019 7.721 1.00 0.00 H new ATOM 381 N PRO A 28 -14.877 -3.760 3.988 1.00 0.00 N ATOM 382 CA PRO A 28 -14.743 -2.675 3.031 1.00 0.00 C ATOM 383 C PRO A 28 -16.094 -2.112 2.640 1.00 0.00 C ATOM 384 O PRO A 28 -17.119 -2.768 2.787 1.00 0.00 O ATOM 385 CB PRO A 28 -14.051 -3.319 1.843 1.00 0.00 C ATOM 386 CG PRO A 28 -14.325 -4.831 1.959 1.00 0.00 C ATOM 387 CD PRO A 28 -14.791 -5.093 3.381 1.00 0.00 C ATOM 0 HA PRO A 28 -14.185 -1.830 3.435 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.439 -2.923 0.904 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.980 -3.114 1.857 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -15.085 -5.141 1.241 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.425 -5.404 1.737 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.756 -5.599 3.396 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -14.088 -5.730 3.918 1.00 0.00 H new ATOM 395 N SER A 29 -16.099 -0.889 2.133 1.00 0.00 N ATOM 396 CA SER A 29 -17.352 -0.245 1.712 1.00 0.00 C ATOM 397 C SER A 29 -17.030 0.931 0.826 1.00 0.00 C ATOM 398 O SER A 29 -15.920 1.431 0.822 1.00 0.00 O ATOM 399 CB SER A 29 -18.130 0.230 2.935 1.00 0.00 C ATOM 400 OG SER A 29 -17.276 1.012 3.761 1.00 0.00 O ATOM 0 H SER A 29 -15.263 -0.320 2.000 1.00 0.00 H new ATOM 0 HA SER A 29 -17.962 -0.962 1.163 1.00 0.00 H new ATOM 0 HB2 SER A 29 -18.994 0.818 2.625 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.511 -0.626 3.493 1.00 0.00 H new ATOM 0 HG SER A 29 -17.374 1.959 3.529 1.00 0.00 H new ATOM 406 N VAL A 30 -17.994 1.364 0.070 1.00 0.00 N ATOM 407 CA VAL A 30 -17.806 2.493 -0.840 1.00 0.00 C ATOM 408 C VAL A 30 -18.230 3.768 -0.126 1.00 0.00 C ATOM 409 O VAL A 30 -19.412 4.077 -0.029 1.00 0.00 O ATOM 410 CB VAL A 30 -18.650 2.219 -2.061 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.660 3.429 -2.998 1.00 0.00 C ATOM 412 CG2 VAL A 30 -18.040 1.028 -2.776 1.00 0.00 C ATOM 0 H VAL A 30 -18.931 0.960 0.054 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.767 2.617 -1.144 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.679 2.017 -1.765 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.274 3.208 -3.871 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -19.071 4.292 -2.474 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.642 3.650 -3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.625 0.800 -3.667 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -17.016 1.263 -3.065 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -18.040 0.165 -2.110 1.00 0.00 H new ATOM 422 N TRP A 31 -17.261 4.500 0.385 1.00 0.00 N ATOM 423 CA TRP A 31 -17.550 5.760 1.117 1.00 0.00 C ATOM 424 C TRP A 31 -18.043 6.822 0.153 1.00 0.00 C ATOM 425 O TRP A 31 -18.783 7.720 0.537 1.00 0.00 O ATOM 426 CB TRP A 31 -16.270 6.212 1.845 1.00 0.00 C ATOM 427 CG TRP A 31 -16.185 5.503 3.186 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.971 4.456 3.571 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.296 5.762 4.309 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.639 4.087 4.834 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.614 4.852 5.345 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.260 6.687 4.539 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.944 4.860 6.556 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.578 6.695 5.769 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.924 5.784 6.775 1.00 0.00 C ATOM 0 H TRP A 31 -16.271 4.265 0.319 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.337 5.597 1.854 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.392 5.981 1.241 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.282 7.292 1.991 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.737 3.994 2.966 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -17.095 3.331 5.345 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.988 7.393 3.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.210 4.153 7.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.784 7.407 5.939 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.401 5.798 7.720 1.00 0.00 H new ATOM 446 N ALA A 32 -17.666 6.712 -1.110 1.00 0.00 N ATOM 447 CA ALA A 32 -18.139 7.708 -2.138 1.00 0.00 C ATOM 448 C ALA A 32 -17.545 7.385 -3.516 1.00 0.00 C ATOM 449 O ALA A 32 -16.545 7.961 -3.927 1.00 0.00 O ATOM 450 CB ALA A 32 -17.730 9.135 -1.712 1.00 0.00 C ATOM 0 H ALA A 32 -17.055 5.979 -1.470 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.225 7.649 -2.206 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.074 9.850 -2.459 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.182 9.371 -0.748 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.645 9.193 -1.628 1.00 0.00 H new ATOM 456 N ALA A 33 -18.183 6.483 -4.245 1.00 0.00 N ATOM 457 CA ALA A 33 -17.702 6.126 -5.610 1.00 0.00 C ATOM 458 C ALA A 33 -18.802 6.414 -6.601 1.00 0.00 C ATOM 459 O ALA A 33 -19.937 6.005 -6.408 1.00 0.00 O ATOM 460 CB ALA A 33 -17.343 4.639 -5.691 1.00 0.00 C ATOM 0 H ALA A 33 -19.019 5.983 -3.941 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.812 6.714 -5.834 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -16.995 4.403 -6.697 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.555 4.415 -4.972 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.224 4.039 -5.462 1.00 0.00 H new ATOM 466 N VAL A 34 -18.472 7.096 -7.681 1.00 0.00 N ATOM 467 CA VAL A 34 -19.499 7.416 -8.752 1.00 0.00 C ATOM 468 C VAL A 34 -20.238 6.086 -9.121 1.00 0.00 C ATOM 469 O VAL A 34 -19.650 5.230 -9.763 1.00 0.00 O ATOM 470 CB VAL A 34 -18.772 7.992 -9.983 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.792 8.430 -11.037 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.935 9.213 -9.557 1.00 0.00 C ATOM 0 H VAL A 34 -17.534 7.448 -7.872 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.223 8.151 -8.400 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.124 7.224 -10.404 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.269 8.836 -11.903 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.390 7.572 -11.343 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.444 9.195 -10.616 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.420 9.622 -10.426 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.591 9.973 -9.133 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.201 8.909 -8.810 1.00 0.00 H new ATOM 482 N PRO A 35 -21.494 5.920 -8.640 1.00 0.00 N ATOM 483 CA PRO A 35 -22.256 4.679 -8.859 1.00 0.00 C ATOM 484 C PRO A 35 -22.732 4.529 -10.298 1.00 0.00 C ATOM 485 O PRO A 35 -23.049 5.500 -10.973 1.00 0.00 O ATOM 486 CB PRO A 35 -23.442 4.789 -7.891 1.00 0.00 C ATOM 487 CG PRO A 35 -23.610 6.298 -7.577 1.00 0.00 C ATOM 488 CD PRO A 35 -22.243 6.953 -7.874 1.00 0.00 C ATOM 0 HA PRO A 35 -21.642 3.796 -8.680 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.348 4.382 -8.339 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.254 4.221 -6.980 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.395 6.739 -8.192 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -23.897 6.450 -6.536 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.359 7.870 -8.452 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.723 7.220 -6.954 1.00 0.00 H new ATOM 496 N GLY A 36 -22.792 3.286 -10.758 1.00 0.00 N ATOM 497 CA GLY A 36 -23.253 2.994 -12.144 1.00 0.00 C ATOM 498 C GLY A 36 -22.092 2.458 -12.988 1.00 0.00 C ATOM 499 O GLY A 36 -22.315 1.782 -13.986 1.00 0.00 O ATOM 0 H GLY A 36 -22.535 2.462 -10.214 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.061 2.263 -12.119 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.655 3.899 -12.599 1.00 0.00 H new ATOM 503 N LYS A 37 -20.850 2.778 -12.620 1.00 0.00 N ATOM 504 CA LYS A 37 -19.672 2.306 -13.436 1.00 0.00 C ATOM 505 C LYS A 37 -19.127 0.935 -12.956 1.00 0.00 C ATOM 506 O LYS A 37 -19.593 -0.099 -13.425 1.00 0.00 O ATOM 507 CB LYS A 37 -18.566 3.374 -13.406 1.00 0.00 C ATOM 508 CG LYS A 37 -19.109 4.721 -13.955 1.00 0.00 C ATOM 509 CD LYS A 37 -19.810 4.512 -15.319 1.00 0.00 C ATOM 510 CE LYS A 37 -19.882 5.839 -16.068 1.00 0.00 C ATOM 511 NZ LYS A 37 -18.517 6.226 -16.513 1.00 0.00 N ATOM 0 H LYS A 37 -20.613 3.338 -11.801 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.013 2.160 -14.461 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.206 3.507 -12.386 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.716 3.045 -14.004 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.811 5.154 -13.242 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.290 5.431 -14.066 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.263 3.778 -15.911 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.813 4.115 -15.166 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.546 5.749 -16.928 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.300 6.612 -15.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -18.585 6.837 -17.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.036 6.741 -15.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -17.974 5.371 -16.750 1.00 0.00 H new ATOM 525 N THR A 38 -18.108 0.901 -12.068 1.00 0.00 N ATOM 526 CA THR A 38 -17.524 -0.438 -11.642 1.00 0.00 C ATOM 527 C THR A 38 -16.866 -0.390 -10.227 1.00 0.00 C ATOM 528 O THR A 38 -16.937 -1.357 -9.486 1.00 0.00 O ATOM 529 CB THR A 38 -16.475 -0.845 -12.736 1.00 0.00 C ATOM 530 OG1 THR A 38 -17.129 -1.607 -13.740 1.00 0.00 O ATOM 531 CG2 THR A 38 -15.280 -1.671 -12.165 1.00 0.00 C ATOM 0 H THR A 38 -17.678 1.721 -11.640 1.00 0.00 H new ATOM 0 HA THR A 38 -18.323 -1.175 -11.562 1.00 0.00 H new ATOM 0 HB THR A 38 -16.060 0.077 -13.143 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.054 -1.297 -13.836 1.00 0.00 H new ATOM 0 HG21 THR A 38 -14.591 -1.920 -12.972 1.00 0.00 H new ATOM 0 HG22 THR A 38 -14.758 -1.082 -11.411 1.00 0.00 H new ATOM 0 HG23 THR A 38 -15.655 -2.589 -11.712 1.00 0.00 H new ATOM 539 N PHE A 39 -16.187 0.686 -9.894 1.00 0.00 N ATOM 540 CA PHE A 39 -15.456 0.766 -8.571 1.00 0.00 C ATOM 541 C PHE A 39 -16.396 0.606 -7.391 1.00 0.00 C ATOM 542 O PHE A 39 -16.076 -0.062 -6.435 1.00 0.00 O ATOM 543 CB PHE A 39 -14.803 2.112 -8.428 1.00 0.00 C ATOM 544 CG PHE A 39 -13.582 2.280 -9.345 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.419 1.510 -10.517 1.00 0.00 C ATOM 546 CD2 PHE A 39 -12.601 3.223 -9.001 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.302 1.691 -11.316 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.481 3.390 -9.813 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.338 2.621 -10.967 1.00 0.00 C ATOM 0 H PHE A 39 -16.104 1.517 -10.479 1.00 0.00 H new ATOM 0 HA PHE A 39 -14.724 -0.042 -8.570 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -15.532 2.890 -8.654 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.496 2.254 -7.392 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.166 0.779 -10.791 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -12.714 3.819 -8.107 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.183 1.104 -12.215 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.725 4.114 -9.549 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.468 2.752 -11.594 1.00 0.00 H new ATOM 559 N VAL A 40 -17.532 1.254 -7.449 1.00 0.00 N ATOM 560 CA VAL A 40 -18.537 1.207 -6.327 1.00 0.00 C ATOM 561 C VAL A 40 -18.906 -0.256 -6.015 1.00 0.00 C ATOM 562 O VAL A 40 -19.381 -0.564 -4.926 1.00 0.00 O ATOM 563 CB VAL A 40 -19.789 2.030 -6.716 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.189 1.691 -8.135 1.00 0.00 C ATOM 565 CG2 VAL A 40 -20.953 1.729 -5.754 1.00 0.00 C ATOM 0 H VAL A 40 -17.817 1.828 -8.242 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.105 1.645 -5.428 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.553 3.092 -6.647 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.071 2.269 -8.412 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.369 1.932 -8.812 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.416 0.627 -8.205 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -21.825 2.316 -6.043 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.199 0.668 -5.801 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -20.661 1.989 -4.737 1.00 0.00 H new ATOM 575 N ASN A 41 -18.662 -1.163 -6.942 1.00 0.00 N ATOM 576 CA ASN A 41 -18.945 -2.586 -6.697 1.00 0.00 C ATOM 577 C ASN A 41 -17.722 -3.209 -5.984 1.00 0.00 C ATOM 578 O ASN A 41 -17.479 -4.409 -6.086 1.00 0.00 O ATOM 579 CB ASN A 41 -19.174 -3.271 -8.033 1.00 0.00 C ATOM 580 CG ASN A 41 -20.621 -3.051 -8.485 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.471 -3.894 -8.274 1.00 0.00 O ATOM 582 ND2 ASN A 41 -20.937 -1.947 -9.102 1.00 0.00 N ATOM 0 H ASN A 41 -18.274 -0.956 -7.862 1.00 0.00 H new ATOM 0 HA ASN A 41 -19.831 -2.707 -6.074 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -18.486 -2.874 -8.779 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -18.968 -4.338 -7.946 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -21.897 -1.791 -9.408 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -20.224 -1.240 -9.279 1.00 0.00 H new ATOM 589 N ILE A 42 -16.922 -2.379 -5.276 1.00 0.00 N ATOM 590 CA ILE A 42 -15.721 -2.880 -4.595 1.00 0.00 C ATOM 591 C ILE A 42 -16.098 -3.671 -3.300 1.00 0.00 C ATOM 592 O ILE A 42 -16.933 -3.280 -2.505 1.00 0.00 O ATOM 593 CB ILE A 42 -14.764 -1.669 -4.312 1.00 0.00 C ATOM 594 CG1 ILE A 42 -13.816 -1.508 -5.519 1.00 0.00 C ATOM 595 CG2 ILE A 42 -13.924 -1.882 -3.035 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.434 -0.033 -5.703 1.00 0.00 C ATOM 0 H ILE A 42 -17.087 -1.379 -5.166 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.195 -3.591 -5.233 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.372 -0.777 -4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -12.918 -2.107 -5.367 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.299 -1.881 -6.422 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.276 -1.020 -2.878 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.588 -1.998 -2.178 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.314 -2.779 -3.146 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.765 0.066 -6.558 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.334 0.557 -5.876 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.931 0.327 -4.805 1.00 0.00 H new ATOM 608 N THR A 43 -15.442 -4.774 -3.157 1.00 0.00 N ATOM 609 CA THR A 43 -15.601 -5.730 -2.011 1.00 0.00 C ATOM 610 C THR A 43 -14.177 -5.955 -1.397 1.00 0.00 C ATOM 611 O THR A 43 -13.238 -5.374 -1.894 1.00 0.00 O ATOM 612 CB THR A 43 -16.136 -7.039 -2.642 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.446 -7.302 -3.865 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.631 -6.894 -2.934 1.00 0.00 C ATOM 0 H THR A 43 -14.746 -5.084 -3.836 1.00 0.00 H new ATOM 0 HA THR A 43 -16.273 -5.377 -1.229 1.00 0.00 H new ATOM 0 HB THR A 43 -15.974 -7.862 -1.946 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.786 -8.132 -4.261 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.006 -7.816 -3.378 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.166 -6.695 -2.005 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.788 -6.067 -3.627 1.00 0.00 H new ATOM 622 N PRO A 44 -14.020 -6.817 -0.352 1.00 0.00 N ATOM 623 CA PRO A 44 -12.675 -7.082 0.227 1.00 0.00 C ATOM 624 C PRO A 44 -11.793 -7.913 -0.717 1.00 0.00 C ATOM 625 O PRO A 44 -10.633 -8.178 -0.425 1.00 0.00 O ATOM 626 CB PRO A 44 -12.956 -7.810 1.518 1.00 0.00 C ATOM 627 CG PRO A 44 -14.387 -8.400 1.400 1.00 0.00 C ATOM 628 CD PRO A 44 -15.113 -7.571 0.313 1.00 0.00 C ATOM 0 HA PRO A 44 -12.113 -6.162 0.388 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.224 -8.601 1.682 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.887 -7.131 2.368 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.351 -9.454 1.125 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -14.913 -8.337 2.353 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.642 -8.213 -0.392 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.853 -6.900 0.750 1.00 0.00 H new ATOM 636 N ALA A 45 -12.328 -8.280 -1.847 1.00 0.00 N ATOM 637 CA ALA A 45 -11.564 -9.053 -2.869 1.00 0.00 C ATOM 638 C ALA A 45 -10.745 -8.075 -3.688 1.00 0.00 C ATOM 639 O ALA A 45 -9.507 -8.081 -3.665 1.00 0.00 O ATOM 640 CB ALA A 45 -12.551 -9.759 -3.783 1.00 0.00 C ATOM 0 H ALA A 45 -13.290 -8.071 -2.113 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.913 -9.785 -2.390 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.006 -10.329 -4.536 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.172 -10.435 -3.195 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.184 -9.020 -4.275 1.00 0.00 H new ATOM 646 N GLU A 46 -11.436 -7.218 -4.391 1.00 0.00 N ATOM 647 CA GLU A 46 -10.736 -6.164 -5.244 1.00 0.00 C ATOM 648 C GLU A 46 -9.921 -5.268 -4.313 1.00 0.00 C ATOM 649 O GLU A 46 -8.810 -4.873 -4.629 1.00 0.00 O ATOM 650 CB GLU A 46 -11.744 -5.307 -6.072 1.00 0.00 C ATOM 651 CG GLU A 46 -13.072 -5.175 -5.374 1.00 0.00 C ATOM 652 CD GLU A 46 -14.091 -6.151 -5.984 1.00 0.00 C ATOM 653 OE1 GLU A 46 -13.771 -7.323 -6.093 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.173 -5.707 -6.330 1.00 0.00 O ATOM 0 H GLU A 46 -12.455 -7.188 -4.423 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.091 -6.667 -5.965 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.323 -4.316 -6.243 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.892 -5.764 -7.050 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -12.954 -5.379 -4.310 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.438 -4.152 -5.464 1.00 0.00 H new ATOM 661 N VAL A 47 -10.454 -5.014 -3.132 1.00 0.00 N ATOM 662 CA VAL A 47 -9.733 -4.221 -2.099 1.00 0.00 C ATOM 663 C VAL A 47 -8.702 -5.112 -1.395 1.00 0.00 C ATOM 664 O VAL A 47 -7.725 -4.619 -0.867 1.00 0.00 O ATOM 665 CB VAL A 47 -10.781 -3.564 -1.147 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.310 -3.469 0.262 1.00 0.00 C ATOM 667 CG2 VAL A 47 -10.967 -2.109 -1.568 1.00 0.00 C ATOM 0 H VAL A 47 -11.379 -5.335 -2.845 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.163 -3.404 -2.541 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.677 -4.181 -1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.083 -3.004 0.873 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.098 -4.468 0.643 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.403 -2.866 0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.697 -1.631 -0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.015 -1.584 -1.494 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.323 -2.071 -2.598 1.00 0.00 H new ATOM 677 N GLY A 48 -8.902 -6.413 -1.421 1.00 0.00 N ATOM 678 CA GLY A 48 -7.925 -7.351 -0.792 1.00 0.00 C ATOM 679 C GLY A 48 -6.587 -7.241 -1.513 1.00 0.00 C ATOM 680 O GLY A 48 -5.547 -7.489 -0.942 1.00 0.00 O ATOM 0 H GLY A 48 -9.708 -6.863 -1.856 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.803 -7.113 0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.298 -8.374 -0.847 1.00 0.00 H new ATOM 684 N VAL A 49 -6.620 -6.874 -2.775 1.00 0.00 N ATOM 685 CA VAL A 49 -5.344 -6.734 -3.578 1.00 0.00 C ATOM 686 C VAL A 49 -4.930 -5.255 -3.671 1.00 0.00 C ATOM 687 O VAL A 49 -3.748 -4.936 -3.725 1.00 0.00 O ATOM 688 CB VAL A 49 -5.527 -7.340 -4.976 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.582 -6.565 -5.776 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.187 -7.306 -5.712 1.00 0.00 C ATOM 0 H VAL A 49 -7.475 -6.663 -3.291 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.548 -7.279 -3.071 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.871 -8.369 -4.874 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.693 -7.014 -6.763 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.537 -6.602 -5.251 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.267 -5.527 -5.883 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.307 -7.735 -6.707 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.846 -6.274 -5.800 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.451 -7.885 -5.154 1.00 0.00 H new ATOM 700 N LEU A 50 -5.893 -4.372 -3.640 1.00 0.00 N ATOM 701 CA LEU A 50 -5.624 -2.914 -3.664 1.00 0.00 C ATOM 702 C LEU A 50 -5.074 -2.471 -2.311 1.00 0.00 C ATOM 703 O LEU A 50 -4.636 -1.338 -2.160 1.00 0.00 O ATOM 704 CB LEU A 50 -6.956 -2.192 -3.860 1.00 0.00 C ATOM 705 CG LEU A 50 -7.317 -1.908 -5.309 1.00 0.00 C ATOM 706 CD1 LEU A 50 -8.861 -1.808 -5.414 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.725 -0.558 -5.709 1.00 0.00 C ATOM 0 H LEU A 50 -6.883 -4.614 -3.598 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.913 -2.688 -4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.748 -2.792 -3.413 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.926 -1.248 -3.316 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.933 -2.697 -5.955 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.143 -1.604 -6.447 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.309 -2.749 -5.094 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.218 -1.001 -4.775 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.978 -0.343 -6.747 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.133 0.223 -5.067 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.641 -0.589 -5.598 1.00 0.00 H new ATOM 719 N VAL A 51 -5.201 -3.323 -1.298 1.00 0.00 N ATOM 720 CA VAL A 51 -4.800 -2.909 0.095 1.00 0.00 C ATOM 721 C VAL A 51 -4.221 -4.074 0.919 1.00 0.00 C ATOM 722 O VAL A 51 -3.533 -3.848 1.908 1.00 0.00 O ATOM 723 CB VAL A 51 -6.100 -2.320 0.799 1.00 0.00 C ATOM 724 CG1 VAL A 51 -6.983 -1.596 -0.236 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.951 -3.438 1.462 1.00 0.00 C ATOM 0 H VAL A 51 -5.561 -4.274 -1.380 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.005 -2.166 0.035 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.760 -1.626 1.568 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.869 -1.197 0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.420 -0.779 -0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.285 -2.299 -1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.830 -2.996 1.932 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.267 -4.154 0.703 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.354 -3.950 2.217 1.00 0.00 H new ATOM 735 N GLY A 52 -4.516 -5.303 0.541 1.00 0.00 N ATOM 736 CA GLY A 52 -4.027 -6.488 1.295 1.00 0.00 C ATOM 737 C GLY A 52 -2.545 -6.371 1.587 1.00 0.00 C ATOM 738 O GLY A 52 -1.821 -5.611 0.958 1.00 0.00 O ATOM 0 H GLY A 52 -5.086 -5.527 -0.275 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.579 -6.582 2.230 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -4.218 -7.394 0.720 1.00 0.00 H new ATOM 822 N PHE A 58 0.417 -9.040 -6.973 1.00 0.00 N ATOM 823 CA PHE A 58 -0.253 -7.865 -7.703 1.00 0.00 C ATOM 824 C PHE A 58 0.684 -6.744 -8.157 1.00 0.00 C ATOM 825 O PHE A 58 0.347 -6.040 -9.099 1.00 0.00 O ATOM 826 CB PHE A 58 -1.454 -7.311 -6.907 1.00 0.00 C ATOM 827 CG PHE A 58 -1.071 -6.365 -5.772 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.547 -5.089 -6.043 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.313 -6.750 -4.446 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.269 -4.212 -4.992 1.00 0.00 C ATOM 831 CE2 PHE A 58 -1.025 -5.871 -3.396 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.507 -4.605 -3.669 1.00 0.00 C ATOM 0 HA PHE A 58 -0.615 -8.303 -8.633 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.119 -6.786 -7.593 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.018 -8.147 -6.493 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.360 -4.787 -7.063 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.722 -7.727 -4.234 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.130 -3.230 -5.200 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.204 -6.173 -2.375 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.289 -3.926 -2.858 1.00 0.00 H new ATOM 842 N TYR A 59 1.833 -6.531 -7.527 1.00 0.00 N ATOM 843 CA TYR A 59 2.730 -5.397 -7.994 1.00 0.00 C ATOM 844 C TYR A 59 3.194 -5.570 -9.443 1.00 0.00 C ATOM 845 O TYR A 59 3.867 -4.696 -9.981 1.00 0.00 O ATOM 846 CB TYR A 59 3.962 -5.242 -7.107 1.00 0.00 C ATOM 847 CG TYR A 59 3.608 -5.288 -5.647 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.727 -4.358 -5.108 1.00 0.00 C ATOM 849 CD2 TYR A 59 4.203 -6.241 -4.831 1.00 0.00 C ATOM 850 CE1 TYR A 59 2.438 -4.383 -3.739 1.00 0.00 C ATOM 851 CE2 TYR A 59 3.910 -6.276 -3.463 1.00 0.00 C ATOM 852 CZ TYR A 59 3.028 -5.345 -2.917 1.00 0.00 C ATOM 853 OH TYR A 59 2.743 -5.369 -1.568 1.00 0.00 O ATOM 0 H TYR A 59 2.181 -7.073 -6.736 1.00 0.00 H new ATOM 0 HA TYR A 59 2.114 -4.500 -7.926 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.675 -6.035 -7.333 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.455 -4.296 -7.332 1.00 0.00 H new ATOM 0 HD1 TYR A 59 2.266 -3.617 -5.745 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.893 -6.957 -5.253 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.758 -3.657 -3.318 1.00 0.00 H new ATOM 0 HE2 TYR A 59 4.367 -7.023 -2.831 1.00 0.00 H new ATOM 0 HH TYR A 59 3.236 -6.101 -1.142 1.00 0.00 H new ATOM 863 N VAL A 60 2.889 -6.678 -10.058 1.00 0.00 N ATOM 864 CA VAL A 60 3.341 -6.939 -11.443 1.00 0.00 C ATOM 865 C VAL A 60 2.167 -7.329 -12.350 1.00 0.00 C ATOM 866 O VAL A 60 2.222 -7.101 -13.556 1.00 0.00 O ATOM 867 CB VAL A 60 4.352 -8.093 -11.427 1.00 0.00 C ATOM 868 CG1 VAL A 60 5.752 -7.533 -11.220 1.00 0.00 C ATOM 869 CG2 VAL A 60 4.034 -9.094 -10.291 1.00 0.00 C ATOM 0 H VAL A 60 2.333 -7.427 -9.645 1.00 0.00 H new ATOM 0 HA VAL A 60 3.793 -6.027 -11.833 1.00 0.00 H new ATOM 0 HB VAL A 60 4.291 -8.618 -12.380 1.00 0.00 H new ATOM 0 HG11 VAL A 60 6.473 -8.351 -11.208 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.994 -6.848 -12.033 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.794 -6.999 -10.271 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.766 -9.902 -10.302 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.076 -8.580 -9.331 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.036 -9.507 -10.438 1.00 0.00 H new ATOM 879 N ASN A 61 1.120 -7.949 -11.798 1.00 0.00 N ATOM 880 CA ASN A 61 -0.016 -8.386 -12.636 1.00 0.00 C ATOM 881 C ASN A 61 -1.116 -7.315 -12.708 1.00 0.00 C ATOM 882 O ASN A 61 -1.759 -7.165 -13.743 1.00 0.00 O ATOM 883 CB ASN A 61 -0.575 -9.698 -12.089 1.00 0.00 C ATOM 884 CG ASN A 61 -1.095 -9.536 -10.672 1.00 0.00 C ATOM 885 OD1 ASN A 61 -1.957 -8.732 -10.413 1.00 0.00 O ATOM 886 ND2 ASN A 61 -0.610 -10.297 -9.732 1.00 0.00 N ATOM 0 H ASN A 61 1.029 -8.158 -10.804 1.00 0.00 H new ATOM 0 HA ASN A 61 0.346 -8.541 -13.652 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.380 -10.049 -12.735 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.203 -10.461 -12.107 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.959 -10.213 -8.777 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.119 -10.976 -9.951 1.00 0.00 H new ATOM 893 N GLY A 62 -1.342 -6.567 -11.629 1.00 0.00 N ATOM 894 CA GLY A 62 -2.387 -5.520 -11.644 1.00 0.00 C ATOM 895 C GLY A 62 -3.416 -5.802 -10.548 1.00 0.00 C ATOM 896 O GLY A 62 -3.612 -6.938 -10.143 1.00 0.00 O ATOM 0 H GLY A 62 -0.834 -6.655 -10.749 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -1.936 -4.540 -11.489 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.876 -5.495 -12.618 1.00 0.00 H new ATOM 900 N LEU A 63 -4.071 -4.763 -10.064 1.00 0.00 N ATOM 901 CA LEU A 63 -5.111 -4.937 -8.969 1.00 0.00 C ATOM 902 C LEU A 63 -6.456 -5.270 -9.602 1.00 0.00 C ATOM 903 O LEU A 63 -6.508 -5.802 -10.700 1.00 0.00 O ATOM 904 CB LEU A 63 -5.252 -3.641 -8.112 1.00 0.00 C ATOM 905 CG LEU A 63 -3.905 -3.065 -7.754 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.125 -1.682 -7.138 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.229 -3.973 -6.738 1.00 0.00 C ATOM 0 H LEU A 63 -3.935 -3.801 -10.375 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.789 -5.747 -8.315 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.831 -2.900 -8.664 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.807 -3.865 -7.201 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.275 -2.985 -8.640 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.163 -1.245 -6.871 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.628 -1.038 -7.860 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.742 -1.776 -6.244 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.254 -3.562 -6.475 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.848 -4.042 -5.843 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.100 -4.967 -7.167 1.00 0.00 H new ATOM 919 N THR A 64 -7.549 -4.947 -8.913 1.00 0.00 N ATOM 920 CA THR A 64 -8.883 -5.215 -9.416 1.00 0.00 C ATOM 921 C THR A 64 -9.803 -4.319 -8.661 1.00 0.00 C ATOM 922 O THR A 64 -9.688 -4.198 -7.457 1.00 0.00 O ATOM 923 CB THR A 64 -9.270 -6.665 -9.150 1.00 0.00 C ATOM 924 OG1 THR A 64 -8.968 -6.994 -7.808 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.501 -7.580 -10.081 1.00 0.00 C ATOM 0 H THR A 64 -7.529 -4.496 -7.998 1.00 0.00 H new ATOM 0 HA THR A 64 -8.933 -5.042 -10.491 1.00 0.00 H new ATOM 0 HB THR A 64 -10.338 -6.791 -9.325 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.218 -7.926 -7.635 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.781 -8.615 -9.887 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.736 -7.328 -11.115 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.431 -7.456 -9.912 1.00 0.00 H new ATOM 933 N LEU A 65 -10.672 -3.683 -9.345 1.00 0.00 N ATOM 934 CA LEU A 65 -11.637 -2.752 -8.698 1.00 0.00 C ATOM 935 C LEU A 65 -13.020 -2.981 -9.274 1.00 0.00 C ATOM 936 O LEU A 65 -13.327 -2.590 -10.390 1.00 0.00 O ATOM 937 CB LEU A 65 -11.194 -1.296 -8.847 1.00 0.00 C ATOM 938 CG LEU A 65 -10.374 -1.055 -10.133 1.00 0.00 C ATOM 939 CD1 LEU A 65 -11.279 -1.093 -11.352 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.695 0.316 -10.031 1.00 0.00 C ATOM 0 H LEU A 65 -10.771 -3.760 -10.357 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.667 -2.958 -7.628 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.073 -0.651 -8.854 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.597 -1.011 -7.981 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.623 -1.838 -10.239 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.686 -0.921 -12.251 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.762 -2.068 -11.416 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.039 -0.317 -11.265 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.111 0.501 -10.933 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.454 1.091 -9.925 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.036 0.332 -9.163 1.00 0.00 H new ATOM 952 N GLY A 66 -13.847 -3.665 -8.512 1.00 0.00 N ATOM 953 CA GLY A 66 -15.222 -4.003 -8.964 1.00 0.00 C ATOM 954 C GLY A 66 -15.120 -5.143 -9.969 1.00 0.00 C ATOM 955 O GLY A 66 -15.928 -5.257 -10.879 1.00 0.00 O ATOM 0 H GLY A 66 -13.614 -4.006 -7.579 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -15.841 -4.297 -8.116 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.698 -3.135 -9.420 1.00 0.00 H new ATOM 959 N GLY A 67 -14.100 -5.986 -9.810 1.00 0.00 N ATOM 960 CA GLY A 67 -13.888 -7.125 -10.741 1.00 0.00 C ATOM 961 C GLY A 67 -13.191 -6.632 -12.021 1.00 0.00 C ATOM 962 O GLY A 67 -13.105 -7.370 -12.995 1.00 0.00 O ATOM 0 H GLY A 67 -13.410 -5.915 -9.062 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.282 -7.892 -10.259 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -14.844 -7.585 -10.991 1.00 0.00 H new ATOM 966 N GLN A 68 -12.676 -5.384 -12.033 1.00 0.00 N ATOM 967 CA GLN A 68 -11.976 -4.873 -13.277 1.00 0.00 C ATOM 968 C GLN A 68 -10.478 -4.764 -13.013 1.00 0.00 C ATOM 969 O GLN A 68 -10.003 -3.830 -12.382 1.00 0.00 O ATOM 970 CB GLN A 68 -12.560 -3.524 -13.689 1.00 0.00 C ATOM 971 CG GLN A 68 -11.630 -2.729 -14.687 1.00 0.00 C ATOM 972 CD GLN A 68 -11.035 -3.663 -15.769 1.00 0.00 C ATOM 973 OE1 GLN A 68 -11.702 -4.556 -16.248 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.791 -3.481 -16.174 1.00 0.00 N ATOM 0 H GLN A 68 -12.715 -4.728 -11.253 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.132 -5.574 -14.097 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.533 -3.682 -14.155 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.728 -2.919 -12.798 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.202 -1.934 -15.165 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.822 -2.251 -14.132 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.229 -2.731 -15.773 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.393 -4.091 -16.888 1.00 0.00 H new ATOM 983 N LYS A 69 -9.749 -5.727 -13.502 1.00 0.00 N ATOM 984 CA LYS A 69 -8.282 -5.767 -13.321 1.00 0.00 C ATOM 985 C LYS A 69 -7.599 -4.526 -13.892 1.00 0.00 C ATOM 986 O LYS A 69 -7.579 -4.317 -15.098 1.00 0.00 O ATOM 987 CB LYS A 69 -7.755 -6.994 -14.052 1.00 0.00 C ATOM 988 CG LYS A 69 -6.660 -7.665 -13.230 1.00 0.00 C ATOM 989 CD LYS A 69 -6.600 -9.149 -13.600 1.00 0.00 C ATOM 990 CE LYS A 69 -5.209 -9.493 -14.169 1.00 0.00 C ATOM 991 NZ LYS A 69 -5.217 -9.345 -15.661 1.00 0.00 N ATOM 0 H LYS A 69 -10.127 -6.510 -14.036 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.065 -5.804 -12.254 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.568 -7.697 -14.231 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.363 -6.705 -15.027 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.699 -7.189 -13.424 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.864 -7.550 -12.165 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.804 -9.760 -12.721 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.371 -9.381 -14.335 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.456 -8.836 -13.734 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.938 -10.513 -13.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.276 -9.578 -16.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.924 -9.989 -16.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -5.457 -8.364 -15.911 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.953 -3.758 -13.030 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.164 -2.593 -13.477 1.00 0.00 C ATOM 1007 C CYS A 70 -4.707 -2.997 -13.275 1.00 0.00 C ATOM 1008 O CYS A 70 -4.430 -4.104 -12.811 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.530 -1.354 -12.675 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.622 -1.730 -10.904 1.00 0.00 S ATOM 0 H CYS A 70 -6.951 -3.908 -12.021 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.359 -2.334 -14.518 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.789 -0.573 -12.847 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.489 -0.964 -13.018 1.00 0.00 H new ATOM 0 HG CYS A 70 -7.558 -2.608 -10.695 1.00 0.00 H new ATOM 1016 N SER A 71 -3.785 -2.179 -13.664 1.00 0.00 N ATOM 1017 CA SER A 71 -2.337 -2.591 -13.568 1.00 0.00 C ATOM 1018 C SER A 71 -1.450 -1.559 -12.932 1.00 0.00 C ATOM 1019 O SER A 71 -1.083 -0.561 -13.549 1.00 0.00 O ATOM 1020 CB SER A 71 -1.856 -2.827 -14.940 1.00 0.00 C ATOM 1021 OG SER A 71 -2.001 -1.606 -15.657 1.00 0.00 O ATOM 0 H SER A 71 -3.951 -1.247 -14.044 1.00 0.00 H new ATOM 0 HA SER A 71 -2.290 -3.477 -12.935 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.814 -3.146 -14.932 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.429 -3.622 -15.416 1.00 0.00 H new ATOM 0 HG SER A 71 -1.471 -0.906 -15.222 1.00 0.00 H new ATOM 1027 N VAL A 72 -1.050 -1.814 -11.723 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.124 -0.889 -10.990 1.00 0.00 C ATOM 1029 C VAL A 72 1.028 -0.490 -11.874 1.00 0.00 C ATOM 1030 O VAL A 72 1.800 -1.325 -12.340 1.00 0.00 O ATOM 1031 CB VAL A 72 0.456 -1.563 -9.775 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.120 -0.511 -8.879 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.634 -2.308 -8.999 1.00 0.00 C ATOM 0 H VAL A 72 -1.327 -2.640 -11.193 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.706 -0.016 -10.696 1.00 0.00 H new ATOM 0 HB VAL A 72 1.202 -2.291 -10.094 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.541 -0.996 -7.998 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.915 -0.011 -9.432 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.377 0.223 -8.568 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.195 -2.788 -8.125 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.400 -1.602 -8.678 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.085 -3.065 -9.641 1.00 0.00 H new ATOM 1043 N ILE A 73 1.158 0.778 -12.068 1.00 0.00 N ATOM 1044 CA ILE A 73 2.237 1.322 -12.860 1.00 0.00 C ATOM 1045 C ILE A 73 2.898 2.414 -11.994 1.00 0.00 C ATOM 1046 O ILE A 73 2.687 3.578 -12.133 1.00 0.00 O ATOM 1047 CB ILE A 73 1.722 1.833 -14.212 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.325 0.603 -15.098 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.816 2.639 -14.939 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.134 0.940 -16.036 1.00 0.00 C ATOM 0 H ILE A 73 0.523 1.479 -11.686 1.00 0.00 H new ATOM 0 HA ILE A 73 2.980 0.567 -13.119 1.00 0.00 H new ATOM 0 HB ILE A 73 0.861 2.480 -14.042 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.182 0.291 -15.694 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.059 -0.238 -14.457 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.432 2.993 -15.896 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.107 3.492 -14.327 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.684 2.002 -15.110 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.115 0.065 -16.636 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.730 1.228 -15.438 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.411 1.764 -16.694 1.00 0.00 H new ATOM 1062 N ARG A 74 3.635 1.939 -11.053 1.00 0.00 N ATOM 1063 CA ARG A 74 4.397 2.752 -10.016 1.00 0.00 C ATOM 1064 C ARG A 74 3.622 2.720 -8.709 1.00 0.00 C ATOM 1065 O ARG A 74 2.909 3.657 -8.359 1.00 0.00 O ATOM 1066 CB ARG A 74 4.674 4.212 -10.470 1.00 0.00 C ATOM 1067 CG ARG A 74 6.077 4.635 -10.009 1.00 0.00 C ATOM 1068 CD ARG A 74 7.122 4.128 -11.017 1.00 0.00 C ATOM 1069 NE ARG A 74 8.402 3.832 -10.311 1.00 0.00 N ATOM 1070 CZ ARG A 74 9.473 4.531 -10.582 1.00 0.00 C ATOM 1071 NH1 ARG A 74 9.803 4.768 -11.826 1.00 0.00 N ATOM 1072 NH2 ARG A 74 10.215 4.993 -9.612 1.00 0.00 N ATOM 0 H ARG A 74 3.766 0.935 -10.931 1.00 0.00 H new ATOM 0 HA ARG A 74 5.379 2.298 -9.882 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.598 4.287 -11.555 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.924 4.883 -10.051 1.00 0.00 H new ATOM 0 HG2 ARG A 74 6.132 5.720 -9.926 1.00 0.00 H new ATOM 0 HG3 ARG A 74 6.284 4.229 -9.019 1.00 0.00 H new ATOM 0 HD2 ARG A 74 6.755 3.231 -11.515 1.00 0.00 H new ATOM 0 HD3 ARG A 74 7.288 4.877 -11.791 1.00 0.00 H new ATOM 0 HE ARG A 74 8.442 3.085 -9.618 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.224 4.407 -12.585 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.639 5.313 -12.037 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.959 4.809 -8.642 1.00 0.00 H new ATOM 0 HH22 ARG A 74 11.050 5.538 -9.824 1.00 0.00 H new ATOM 1086 N ASP A 75 3.750 1.613 -7.979 1.00 0.00 N ATOM 1087 CA ASP A 75 3.028 1.461 -6.692 1.00 0.00 C ATOM 1088 C ASP A 75 3.649 2.348 -5.614 1.00 0.00 C ATOM 1089 O ASP A 75 4.749 2.113 -5.133 1.00 0.00 O ATOM 1090 CB ASP A 75 2.969 -0.066 -6.271 1.00 0.00 C ATOM 1091 CG ASP A 75 2.958 -0.278 -4.731 1.00 0.00 C ATOM 1092 OD1 ASP A 75 3.939 0.057 -4.098 1.00 0.00 O ATOM 1093 OD2 ASP A 75 1.973 -0.794 -4.229 1.00 0.00 O ATOM 0 H ASP A 75 4.332 0.816 -8.239 1.00 0.00 H new ATOM 0 HA ASP A 75 1.999 1.798 -6.817 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.076 -0.520 -6.700 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.827 -0.587 -6.697 1.00 0.00 H new ATOM 1098 N SER A 76 2.893 3.342 -5.213 1.00 0.00 N ATOM 1099 CA SER A 76 3.325 4.265 -4.114 1.00 0.00 C ATOM 1100 C SER A 76 2.147 4.407 -3.098 1.00 0.00 C ATOM 1101 O SER A 76 2.258 5.092 -2.110 1.00 0.00 O ATOM 1102 CB SER A 76 3.713 5.646 -4.674 1.00 0.00 C ATOM 1103 OG SER A 76 4.944 6.058 -4.092 1.00 0.00 O ATOM 0 H SER A 76 1.978 3.557 -5.608 1.00 0.00 H new ATOM 0 HA SER A 76 4.203 3.852 -3.618 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.808 5.598 -5.759 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.932 6.373 -4.454 1.00 0.00 H new ATOM 0 HG SER A 76 5.500 6.489 -4.774 1.00 0.00 H new ATOM 1109 N LEU A 77 1.012 3.716 -3.358 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.211 3.738 -2.458 1.00 0.00 C ATOM 1111 C LEU A 77 0.193 3.661 -1.024 1.00 0.00 C ATOM 1112 O LEU A 77 -0.481 4.222 -0.166 1.00 0.00 O ATOM 1113 CB LEU A 77 -1.040 2.507 -2.832 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.422 2.550 -2.240 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.203 3.676 -2.884 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -3.109 1.224 -2.561 1.00 0.00 C ATOM 0 H LEU A 77 0.898 3.128 -4.183 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.777 4.660 -2.590 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.114 2.437 -3.917 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.528 1.608 -2.489 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.373 2.710 -1.163 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.206 3.713 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.696 4.623 -2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.270 3.504 -3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.116 1.225 -2.143 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.165 1.095 -3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.537 0.404 -2.127 1.00 0.00 H new ATOM 1128 N LEU A 78 1.296 3.022 -0.732 1.00 0.00 N ATOM 1129 CA LEU A 78 1.743 2.971 0.657 1.00 0.00 C ATOM 1130 C LEU A 78 2.753 4.086 0.880 1.00 0.00 C ATOM 1131 O LEU A 78 3.670 4.254 0.126 1.00 0.00 O ATOM 1132 CB LEU A 78 2.258 1.611 0.980 1.00 0.00 C ATOM 1133 CG LEU A 78 1.069 0.628 0.932 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.553 -0.818 0.997 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.136 0.902 2.112 1.00 0.00 C ATOM 0 H LEU A 78 1.893 2.540 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 78 0.917 3.141 1.347 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.027 1.315 0.266 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.720 1.603 1.967 1.00 0.00 H new ATOM 0 HG LEU A 78 0.538 0.774 -0.009 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.696 -1.491 0.962 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.209 -1.021 0.150 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.101 -0.977 1.926 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.704 0.209 2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.682 0.768 3.046 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.235 1.925 2.052 1.00 0.00 H new ATOM 1183 N GLU A 82 4.228 9.213 -0.818 1.00 0.00 N ATOM 1184 CA GLU A 82 3.383 9.317 -2.029 1.00 0.00 C ATOM 1185 C GLU A 82 1.904 8.847 -1.853 1.00 0.00 C ATOM 1186 O GLU A 82 0.985 9.532 -2.272 1.00 0.00 O ATOM 1187 CB GLU A 82 3.997 8.403 -3.059 1.00 0.00 C ATOM 1188 CG GLU A 82 5.021 9.125 -3.924 1.00 0.00 C ATOM 1189 CD GLU A 82 6.428 8.938 -3.337 1.00 0.00 C ATOM 1190 OE1 GLU A 82 6.764 7.815 -2.989 1.00 0.00 O ATOM 1191 OE2 GLU A 82 7.148 9.920 -3.253 1.00 0.00 O ATOM 0 HA GLU A 82 3.349 10.373 -2.297 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.475 7.561 -2.558 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.212 7.992 -3.693 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.988 8.737 -4.942 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.779 10.186 -3.980 1.00 0.00 H new ATOM 1198 N PHE A 83 1.705 7.623 -1.373 1.00 0.00 N ATOM 1199 CA PHE A 83 0.311 6.991 -1.320 1.00 0.00 C ATOM 1200 C PHE A 83 -0.431 7.246 -2.681 1.00 0.00 C ATOM 1201 O PHE A 83 -1.560 7.728 -2.718 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.605 7.433 -0.168 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.174 8.624 0.525 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.995 8.612 1.129 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -0.996 9.713 0.564 1.00 0.00 C ATOM 1206 CE1 PHE A 83 1.449 9.731 1.838 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.602 10.861 1.258 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.640 10.872 1.904 1.00 0.00 C ATOM 0 H PHE A 83 2.450 7.027 -1.012 1.00 0.00 H new ATOM 0 HA PHE A 83 0.505 5.934 -1.135 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.607 7.602 -0.563 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.680 6.618 0.552 1.00 0.00 H new ATOM 0 HD1 PHE A 83 1.612 7.727 1.077 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.950 9.688 0.059 1.00 0.00 H new ATOM 0 HE1 PHE A 83 2.411 9.714 2.328 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.246 11.727 1.295 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.969 11.747 2.445 1.00 0.00 H new ATOM 1218 N SER A 84 0.218 6.915 -3.774 1.00 0.00 N ATOM 1219 CA SER A 84 -0.380 7.086 -5.145 1.00 0.00 C ATOM 1220 C SER A 84 0.125 5.930 -5.985 1.00 0.00 C ATOM 1221 O SER A 84 1.273 5.537 -5.883 1.00 0.00 O ATOM 1222 CB SER A 84 0.036 8.432 -5.737 1.00 0.00 C ATOM 1223 OG SER A 84 1.419 8.650 -5.495 1.00 0.00 O ATOM 0 H SER A 84 1.160 6.524 -3.776 1.00 0.00 H new ATOM 0 HA SER A 84 -1.469 7.081 -5.111 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.163 8.447 -6.809 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.553 9.234 -5.292 1.00 0.00 H new ATOM 0 HG SER A 84 1.686 9.513 -5.876 1.00 0.00 H new ATOM 1229 N MET A 85 -0.752 5.339 -6.749 1.00 0.00 N ATOM 1230 CA MET A 85 -0.404 4.136 -7.549 1.00 0.00 C ATOM 1231 C MET A 85 -1.018 4.284 -8.937 1.00 0.00 C ATOM 1232 O MET A 85 -2.167 4.621 -9.047 1.00 0.00 O ATOM 1233 CB MET A 85 -1.068 2.998 -6.798 1.00 0.00 C ATOM 1234 CG MET A 85 -0.459 1.660 -7.117 1.00 0.00 C ATOM 1235 SD MET A 85 0.012 0.848 -5.580 1.00 0.00 S ATOM 1236 CE MET A 85 -0.757 -0.734 -5.916 1.00 0.00 C ATOM 0 H MET A 85 -1.718 5.649 -6.853 1.00 0.00 H new ATOM 0 HA MET A 85 0.668 3.980 -7.672 1.00 0.00 H new ATOM 0 HB2 MET A 85 -0.991 3.182 -5.726 1.00 0.00 H new ATOM 0 HB3 MET A 85 -2.130 2.977 -7.043 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.171 1.043 -7.665 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.413 1.787 -7.758 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.354 -1.038 -5.056 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.400 -0.647 -6.792 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.014 -1.481 -6.104 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.270 4.050 -10.012 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.886 4.216 -11.371 1.00 0.00 C ATOM 1248 C ASP A 86 -1.424 2.871 -11.879 1.00 0.00 C ATOM 1249 O ASP A 86 -0.843 2.255 -12.773 1.00 0.00 O ATOM 1250 CB ASP A 86 0.164 4.723 -12.298 1.00 0.00 C ATOM 1251 CG ASP A 86 0.169 6.250 -12.315 1.00 0.00 C ATOM 1252 OD1 ASP A 86 0.354 6.835 -11.261 1.00 0.00 O ATOM 1253 OD2 ASP A 86 -0.010 6.810 -13.384 1.00 0.00 O ATOM 0 H ASP A 86 0.708 3.761 -10.000 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.718 4.919 -11.319 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.141 4.354 -11.987 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.016 4.343 -13.304 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.560 2.413 -11.369 1.00 0.00 N ATOM 1259 CA LEU A 87 -3.090 1.119 -11.870 1.00 0.00 C ATOM 1260 C LEU A 87 -4.072 1.379 -12.981 1.00 0.00 C ATOM 1261 O LEU A 87 -5.121 1.961 -12.791 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.644 0.160 -10.760 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.277 0.841 -9.522 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.268 1.699 -8.767 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.487 1.659 -9.943 1.00 0.00 C ATOM 0 H LEU A 87 -3.117 2.875 -10.650 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.246 0.557 -12.270 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.392 -0.492 -11.212 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.828 -0.478 -10.420 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.602 0.060 -8.835 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.753 2.158 -7.906 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.441 1.075 -8.427 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.887 2.478 -9.427 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.927 2.135 -9.067 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.179 2.424 -10.655 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.224 1.005 -10.409 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.673 1.000 -14.185 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.530 1.277 -15.405 1.00 0.00 C ATOM 1279 C ARG A 88 -5.127 0.001 -16.003 1.00 0.00 C ATOM 1280 O ARG A 88 -4.447 -0.998 -16.183 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.669 2.040 -16.485 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.934 1.093 -17.500 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.366 1.951 -18.628 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.907 1.709 -18.761 1.00 0.00 N ATOM 1285 CZ ARG A 88 -0.146 2.605 -19.327 1.00 0.00 C ATOM 1286 NH1 ARG A 88 -0.253 3.862 -18.993 1.00 0.00 N ATOM 1287 NH2 ARG A 88 0.722 2.243 -20.232 1.00 0.00 N ATOM 0 H ARG A 88 -2.797 0.514 -14.377 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.369 1.897 -15.090 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.318 2.717 -17.040 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -2.928 2.655 -15.975 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.135 0.546 -16.999 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.627 0.352 -17.898 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.870 1.715 -19.565 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.551 3.005 -18.423 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.500 0.842 -18.410 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.933 4.146 -18.288 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.343 4.560 -19.437 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.804 1.261 -20.496 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.318 2.942 -20.676 1.00 0.00 H new ATOM 1301 N THR A 89 -6.396 0.075 -16.384 1.00 0.00 N ATOM 1302 CA THR A 89 -7.079 -1.085 -17.056 1.00 0.00 C ATOM 1303 C THR A 89 -6.328 -1.316 -18.369 1.00 0.00 C ATOM 1304 O THR A 89 -6.589 -0.655 -19.364 1.00 0.00 O ATOM 1305 CB THR A 89 -8.581 -0.728 -17.342 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.688 0.050 -18.489 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.180 0.063 -16.178 1.00 0.00 C ATOM 0 H THR A 89 -6.985 0.897 -16.254 1.00 0.00 H new ATOM 0 HA THR A 89 -7.067 -1.978 -16.431 1.00 0.00 H new ATOM 0 HB THR A 89 -9.120 -1.666 -17.472 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.794 0.316 -18.789 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.221 0.300 -16.397 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.127 -0.534 -15.267 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.619 0.987 -16.039 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.366 -2.188 -18.370 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.579 -2.382 -19.575 1.00 0.00 C ATOM 1317 C LYS A 90 -5.363 -3.235 -20.550 1.00 0.00 C ATOM 1318 O LYS A 90 -6.387 -3.827 -20.218 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.235 -3.046 -19.276 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.735 -2.735 -17.889 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.223 -3.043 -17.863 1.00 0.00 C ATOM 1322 CE LYS A 90 -1.000 -4.530 -17.539 1.00 0.00 C ATOM 1323 NZ LYS A 90 0.462 -4.841 -17.564 1.00 0.00 N ATOM 0 H LYS A 90 -5.102 -2.770 -17.575 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.374 -1.403 -20.007 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.333 -4.126 -19.390 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.498 -2.714 -20.008 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.918 -1.690 -17.641 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.262 -3.336 -17.148 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.776 -2.800 -18.827 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.728 -2.421 -17.117 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.414 -4.764 -16.558 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.526 -5.152 -18.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.607 -5.847 -17.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.845 -4.634 -18.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.953 -4.258 -16.856 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.940 4.532 -17.435 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.939 4.685 -16.313 1.00 0.00 C ATOM 1436 C ASN A 99 -6.606 5.177 -15.036 1.00 0.00 C ATOM 1437 O ASN A 99 -7.541 5.961 -15.050 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.754 5.619 -16.718 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.416 5.525 -18.231 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -5.255 5.259 -19.060 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.186 5.746 -18.608 1.00 0.00 N ATOM 0 HA ASN A 99 -5.526 3.695 -16.116 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.006 6.650 -16.468 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.872 5.356 -16.134 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -2.938 5.694 -19.596 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.473 5.971 -17.915 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.115 4.667 -13.928 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.653 4.995 -12.584 1.00 0.00 C ATOM 1450 C VAL A 100 -5.497 5.290 -11.656 1.00 0.00 C ATOM 1451 O VAL A 100 -4.531 4.528 -11.615 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.361 3.752 -11.997 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.245 4.160 -10.830 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.208 3.061 -13.073 1.00 0.00 C ATOM 0 H VAL A 100 -5.333 4.012 -13.911 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.335 5.840 -12.674 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.602 3.054 -11.645 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.740 3.278 -10.423 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.634 4.624 -10.055 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.996 4.871 -11.174 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.700 2.188 -12.644 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.961 3.756 -13.445 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.566 2.748 -13.896 1.00 0.00 H new ATOM 1464 N THR A 101 -5.608 6.316 -10.848 1.00 0.00 N ATOM 1465 CA THR A 101 -4.570 6.589 -9.854 1.00 0.00 C ATOM 1466 C THR A 101 -5.234 6.323 -8.549 1.00 0.00 C ATOM 1467 O THR A 101 -6.280 6.874 -8.274 1.00 0.00 O ATOM 1468 CB THR A 101 -4.076 8.024 -9.904 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.513 8.285 -11.183 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.006 8.218 -8.812 1.00 0.00 C ATOM 0 H THR A 101 -6.389 6.973 -10.849 1.00 0.00 H new ATOM 0 HA THR A 101 -3.688 5.973 -10.029 1.00 0.00 H new ATOM 0 HB THR A 101 -4.904 8.712 -9.733 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.556 8.073 -11.169 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.643 9.245 -8.837 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.442 8.011 -7.835 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.176 7.535 -8.991 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.675 5.466 -7.765 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.292 5.100 -6.490 1.00 0.00 C ATOM 1480 C VAL A 102 -4.397 5.555 -5.355 1.00 0.00 C ATOM 1481 O VAL A 102 -3.230 5.228 -5.299 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.520 3.570 -6.524 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.702 2.984 -5.112 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.774 3.303 -7.339 1.00 0.00 C ATOM 0 H VAL A 102 -3.793 4.994 -7.964 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.254 5.587 -6.329 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.645 3.095 -6.967 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.859 1.908 -5.182 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.810 3.182 -4.518 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.566 3.447 -4.635 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.960 2.230 -7.380 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.624 3.801 -6.872 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.639 3.687 -8.350 1.00 0.00 H new ATOM 1494 N THR A 103 -4.961 6.328 -4.459 1.00 0.00 N ATOM 1495 CA THR A 103 -4.195 6.852 -3.299 1.00 0.00 C ATOM 1496 C THR A 103 -4.681 6.168 -2.026 1.00 0.00 C ATOM 1497 O THR A 103 -5.682 5.453 -2.030 1.00 0.00 O ATOM 1498 CB THR A 103 -4.389 8.367 -3.170 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.762 8.676 -3.298 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.601 9.089 -4.264 1.00 0.00 C ATOM 0 H THR A 103 -5.938 6.620 -4.489 1.00 0.00 H new ATOM 0 HA THR A 103 -3.136 6.646 -3.451 1.00 0.00 H new ATOM 0 HB THR A 103 -4.028 8.693 -2.195 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.025 8.611 -4.240 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.744 10.165 -4.166 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.541 8.853 -4.165 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.955 8.764 -5.242 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.970 6.371 -0.939 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.355 5.723 0.365 1.00 0.00 C ATOM 1510 C LYS A 104 -4.075 6.652 1.544 1.00 0.00 C ATOM 1511 O LYS A 104 -3.072 7.351 1.583 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.531 4.445 0.526 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.887 3.714 1.846 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.776 2.514 1.550 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.010 1.513 0.687 1.00 0.00 C ATOM 1516 NZ LYS A 104 -4.691 0.200 0.713 1.00 0.00 N ATOM 0 H LYS A 104 -3.137 6.959 -0.896 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.422 5.502 0.352 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.712 3.783 -0.320 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.469 4.690 0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.976 3.388 2.348 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -4.398 4.398 2.524 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.090 2.042 2.481 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.681 2.837 1.035 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -3.945 1.878 -0.338 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -2.989 1.410 1.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.669 -0.222 -0.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -4.205 -0.430 1.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.679 0.327 1.012 1.00 0.00 H new ATOM 1530 N THR A 105 -4.952 6.611 2.525 1.00 0.00 N ATOM 1531 CA THR A 105 -4.781 7.423 3.768 1.00 0.00 C ATOM 1532 C THR A 105 -4.470 6.433 4.915 1.00 0.00 C ATOM 1533 O THR A 105 -3.833 5.411 4.682 1.00 0.00 O ATOM 1534 CB THR A 105 -6.083 8.194 4.057 1.00 0.00 C ATOM 1535 OG1 THR A 105 -7.117 7.268 4.343 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.472 9.051 2.847 1.00 0.00 C ATOM 0 H THR A 105 -5.794 6.036 2.511 1.00 0.00 H new ATOM 0 HA THR A 105 -3.975 8.149 3.664 1.00 0.00 H new ATOM 0 HB THR A 105 -5.930 8.851 4.913 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.883 7.442 3.758 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.394 9.591 3.065 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.675 9.764 2.635 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.624 8.408 1.980 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.926 6.706 6.141 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.669 5.763 7.274 1.00 0.00 C ATOM 1546 C ASP A 106 -5.914 4.890 7.515 1.00 0.00 C ATOM 1547 O ASP A 106 -5.830 3.861 8.176 1.00 0.00 O ATOM 1548 CB ASP A 106 -4.349 6.547 8.541 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.881 5.579 9.626 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -4.722 4.889 10.177 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -2.689 5.538 9.884 1.00 0.00 O ATOM 0 H ASP A 106 -5.460 7.540 6.387 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.821 5.127 7.020 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.575 7.287 8.339 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.231 7.092 8.878 1.00 0.00 H new ATOM 1556 N LYS A 107 -7.078 5.295 6.984 1.00 0.00 N ATOM 1557 CA LYS A 107 -8.331 4.485 7.191 1.00 0.00 C ATOM 1558 C LYS A 107 -9.261 4.591 5.957 1.00 0.00 C ATOM 1559 O LYS A 107 -10.442 4.340 6.058 1.00 0.00 O ATOM 1560 CB LYS A 107 -9.087 4.999 8.435 1.00 0.00 C ATOM 1561 CG LYS A 107 -8.122 5.234 9.592 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.925 5.483 10.879 1.00 0.00 C ATOM 1563 CE LYS A 107 -8.036 5.241 12.102 1.00 0.00 C ATOM 1564 NZ LYS A 107 -8.854 4.654 13.205 1.00 0.00 N ATOM 0 H LYS A 107 -7.198 6.141 6.427 1.00 0.00 H new ATOM 0 HA LYS A 107 -8.044 3.443 7.333 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.606 5.926 8.194 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.847 4.275 8.730 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.470 4.370 9.718 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.481 6.089 9.378 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.303 6.505 10.890 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.791 4.822 10.911 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.219 4.568 11.843 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.585 6.178 12.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -8.250 4.490 14.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.619 5.312 13.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -9.264 3.751 12.891 1.00 0.00 H new ATOM 1578 N THR A 108 -8.731 4.947 4.786 1.00 0.00 N ATOM 1579 CA THR A 108 -9.594 5.052 3.560 1.00 0.00 C ATOM 1580 C THR A 108 -8.769 4.645 2.323 1.00 0.00 C ATOM 1581 O THR A 108 -7.553 4.757 2.309 1.00 0.00 O ATOM 1582 CB THR A 108 -10.128 6.494 3.414 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.102 7.352 2.943 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.634 6.991 4.777 1.00 0.00 C ATOM 0 H THR A 108 -7.745 5.165 4.639 1.00 0.00 H new ATOM 0 HA THR A 108 -10.448 4.381 3.651 1.00 0.00 H new ATOM 0 HB THR A 108 -10.947 6.500 2.695 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.093 7.344 1.963 1.00 0.00 H new ATOM 0 HG21 THR A 108 -11.011 8.009 4.676 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.435 6.340 5.127 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.815 6.977 5.496 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.438 4.169 1.308 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.762 3.722 0.039 1.00 0.00 C ATOM 1594 C LEU A 109 -9.334 4.594 -1.087 1.00 0.00 C ATOM 1595 O LEU A 109 -10.376 4.273 -1.639 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.151 2.232 -0.196 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.065 1.375 -0.905 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.728 0.501 -1.975 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.999 2.217 -1.559 1.00 0.00 C ATOM 0 H LEU A 109 -10.453 4.066 1.298 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.677 3.815 0.081 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.381 1.776 0.767 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.064 2.200 -0.791 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.585 0.765 -0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.969 -0.101 -2.474 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.461 -0.155 -1.506 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.226 1.137 -2.707 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.266 1.568 -2.039 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -7.455 2.865 -2.307 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.503 2.827 -0.804 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.687 5.707 -1.434 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.255 6.576 -2.482 1.00 0.00 C ATOM 1613 C VAL A 110 -8.793 6.070 -3.822 1.00 0.00 C ATOM 1614 O VAL A 110 -7.674 5.624 -3.963 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.791 8.059 -2.232 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.809 8.878 -3.533 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.747 8.733 -1.218 1.00 0.00 C ATOM 0 H VAL A 110 -7.806 6.025 -1.029 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.345 6.557 -2.459 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.772 8.031 -1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.483 9.897 -3.326 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.136 8.422 -4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.821 8.896 -3.938 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.427 9.760 -1.044 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.761 8.732 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.727 8.182 -0.278 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.643 6.186 -4.808 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.278 5.785 -6.175 1.00 0.00 C ATOM 1629 C LEU A 111 -9.684 6.926 -7.096 1.00 0.00 C ATOM 1630 O LEU A 111 -10.599 7.691 -6.800 1.00 0.00 O ATOM 1631 CB LEU A 111 -9.998 4.477 -6.640 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.041 3.372 -5.542 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.395 2.016 -6.201 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.706 3.238 -4.810 1.00 0.00 C ATOM 0 H LEU A 111 -10.591 6.550 -4.709 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.208 5.581 -6.204 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.017 4.719 -6.942 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.490 4.084 -7.521 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.797 3.658 -4.810 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.427 1.238 -5.438 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.369 2.090 -6.685 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -9.639 1.764 -6.945 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.782 2.457 -4.054 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.924 2.977 -5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.458 4.184 -4.330 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.020 7.038 -8.194 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.323 8.087 -9.184 1.00 0.00 C ATOM 1648 C LEU A 112 -9.417 7.378 -10.504 1.00 0.00 C ATOM 1649 O LEU A 112 -8.411 7.008 -11.070 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.171 9.092 -9.228 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.583 10.493 -9.785 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.736 10.416 -10.828 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.997 11.368 -8.611 1.00 0.00 C ATOM 0 H LEU A 112 -8.250 6.423 -8.457 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.239 8.626 -8.942 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.768 9.214 -8.223 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.370 8.686 -9.845 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.726 10.917 -10.309 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.978 11.420 -11.178 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.422 9.803 -11.673 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.617 9.972 -10.365 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.289 12.353 -8.976 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.839 10.908 -8.094 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.160 11.471 -7.921 1.00 0.00 H new ATOM 1665 N MET A 113 -10.587 7.149 -11.001 1.00 0.00 N ATOM 1666 CA MET A 113 -10.669 6.403 -12.300 1.00 0.00 C ATOM 1667 C MET A 113 -10.644 7.364 -13.420 1.00 0.00 C ATOM 1668 O MET A 113 -11.110 8.480 -13.300 1.00 0.00 O ATOM 1669 CB MET A 113 -11.916 5.557 -12.370 1.00 0.00 C ATOM 1670 CG MET A 113 -11.711 4.379 -13.338 1.00 0.00 C ATOM 1671 SD MET A 113 -12.184 4.868 -15.012 1.00 0.00 S ATOM 1672 CE MET A 113 -13.360 3.531 -15.318 1.00 0.00 C ATOM 0 H MET A 113 -11.476 7.431 -10.588 1.00 0.00 H new ATOM 0 HA MET A 113 -9.810 5.735 -12.369 1.00 0.00 H new ATOM 0 HB2 MET A 113 -12.164 5.181 -11.377 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.758 6.165 -12.701 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.668 4.062 -13.323 1.00 0.00 H new ATOM 0 HG3 MET A 113 -12.308 3.525 -13.017 1.00 0.00 H new ATOM 0 HE1 MET A 113 -13.936 3.752 -16.217 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.819 2.595 -15.454 1.00 0.00 H new ATOM 0 HE3 MET A 113 -14.036 3.439 -14.468 1.00 0.00 H new ATOM 1682 N GLY A 114 -10.082 6.935 -14.515 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.984 7.784 -15.704 1.00 0.00 C ATOM 1684 C GLY A 114 -10.154 6.951 -16.968 1.00 0.00 C ATOM 1685 O GLY A 114 -9.767 5.789 -17.039 1.00 0.00 O ATOM 0 H GLY A 114 -9.680 6.004 -14.625 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.748 8.561 -15.668 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.017 8.288 -15.720 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.219 11.198 -15.364 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.349 12.057 -14.477 1.00 0.00 C ATOM 1775 C GLY A 121 -1.177 13.200 -13.871 1.00 0.00 C ATOM 1776 O GLY A 121 -0.876 13.684 -12.783 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.084 11.450 -13.682 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.481 12.465 -15.054 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.232 13.616 -14.552 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.110 14.713 -14.021 1.00 0.00 C ATOM 1782 C LEU A 122 -4.098 14.074 -13.069 1.00 0.00 C ATOM 1783 O LEU A 122 -4.491 14.664 -12.114 1.00 0.00 O ATOM 1784 CB LEU A 122 -3.905 15.439 -15.156 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.209 15.344 -16.549 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -4.228 14.862 -17.589 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -2.684 16.725 -16.959 1.00 0.00 C ATOM 0 H LEU A 122 -2.519 13.238 -15.455 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.484 15.460 -13.533 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.903 15.007 -15.225 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.030 16.489 -14.890 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.377 14.643 -16.492 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.747 14.794 -18.565 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.606 13.881 -17.301 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.056 15.568 -17.641 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.198 16.655 -17.932 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.515 17.428 -17.018 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.965 17.075 -16.219 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.467 12.841 -13.327 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.388 12.107 -12.419 1.00 0.00 C ATOM 1801 C ILE A 123 -4.585 11.778 -11.182 1.00 0.00 C ATOM 1802 O ILE A 123 -5.094 11.817 -10.084 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.822 10.836 -13.132 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.813 11.198 -14.267 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.494 9.800 -12.165 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.908 10.037 -15.231 1.00 0.00 C ATOM 0 H ILE A 123 -4.161 12.310 -14.142 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.275 12.681 -12.152 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.925 10.367 -13.537 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.795 11.422 -13.851 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.476 12.093 -14.789 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.784 8.912 -12.727 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.787 9.520 -11.384 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.379 10.247 -11.711 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.604 10.285 -16.032 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.924 9.834 -15.655 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.264 9.153 -14.702 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.308 11.467 -11.371 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.428 11.161 -10.222 1.00 0.00 C ATOM 1820 C ASN A 124 -2.283 12.420 -9.386 1.00 0.00 C ATOM 1821 O ASN A 124 -2.077 12.355 -8.174 1.00 0.00 O ATOM 1822 CB ASN A 124 -1.040 10.710 -10.732 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.121 10.375 -9.542 1.00 0.00 C ATOM 1824 OD1 ASN A 124 -0.568 9.893 -8.520 1.00 0.00 O ATOM 1825 ND2 ASN A 124 1.155 10.620 -9.637 1.00 0.00 N ATOM 0 H ASN A 124 -2.855 11.417 -12.284 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.858 10.358 -9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -1.147 9.837 -11.376 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.592 11.499 -11.336 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.775 10.407 -8.855 1.00 0.00 H new ATOM 0 HD22 ASN A 124 1.534 11.025 -10.493 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.389 13.574 -10.026 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.245 14.870 -9.276 1.00 0.00 C ATOM 1834 C LYS A 125 -3.605 15.147 -8.557 1.00 0.00 C ATOM 1835 O LYS A 125 -3.658 15.696 -7.461 1.00 0.00 O ATOM 1836 CB LYS A 125 -1.878 16.006 -10.312 1.00 0.00 C ATOM 1837 CG LYS A 125 -3.104 16.756 -10.854 1.00 0.00 C ATOM 1838 CD LYS A 125 -3.342 17.989 -9.982 1.00 0.00 C ATOM 1839 CE LYS A 125 -2.829 19.240 -10.702 1.00 0.00 C ATOM 1840 NZ LYS A 125 -1.377 19.084 -10.998 1.00 0.00 N ATOM 0 H LYS A 125 -2.567 13.670 -11.026 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.454 14.833 -8.527 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -1.206 16.720 -9.835 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.333 15.564 -11.146 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.940 17.051 -11.890 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -3.981 16.108 -10.842 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.405 18.093 -9.766 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -2.832 17.874 -9.026 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -3.385 19.394 -11.627 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -2.992 20.122 -10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -0.995 19.986 -11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -0.874 18.806 -10.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.247 18.350 -11.723 1.00 0.00 H new ATOM 1854 N LYS A 126 -4.690 14.750 -9.205 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.076 14.952 -8.651 1.00 0.00 C ATOM 1856 C LYS A 126 -6.436 13.835 -7.664 1.00 0.00 C ATOM 1857 O LYS A 126 -7.390 13.959 -6.912 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.065 14.947 -9.794 1.00 0.00 C ATOM 1859 CG LYS A 126 -6.892 16.228 -10.613 1.00 0.00 C ATOM 1860 CD LYS A 126 -7.795 16.172 -11.841 1.00 0.00 C ATOM 1861 CE LYS A 126 -6.961 15.947 -13.114 1.00 0.00 C ATOM 1862 NZ LYS A 126 -5.900 17.006 -13.233 1.00 0.00 N ATOM 0 H LYS A 126 -4.668 14.285 -10.113 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.110 15.905 -8.122 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.905 14.073 -10.425 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.083 14.881 -9.410 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -7.141 17.098 -10.005 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -5.852 16.340 -10.918 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.522 15.368 -11.729 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.358 17.101 -11.928 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.499 14.960 -13.085 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -7.608 15.970 -13.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -5.850 17.339 -14.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -6.135 17.804 -12.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -4.980 16.608 -12.955 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.646 12.773 -7.630 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.878 11.661 -6.653 1.00 0.00 C ATOM 1878 C CYS A 127 -5.174 12.071 -5.395 1.00 0.00 C ATOM 1879 O CYS A 127 -5.606 11.781 -4.306 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.284 10.352 -7.165 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.044 8.972 -6.279 1.00 0.00 S ATOM 0 H CYS A 127 -4.845 12.636 -8.247 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.944 11.495 -6.497 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.459 10.253 -8.236 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.204 10.345 -7.016 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.487 8.099 -7.134 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.077 12.785 -5.567 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.300 13.303 -4.436 1.00 0.00 C ATOM 1889 C TYR A 128 -4.192 14.337 -3.720 1.00 0.00 C ATOM 1890 O TYR A 128 -4.180 14.457 -2.506 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.071 14.002 -5.024 1.00 0.00 C ATOM 1892 CG TYR A 128 -0.865 13.920 -4.121 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.985 13.733 -2.729 1.00 0.00 C ATOM 1894 CD2 TYR A 128 0.392 14.035 -4.705 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.162 13.663 -1.933 1.00 0.00 C ATOM 1896 CE2 TYR A 128 1.545 13.965 -3.910 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.428 13.780 -2.521 1.00 0.00 C ATOM 1898 OH TYR A 128 2.561 13.716 -1.733 1.00 0.00 O ATOM 0 H TYR A 128 -3.695 13.025 -6.482 1.00 0.00 H new ATOM 0 HA TYR A 128 -2.992 12.523 -3.740 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.829 13.553 -5.987 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.309 15.049 -5.211 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.962 13.644 -2.278 1.00 0.00 H new ATOM 0 HD2 TYR A 128 0.480 14.178 -5.772 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.072 13.519 -0.866 1.00 0.00 H new ATOM 0 HE2 TYR A 128 2.521 14.053 -4.364 1.00 0.00 H new ATOM 0 HH TYR A 128 3.357 13.813 -2.296 1.00 0.00 H new ATOM 1908 N GLU A 129 -4.988 15.079 -4.507 1.00 0.00 N ATOM 1909 CA GLU A 129 -5.923 16.121 -3.922 1.00 0.00 C ATOM 1910 C GLU A 129 -7.173 15.435 -3.333 1.00 0.00 C ATOM 1911 O GLU A 129 -7.731 15.880 -2.330 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.358 17.095 -5.029 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.114 17.703 -5.706 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.260 19.224 -5.796 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -6.300 19.676 -6.245 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -4.327 19.912 -5.413 1.00 0.00 O ATOM 0 H GLU A 129 -5.023 15.000 -5.523 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.403 16.664 -3.133 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.967 16.573 -5.767 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -6.978 17.886 -4.607 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.219 17.448 -5.138 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.990 17.281 -6.703 1.00 0.00 H new ATOM 1923 N MET A 130 -7.600 14.349 -3.944 1.00 0.00 N ATOM 1924 CA MET A 130 -8.802 13.591 -3.450 1.00 0.00 C ATOM 1925 C MET A 130 -8.430 13.068 -2.013 1.00 0.00 C ATOM 1926 O MET A 130 -9.204 13.174 -1.039 1.00 0.00 O ATOM 1927 CB MET A 130 -9.048 12.421 -4.455 1.00 0.00 C ATOM 1928 CG MET A 130 -10.556 12.072 -4.574 1.00 0.00 C ATOM 1929 SD MET A 130 -10.746 10.477 -5.403 1.00 0.00 S ATOM 1930 CE MET A 130 -12.543 10.346 -5.252 1.00 0.00 C ATOM 0 H MET A 130 -7.161 13.951 -4.774 1.00 0.00 H new ATOM 0 HA MET A 130 -9.711 14.189 -3.389 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.660 12.696 -5.436 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.495 11.540 -4.129 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.010 12.035 -3.584 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.076 12.849 -5.134 1.00 0.00 H new ATOM 0 HE1 MET A 130 -12.817 9.310 -5.050 1.00 0.00 H new ATOM 0 HE2 MET A 130 -12.886 10.978 -4.433 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.011 10.670 -6.182 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.207 12.575 -1.882 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.685 12.095 -0.562 1.00 0.00 C ATOM 1942 C ALA A 131 -6.182 13.286 0.241 1.00 0.00 C ATOM 1943 O ALA A 131 -6.018 13.187 1.438 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.535 11.111 -0.786 1.00 0.00 C ATOM 0 H ALA A 131 -6.544 12.487 -2.653 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.485 11.594 -0.017 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.159 10.765 0.177 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.893 10.258 -1.363 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.732 11.607 -1.332 1.00 0.00 H new ATOM 1950 N SER A 132 -5.957 14.443 -0.412 1.00 0.00 N ATOM 1951 CA SER A 132 -5.504 15.658 0.335 1.00 0.00 C ATOM 1952 C SER A 132 -6.591 15.996 1.331 1.00 0.00 C ATOM 1953 O SER A 132 -6.309 16.436 2.437 1.00 0.00 O ATOM 1954 CB SER A 132 -5.291 16.837 -0.615 1.00 0.00 C ATOM 1955 OG SER A 132 -4.088 16.642 -1.343 1.00 0.00 O ATOM 0 H SER A 132 -6.073 14.573 -1.417 1.00 0.00 H new ATOM 0 HA SER A 132 -4.554 15.461 0.832 1.00 0.00 H new ATOM 0 HB2 SER A 132 -6.134 16.924 -1.300 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.241 17.769 -0.051 1.00 0.00 H new ATOM 0 HG SER A 132 -3.988 15.692 -1.561 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.864 15.751 0.955 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.970 16.012 1.911 1.00 0.00 C ATOM 1963 C HIS A 133 -9.019 14.880 2.883 1.00 0.00 C ATOM 1964 O HIS A 133 -9.238 15.101 4.049 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.327 16.138 1.251 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.235 16.780 2.256 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.123 18.120 2.600 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -12.266 16.282 3.013 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.064 18.380 3.527 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -12.789 17.293 3.816 1.00 0.00 N ATOM 0 H HIS A 133 -8.147 15.391 0.044 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.763 16.968 2.392 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.263 16.742 0.346 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.706 15.160 0.956 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -12.618 15.261 2.990 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.215 19.348 3.982 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.559 17.220 4.481 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.810 13.636 2.419 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.837 12.477 3.384 1.00 0.00 C ATOM 1980 C LEU A 134 -7.636 12.534 4.338 1.00 0.00 C ATOM 1981 O LEU A 134 -7.609 11.848 5.352 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.868 11.176 2.613 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.289 10.969 2.071 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.340 11.283 0.582 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.725 9.523 2.314 1.00 0.00 C ATOM 0 H LEU A 134 -8.629 13.394 1.445 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.738 12.540 3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.150 11.203 1.794 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.583 10.345 3.259 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.968 11.644 2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.354 11.131 0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.045 12.320 0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.657 10.623 0.047 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.734 9.378 1.929 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -10.040 8.846 1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.711 9.314 3.384 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.693 13.398 4.063 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.529 13.593 4.993 1.00 0.00 C ATOM 1999 C ARG A 135 -5.925 14.714 5.930 1.00 0.00 C ATOM 2000 O ARG A 135 -5.675 14.660 7.128 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.266 13.959 4.214 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.497 12.678 3.832 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.132 12.658 4.540 1.00 0.00 C ATOM 2004 NE ARG A 135 -2.182 11.712 5.691 1.00 0.00 N ATOM 2005 CZ ARG A 135 -2.676 12.105 6.840 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -2.280 13.231 7.373 1.00 0.00 N ATOM 2007 NH2 ARG A 135 -3.565 11.372 7.453 1.00 0.00 N ATOM 0 H ARG A 135 -6.675 13.984 3.228 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.303 12.678 5.541 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.531 14.516 3.316 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.632 14.609 4.817 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.076 11.798 4.113 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.357 12.635 2.752 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.352 12.356 3.841 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.877 13.659 4.889 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.832 10.760 5.585 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -1.586 13.805 6.895 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -2.665 13.535 8.267 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -3.875 10.493 7.038 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -3.949 11.678 8.347 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.628 15.704 5.387 1.00 0.00 N ATOM 2022 CA ARG A 136 -7.156 16.813 6.220 1.00 0.00 C ATOM 2023 C ARG A 136 -8.460 16.327 6.900 1.00 0.00 C ATOM 2024 O ARG A 136 -9.051 17.031 7.705 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.462 18.019 5.326 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.151 18.708 4.908 1.00 0.00 C ATOM 2027 CD ARG A 136 -6.000 20.038 5.658 1.00 0.00 C ATOM 2028 NE ARG A 136 -4.813 20.771 5.136 1.00 0.00 N ATOM 2029 CZ ARG A 136 -4.962 21.686 4.218 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -5.902 22.581 4.335 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -4.167 21.708 3.183 1.00 0.00 N ATOM 0 H ARG A 136 -6.850 15.774 4.394 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.424 17.105 6.973 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.012 17.697 4.442 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.100 18.725 5.858 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.303 18.059 5.126 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.149 18.884 3.832 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.898 20.643 5.532 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.886 19.854 6.726 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.883 20.557 5.497 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.522 22.567 5.145 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.018 23.296 3.617 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -3.429 21.010 3.092 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.284 22.423 2.465 1.00 0.00 H new ATOM 2045 N SER A 137 -8.894 15.100 6.575 1.00 0.00 N ATOM 2046 CA SER A 137 -10.119 14.515 7.167 1.00 0.00 C ATOM 2047 C SER A 137 -9.766 13.905 8.542 1.00 0.00 C ATOM 2048 O SER A 137 -10.646 13.617 9.339 1.00 0.00 O ATOM 2049 CB SER A 137 -10.662 13.427 6.207 1.00 0.00 C ATOM 2050 OG SER A 137 -9.831 12.275 6.260 1.00 0.00 O ATOM 0 H SER A 137 -8.420 14.491 5.908 1.00 0.00 H new ATOM 0 HA SER A 137 -10.885 15.278 7.308 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.683 13.163 6.483 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.698 13.814 5.188 1.00 0.00 H new ATOM 0 HG SER A 137 -8.901 12.549 6.400 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.458 13.709 8.820 1.00 0.00 N ATOM 2057 CA GLN A 138 -8.017 13.126 10.142 1.00 0.00 C ATOM 2058 C GLN A 138 -8.398 11.638 10.189 1.00 0.00 C ATOM 2059 O GLN A 138 -8.739 11.098 11.240 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.686 13.900 11.311 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.642 14.748 12.049 1.00 0.00 C ATOM 2062 CD GLN A 138 -8.348 15.623 13.096 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -7.962 15.643 14.249 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -9.375 16.350 12.737 1.00 0.00 N ATOM 0 H GLN A 138 -7.697 13.933 8.179 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.936 13.220 10.245 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -9.480 14.540 10.926 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.151 13.198 12.003 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -6.908 14.103 12.532 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -7.099 15.374 11.341 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -9.699 16.333 11.770 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -9.852 16.934 13.424 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.322 10.971 9.047 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.656 9.513 8.977 1.00 0.00 C ATOM 2075 C TYR A 139 -7.358 8.711 8.862 1.00 0.00 C ATOM 2076 O TYR A 139 -6.778 8.698 7.785 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.545 9.251 7.754 1.00 0.00 C ATOM 2078 CG TYR A 139 -10.997 9.258 8.171 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.580 8.098 8.690 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.759 10.425 8.038 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.926 8.103 9.076 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -13.104 10.431 8.423 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.688 9.270 8.942 1.00 0.00 C ATOM 2084 OH TYR A 139 -15.014 9.276 9.320 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.957 8.139 9.858 1.00 0.00 O ATOM 0 H TYR A 139 -8.040 11.386 8.159 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.192 9.209 9.876 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.371 10.014 6.995 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.290 8.291 7.305 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.992 7.198 8.793 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.308 11.321 7.638 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -13.376 7.207 9.477 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.691 11.331 8.320 1.00 0.00 H new ATOM 0 HH TYR A 139 -15.395 10.165 9.162 1.00 0.00 H new