USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 880 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 59 ASN : amide:sc= 0.472 K(o=-0.98,f=-13!) USER MOD Set 1.2: A 62 ASN : amide:sc= -1.45 K(o=-0.98,f=-5.2!) USER MOD Set 2.1: A 47 SER OG : rot 138:sc=0.000961 USER MOD Set 2.2: A 49 HIS : no HD1:sc= -2.59 K(o=-2.6,f=-1.5) USER MOD Set 3.1: A 24 ASN : amide:sc= -1.55! C(o=-0.3!,f=-4.3!) USER MOD Set 3.2: A 78 GLN : amide:sc= 1.26 K(o=-0.3,f=-5!) USER MOD Set 4.1: A 13 SER OG : rot 30:sc= 0.722 USER MOD Set 4.2: A 16 SER OG : rot 180:sc= -0.537 USER MOD Set 4.3: A 56 GLN : amide:sc= 0.993 X(o=1.2,f=1.5) USER MOD Set 5.1: A 7 ASN : amide:sc= -0.348 K(o=0.88,f=-0.8) USER MOD Set 5.2: B 5 U O2' : rot -39:sc= 1.22 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0.0258 K(o=0.026,f=-3.9!) USER MOD Single : A 6 THR OG1 : rot 77:sc= 1.2 USER MOD Single : A 8 LYS NZ :NH3+ -156:sc= -0.0787 (180deg=-0.393) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 172:sc= -1.19 (180deg=-1.36) USER MOD Single : A 15 ASN : amide:sc= 0.889 K(o=0.89,f=-1.9) USER MOD Single : A 22 ASN : amide:sc= 0.687 K(o=0.69,f=-1.2) USER MOD Single : A 25 THR OG1 : rot -13:sc= 1.2 USER MOD Single : A 29 LYS NZ :NH3+ -169:sc= 0.956 (180deg=0.847) USER MOD Single : A 30 LYS NZ :NH3+ 174:sc= 1.16 (180deg=1.09) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -29:sc= 0.289 USER MOD Single : A 39 LYS NZ :NH3+ -170:sc= 0.938 (180deg=0.767) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot 26:sc= -0.276 USER MOD Single : A 50 LYS NZ :NH3+ 176:sc= 0.396 (180deg=0.382) USER MOD Single : A 57 TYR OH : rot -4:sc= 0.623 USER MOD Single : A 74 MET CE :methyl -133:sc= -0.0651 (180deg=-0.788) USER MOD Single : A 83 ASN : amide:sc= 1.46 K(o=1.5,f=-0.12) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.519 K(o=-0.52,f=-0.0097) USER MOD Single : A 94 LYS NZ :NH3+ -171:sc=-0.00247 (180deg=-0.112) USER MOD Single : A 98 LYS NZ :NH3+ 172:sc= 1.24 (180deg=1.12) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 A O2' : rot 15:sc= 0.241 USER MOD Single : B 1 A O5' : rot -76:sc= 0.0135 USER MOD Single : B 2 U O2' : rot 18:sc= 0.0885 USER MOD Single : B 3 U O2' : rot -43:sc= 1.12 USER MOD Single : B 4 U O2' : rot 15:sc= 0.235 USER MOD Single : B 6 U O2' : rot 146:sc= 0.611 USER MOD Single : B 7 C O2' : rot 173:sc= 0.017 USER MOD Single : B 7 C O3' : rot 143:sc= 0.0949 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 1.126 10.166 -6.540 1.00 0.00 N ATOM 2 CA ALA A 2 0.503 11.245 -5.753 1.00 0.00 C ATOM 3 C ALA A 2 1.219 11.421 -4.417 1.00 0.00 C ATOM 4 O ALA A 2 2.130 10.657 -4.097 1.00 0.00 O ATOM 5 CB ALA A 2 -0.990 10.972 -5.545 1.00 0.00 C ATOM 0 HA ALA A 2 0.600 12.176 -6.312 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -1.430 11.781 -4.962 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.487 10.911 -6.513 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.117 10.030 -5.012 1.00 0.00 H new ATOM 12 N SER A 3 0.808 12.426 -3.639 1.00 0.00 N ATOM 13 CA SER A 3 1.401 12.741 -2.341 1.00 0.00 C ATOM 14 C SER A 3 1.243 11.582 -1.357 1.00 0.00 C ATOM 15 O SER A 3 0.611 10.574 -1.669 1.00 0.00 O ATOM 16 CB SER A 3 0.755 14.014 -1.787 1.00 0.00 C ATOM 17 OG SER A 3 0.910 15.072 -2.714 1.00 0.00 O ATOM 0 H SER A 3 0.044 13.050 -3.898 1.00 0.00 H new ATOM 0 HA SER A 3 2.470 12.905 -2.476 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.303 13.841 -1.592 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.214 14.282 -0.835 1.00 0.00 H new ATOM 0 HG SER A 3 0.494 15.884 -2.356 1.00 0.00 H new ATOM 23 N ASN A 4 1.822 11.720 -0.165 1.00 0.00 N ATOM 24 CA ASN A 4 1.843 10.656 0.829 1.00 0.00 C ATOM 25 C ASN A 4 0.895 10.917 2.006 1.00 0.00 C ATOM 26 O ASN A 4 1.083 10.350 3.079 1.00 0.00 O ATOM 27 CB ASN A 4 3.284 10.401 1.288 1.00 0.00 C ATOM 28 CG ASN A 4 3.902 11.594 2.015 1.00 0.00 C ATOM 29 OD1 ASN A 4 3.316 12.672 2.093 1.00 0.00 O ATOM 30 ND2 ASN A 4 5.101 11.405 2.555 1.00 0.00 N ATOM 0 H ASN A 4 2.289 12.575 0.136 1.00 0.00 H new ATOM 0 HA ASN A 4 1.464 9.750 0.355 1.00 0.00 H new ATOM 0 HB2 ASN A 4 3.301 9.533 1.947 1.00 0.00 H new ATOM 0 HB3 ASN A 4 3.897 10.154 0.421 1.00 0.00 H new ATOM 0 HD21 ASN A 4 5.562 12.167 3.052 1.00 0.00 H new ATOM 0 HD22 ASN A 4 5.560 10.498 2.472 1.00 0.00 H new ATOM 37 N VAL A 5 -0.125 11.768 1.827 1.00 0.00 N ATOM 38 CA VAL A 5 -0.977 12.203 2.924 1.00 0.00 C ATOM 39 C VAL A 5 -2.404 11.720 2.714 1.00 0.00 C ATOM 40 O VAL A 5 -2.965 11.879 1.632 1.00 0.00 O ATOM 41 CB VAL A 5 -0.927 13.727 3.062 1.00 0.00 C ATOM 42 CG1 VAL A 5 -1.683 14.191 4.306 1.00 0.00 C ATOM 43 CG2 VAL A 5 0.524 14.194 3.166 1.00 0.00 C ATOM 0 H VAL A 5 -0.375 12.167 0.922 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.607 11.765 3.851 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.398 14.158 2.178 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.631 15.277 4.379 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.726 13.881 4.235 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.232 13.746 5.193 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.551 15.279 3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 5 0.991 13.739 4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 5 1.067 13.897 2.269 1.00 0.00 H new ATOM 53 N THR A 6 -2.984 11.132 3.763 1.00 0.00 N ATOM 54 CA THR A 6 -4.346 10.608 3.733 1.00 0.00 C ATOM 55 C THR A 6 -5.040 10.766 5.083 1.00 0.00 C ATOM 56 O THR A 6 -6.152 10.270 5.250 1.00 0.00 O ATOM 57 CB THR A 6 -4.344 9.134 3.333 1.00 0.00 C ATOM 58 OG1 THR A 6 -3.557 8.391 4.236 1.00 0.00 O ATOM 59 CG2 THR A 6 -3.749 8.929 1.940 1.00 0.00 C ATOM 0 H THR A 6 -2.517 11.007 4.661 1.00 0.00 H new ATOM 0 HA THR A 6 -4.898 11.187 2.992 1.00 0.00 H new ATOM 0 HB THR A 6 -5.382 8.801 3.343 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.058 8.248 5.066 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.764 7.868 1.690 1.00 0.00 H new ATOM 0 HG22 THR A 6 -4.337 9.483 1.208 1.00 0.00 H new ATOM 0 HG23 THR A 6 -2.721 9.290 1.927 1.00 0.00 H new ATOM 67 N ASN A 7 -4.412 11.441 6.048 1.00 0.00 N ATOM 68 CA ASN A 7 -5.001 11.634 7.362 1.00 0.00 C ATOM 69 C ASN A 7 -5.682 13.004 7.428 1.00 0.00 C ATOM 70 O ASN A 7 -6.474 13.320 6.545 1.00 0.00 O ATOM 71 CB ASN A 7 -3.952 11.375 8.446 1.00 0.00 C ATOM 72 CG ASN A 7 -4.562 11.187 9.825 1.00 0.00 C ATOM 73 OD1 ASN A 7 -5.768 11.301 10.010 1.00 0.00 O ATOM 74 ND2 ASN A 7 -3.718 10.892 10.807 1.00 0.00 N ATOM 0 H ASN A 7 -3.490 11.863 5.937 1.00 0.00 H new ATOM 0 HA ASN A 7 -5.792 10.908 7.549 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -3.378 10.486 8.184 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -3.252 12.210 8.474 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -4.067 10.752 11.755 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -2.720 10.806 10.613 1.00 0.00 H new ATOM 81 N LYS A 8 -5.380 13.809 8.453 1.00 0.00 N ATOM 82 CA LYS A 8 -6.101 15.034 8.791 1.00 0.00 C ATOM 83 C LYS A 8 -7.557 14.710 9.132 1.00 0.00 C ATOM 84 O LYS A 8 -8.003 13.573 8.975 1.00 0.00 O ATOM 85 CB LYS A 8 -5.971 16.085 7.685 1.00 0.00 C ATOM 86 CG LYS A 8 -4.621 16.810 7.642 1.00 0.00 C ATOM 87 CD LYS A 8 -3.460 15.898 7.245 1.00 0.00 C ATOM 88 CE LYS A 8 -2.718 15.344 8.466 1.00 0.00 C ATOM 89 NZ LYS A 8 -2.011 16.411 9.201 1.00 0.00 N ATOM 0 H LYS A 8 -4.604 13.617 9.087 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.648 15.476 9.678 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.139 15.602 6.723 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -6.761 16.825 7.812 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -4.683 17.637 6.935 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.417 17.242 8.622 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -3.839 15.070 6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -2.762 16.453 6.618 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.427 14.851 9.131 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.003 14.587 8.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -1.224 15.998 9.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.639 17.110 8.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.671 16.878 9.855 1.00 0.00 H new ATOM 103 N THR A 9 -8.313 15.702 9.604 1.00 0.00 N ATOM 104 CA THR A 9 -9.673 15.478 10.089 1.00 0.00 C ATOM 105 C THR A 9 -10.638 16.571 9.637 1.00 0.00 C ATOM 106 O THR A 9 -11.607 16.867 10.335 1.00 0.00 O ATOM 107 CB THR A 9 -9.682 15.326 11.613 1.00 0.00 C ATOM 108 OG1 THR A 9 -9.079 16.450 12.214 1.00 0.00 O ATOM 109 CG2 THR A 9 -8.914 14.070 12.035 1.00 0.00 C ATOM 0 H THR A 9 -8.004 16.672 9.660 1.00 0.00 H new ATOM 0 HA THR A 9 -10.027 14.547 9.645 1.00 0.00 H new ATOM 0 HB THR A 9 -10.719 15.241 11.938 1.00 0.00 H new ATOM 0 HG1 THR A 9 -9.090 16.346 13.188 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.932 13.980 13.121 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.381 13.191 11.590 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.881 14.143 11.694 1.00 0.00 H new ATOM 117 N ASP A 10 -10.387 17.176 8.473 1.00 0.00 N ATOM 118 CA ASP A 10 -11.247 18.227 7.945 1.00 0.00 C ATOM 119 C ASP A 10 -12.630 17.665 7.599 1.00 0.00 C ATOM 120 O ASP A 10 -12.756 16.488 7.264 1.00 0.00 O ATOM 121 CB ASP A 10 -10.585 18.869 6.724 1.00 0.00 C ATOM 122 CG ASP A 10 -9.284 19.568 7.100 1.00 0.00 C ATOM 123 OD1 ASP A 10 -9.366 20.701 7.619 1.00 0.00 O ATOM 124 OD2 ASP A 10 -8.218 18.957 6.860 1.00 0.00 O ATOM 0 H ASP A 10 -9.589 16.951 7.879 1.00 0.00 H new ATOM 0 HA ASP A 10 -11.385 18.996 8.705 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -10.385 18.105 5.973 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.269 19.588 6.273 1.00 0.00 H new ATOM 129 N PRO A 11 -13.677 18.500 7.673 1.00 0.00 N ATOM 130 CA PRO A 11 -15.063 18.086 7.513 1.00 0.00 C ATOM 131 C PRO A 11 -15.391 17.587 6.105 1.00 0.00 C ATOM 132 O PRO A 11 -16.477 17.051 5.889 1.00 0.00 O ATOM 133 CB PRO A 11 -15.885 19.327 7.859 1.00 0.00 C ATOM 134 CG PRO A 11 -14.945 20.484 7.534 1.00 0.00 C ATOM 135 CD PRO A 11 -13.588 19.924 7.941 1.00 0.00 C ATOM 0 HA PRO A 11 -15.284 17.236 8.158 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -16.801 19.378 7.271 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -16.180 19.333 8.908 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -14.975 20.748 6.477 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.198 21.384 8.095 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -12.783 20.384 7.369 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -13.381 20.116 8.994 1.00 0.00 H new ATOM 143 N ARG A 12 -14.474 17.749 5.148 1.00 0.00 N ATOM 144 CA ARG A 12 -14.667 17.235 3.796 1.00 0.00 C ATOM 145 C ARG A 12 -13.537 16.301 3.387 1.00 0.00 C ATOM 146 O ARG A 12 -13.613 15.675 2.333 1.00 0.00 O ATOM 147 CB ARG A 12 -14.878 18.393 2.812 1.00 0.00 C ATOM 148 CG ARG A 12 -13.649 19.292 2.634 1.00 0.00 C ATOM 149 CD ARG A 12 -12.663 18.719 1.613 1.00 0.00 C ATOM 150 NE ARG A 12 -11.552 19.647 1.381 1.00 0.00 N ATOM 151 CZ ARG A 12 -10.740 19.599 0.322 1.00 0.00 C ATOM 152 NH1 ARG A 12 -10.910 18.674 -0.619 1.00 0.00 N ATOM 153 NH2 ARG A 12 -9.754 20.482 0.196 1.00 0.00 N ATOM 0 H ARG A 12 -13.588 18.235 5.289 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.573 16.629 3.776 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -15.160 17.985 1.842 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.714 19.002 3.157 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -13.968 20.283 2.313 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -13.147 19.414 3.594 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -12.276 17.765 1.971 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.180 18.522 0.674 1.00 0.00 H new ATOM 0 HE ARG A 12 -11.389 20.377 2.074 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.665 17.994 -0.535 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -10.285 18.645 -1.424 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -9.616 21.198 0.909 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.135 20.443 -0.614 1.00 0.00 H new ATOM 167 N SER A 13 -12.492 16.203 4.213 1.00 0.00 N ATOM 168 CA SER A 13 -11.382 15.293 3.965 1.00 0.00 C ATOM 169 C SER A 13 -11.681 13.932 4.594 1.00 0.00 C ATOM 170 O SER A 13 -11.210 12.904 4.111 1.00 0.00 O ATOM 171 CB SER A 13 -10.096 15.890 4.525 1.00 0.00 C ATOM 172 OG SER A 13 -9.007 15.032 4.250 1.00 0.00 O ATOM 0 H SER A 13 -12.396 16.752 5.068 1.00 0.00 H new ATOM 0 HA SER A 13 -11.253 15.150 2.892 1.00 0.00 H new ATOM 0 HB2 SER A 13 -9.918 16.871 4.084 1.00 0.00 H new ATOM 0 HB3 SER A 13 -10.192 16.037 5.601 1.00 0.00 H new ATOM 0 HG SER A 13 -9.180 14.539 3.421 1.00 0.00 H new ATOM 178 N MET A 14 -12.471 13.926 5.675 1.00 0.00 N ATOM 179 CA MET A 14 -12.884 12.713 6.366 1.00 0.00 C ATOM 180 C MET A 14 -13.816 11.879 5.492 1.00 0.00 C ATOM 181 O MET A 14 -14.091 10.725 5.808 1.00 0.00 O ATOM 182 CB MET A 14 -13.590 13.106 7.663 1.00 0.00 C ATOM 183 CG MET A 14 -12.560 13.443 8.740 1.00 0.00 C ATOM 184 SD MET A 14 -12.323 12.144 9.986 1.00 0.00 S ATOM 185 CE MET A 14 -12.115 10.677 8.939 1.00 0.00 C ATOM 0 H MET A 14 -12.843 14.778 6.094 1.00 0.00 H new ATOM 0 HA MET A 14 -12.005 12.107 6.587 1.00 0.00 H new ATOM 0 HB2 MET A 14 -14.238 13.964 7.488 1.00 0.00 H new ATOM 0 HB3 MET A 14 -14.227 12.289 8.001 1.00 0.00 H new ATOM 0 HG2 MET A 14 -11.603 13.647 8.259 1.00 0.00 H new ATOM 0 HG3 MET A 14 -12.866 14.360 9.243 1.00 0.00 H new ATOM 0 HE1 MET A 14 -11.820 9.828 9.556 1.00 0.00 H new ATOM 0 HE2 MET A 14 -13.056 10.451 8.438 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.344 10.869 8.193 1.00 0.00 H new ATOM 195 N ASN A 15 -14.303 12.461 4.393 1.00 0.00 N ATOM 196 CA ASN A 15 -15.206 11.781 3.481 1.00 0.00 C ATOM 197 C ASN A 15 -14.720 11.846 2.034 1.00 0.00 C ATOM 198 O ASN A 15 -15.465 11.494 1.126 1.00 0.00 O ATOM 199 CB ASN A 15 -16.629 12.317 3.654 1.00 0.00 C ATOM 200 CG ASN A 15 -16.666 13.830 3.774 1.00 0.00 C ATOM 201 OD1 ASN A 15 -16.743 14.545 2.778 1.00 0.00 O ATOM 202 ND2 ASN A 15 -16.609 14.327 5.004 1.00 0.00 N ATOM 0 H ASN A 15 -14.078 13.417 4.117 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.218 10.721 3.735 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.237 12.008 2.804 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.076 11.873 4.544 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -16.629 15.337 5.147 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.546 13.699 5.805 1.00 0.00 H new ATOM 209 N SER A 16 -13.479 12.291 1.810 1.00 0.00 N ATOM 210 CA SER A 16 -12.880 12.305 0.483 1.00 0.00 C ATOM 211 C SER A 16 -11.713 11.327 0.394 1.00 0.00 C ATOM 212 O SER A 16 -11.057 11.229 -0.641 1.00 0.00 O ATOM 213 CB SER A 16 -12.454 13.721 0.106 1.00 0.00 C ATOM 214 OG SER A 16 -11.368 14.116 0.907 1.00 0.00 O ATOM 0 H SER A 16 -12.868 12.649 2.544 1.00 0.00 H new ATOM 0 HA SER A 16 -13.631 11.976 -0.236 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.175 13.759 -0.947 1.00 0.00 H new ATOM 0 HB3 SER A 16 -13.288 14.410 0.240 1.00 0.00 H new ATOM 0 HG SER A 16 -11.095 15.025 0.663 1.00 0.00 H new ATOM 220 N ARG A 17 -11.446 10.593 1.479 1.00 0.00 N ATOM 221 CA ARG A 17 -10.405 9.576 1.508 1.00 0.00 C ATOM 222 C ARG A 17 -11.040 8.186 1.533 1.00 0.00 C ATOM 223 O ARG A 17 -12.247 8.058 1.736 1.00 0.00 O ATOM 224 CB ARG A 17 -9.459 9.831 2.683 1.00 0.00 C ATOM 225 CG ARG A 17 -10.070 9.322 3.985 1.00 0.00 C ATOM 226 CD ARG A 17 -9.234 9.736 5.189 1.00 0.00 C ATOM 227 NE ARG A 17 -9.193 11.193 5.303 1.00 0.00 N ATOM 228 CZ ARG A 17 -9.104 11.865 6.449 1.00 0.00 C ATOM 229 NH1 ARG A 17 -8.938 11.237 7.610 1.00 0.00 N ATOM 230 NH2 ARG A 17 -9.181 13.190 6.441 1.00 0.00 N ATOM 0 H ARG A 17 -11.950 10.692 2.360 1.00 0.00 H new ATOM 0 HA ARG A 17 -9.799 9.628 0.604 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.506 9.334 2.504 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -9.252 10.898 2.765 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -11.082 9.712 4.091 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -10.149 8.235 3.951 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -9.655 9.305 6.098 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -8.222 9.344 5.089 1.00 0.00 H new ATOM 0 HE ARG A 17 -9.236 11.735 4.440 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -8.876 10.219 7.635 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -8.872 11.773 8.475 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -9.308 13.688 5.560 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -9.113 13.710 7.316 1.00 0.00 H new ATOM 244 N VAL A 18 -10.229 7.151 1.327 1.00 0.00 N ATOM 245 CA VAL A 18 -10.696 5.772 1.253 1.00 0.00 C ATOM 246 C VAL A 18 -9.936 4.914 2.252 1.00 0.00 C ATOM 247 O VAL A 18 -8.711 4.986 2.313 1.00 0.00 O ATOM 248 CB VAL A 18 -10.469 5.238 -0.165 1.00 0.00 C ATOM 249 CG1 VAL A 18 -11.047 3.834 -0.305 1.00 0.00 C ATOM 250 CG2 VAL A 18 -11.106 6.142 -1.220 1.00 0.00 C ATOM 0 H VAL A 18 -9.221 7.248 1.206 1.00 0.00 H new ATOM 0 HA VAL A 18 -11.759 5.736 1.492 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.392 5.216 -0.329 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.877 3.470 -1.318 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -10.560 3.167 0.407 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -12.118 3.860 -0.104 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -10.923 5.729 -2.212 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.180 6.204 -1.046 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.670 7.139 -1.156 1.00 0.00 H new ATOM 260 N PHE A 19 -10.659 4.102 3.028 1.00 0.00 N ATOM 261 CA PHE A 19 -10.048 3.121 3.905 1.00 0.00 C ATOM 262 C PHE A 19 -9.973 1.797 3.147 1.00 0.00 C ATOM 263 O PHE A 19 -10.944 1.406 2.500 1.00 0.00 O ATOM 264 CB PHE A 19 -10.871 2.991 5.188 1.00 0.00 C ATOM 265 CG PHE A 19 -10.374 1.928 6.148 1.00 0.00 C ATOM 266 CD1 PHE A 19 -9.010 1.804 6.444 1.00 0.00 C ATOM 267 CD2 PHE A 19 -11.300 1.062 6.749 1.00 0.00 C ATOM 268 CE1 PHE A 19 -8.573 0.815 7.338 1.00 0.00 C ATOM 269 CE2 PHE A 19 -10.859 0.071 7.639 1.00 0.00 C ATOM 270 CZ PHE A 19 -9.496 -0.053 7.934 1.00 0.00 C ATOM 0 H PHE A 19 -11.678 4.112 3.060 1.00 0.00 H new ATOM 0 HA PHE A 19 -9.042 3.426 4.195 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.875 3.953 5.701 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -11.904 2.767 4.921 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -8.295 2.470 5.984 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -12.352 1.158 6.527 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.522 0.723 7.567 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -11.573 -0.598 8.098 1.00 0.00 H new ATOM 0 HZ PHE A 19 -9.157 -0.816 8.619 1.00 0.00 H new ATOM 280 N ILE A 20 -8.831 1.106 3.221 1.00 0.00 N ATOM 281 CA ILE A 20 -8.615 -0.141 2.498 1.00 0.00 C ATOM 282 C ILE A 20 -8.070 -1.174 3.476 1.00 0.00 C ATOM 283 O ILE A 20 -6.861 -1.385 3.563 1.00 0.00 O ATOM 284 CB ILE A 20 -7.648 0.098 1.329 1.00 0.00 C ATOM 285 CG1 ILE A 20 -8.152 1.224 0.420 1.00 0.00 C ATOM 286 CG2 ILE A 20 -7.491 -1.198 0.522 1.00 0.00 C ATOM 287 CD1 ILE A 20 -7.084 1.649 -0.582 1.00 0.00 C ATOM 0 H ILE A 20 -8.033 1.399 3.785 1.00 0.00 H new ATOM 0 HA ILE A 20 -9.550 -0.512 2.078 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.681 0.398 1.733 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -9.043 0.892 -0.114 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -8.445 2.080 1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.805 -1.029 -0.308 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -7.095 -1.982 1.167 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.462 -1.504 0.133 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -7.473 2.449 -1.212 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.204 2.004 -0.047 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.810 0.798 -1.205 1.00 0.00 H new ATOM 299 N GLY A 21 -8.973 -1.813 4.217 1.00 0.00 N ATOM 300 CA GLY A 21 -8.617 -2.792 5.232 1.00 0.00 C ATOM 301 C GLY A 21 -8.479 -4.201 4.662 1.00 0.00 C ATOM 302 O GLY A 21 -8.784 -4.447 3.495 1.00 0.00 O ATOM 0 H GLY A 21 -9.978 -1.662 4.126 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.677 -2.499 5.701 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.376 -2.793 6.014 1.00 0.00 H new ATOM 306 N ASN A 22 -8.016 -5.127 5.508 1.00 0.00 N ATOM 307 CA ASN A 22 -7.831 -6.537 5.183 1.00 0.00 C ATOM 308 C ASN A 22 -6.914 -6.735 3.969 1.00 0.00 C ATOM 309 O ASN A 22 -6.934 -7.783 3.327 1.00 0.00 O ATOM 310 CB ASN A 22 -9.204 -7.208 5.039 1.00 0.00 C ATOM 311 CG ASN A 22 -9.133 -8.718 5.240 1.00 0.00 C ATOM 312 OD1 ASN A 22 -9.235 -9.198 6.365 1.00 0.00 O ATOM 313 ND2 ASN A 22 -8.959 -9.477 4.161 1.00 0.00 N ATOM 0 H ASN A 22 -7.752 -4.904 6.468 1.00 0.00 H new ATOM 0 HA ASN A 22 -7.308 -7.032 6.001 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -9.894 -6.779 5.766 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -9.609 -6.994 4.050 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -8.907 -10.491 4.254 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -8.878 -9.044 3.241 1.00 0.00 H new ATOM 320 N LEU A 23 -6.106 -5.724 3.647 1.00 0.00 N ATOM 321 CA LEU A 23 -5.231 -5.751 2.489 1.00 0.00 C ATOM 322 C LEU A 23 -4.045 -6.692 2.720 1.00 0.00 C ATOM 323 O LEU A 23 -3.625 -6.904 3.856 1.00 0.00 O ATOM 324 CB LEU A 23 -4.805 -4.309 2.191 1.00 0.00 C ATOM 325 CG LEU A 23 -3.968 -4.150 0.919 1.00 0.00 C ATOM 326 CD1 LEU A 23 -4.704 -4.664 -0.318 1.00 0.00 C ATOM 327 CD2 LEU A 23 -3.678 -2.667 0.714 1.00 0.00 C ATOM 0 H LEU A 23 -6.045 -4.862 4.189 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.750 -6.150 1.618 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.697 -3.689 2.105 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.234 -3.929 3.038 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.054 -4.731 1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.074 -4.532 -1.197 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.933 -5.722 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.631 -4.105 -0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.082 -2.534 -0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.617 -2.123 0.612 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.127 -2.282 1.572 1.00 0.00 H new ATOM 339 N ASN A 24 -3.509 -7.250 1.630 1.00 0.00 N ATOM 340 CA ASN A 24 -2.395 -8.188 1.664 1.00 0.00 C ATOM 341 C ASN A 24 -1.141 -7.541 2.256 1.00 0.00 C ATOM 342 O ASN A 24 -0.491 -8.127 3.119 1.00 0.00 O ATOM 343 CB ASN A 24 -2.144 -8.644 0.227 1.00 0.00 C ATOM 344 CG ASN A 24 -0.830 -9.394 0.088 1.00 0.00 C ATOM 345 OD1 ASN A 24 -0.575 -10.376 0.777 1.00 0.00 O ATOM 346 ND2 ASN A 24 0.017 -8.921 -0.814 1.00 0.00 N ATOM 0 H ASN A 24 -3.846 -7.056 0.687 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.637 -9.038 2.302 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -2.963 -9.285 -0.098 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.137 -7.776 -0.433 1.00 0.00 H new ATOM 0 HD21 ASN A 24 0.919 -9.376 -0.955 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -0.233 -8.101 -1.368 1.00 0.00 H new ATOM 353 N THR A 25 -0.807 -6.333 1.786 1.00 0.00 N ATOM 354 CA THR A 25 0.313 -5.512 2.251 1.00 0.00 C ATOM 355 C THR A 25 1.691 -6.182 2.263 1.00 0.00 C ATOM 356 O THR A 25 2.644 -5.585 2.765 1.00 0.00 O ATOM 357 CB THR A 25 -0.011 -4.872 3.607 1.00 0.00 C ATOM 358 OG1 THR A 25 -0.019 -5.840 4.630 1.00 0.00 O ATOM 359 CG2 THR A 25 -1.379 -4.198 3.563 1.00 0.00 C ATOM 0 H THR A 25 -1.335 -5.883 1.038 1.00 0.00 H new ATOM 0 HA THR A 25 0.415 -4.740 1.488 1.00 0.00 H new ATOM 0 HB THR A 25 0.761 -4.132 3.815 1.00 0.00 H new ATOM 0 HG1 THR A 25 -0.020 -6.736 4.233 1.00 0.00 H new ATOM 0 HG21 THR A 25 -1.595 -3.749 4.532 1.00 0.00 H new ATOM 0 HG22 THR A 25 -1.379 -3.424 2.796 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.143 -4.940 3.329 1.00 0.00 H new ATOM 367 N LEU A 26 1.824 -7.402 1.726 1.00 0.00 N ATOM 368 CA LEU A 26 3.133 -8.039 1.603 1.00 0.00 C ATOM 369 C LEU A 26 3.683 -7.894 0.185 1.00 0.00 C ATOM 370 O LEU A 26 4.870 -8.118 -0.045 1.00 0.00 O ATOM 371 CB LEU A 26 3.070 -9.528 1.960 1.00 0.00 C ATOM 372 CG LEU A 26 2.452 -9.864 3.316 1.00 0.00 C ATOM 373 CD1 LEU A 26 2.886 -11.285 3.666 1.00 0.00 C ATOM 374 CD2 LEU A 26 2.897 -8.924 4.432 1.00 0.00 C ATOM 0 H LEU A 26 1.046 -7.960 1.374 1.00 0.00 H new ATOM 0 HA LEU A 26 3.796 -7.533 2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.502 -10.044 1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.082 -9.931 1.934 1.00 0.00 H new ATOM 0 HG LEU A 26 1.370 -9.759 3.235 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.465 -11.567 4.631 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.530 -11.973 2.900 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.974 -11.331 3.717 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.421 -9.219 5.367 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.980 -8.978 4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 26 2.608 -7.903 4.184 1.00 0.00 H new ATOM 386 N VAL A 27 2.820 -7.524 -0.764 1.00 0.00 N ATOM 387 CA VAL A 27 3.173 -7.446 -2.179 1.00 0.00 C ATOM 388 C VAL A 27 2.676 -6.135 -2.789 1.00 0.00 C ATOM 389 O VAL A 27 3.104 -5.769 -3.880 1.00 0.00 O ATOM 390 CB VAL A 27 2.594 -8.662 -2.918 1.00 0.00 C ATOM 391 CG1 VAL A 27 3.160 -8.767 -4.334 1.00 0.00 C ATOM 392 CG2 VAL A 27 2.929 -9.964 -2.182 1.00 0.00 C ATOM 0 H VAL A 27 1.852 -7.269 -0.569 1.00 0.00 H new ATOM 0 HA VAL A 27 4.258 -7.460 -2.281 1.00 0.00 H new ATOM 0 HB VAL A 27 1.514 -8.520 -2.957 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.733 -9.637 -4.833 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.908 -7.867 -4.894 1.00 0.00 H new ATOM 0 HG13 VAL A 27 4.244 -8.873 -4.286 1.00 0.00 H new ATOM 0 HG21 VAL A 27 2.507 -10.809 -2.727 1.00 0.00 H new ATOM 0 HG22 VAL A 27 4.011 -10.078 -2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.507 -9.933 -1.177 1.00 0.00 H new ATOM 402 N VAL A 28 1.780 -5.425 -2.097 1.00 0.00 N ATOM 403 CA VAL A 28 1.327 -4.120 -2.544 1.00 0.00 C ATOM 404 C VAL A 28 2.318 -3.070 -2.042 1.00 0.00 C ATOM 405 O VAL A 28 3.030 -3.303 -1.064 1.00 0.00 O ATOM 406 CB VAL A 28 -0.108 -3.868 -2.060 1.00 0.00 C ATOM 407 CG1 VAL A 28 -0.116 -3.002 -0.803 1.00 0.00 C ATOM 408 CG2 VAL A 28 -0.931 -3.154 -3.127 1.00 0.00 C ATOM 0 H VAL A 28 1.358 -5.740 -1.224 1.00 0.00 H new ATOM 0 HA VAL A 28 1.298 -4.065 -3.632 1.00 0.00 H new ATOM 0 HB VAL A 28 -0.544 -4.844 -1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.144 -2.838 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.437 -3.506 -0.010 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.354 -2.042 -1.019 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.943 -2.989 -2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.469 -2.195 -3.361 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.970 -3.767 -4.027 1.00 0.00 H new ATOM 418 N LYS A 29 2.367 -1.916 -2.701 1.00 0.00 N ATOM 419 CA LYS A 29 3.247 -0.819 -2.320 1.00 0.00 C ATOM 420 C LYS A 29 2.573 0.522 -2.584 1.00 0.00 C ATOM 421 O LYS A 29 1.483 0.575 -3.154 1.00 0.00 O ATOM 422 CB LYS A 29 4.590 -0.902 -3.063 1.00 0.00 C ATOM 423 CG LYS A 29 4.483 -1.515 -4.460 1.00 0.00 C ATOM 424 CD LYS A 29 4.869 -2.995 -4.401 1.00 0.00 C ATOM 425 CE LYS A 29 4.486 -3.674 -5.709 1.00 0.00 C ATOM 426 NZ LYS A 29 5.012 -5.050 -5.777 1.00 0.00 N ATOM 0 H LYS A 29 1.793 -1.716 -3.520 1.00 0.00 H new ATOM 0 HA LYS A 29 3.448 -0.904 -1.252 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.011 0.100 -3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.288 -1.493 -2.469 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.466 -1.409 -4.838 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.138 -0.985 -5.152 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.940 -3.095 -4.227 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.364 -3.480 -3.566 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.401 -3.693 -5.806 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.871 -3.094 -6.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.898 -5.418 -6.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.021 -5.049 -5.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.489 -5.655 -5.112 1.00 0.00 H new ATOM 440 N LYS A 30 3.233 1.605 -2.164 1.00 0.00 N ATOM 441 CA LYS A 30 2.737 2.966 -2.325 1.00 0.00 C ATOM 442 C LYS A 30 2.511 3.292 -3.798 1.00 0.00 C ATOM 443 O LYS A 30 1.719 4.177 -4.109 1.00 0.00 O ATOM 444 CB LYS A 30 3.764 3.928 -1.712 1.00 0.00 C ATOM 445 CG LYS A 30 3.503 5.400 -2.041 1.00 0.00 C ATOM 446 CD LYS A 30 2.137 5.887 -1.546 1.00 0.00 C ATOM 447 CE LYS A 30 2.019 7.400 -1.725 1.00 0.00 C ATOM 448 NZ LYS A 30 2.295 7.823 -3.113 1.00 0.00 N ATOM 0 H LYS A 30 4.138 1.556 -1.697 1.00 0.00 H new ATOM 0 HA LYS A 30 1.778 3.070 -1.817 1.00 0.00 H new ATOM 0 HB2 LYS A 30 3.765 3.802 -0.629 1.00 0.00 H new ATOM 0 HB3 LYS A 30 4.759 3.657 -2.066 1.00 0.00 H new ATOM 0 HG2 LYS A 30 4.286 6.012 -1.593 1.00 0.00 H new ATOM 0 HG3 LYS A 30 3.565 5.543 -3.120 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.342 5.385 -2.098 1.00 0.00 H new ATOM 0 HD3 LYS A 30 2.009 5.627 -0.495 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.016 7.720 -1.443 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.715 7.899 -1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.105 8.841 -3.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.292 7.634 -3.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 1.683 7.293 -3.766 1.00 0.00 H new ATOM 462 N SER A 31 3.194 2.589 -4.704 1.00 0.00 N ATOM 463 CA SER A 31 3.063 2.825 -6.135 1.00 0.00 C ATOM 464 C SER A 31 2.013 1.909 -6.767 1.00 0.00 C ATOM 465 O SER A 31 1.721 2.045 -7.953 1.00 0.00 O ATOM 466 CB SER A 31 4.429 2.648 -6.795 1.00 0.00 C ATOM 467 OG SER A 31 4.906 1.339 -6.569 1.00 0.00 O ATOM 0 H SER A 31 3.849 1.845 -4.464 1.00 0.00 H new ATOM 0 HA SER A 31 2.716 3.846 -6.295 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.352 2.837 -7.866 1.00 0.00 H new ATOM 0 HB3 SER A 31 5.134 3.376 -6.393 1.00 0.00 H new ATOM 0 HG SER A 31 5.781 1.232 -6.996 1.00 0.00 H new ATOM 473 N ASP A 32 1.440 0.984 -5.990 1.00 0.00 N ATOM 474 CA ASP A 32 0.386 0.105 -6.468 1.00 0.00 C ATOM 475 C ASP A 32 -0.980 0.630 -6.038 1.00 0.00 C ATOM 476 O ASP A 32 -1.919 0.606 -6.829 1.00 0.00 O ATOM 477 CB ASP A 32 0.604 -1.306 -5.927 1.00 0.00 C ATOM 478 CG ASP A 32 1.510 -2.148 -6.823 1.00 0.00 C ATOM 479 OD1 ASP A 32 2.457 -1.574 -7.403 1.00 0.00 O ATOM 480 OD2 ASP A 32 1.245 -3.367 -6.921 1.00 0.00 O ATOM 0 H ASP A 32 1.698 0.830 -5.015 1.00 0.00 H new ATOM 0 HA ASP A 32 0.417 0.077 -7.557 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.041 -1.245 -4.930 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.360 -1.803 -5.822 1.00 0.00 H new ATOM 485 N VAL A 33 -1.113 1.110 -4.800 1.00 0.00 N ATOM 486 CA VAL A 33 -2.411 1.570 -4.320 1.00 0.00 C ATOM 487 C VAL A 33 -2.831 2.820 -5.092 1.00 0.00 C ATOM 488 O VAL A 33 -4.013 3.002 -5.387 1.00 0.00 O ATOM 489 CB VAL A 33 -2.351 1.822 -2.810 1.00 0.00 C ATOM 490 CG1 VAL A 33 -3.717 2.268 -2.293 1.00 0.00 C ATOM 491 CG2 VAL A 33 -1.960 0.539 -2.075 1.00 0.00 C ATOM 0 H VAL A 33 -0.352 1.188 -4.125 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.164 0.802 -4.494 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.610 2.600 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.660 2.444 -1.219 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.014 3.189 -2.796 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -4.454 1.491 -2.495 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.921 0.731 -1.003 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.699 -0.236 -2.278 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.981 0.206 -2.420 1.00 0.00 H new ATOM 501 N GLU A 34 -1.870 3.685 -5.428 1.00 0.00 N ATOM 502 CA GLU A 34 -2.142 4.873 -6.222 1.00 0.00 C ATOM 503 C GLU A 34 -2.293 4.537 -7.706 1.00 0.00 C ATOM 504 O GLU A 34 -2.478 5.436 -8.524 1.00 0.00 O ATOM 505 CB GLU A 34 -1.059 5.926 -5.989 1.00 0.00 C ATOM 506 CG GLU A 34 0.299 5.476 -6.527 1.00 0.00 C ATOM 507 CD GLU A 34 1.367 6.553 -6.323 1.00 0.00 C ATOM 508 OE1 GLU A 34 1.101 7.499 -5.547 1.00 0.00 O ATOM 509 OE2 GLU A 34 2.447 6.424 -6.944 1.00 0.00 O ATOM 0 H GLU A 34 -0.892 3.578 -5.157 1.00 0.00 H new ATOM 0 HA GLU A 34 -3.095 5.289 -5.896 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.350 6.859 -6.472 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -0.977 6.132 -4.922 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.605 4.559 -6.024 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.212 5.244 -7.589 1.00 0.00 H new ATOM 516 N ALA A 35 -2.215 3.250 -8.060 1.00 0.00 N ATOM 517 CA ALA A 35 -2.377 2.792 -9.433 1.00 0.00 C ATOM 518 C ALA A 35 -3.604 1.891 -9.580 1.00 0.00 C ATOM 519 O ALA A 35 -3.987 1.547 -10.694 1.00 0.00 O ATOM 520 CB ALA A 35 -1.104 2.059 -9.855 1.00 0.00 C ATOM 0 H ALA A 35 -2.037 2.498 -7.395 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.539 3.652 -10.083 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.209 1.709 -10.882 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.254 2.738 -9.788 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -0.940 1.206 -9.196 1.00 0.00 H new ATOM 526 N ILE A 36 -4.223 1.510 -8.456 1.00 0.00 N ATOM 527 CA ILE A 36 -5.402 0.655 -8.437 1.00 0.00 C ATOM 528 C ILE A 36 -6.659 1.482 -8.166 1.00 0.00 C ATOM 529 O ILE A 36 -7.760 1.067 -8.519 1.00 0.00 O ATOM 530 CB ILE A 36 -5.183 -0.440 -7.386 1.00 0.00 C ATOM 531 CG1 ILE A 36 -4.050 -1.363 -7.844 1.00 0.00 C ATOM 532 CG2 ILE A 36 -6.446 -1.271 -7.162 1.00 0.00 C ATOM 533 CD1 ILE A 36 -3.461 -2.137 -6.665 1.00 0.00 C ATOM 0 H ILE A 36 -3.911 1.793 -7.527 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.551 0.182 -9.408 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.925 0.046 -6.445 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.426 -2.062 -8.591 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.268 -0.774 -8.324 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.250 -2.036 -6.411 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.252 -0.623 -6.818 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.738 -1.748 -8.097 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.659 -2.784 -7.019 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.064 -1.436 -5.931 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.240 -2.744 -6.203 1.00 0.00 H new ATOM 545 N PHE A 37 -6.498 2.656 -7.546 1.00 0.00 N ATOM 546 CA PHE A 37 -7.612 3.528 -7.211 1.00 0.00 C ATOM 547 C PHE A 37 -7.631 4.779 -8.094 1.00 0.00 C ATOM 548 O PHE A 37 -8.603 5.530 -8.076 1.00 0.00 O ATOM 549 CB PHE A 37 -7.535 3.850 -5.719 1.00 0.00 C ATOM 550 CG PHE A 37 -7.891 2.675 -4.836 1.00 0.00 C ATOM 551 CD1 PHE A 37 -7.025 1.578 -4.740 1.00 0.00 C ATOM 552 CD2 PHE A 37 -9.097 2.683 -4.119 1.00 0.00 C ATOM 553 CE1 PHE A 37 -7.375 0.476 -3.944 1.00 0.00 C ATOM 554 CE2 PHE A 37 -9.444 1.581 -3.322 1.00 0.00 C ATOM 555 CZ PHE A 37 -8.582 0.478 -3.233 1.00 0.00 C ATOM 0 H PHE A 37 -5.588 3.022 -7.265 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.558 3.025 -7.410 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.526 4.185 -5.478 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.207 4.679 -5.498 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -6.089 1.580 -5.278 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -9.757 3.536 -4.180 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -6.713 -0.375 -3.880 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.376 1.582 -2.776 1.00 0.00 H new ATOM 0 HZ PHE A 37 -8.848 -0.368 -2.617 1.00 0.00 H new ATOM 565 N SER A 38 -6.576 5.019 -8.877 1.00 0.00 N ATOM 566 CA SER A 38 -6.519 6.184 -9.754 1.00 0.00 C ATOM 567 C SER A 38 -7.468 6.034 -10.944 1.00 0.00 C ATOM 568 O SER A 38 -7.687 6.986 -11.692 1.00 0.00 O ATOM 569 CB SER A 38 -5.075 6.406 -10.203 1.00 0.00 C ATOM 570 OG SER A 38 -4.967 7.578 -10.979 1.00 0.00 O ATOM 0 H SER A 38 -5.751 4.420 -8.919 1.00 0.00 H new ATOM 0 HA SER A 38 -6.853 7.063 -9.203 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.426 6.481 -9.331 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.733 5.548 -10.782 1.00 0.00 H new ATOM 0 HG SER A 38 -5.813 7.741 -11.446 1.00 0.00 H new ATOM 576 N LYS A 39 -8.043 4.841 -11.132 1.00 0.00 N ATOM 577 CA LYS A 39 -8.986 4.580 -12.213 1.00 0.00 C ATOM 578 C LYS A 39 -10.406 5.007 -11.837 1.00 0.00 C ATOM 579 O LYS A 39 -11.304 4.945 -12.677 1.00 0.00 O ATOM 580 CB LYS A 39 -8.950 3.095 -12.588 1.00 0.00 C ATOM 581 CG LYS A 39 -9.439 2.231 -11.424 1.00 0.00 C ATOM 582 CD LYS A 39 -9.546 0.771 -11.854 1.00 0.00 C ATOM 583 CE LYS A 39 -10.101 -0.040 -10.684 1.00 0.00 C ATOM 584 NZ LYS A 39 -10.342 -1.445 -11.061 1.00 0.00 N ATOM 0 H LYS A 39 -7.864 4.033 -10.536 1.00 0.00 H new ATOM 0 HA LYS A 39 -8.686 5.174 -13.076 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.575 2.921 -13.464 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.934 2.808 -12.859 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.751 2.320 -10.583 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -10.410 2.588 -11.081 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.199 0.679 -12.722 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.568 0.390 -12.149 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.400 -0.002 -9.850 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -11.032 0.409 -10.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.872 -1.922 -10.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.893 -1.478 -11.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.432 -1.927 -11.203 1.00 0.00 H new ATOM 598 N TYR A 40 -10.612 5.435 -10.588 1.00 0.00 N ATOM 599 CA TYR A 40 -11.926 5.819 -10.088 1.00 0.00 C ATOM 600 C TYR A 40 -11.957 7.270 -9.610 1.00 0.00 C ATOM 601 O TYR A 40 -13.010 7.763 -9.213 1.00 0.00 O ATOM 602 CB TYR A 40 -12.343 4.858 -8.973 1.00 0.00 C ATOM 603 CG TYR A 40 -13.075 3.630 -9.463 1.00 0.00 C ATOM 604 CD1 TYR A 40 -14.236 3.772 -10.240 1.00 0.00 C ATOM 605 CD2 TYR A 40 -12.606 2.350 -9.135 1.00 0.00 C ATOM 606 CE1 TYR A 40 -14.923 2.641 -10.697 1.00 0.00 C ATOM 607 CE2 TYR A 40 -13.290 1.214 -9.584 1.00 0.00 C ATOM 608 CZ TYR A 40 -14.450 1.350 -10.372 1.00 0.00 C ATOM 609 OH TYR A 40 -15.113 0.248 -10.822 1.00 0.00 O ATOM 0 H TYR A 40 -9.867 5.523 -9.897 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.641 5.751 -10.908 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -11.454 4.544 -8.426 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -12.980 5.391 -8.267 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.601 4.758 -10.486 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.715 2.240 -8.535 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -15.814 2.755 -11.297 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.927 0.230 -9.325 1.00 0.00 H new ATOM 0 HH TYR A 40 -14.655 -0.560 -10.509 1.00 0.00 H new ATOM 619 N GLY A 41 -10.819 7.968 -9.643 1.00 0.00 N ATOM 620 CA GLY A 41 -10.778 9.360 -9.227 1.00 0.00 C ATOM 621 C GLY A 41 -9.365 9.927 -9.237 1.00 0.00 C ATOM 622 O GLY A 41 -8.393 9.180 -9.338 1.00 0.00 O ATOM 0 H GLY A 41 -9.923 7.590 -9.952 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.409 9.953 -9.889 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.195 9.449 -8.224 1.00 0.00 H new ATOM 626 N LYS A 42 -9.257 11.254 -9.132 1.00 0.00 N ATOM 627 CA LYS A 42 -7.971 11.926 -9.056 1.00 0.00 C ATOM 628 C LYS A 42 -7.412 11.766 -7.650 1.00 0.00 C ATOM 629 O LYS A 42 -7.970 12.310 -6.698 1.00 0.00 O ATOM 630 CB LYS A 42 -8.146 13.407 -9.415 1.00 0.00 C ATOM 631 CG LYS A 42 -6.890 14.223 -9.092 1.00 0.00 C ATOM 632 CD LYS A 42 -5.647 13.703 -9.810 1.00 0.00 C ATOM 633 CE LYS A 42 -4.429 14.451 -9.273 1.00 0.00 C ATOM 634 NZ LYS A 42 -3.191 13.996 -9.934 1.00 0.00 N ATOM 0 H LYS A 42 -10.058 11.884 -9.098 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.270 11.484 -9.764 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -8.376 13.499 -10.476 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.996 13.816 -8.868 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -7.056 15.264 -9.371 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.717 14.205 -8.016 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.536 12.631 -9.646 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -5.740 13.853 -10.886 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -4.557 15.522 -9.432 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -4.348 14.296 -8.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.379 14.521 -9.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.059 12.979 -9.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.261 14.167 -10.957 1.00 0.00 H new ATOM 648 N ILE A 43 -6.315 11.024 -7.519 1.00 0.00 N ATOM 649 CA ILE A 43 -5.649 10.859 -6.240 1.00 0.00 C ATOM 650 C ILE A 43 -4.681 12.019 -6.043 1.00 0.00 C ATOM 651 O ILE A 43 -3.866 12.310 -6.917 1.00 0.00 O ATOM 652 CB ILE A 43 -4.948 9.496 -6.178 1.00 0.00 C ATOM 653 CG1 ILE A 43 -5.999 8.383 -6.300 1.00 0.00 C ATOM 654 CG2 ILE A 43 -4.201 9.360 -4.852 1.00 0.00 C ATOM 655 CD1 ILE A 43 -5.410 6.980 -6.165 1.00 0.00 C ATOM 0 H ILE A 43 -5.870 10.527 -8.291 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.374 10.874 -5.426 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.233 9.414 -6.997 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.760 8.526 -5.533 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.499 8.469 -7.265 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.704 8.390 -4.812 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.457 10.152 -4.771 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.908 9.440 -4.026 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -6.205 6.241 -6.261 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.669 6.819 -6.948 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.935 6.877 -5.190 1.00 0.00 H new ATOM 667 N VAL A 44 -4.774 12.679 -4.888 1.00 0.00 N ATOM 668 CA VAL A 44 -3.893 13.780 -4.513 1.00 0.00 C ATOM 669 C VAL A 44 -3.124 13.444 -3.238 1.00 0.00 C ATOM 670 O VAL A 44 -2.426 14.289 -2.686 1.00 0.00 O ATOM 671 CB VAL A 44 -4.686 15.079 -4.370 1.00 0.00 C ATOM 672 CG1 VAL A 44 -5.178 15.536 -5.742 1.00 0.00 C ATOM 673 CG2 VAL A 44 -5.887 14.898 -3.444 1.00 0.00 C ATOM 0 H VAL A 44 -5.473 12.459 -4.179 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.161 13.928 -5.307 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.024 15.830 -3.938 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.743 16.462 -5.636 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.323 15.705 -6.397 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.819 14.767 -6.173 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.430 15.840 -3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.548 14.132 -3.850 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.542 14.593 -2.456 1.00 0.00 H new ATOM 683 N GLY A 45 -3.260 12.200 -2.779 1.00 0.00 N ATOM 684 CA GLY A 45 -2.555 11.684 -1.621 1.00 0.00 C ATOM 685 C GLY A 45 -2.809 10.183 -1.511 1.00 0.00 C ATOM 686 O GLY A 45 -3.885 9.709 -1.868 1.00 0.00 O ATOM 0 H GLY A 45 -3.877 11.515 -3.215 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.487 11.879 -1.713 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.895 12.190 -0.717 1.00 0.00 H new ATOM 690 N CYS A 46 -1.832 9.421 -1.021 1.00 0.00 N ATOM 691 CA CYS A 46 -1.983 7.986 -0.865 1.00 0.00 C ATOM 692 C CYS A 46 -1.036 7.496 0.226 1.00 0.00 C ATOM 693 O CYS A 46 0.014 8.092 0.454 1.00 0.00 O ATOM 694 CB CYS A 46 -1.679 7.310 -2.204 1.00 0.00 C ATOM 695 SG CYS A 46 -1.838 5.514 -2.049 1.00 0.00 S ATOM 0 H CYS A 46 -0.925 9.782 -0.725 1.00 0.00 H new ATOM 0 HA CYS A 46 -3.002 7.737 -0.570 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -2.363 7.678 -2.969 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -0.670 7.566 -2.528 1.00 0.00 H new ATOM 0 HG CYS A 46 -2.663 5.233 -1.084 1.00 0.00 H new ATOM 701 N SER A 47 -1.400 6.409 0.904 1.00 0.00 N ATOM 702 CA SER A 47 -0.550 5.829 1.929 1.00 0.00 C ATOM 703 C SER A 47 -0.845 4.341 2.050 1.00 0.00 C ATOM 704 O SER A 47 -1.945 3.893 1.734 1.00 0.00 O ATOM 705 CB SER A 47 -0.784 6.542 3.261 1.00 0.00 C ATOM 706 OG SER A 47 0.165 6.096 4.206 1.00 0.00 O ATOM 0 H SER A 47 -2.280 5.915 0.758 1.00 0.00 H new ATOM 0 HA SER A 47 0.497 5.955 1.654 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.701 7.621 3.128 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.793 6.342 3.621 1.00 0.00 H new ATOM 0 HG SER A 47 0.495 6.860 4.724 1.00 0.00 H new ATOM 712 N VAL A 48 0.133 3.564 2.508 1.00 0.00 N ATOM 713 CA VAL A 48 -0.040 2.130 2.660 1.00 0.00 C ATOM 714 C VAL A 48 0.724 1.646 3.884 1.00 0.00 C ATOM 715 O VAL A 48 1.806 2.139 4.197 1.00 0.00 O ATOM 716 CB VAL A 48 0.362 1.414 1.368 1.00 0.00 C ATOM 717 CG1 VAL A 48 1.781 1.763 0.928 1.00 0.00 C ATOM 718 CG2 VAL A 48 0.241 -0.101 1.519 1.00 0.00 C ATOM 0 H VAL A 48 1.054 3.908 2.780 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.089 1.891 2.831 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.329 1.761 0.599 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.018 1.230 0.007 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.855 2.837 0.755 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.485 1.472 1.707 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.533 -0.584 0.586 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.894 -0.440 2.323 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.791 -0.362 1.755 1.00 0.00 H new ATOM 728 N HIS A 49 0.140 0.669 4.579 1.00 0.00 N ATOM 729 CA HIS A 49 0.629 0.182 5.856 1.00 0.00 C ATOM 730 C HIS A 49 0.558 -1.340 5.860 1.00 0.00 C ATOM 731 O HIS A 49 0.407 -1.951 4.804 1.00 0.00 O ATOM 732 CB HIS A 49 -0.252 0.776 6.962 1.00 0.00 C ATOM 733 CG HIS A 49 -0.525 2.248 6.769 1.00 0.00 C ATOM 734 ND1 HIS A 49 0.305 3.290 7.187 1.00 0.00 N ATOM 735 CD2 HIS A 49 -1.622 2.769 6.146 1.00 0.00 C ATOM 736 CE1 HIS A 49 -0.317 4.414 6.800 1.00 0.00 C ATOM 737 NE2 HIS A 49 -1.475 4.133 6.177 1.00 0.00 N ATOM 0 H HIS A 49 -0.701 0.189 4.259 1.00 0.00 H new ATOM 0 HA HIS A 49 1.664 0.480 6.025 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.199 0.237 6.994 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.233 0.625 7.926 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -2.443 2.217 5.714 1.00 0.00 H new ATOM 0 HE1 HIS A 49 0.062 5.412 6.967 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -2.130 4.815 5.794 1.00 0.00 H new ATOM 745 N LYS A 50 0.666 -1.964 7.035 1.00 0.00 N ATOM 746 CA LYS A 50 0.461 -3.398 7.166 1.00 0.00 C ATOM 747 C LYS A 50 -0.997 -3.675 7.523 1.00 0.00 C ATOM 748 O LYS A 50 -1.546 -3.054 8.429 1.00 0.00 O ATOM 749 CB LYS A 50 1.421 -3.975 8.209 1.00 0.00 C ATOM 750 CG LYS A 50 2.806 -4.223 7.602 1.00 0.00 C ATOM 751 CD LYS A 50 2.784 -5.475 6.722 1.00 0.00 C ATOM 752 CE LYS A 50 4.153 -5.742 6.101 1.00 0.00 C ATOM 753 NZ LYS A 50 4.472 -4.756 5.050 1.00 0.00 N ATOM 0 H LYS A 50 0.895 -1.492 7.909 1.00 0.00 H new ATOM 0 HA LYS A 50 0.676 -3.889 6.217 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.506 -3.287 9.050 1.00 0.00 H new ATOM 0 HB3 LYS A 50 1.019 -4.909 8.601 1.00 0.00 H new ATOM 0 HG2 LYS A 50 3.111 -3.360 7.010 1.00 0.00 H new ATOM 0 HG3 LYS A 50 3.543 -4.342 8.396 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.479 -6.335 7.318 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.042 -5.354 5.933 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.918 -5.709 6.877 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.172 -6.746 5.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.435 -4.925 4.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.794 -4.852 4.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.412 -3.796 5.445 1.00 0.00 H new ATOM 767 N GLY A 51 -1.614 -4.612 6.801 1.00 0.00 N ATOM 768 CA GLY A 51 -2.998 -5.013 6.991 1.00 0.00 C ATOM 769 C GLY A 51 -4.009 -4.018 6.417 1.00 0.00 C ATOM 770 O GLY A 51 -5.178 -4.370 6.268 1.00 0.00 O ATOM 0 H GLY A 51 -1.148 -5.122 6.051 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -3.153 -5.986 6.524 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.188 -5.137 8.057 1.00 0.00 H new ATOM 774 N PHE A 52 -3.592 -2.791 6.090 1.00 0.00 N ATOM 775 CA PHE A 52 -4.498 -1.796 5.538 1.00 0.00 C ATOM 776 C PHE A 52 -3.739 -0.733 4.749 1.00 0.00 C ATOM 777 O PHE A 52 -2.510 -0.664 4.792 1.00 0.00 O ATOM 778 CB PHE A 52 -5.296 -1.123 6.659 1.00 0.00 C ATOM 779 CG PHE A 52 -4.449 -0.373 7.663 1.00 0.00 C ATOM 780 CD1 PHE A 52 -3.862 -1.046 8.741 1.00 0.00 C ATOM 781 CD2 PHE A 52 -4.256 1.006 7.509 1.00 0.00 C ATOM 782 CE1 PHE A 52 -3.070 -0.349 9.661 1.00 0.00 C ATOM 783 CE2 PHE A 52 -3.463 1.702 8.427 1.00 0.00 C ATOM 784 CZ PHE A 52 -2.867 1.027 9.502 1.00 0.00 C ATOM 0 H PHE A 52 -2.631 -2.469 6.201 1.00 0.00 H new ATOM 0 HA PHE A 52 -5.180 -2.310 4.861 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -6.011 -0.430 6.215 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -5.874 -1.883 7.185 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.021 -2.107 8.863 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -4.718 1.529 6.685 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -2.617 -0.871 10.491 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.309 2.764 8.307 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.252 1.568 10.206 1.00 0.00 H new ATOM 794 N ALA A 53 -4.486 0.104 4.029 1.00 0.00 N ATOM 795 CA ALA A 53 -3.955 1.217 3.262 1.00 0.00 C ATOM 796 C ALA A 53 -4.983 2.345 3.209 1.00 0.00 C ATOM 797 O ALA A 53 -6.119 2.180 3.654 1.00 0.00 O ATOM 798 CB ALA A 53 -3.603 0.732 1.856 1.00 0.00 C ATOM 0 H ALA A 53 -5.501 0.020 3.965 1.00 0.00 H new ATOM 0 HA ALA A 53 -3.053 1.602 3.738 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -3.204 1.563 1.274 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -2.855 -0.059 1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -4.499 0.346 1.369 1.00 0.00 H new ATOM 804 N PHE A 54 -4.575 3.493 2.660 1.00 0.00 N ATOM 805 CA PHE A 54 -5.423 4.663 2.541 1.00 0.00 C ATOM 806 C PHE A 54 -5.170 5.384 1.220 1.00 0.00 C ATOM 807 O PHE A 54 -4.074 5.328 0.661 1.00 0.00 O ATOM 808 CB PHE A 54 -5.166 5.620 3.707 1.00 0.00 C ATOM 809 CG PHE A 54 -6.020 5.360 4.927 1.00 0.00 C ATOM 810 CD1 PHE A 54 -7.340 5.837 4.956 1.00 0.00 C ATOM 811 CD2 PHE A 54 -5.507 4.658 6.028 1.00 0.00 C ATOM 812 CE1 PHE A 54 -8.150 5.604 6.075 1.00 0.00 C ATOM 813 CE2 PHE A 54 -6.317 4.421 7.143 1.00 0.00 C ATOM 814 CZ PHE A 54 -7.636 4.896 7.167 1.00 0.00 C ATOM 0 H PHE A 54 -3.636 3.628 2.285 1.00 0.00 H new ATOM 0 HA PHE A 54 -6.462 4.334 2.565 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.116 5.552 3.992 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.339 6.641 3.368 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.732 6.386 4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.488 4.301 6.014 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.166 5.969 6.095 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.926 3.871 7.987 1.00 0.00 H new ATOM 0 HZ PHE A 54 -8.257 4.715 8.031 1.00 0.00 H new ATOM 824 N VAL A 55 -6.200 6.071 0.723 1.00 0.00 N ATOM 825 CA VAL A 55 -6.112 6.876 -0.486 1.00 0.00 C ATOM 826 C VAL A 55 -6.846 8.187 -0.243 1.00 0.00 C ATOM 827 O VAL A 55 -7.824 8.211 0.498 1.00 0.00 O ATOM 828 CB VAL A 55 -6.716 6.115 -1.672 1.00 0.00 C ATOM 829 CG1 VAL A 55 -6.722 6.976 -2.934 1.00 0.00 C ATOM 830 CG2 VAL A 55 -5.896 4.859 -1.955 1.00 0.00 C ATOM 0 H VAL A 55 -7.124 6.081 1.155 1.00 0.00 H new ATOM 0 HA VAL A 55 -5.070 7.085 -0.727 1.00 0.00 H new ATOM 0 HB VAL A 55 -7.741 5.853 -1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.156 6.410 -3.758 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.314 7.874 -2.759 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.700 7.259 -3.186 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.331 4.323 -2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.870 5.140 -2.193 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.901 4.216 -1.075 1.00 0.00 H new ATOM 840 N GLN A 56 -6.381 9.270 -0.861 1.00 0.00 N ATOM 841 CA GLN A 56 -6.957 10.590 -0.683 1.00 0.00 C ATOM 842 C GLN A 56 -7.327 11.165 -2.045 1.00 0.00 C ATOM 843 O GLN A 56 -6.454 11.436 -2.867 1.00 0.00 O ATOM 844 CB GLN A 56 -5.941 11.468 0.056 1.00 0.00 C ATOM 845 CG GLN A 56 -6.427 12.899 0.290 1.00 0.00 C ATOM 846 CD GLN A 56 -7.654 12.928 1.185 1.00 0.00 C ATOM 847 OE1 GLN A 56 -7.551 12.824 2.405 1.00 0.00 O ATOM 848 NE2 GLN A 56 -8.824 13.070 0.580 1.00 0.00 N ATOM 0 H GLN A 56 -5.588 9.251 -1.503 1.00 0.00 H new ATOM 0 HA GLN A 56 -7.869 10.545 -0.087 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.708 11.010 1.017 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.014 11.497 -0.516 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -5.629 13.486 0.745 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.661 13.366 -0.666 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -8.866 13.153 -0.436 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.683 13.096 1.130 1.00 0.00 H new ATOM 857 N TYR A 57 -8.627 11.348 -2.271 1.00 0.00 N ATOM 858 CA TYR A 57 -9.140 11.947 -3.491 1.00 0.00 C ATOM 859 C TYR A 57 -9.337 13.443 -3.289 1.00 0.00 C ATOM 860 O TYR A 57 -9.052 13.976 -2.217 1.00 0.00 O ATOM 861 CB TYR A 57 -10.457 11.285 -3.884 1.00 0.00 C ATOM 862 CG TYR A 57 -10.341 9.857 -4.365 1.00 0.00 C ATOM 863 CD1 TYR A 57 -9.462 9.544 -5.413 1.00 0.00 C ATOM 864 CD2 TYR A 57 -11.130 8.856 -3.785 1.00 0.00 C ATOM 865 CE1 TYR A 57 -9.402 8.238 -5.915 1.00 0.00 C ATOM 866 CE2 TYR A 57 -11.079 7.548 -4.286 1.00 0.00 C ATOM 867 CZ TYR A 57 -10.216 7.236 -5.354 1.00 0.00 C ATOM 868 OH TYR A 57 -10.173 5.969 -5.839 1.00 0.00 O ATOM 0 H TYR A 57 -9.353 11.082 -1.606 1.00 0.00 H new ATOM 0 HA TYR A 57 -8.420 11.794 -4.295 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -11.128 11.309 -3.025 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -10.924 11.879 -4.669 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.830 10.312 -5.834 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -11.777 9.092 -2.953 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -8.734 8.001 -6.729 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.702 6.779 -3.853 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.577 5.936 -6.617 1.00 0.00 H new ATOM 878 N VAL A 58 -9.833 14.121 -4.330 1.00 0.00 N ATOM 879 CA VAL A 58 -10.064 15.558 -4.280 1.00 0.00 C ATOM 880 C VAL A 58 -11.402 15.862 -3.606 1.00 0.00 C ATOM 881 O VAL A 58 -11.597 16.955 -3.077 1.00 0.00 O ATOM 882 CB VAL A 58 -10.019 16.122 -5.705 1.00 0.00 C ATOM 883 CG1 VAL A 58 -10.285 17.629 -5.725 1.00 0.00 C ATOM 884 CG2 VAL A 58 -8.643 15.882 -6.324 1.00 0.00 C ATOM 0 H VAL A 58 -10.082 13.689 -5.220 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.284 16.035 -3.687 1.00 0.00 H new ATOM 0 HB VAL A 58 -10.795 15.610 -6.274 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.245 17.992 -6.752 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -11.272 17.830 -5.307 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.528 18.140 -5.130 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.624 16.287 -7.336 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.881 16.376 -5.721 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.441 14.811 -6.358 1.00 0.00 H new ATOM 894 N ASN A 59 -12.330 14.900 -3.624 1.00 0.00 N ATOM 895 CA ASN A 59 -13.675 15.083 -3.092 1.00 0.00 C ATOM 896 C ASN A 59 -14.305 13.754 -2.675 1.00 0.00 C ATOM 897 O ASN A 59 -13.710 12.690 -2.837 1.00 0.00 O ATOM 898 CB ASN A 59 -14.531 15.759 -4.168 1.00 0.00 C ATOM 899 CG ASN A 59 -14.571 14.928 -5.439 1.00 0.00 C ATOM 900 OD1 ASN A 59 -15.042 13.796 -5.438 1.00 0.00 O ATOM 901 ND2 ASN A 59 -14.074 15.479 -6.538 1.00 0.00 N ATOM 0 H ASN A 59 -12.164 13.971 -4.010 1.00 0.00 H new ATOM 0 HA ASN A 59 -13.621 15.705 -2.199 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -15.544 15.904 -3.793 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -14.129 16.748 -4.389 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -14.077 14.959 -7.415 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.689 16.423 -6.506 1.00 0.00 H new ATOM 908 N GLU A 60 -15.523 13.829 -2.131 1.00 0.00 N ATOM 909 CA GLU A 60 -16.267 12.667 -1.659 1.00 0.00 C ATOM 910 C GLU A 60 -16.789 11.821 -2.817 1.00 0.00 C ATOM 911 O GLU A 60 -16.845 10.598 -2.713 1.00 0.00 O ATOM 912 CB GLU A 60 -17.424 13.163 -0.790 1.00 0.00 C ATOM 913 CG GLU A 60 -18.465 12.063 -0.572 1.00 0.00 C ATOM 914 CD GLU A 60 -19.505 12.461 0.471 1.00 0.00 C ATOM 915 OE1 GLU A 60 -19.966 13.625 0.421 1.00 0.00 O ATOM 916 OE2 GLU A 60 -19.833 11.594 1.313 1.00 0.00 O ATOM 0 H GLU A 60 -16.022 14.710 -2.006 1.00 0.00 H new ATOM 0 HA GLU A 60 -15.603 12.027 -1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -17.040 13.500 0.173 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -17.895 14.024 -1.264 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -18.964 11.843 -1.516 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -17.965 11.148 -0.255 1.00 0.00 H new ATOM 923 N ARG A 61 -17.171 12.462 -3.922 1.00 0.00 N ATOM 924 CA ARG A 61 -17.721 11.785 -5.086 1.00 0.00 C ATOM 925 C ARG A 61 -16.729 10.744 -5.602 1.00 0.00 C ATOM 926 O ARG A 61 -17.116 9.644 -5.993 1.00 0.00 O ATOM 927 CB ARG A 61 -18.051 12.888 -6.101 1.00 0.00 C ATOM 928 CG ARG A 61 -17.805 12.512 -7.559 1.00 0.00 C ATOM 929 CD ARG A 61 -18.760 11.416 -8.028 1.00 0.00 C ATOM 930 NE ARG A 61 -20.146 11.899 -8.079 1.00 0.00 N ATOM 931 CZ ARG A 61 -21.208 11.108 -8.253 1.00 0.00 C ATOM 932 NH1 ARG A 61 -21.064 9.792 -8.403 1.00 0.00 N ATOM 933 NH2 ARG A 61 -22.429 11.637 -8.280 1.00 0.00 N ATOM 0 H ARG A 61 -17.105 13.474 -4.030 1.00 0.00 H new ATOM 0 HA ARG A 61 -18.628 11.224 -4.864 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -19.098 13.168 -5.985 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -17.457 13.770 -5.863 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -17.926 13.394 -8.188 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -16.776 12.174 -7.679 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -18.458 11.066 -9.015 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -18.695 10.562 -7.354 1.00 0.00 H new ATOM 0 HE ARG A 61 -20.308 12.901 -7.975 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -20.133 9.376 -8.386 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -21.885 9.201 -8.535 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -22.551 12.643 -8.168 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -23.242 11.036 -8.413 1.00 0.00 H new ATOM 947 N ASN A 62 -15.442 11.085 -5.605 1.00 0.00 N ATOM 948 CA ASN A 62 -14.395 10.184 -6.056 1.00 0.00 C ATOM 949 C ASN A 62 -14.248 9.015 -5.075 1.00 0.00 C ATOM 950 O ASN A 62 -13.945 7.891 -5.482 1.00 0.00 O ATOM 951 CB ASN A 62 -13.091 10.975 -6.171 1.00 0.00 C ATOM 952 CG ASN A 62 -13.006 11.777 -7.465 1.00 0.00 C ATOM 953 OD1 ASN A 62 -12.015 11.698 -8.181 1.00 0.00 O ATOM 954 ND2 ASN A 62 -14.028 12.557 -7.785 1.00 0.00 N ATOM 0 H ASN A 62 -15.100 11.994 -5.294 1.00 0.00 H new ATOM 0 HA ASN A 62 -14.649 9.767 -7.030 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -13.005 11.652 -5.321 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -12.247 10.287 -6.118 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.000 13.108 -8.643 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -14.843 12.607 -7.173 1.00 0.00 H new ATOM 961 N ALA A 63 -14.461 9.263 -3.780 1.00 0.00 N ATOM 962 CA ALA A 63 -14.364 8.208 -2.783 1.00 0.00 C ATOM 963 C ALA A 63 -15.489 7.190 -2.952 1.00 0.00 C ATOM 964 O ALA A 63 -15.247 5.992 -2.830 1.00 0.00 O ATOM 965 CB ALA A 63 -14.383 8.819 -1.381 1.00 0.00 C ATOM 0 H ALA A 63 -14.700 10.181 -3.405 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.421 7.679 -2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -14.310 8.025 -0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -13.539 9.500 -1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -15.313 9.368 -1.236 1.00 0.00 H new ATOM 971 N ARG A 64 -16.714 7.643 -3.239 1.00 0.00 N ATOM 972 CA ARG A 64 -17.840 6.738 -3.456 1.00 0.00 C ATOM 973 C ARG A 64 -17.615 5.913 -4.717 1.00 0.00 C ATOM 974 O ARG A 64 -18.155 4.811 -4.827 1.00 0.00 O ATOM 975 CB ARG A 64 -19.132 7.545 -3.604 1.00 0.00 C ATOM 976 CG ARG A 64 -19.443 8.438 -2.402 1.00 0.00 C ATOM 977 CD ARG A 64 -19.661 7.634 -1.121 1.00 0.00 C ATOM 978 NE ARG A 64 -19.931 8.541 0.001 1.00 0.00 N ATOM 979 CZ ARG A 64 -20.296 8.147 1.222 1.00 0.00 C ATOM 980 NH1 ARG A 64 -20.456 6.857 1.512 1.00 0.00 N ATOM 981 NH2 ARG A 64 -20.507 9.058 2.168 1.00 0.00 N ATOM 0 H ARG A 64 -16.948 8.632 -3.326 1.00 0.00 H new ATOM 0 HA ARG A 64 -17.922 6.069 -2.599 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -19.061 8.166 -4.497 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -19.963 6.857 -3.759 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -18.623 9.140 -2.252 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -20.334 9.029 -2.613 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -20.496 6.945 -1.252 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -18.780 7.030 -0.907 1.00 0.00 H new ATOM 0 HE ARG A 64 -19.833 9.543 -0.165 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -20.299 6.150 0.794 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -20.736 6.576 2.452 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -20.389 10.049 1.957 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -20.786 8.766 3.104 1.00 0.00 H new ATOM 995 N ALA A 65 -16.825 6.429 -5.664 1.00 0.00 N ATOM 996 CA ALA A 65 -16.555 5.721 -6.900 1.00 0.00 C ATOM 997 C ALA A 65 -15.701 4.482 -6.646 1.00 0.00 C ATOM 998 O ALA A 65 -15.953 3.437 -7.240 1.00 0.00 O ATOM 999 CB ALA A 65 -15.836 6.664 -7.862 1.00 0.00 C ATOM 0 H ALA A 65 -16.365 7.336 -5.589 1.00 0.00 H new ATOM 0 HA ALA A 65 -17.499 5.392 -7.335 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -15.628 6.142 -8.796 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.467 7.529 -8.063 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -14.899 6.995 -7.415 1.00 0.00 H new ATOM 1005 N ALA A 66 -14.696 4.587 -5.768 1.00 0.00 N ATOM 1006 CA ALA A 66 -13.828 3.450 -5.484 1.00 0.00 C ATOM 1007 C ALA A 66 -14.312 2.631 -4.290 1.00 0.00 C ATOM 1008 O ALA A 66 -14.056 1.429 -4.230 1.00 0.00 O ATOM 1009 CB ALA A 66 -12.408 3.957 -5.264 1.00 0.00 C ATOM 0 H ALA A 66 -14.470 5.437 -5.251 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.851 2.776 -6.340 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -11.750 3.115 -5.051 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.062 4.470 -6.161 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -12.395 4.650 -4.422 1.00 0.00 H new ATOM 1015 N VAL A 67 -15.011 3.258 -3.341 1.00 0.00 N ATOM 1016 CA VAL A 67 -15.564 2.552 -2.191 1.00 0.00 C ATOM 1017 C VAL A 67 -16.687 1.619 -2.639 1.00 0.00 C ATOM 1018 O VAL A 67 -17.011 0.659 -1.941 1.00 0.00 O ATOM 1019 CB VAL A 67 -16.018 3.554 -1.120 1.00 0.00 C ATOM 1020 CG1 VAL A 67 -16.951 2.902 -0.104 1.00 0.00 C ATOM 1021 CG2 VAL A 67 -14.795 4.085 -0.380 1.00 0.00 C ATOM 0 H VAL A 67 -15.206 4.259 -3.350 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.793 1.930 -1.736 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.554 4.361 -1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -17.253 3.640 0.639 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -17.835 2.519 -0.615 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -16.433 2.080 0.390 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -15.112 4.797 0.382 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.268 3.257 0.094 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -14.129 4.581 -1.086 1.00 0.00 H new ATOM 1031 N ALA A 68 -17.279 1.891 -3.804 1.00 0.00 N ATOM 1032 CA ALA A 68 -18.260 0.997 -4.403 1.00 0.00 C ATOM 1033 C ALA A 68 -17.715 0.314 -5.662 1.00 0.00 C ATOM 1034 O ALA A 68 -18.335 -0.621 -6.164 1.00 0.00 O ATOM 1035 CB ALA A 68 -19.530 1.789 -4.707 1.00 0.00 C ATOM 0 H ALA A 68 -17.091 2.731 -4.351 1.00 0.00 H new ATOM 0 HA ALA A 68 -18.490 0.200 -3.696 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -20.272 1.129 -5.156 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -19.928 2.207 -3.782 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -19.297 2.598 -5.400 1.00 0.00 H new ATOM 1041 N GLY A 69 -16.566 0.766 -6.180 1.00 0.00 N ATOM 1042 CA GLY A 69 -15.993 0.210 -7.400 1.00 0.00 C ATOM 1043 C GLY A 69 -14.944 -0.877 -7.160 1.00 0.00 C ATOM 1044 O GLY A 69 -14.760 -1.738 -8.015 1.00 0.00 O ATOM 0 H GLY A 69 -16.017 1.519 -5.766 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.796 -0.204 -8.010 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -15.539 1.017 -7.976 1.00 0.00 H new ATOM 1048 N GLU A 70 -14.257 -0.852 -6.014 1.00 0.00 N ATOM 1049 CA GLU A 70 -13.183 -1.797 -5.711 1.00 0.00 C ATOM 1050 C GLU A 70 -13.489 -2.628 -4.469 1.00 0.00 C ATOM 1051 O GLU A 70 -12.828 -3.635 -4.238 1.00 0.00 O ATOM 1052 CB GLU A 70 -11.877 -1.029 -5.503 1.00 0.00 C ATOM 1053 CG GLU A 70 -11.376 -0.357 -6.780 1.00 0.00 C ATOM 1054 CD GLU A 70 -10.865 -1.384 -7.787 1.00 0.00 C ATOM 1055 OE1 GLU A 70 -9.663 -1.713 -7.716 1.00 0.00 O ATOM 1056 OE2 GLU A 70 -11.677 -1.835 -8.626 1.00 0.00 O ATOM 0 H GLU A 70 -14.431 -0.175 -5.271 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.091 -2.482 -6.554 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.025 -0.272 -4.733 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -11.113 -1.713 -5.134 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.183 0.224 -7.228 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -10.577 0.343 -6.535 1.00 0.00 H new ATOM 1063 N ASP A 71 -14.473 -2.236 -3.661 1.00 0.00 N ATOM 1064 CA ASP A 71 -14.756 -2.960 -2.435 1.00 0.00 C ATOM 1065 C ASP A 71 -15.116 -4.415 -2.737 1.00 0.00 C ATOM 1066 O ASP A 71 -15.960 -4.692 -3.589 1.00 0.00 O ATOM 1067 CB ASP A 71 -15.872 -2.248 -1.675 1.00 0.00 C ATOM 1068 CG ASP A 71 -16.308 -3.059 -0.459 1.00 0.00 C ATOM 1069 OD1 ASP A 71 -15.405 -3.540 0.260 1.00 0.00 O ATOM 1070 OD2 ASP A 71 -17.537 -3.194 -0.259 1.00 0.00 O ATOM 0 H ASP A 71 -15.077 -1.432 -3.834 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.865 -2.976 -1.807 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.529 -1.264 -1.356 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -16.724 -2.090 -2.336 1.00 0.00 H new ATOM 1075 N GLY A 72 -14.466 -5.345 -2.029 1.00 0.00 N ATOM 1076 CA GLY A 72 -14.717 -6.769 -2.184 1.00 0.00 C ATOM 1077 C GLY A 72 -13.908 -7.383 -3.327 1.00 0.00 C ATOM 1078 O GLY A 72 -14.203 -8.506 -3.736 1.00 0.00 O ATOM 0 H GLY A 72 -13.752 -5.125 -1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.473 -7.281 -1.254 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.779 -6.930 -2.367 1.00 0.00 H new ATOM 1082 N ARG A 73 -12.899 -6.673 -3.849 1.00 0.00 N ATOM 1083 CA ARG A 73 -12.083 -7.191 -4.943 1.00 0.00 C ATOM 1084 C ARG A 73 -10.854 -7.926 -4.416 1.00 0.00 C ATOM 1085 O ARG A 73 -10.461 -7.730 -3.272 1.00 0.00 O ATOM 1086 CB ARG A 73 -11.693 -6.082 -5.924 1.00 0.00 C ATOM 1087 CG ARG A 73 -10.485 -5.268 -5.457 1.00 0.00 C ATOM 1088 CD ARG A 73 -9.877 -4.521 -6.643 1.00 0.00 C ATOM 1089 NE ARG A 73 -9.152 -5.446 -7.523 1.00 0.00 N ATOM 1090 CZ ARG A 73 -8.395 -5.066 -8.557 1.00 0.00 C ATOM 1091 NH1 ARG A 73 -8.266 -3.779 -8.872 1.00 0.00 N ATOM 1092 NH2 ARG A 73 -7.760 -5.983 -9.283 1.00 0.00 N ATOM 0 H ARG A 73 -12.633 -5.742 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.688 -7.913 -5.491 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -11.472 -6.525 -6.895 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -12.542 -5.413 -6.064 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -10.788 -4.560 -4.686 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.741 -5.927 -5.010 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.664 -4.019 -7.205 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.199 -3.747 -6.283 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.231 -6.445 -7.333 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -8.748 -3.068 -8.322 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -7.685 -3.504 -9.664 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -7.852 -6.972 -9.050 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.181 -5.697 -10.073 1.00 0.00 H new ATOM 1106 N MET A 74 -10.244 -8.766 -5.252 1.00 0.00 N ATOM 1107 CA MET A 74 -9.026 -9.464 -4.881 1.00 0.00 C ATOM 1108 C MET A 74 -7.797 -8.755 -5.440 1.00 0.00 C ATOM 1109 O MET A 74 -7.801 -8.293 -6.583 1.00 0.00 O ATOM 1110 CB MET A 74 -9.094 -10.922 -5.333 1.00 0.00 C ATOM 1111 CG MET A 74 -7.748 -11.605 -5.078 1.00 0.00 C ATOM 1112 SD MET A 74 -7.832 -13.407 -4.986 1.00 0.00 S ATOM 1113 CE MET A 74 -8.614 -13.517 -3.358 1.00 0.00 C ATOM 0 H MET A 74 -10.579 -8.976 -6.192 1.00 0.00 H new ATOM 0 HA MET A 74 -8.934 -9.454 -3.795 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.885 -11.443 -4.794 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.343 -10.973 -6.393 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.056 -11.326 -5.873 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.332 -11.225 -4.145 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.088 -14.253 -2.751 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.571 -12.545 -2.867 1.00 0.00 H new ATOM 0 HE3 MET A 74 -9.655 -13.819 -3.474 1.00 0.00 H new ATOM 1123 N ILE A 75 -6.747 -8.680 -4.617 1.00 0.00 N ATOM 1124 CA ILE A 75 -5.453 -8.132 -4.987 1.00 0.00 C ATOM 1125 C ILE A 75 -4.374 -8.960 -4.293 1.00 0.00 C ATOM 1126 O ILE A 75 -4.484 -9.262 -3.107 1.00 0.00 O ATOM 1127 CB ILE A 75 -5.353 -6.657 -4.568 1.00 0.00 C ATOM 1128 CG1 ILE A 75 -6.525 -5.850 -5.145 1.00 0.00 C ATOM 1129 CG2 ILE A 75 -4.021 -6.059 -5.026 1.00 0.00 C ATOM 1130 CD1 ILE A 75 -6.547 -4.403 -4.655 1.00 0.00 C ATOM 0 H ILE A 75 -6.781 -9.009 -3.652 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.322 -8.177 -6.068 1.00 0.00 H new ATOM 0 HB ILE A 75 -5.401 -6.607 -3.480 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -6.465 -5.859 -6.233 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.463 -6.335 -4.873 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -3.967 -5.014 -4.721 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.199 -6.612 -4.572 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.947 -6.124 -6.112 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -7.397 -3.882 -5.096 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -6.636 -4.388 -3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -5.623 -3.905 -4.950 1.00 0.00 H new ATOM 1142 N ALA A 76 -3.330 -9.331 -5.037 1.00 0.00 N ATOM 1143 CA ALA A 76 -2.210 -10.110 -4.530 1.00 0.00 C ATOM 1144 C ALA A 76 -2.620 -11.399 -3.799 1.00 0.00 C ATOM 1145 O ALA A 76 -1.824 -11.945 -3.039 1.00 0.00 O ATOM 1146 CB ALA A 76 -1.316 -9.214 -3.673 1.00 0.00 C ATOM 0 H ALA A 76 -3.242 -9.092 -6.025 1.00 0.00 H new ATOM 0 HA ALA A 76 -1.645 -10.465 -5.392 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -0.476 -9.795 -3.292 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.941 -8.389 -4.278 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -1.892 -8.818 -2.837 1.00 0.00 H new ATOM 1152 N GLY A 77 -3.845 -11.894 -4.015 1.00 0.00 N ATOM 1153 CA GLY A 77 -4.281 -13.176 -3.475 1.00 0.00 C ATOM 1154 C GLY A 77 -5.224 -13.059 -2.280 1.00 0.00 C ATOM 1155 O GLY A 77 -5.655 -14.080 -1.749 1.00 0.00 O ATOM 0 H GLY A 77 -4.556 -11.415 -4.568 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -4.779 -13.740 -4.264 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.404 -13.750 -3.177 1.00 0.00 H new ATOM 1159 N GLN A 78 -5.552 -11.838 -1.847 1.00 0.00 N ATOM 1160 CA GLN A 78 -6.501 -11.614 -0.761 1.00 0.00 C ATOM 1161 C GLN A 78 -7.495 -10.531 -1.149 1.00 0.00 C ATOM 1162 O GLN A 78 -7.229 -9.709 -2.022 1.00 0.00 O ATOM 1163 CB GLN A 78 -5.778 -11.211 0.529 1.00 0.00 C ATOM 1164 CG GLN A 78 -5.039 -12.390 1.170 1.00 0.00 C ATOM 1165 CD GLN A 78 -3.557 -12.083 1.321 1.00 0.00 C ATOM 1166 OE1 GLN A 78 -3.063 -11.888 2.430 1.00 0.00 O ATOM 1167 NE2 GLN A 78 -2.840 -12.036 0.203 1.00 0.00 N ATOM 0 H GLN A 78 -5.166 -10.980 -2.241 1.00 0.00 H new ATOM 0 HA GLN A 78 -7.033 -12.548 -0.582 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -5.067 -10.414 0.311 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -6.501 -10.809 1.238 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -5.471 -12.608 2.147 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -5.169 -13.282 0.558 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -3.288 -12.204 -0.698 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -1.841 -11.832 0.246 1.00 0.00 H new ATOM 1176 N VAL A 79 -8.655 -10.538 -0.492 1.00 0.00 N ATOM 1177 CA VAL A 79 -9.687 -9.533 -0.703 1.00 0.00 C ATOM 1178 C VAL A 79 -9.527 -8.438 0.341 1.00 0.00 C ATOM 1179 O VAL A 79 -9.114 -8.703 1.466 1.00 0.00 O ATOM 1180 CB VAL A 79 -11.080 -10.167 -0.649 1.00 0.00 C ATOM 1181 CG1 VAL A 79 -12.186 -9.117 -0.786 1.00 0.00 C ATOM 1182 CG2 VAL A 79 -11.238 -11.176 -1.786 1.00 0.00 C ATOM 0 H VAL A 79 -8.902 -11.244 0.202 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.578 -9.093 -1.694 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.174 -10.657 0.320 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.159 -9.606 -0.743 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.106 -8.396 0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.081 -8.601 -1.740 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.231 -11.623 -1.741 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.111 -10.669 -2.743 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.484 -11.957 -1.687 1.00 0.00 H new ATOM 1192 N LEU A 80 -9.861 -7.208 -0.046 1.00 0.00 N ATOM 1193 CA LEU A 80 -9.743 -6.041 0.808 1.00 0.00 C ATOM 1194 C LEU A 80 -11.115 -5.429 1.042 1.00 0.00 C ATOM 1195 O LEU A 80 -11.964 -5.410 0.150 1.00 0.00 O ATOM 1196 CB LEU A 80 -8.727 -5.012 0.277 1.00 0.00 C ATOM 1197 CG LEU A 80 -8.404 -5.016 -1.222 1.00 0.00 C ATOM 1198 CD1 LEU A 80 -7.677 -6.285 -1.667 1.00 0.00 C ATOM 1199 CD2 LEU A 80 -9.652 -4.799 -2.069 1.00 0.00 C ATOM 0 H LEU A 80 -10.225 -6.998 -0.975 1.00 0.00 H new ATOM 0 HA LEU A 80 -9.344 -6.369 1.768 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -9.094 -4.019 0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.792 -5.157 0.819 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.726 -4.178 -1.382 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.474 -6.232 -2.737 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.736 -6.375 -1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.301 -7.154 -1.459 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.381 -4.808 -3.125 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.369 -5.596 -1.871 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -10.100 -3.837 -1.818 1.00 0.00 H new ATOM 1211 N ASP A 81 -11.319 -4.929 2.258 1.00 0.00 N ATOM 1212 CA ASP A 81 -12.574 -4.338 2.678 1.00 0.00 C ATOM 1213 C ASP A 81 -12.439 -2.824 2.579 1.00 0.00 C ATOM 1214 O ASP A 81 -11.813 -2.191 3.429 1.00 0.00 O ATOM 1215 CB ASP A 81 -12.878 -4.797 4.107 1.00 0.00 C ATOM 1216 CG ASP A 81 -14.206 -4.252 4.624 1.00 0.00 C ATOM 1217 OD1 ASP A 81 -15.176 -4.224 3.833 1.00 0.00 O ATOM 1218 OD2 ASP A 81 -14.239 -3.866 5.815 1.00 0.00 O ATOM 0 H ASP A 81 -10.603 -4.926 2.985 1.00 0.00 H new ATOM 0 HA ASP A 81 -13.403 -4.652 2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -12.899 -5.886 4.139 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -12.074 -4.474 4.768 1.00 0.00 H new ATOM 1223 N ILE A 82 -13.032 -2.244 1.532 1.00 0.00 N ATOM 1224 CA ILE A 82 -12.912 -0.821 1.257 1.00 0.00 C ATOM 1225 C ILE A 82 -14.164 -0.097 1.742 1.00 0.00 C ATOM 1226 O ILE A 82 -15.275 -0.598 1.591 1.00 0.00 O ATOM 1227 CB ILE A 82 -12.661 -0.618 -0.237 1.00 0.00 C ATOM 1228 CG1 ILE A 82 -11.362 -1.331 -0.636 1.00 0.00 C ATOM 1229 CG2 ILE A 82 -12.568 0.870 -0.570 1.00 0.00 C ATOM 1230 CD1 ILE A 82 -11.265 -1.459 -2.152 1.00 0.00 C ATOM 0 H ILE A 82 -13.605 -2.750 0.857 1.00 0.00 H new ATOM 0 HA ILE A 82 -12.065 -0.396 1.796 1.00 0.00 H new ATOM 0 HB ILE A 82 -13.495 -1.041 -0.797 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -10.504 -0.775 -0.257 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -11.328 -2.320 -0.179 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.389 0.993 -1.638 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -13.502 1.362 -0.299 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -11.746 1.317 -0.011 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -10.337 -1.967 -2.416 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.112 -2.035 -2.523 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -11.276 -0.466 -2.602 1.00 0.00 H new ATOM 1242 N ASN A 83 -13.981 1.088 2.328 1.00 0.00 N ATOM 1243 CA ASN A 83 -15.083 1.822 2.919 1.00 0.00 C ATOM 1244 C ASN A 83 -14.735 3.303 3.036 1.00 0.00 C ATOM 1245 O ASN A 83 -13.568 3.684 2.946 1.00 0.00 O ATOM 1246 CB ASN A 83 -15.371 1.224 4.300 1.00 0.00 C ATOM 1247 CG ASN A 83 -16.744 1.617 4.829 1.00 0.00 C ATOM 1248 OD1 ASN A 83 -17.733 0.947 4.550 1.00 0.00 O ATOM 1249 ND2 ASN A 83 -16.821 2.701 5.594 1.00 0.00 N ATOM 0 H ASN A 83 -13.076 1.553 2.402 1.00 0.00 H new ATOM 0 HA ASN A 83 -15.968 1.740 2.288 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -15.304 0.138 4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -14.606 1.554 5.003 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -17.722 2.998 5.968 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -15.979 3.236 5.807 1.00 0.00 H new ATOM 1256 N LEU A 84 -15.751 4.143 3.242 1.00 0.00 N ATOM 1257 CA LEU A 84 -15.543 5.553 3.521 1.00 0.00 C ATOM 1258 C LEU A 84 -14.833 5.660 4.872 1.00 0.00 C ATOM 1259 O LEU A 84 -15.077 4.844 5.759 1.00 0.00 O ATOM 1260 CB LEU A 84 -16.902 6.262 3.543 1.00 0.00 C ATOM 1261 CG LEU A 84 -17.002 7.454 2.586 1.00 0.00 C ATOM 1262 CD1 LEU A 84 -16.031 8.556 2.992 1.00 0.00 C ATOM 1263 CD2 LEU A 84 -16.730 7.055 1.135 1.00 0.00 C ATOM 0 H LEU A 84 -16.731 3.862 3.219 1.00 0.00 H new ATOM 0 HA LEU A 84 -14.929 6.029 2.756 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -17.680 5.541 3.291 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -17.104 6.606 4.557 1.00 0.00 H new ATOM 0 HG LEU A 84 -18.026 7.821 2.653 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -16.119 9.392 2.299 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -16.266 8.895 4.001 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -15.012 8.170 2.967 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -16.812 7.933 0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -15.725 6.640 1.054 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -17.458 6.307 0.821 1.00 0.00 H new ATOM 1275 N ALA A 85 -13.959 6.652 5.050 1.00 0.00 N ATOM 1276 CA ALA A 85 -13.130 6.723 6.245 1.00 0.00 C ATOM 1277 C ALA A 85 -13.863 7.298 7.455 1.00 0.00 C ATOM 1278 O ALA A 85 -13.283 7.400 8.533 1.00 0.00 O ATOM 1279 CB ALA A 85 -11.869 7.519 5.935 1.00 0.00 C ATOM 0 H ALA A 85 -13.810 7.411 4.384 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.864 5.703 6.523 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -11.245 7.575 6.827 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -11.315 7.027 5.135 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.143 8.526 5.620 1.00 0.00 H new ATOM 1285 N ALA A 86 -15.130 7.675 7.287 1.00 0.00 N ATOM 1286 CA ALA A 86 -15.947 8.202 8.367 1.00 0.00 C ATOM 1287 C ALA A 86 -17.274 7.450 8.472 1.00 0.00 C ATOM 1288 O ALA A 86 -18.199 7.914 9.136 1.00 0.00 O ATOM 1289 CB ALA A 86 -16.162 9.695 8.147 1.00 0.00 C ATOM 0 H ALA A 86 -15.616 7.621 6.392 1.00 0.00 H new ATOM 0 HA ALA A 86 -15.430 8.057 9.315 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -16.774 10.097 8.954 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -15.198 10.204 8.135 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.668 9.853 7.194 1.00 0.00 H new ATOM 1295 N GLU A 87 -17.374 6.288 7.818 1.00 0.00 N ATOM 1296 CA GLU A 87 -18.604 5.505 7.808 1.00 0.00 C ATOM 1297 C GLU A 87 -18.358 4.019 8.085 1.00 0.00 C ATOM 1298 O GLU A 87 -18.895 3.171 7.371 1.00 0.00 O ATOM 1299 CB GLU A 87 -19.345 5.702 6.481 1.00 0.00 C ATOM 1300 CG GLU A 87 -19.620 7.184 6.214 1.00 0.00 C ATOM 1301 CD GLU A 87 -20.526 7.385 5.000 1.00 0.00 C ATOM 1302 OE1 GLU A 87 -20.682 6.423 4.213 1.00 0.00 O ATOM 1303 OE2 GLU A 87 -21.058 8.508 4.862 1.00 0.00 O ATOM 0 H GLU A 87 -16.610 5.871 7.287 1.00 0.00 H new ATOM 0 HA GLU A 87 -19.229 5.871 8.622 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -18.752 5.287 5.666 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -20.286 5.153 6.502 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -20.085 7.631 7.092 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -18.676 7.705 6.053 1.00 0.00 H new ATOM 1310 N PRO A 88 -17.556 3.670 9.102 1.00 0.00 N ATOM 1311 CA PRO A 88 -17.231 2.288 9.409 1.00 0.00 C ATOM 1312 C PRO A 88 -18.473 1.520 9.857 1.00 0.00 C ATOM 1313 O PRO A 88 -19.354 2.070 10.519 1.00 0.00 O ATOM 1314 CB PRO A 88 -16.186 2.350 10.523 1.00 0.00 C ATOM 1315 CG PRO A 88 -16.487 3.679 11.211 1.00 0.00 C ATOM 1316 CD PRO A 88 -16.919 4.565 10.047 1.00 0.00 C ATOM 0 HA PRO A 88 -16.850 1.760 8.535 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -16.281 1.510 11.211 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.172 2.323 10.125 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.274 3.579 11.959 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.611 4.079 11.722 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.608 5.342 10.379 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.063 5.068 9.597 1.00 0.00 H new ATOM 1324 N LYS A 89 -18.531 0.236 9.490 1.00 0.00 N ATOM 1325 CA LYS A 89 -19.629 -0.648 9.859 1.00 0.00 C ATOM 1326 C LYS A 89 -19.109 -2.055 10.167 1.00 0.00 C ATOM 1327 O LYS A 89 -19.893 -2.963 10.436 1.00 0.00 O ATOM 1328 CB LYS A 89 -20.650 -0.643 8.714 1.00 0.00 C ATOM 1329 CG LYS A 89 -21.990 -1.298 9.067 1.00 0.00 C ATOM 1330 CD LYS A 89 -22.649 -0.688 10.306 1.00 0.00 C ATOM 1331 CE LYS A 89 -22.824 0.824 10.143 1.00 0.00 C ATOM 1332 NZ LYS A 89 -23.481 1.410 11.326 1.00 0.00 N ATOM 0 H LYS A 89 -17.812 -0.217 8.926 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.116 -0.296 10.768 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.831 0.387 8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -20.220 -1.160 7.856 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -22.668 -1.204 8.219 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.834 -2.364 9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -23.620 -1.155 10.473 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -22.040 -0.895 11.186 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.851 1.292 9.993 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -23.418 1.031 9.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -23.588 2.436 11.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -24.418 0.978 11.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -22.900 1.231 12.170 1.00 0.00 H new ATOM 1346 N VAL A 90 -17.786 -2.236 10.125 1.00 0.00 N ATOM 1347 CA VAL A 90 -17.143 -3.521 10.353 1.00 0.00 C ATOM 1348 C VAL A 90 -16.561 -3.575 11.763 1.00 0.00 C ATOM 1349 O VAL A 90 -16.258 -2.544 12.361 1.00 0.00 O ATOM 1350 CB VAL A 90 -16.099 -3.774 9.256 1.00 0.00 C ATOM 1351 CG1 VAL A 90 -14.933 -2.787 9.345 1.00 0.00 C ATOM 1352 CG2 VAL A 90 -15.561 -5.201 9.326 1.00 0.00 C ATOM 0 H VAL A 90 -17.129 -1.481 9.929 1.00 0.00 H new ATOM 0 HA VAL A 90 -17.874 -4.327 10.291 1.00 0.00 H new ATOM 0 HB VAL A 90 -16.605 -3.628 8.302 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.216 -2.999 8.552 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -15.308 -1.770 9.233 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -14.444 -2.889 10.314 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -14.824 -5.351 8.537 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -15.093 -5.366 10.296 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -16.382 -5.906 9.194 1.00 0.00 H new ATOM 1362 N ASN A 91 -16.403 -4.791 12.290 1.00 0.00 N ATOM 1363 CA ASN A 91 -15.931 -5.010 13.653 1.00 0.00 C ATOM 1364 C ASN A 91 -14.411 -4.893 13.761 1.00 0.00 C ATOM 1365 O ASN A 91 -13.854 -5.057 14.847 1.00 0.00 O ATOM 1366 CB ASN A 91 -16.395 -6.385 14.132 1.00 0.00 C ATOM 1367 CG ASN A 91 -17.821 -6.696 13.702 1.00 0.00 C ATOM 1368 OD1 ASN A 91 -18.778 -6.381 14.405 1.00 0.00 O ATOM 1369 ND2 ASN A 91 -17.965 -7.322 12.537 1.00 0.00 N ATOM 0 H ASN A 91 -16.600 -5.652 11.780 1.00 0.00 H new ATOM 0 HA ASN A 91 -16.355 -4.233 14.288 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -15.725 -7.149 13.739 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -16.328 -6.430 15.219 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -18.897 -7.558 12.197 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -17.143 -7.566 11.984 1.00 0.00 H new ATOM 1376 N ARG A 92 -13.746 -4.614 12.634 1.00 0.00 N ATOM 1377 CA ARG A 92 -12.292 -4.574 12.539 1.00 0.00 C ATOM 1378 C ARG A 92 -11.663 -5.825 13.159 1.00 0.00 C ATOM 1379 O ARG A 92 -10.654 -5.749 13.857 1.00 0.00 O ATOM 1380 CB ARG A 92 -11.749 -3.263 13.114 1.00 0.00 C ATOM 1381 CG ARG A 92 -12.275 -2.086 12.287 1.00 0.00 C ATOM 1382 CD ARG A 92 -11.590 -0.772 12.670 1.00 0.00 C ATOM 1383 NE ARG A 92 -11.844 -0.420 14.073 1.00 0.00 N ATOM 1384 CZ ARG A 92 -10.923 -0.434 15.042 1.00 0.00 C ATOM 1385 NH1 ARG A 92 -9.661 -0.784 14.797 1.00 0.00 N ATOM 1386 NH2 ARG A 92 -11.268 -0.093 16.280 1.00 0.00 N ATOM 0 H ARG A 92 -14.215 -4.407 11.752 1.00 0.00 H new ATOM 0 HA ARG A 92 -12.004 -4.589 11.488 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.055 -3.156 14.155 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.659 -3.272 13.101 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -12.113 -2.285 11.228 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -13.351 -1.991 12.433 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.516 -0.859 12.505 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.949 0.028 12.023 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.793 -0.145 14.327 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.379 -1.049 13.853 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -8.977 -0.787 15.553 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.230 0.177 16.485 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -10.571 -0.101 17.024 1.00 0.00 H new ATOM 1400 N GLY A 93 -12.281 -6.979 12.891 1.00 0.00 N ATOM 1401 CA GLY A 93 -11.893 -8.266 13.446 1.00 0.00 C ATOM 1402 C GLY A 93 -10.619 -8.844 12.833 1.00 0.00 C ATOM 1403 O GLY A 93 -10.292 -10.002 13.091 1.00 0.00 O ATOM 0 H GLY A 93 -13.085 -7.039 12.266 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -11.751 -8.159 14.521 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.709 -8.974 13.301 1.00 0.00 H new ATOM 1407 N LYS A 94 -9.902 -8.055 12.025 1.00 0.00 N ATOM 1408 CA LYS A 94 -8.713 -8.456 11.301 1.00 0.00 C ATOM 1409 C LYS A 94 -8.982 -9.593 10.326 1.00 0.00 C ATOM 1410 O LYS A 94 -10.087 -10.121 10.214 1.00 0.00 O ATOM 1411 CB LYS A 94 -7.573 -8.816 12.256 1.00 0.00 C ATOM 1412 CG LYS A 94 -7.506 -7.885 13.471 1.00 0.00 C ATOM 1413 CD LYS A 94 -6.350 -8.276 14.398 1.00 0.00 C ATOM 1414 CE LYS A 94 -6.478 -9.716 14.903 1.00 0.00 C ATOM 1415 NZ LYS A 94 -7.722 -9.906 15.678 1.00 0.00 N ATOM 0 H LYS A 94 -10.154 -7.081 11.858 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.404 -7.593 10.710 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -7.700 -9.843 12.597 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -6.626 -8.774 11.718 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -7.378 -6.855 13.138 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.447 -7.928 14.019 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.405 -8.161 13.867 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.322 -7.595 15.249 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.466 -10.403 14.057 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.618 -9.963 15.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -7.708 -10.841 16.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.793 -9.167 16.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.541 -9.843 15.040 1.00 0.00 H new ATOM 1429 N ALA A 95 -7.915 -9.946 9.626 1.00 0.00 N ATOM 1430 CA ALA A 95 -7.880 -11.014 8.646 1.00 0.00 C ATOM 1431 C ALA A 95 -7.854 -12.391 9.310 1.00 0.00 C ATOM 1432 O ALA A 95 -7.519 -12.518 10.486 1.00 0.00 O ATOM 1433 CB ALA A 95 -6.634 -10.804 7.803 1.00 0.00 C ATOM 0 H ALA A 95 -7.016 -9.476 9.731 1.00 0.00 H new ATOM 0 HA ALA A 95 -8.780 -10.985 8.032 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -6.568 -11.589 7.050 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -6.687 -9.833 7.311 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -5.752 -10.840 8.442 1.00 0.00 H new ATOM 1439 N GLY A 96 -8.205 -13.426 8.540 1.00 0.00 N ATOM 1440 CA GLY A 96 -8.167 -14.806 8.999 1.00 0.00 C ATOM 1441 C GLY A 96 -6.738 -15.345 9.053 1.00 0.00 C ATOM 1442 O GLY A 96 -6.521 -16.485 9.461 1.00 0.00 O ATOM 0 H GLY A 96 -8.524 -13.323 7.577 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -8.619 -14.873 9.989 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.765 -15.428 8.333 1.00 0.00 H new ATOM 1446 N VAL A 97 -5.763 -14.528 8.640 1.00 0.00 N ATOM 1447 CA VAL A 97 -4.353 -14.896 8.647 1.00 0.00 C ATOM 1448 C VAL A 97 -3.818 -14.926 10.076 1.00 0.00 C ATOM 1449 O VAL A 97 -2.852 -15.631 10.370 1.00 0.00 O ATOM 1450 CB VAL A 97 -3.570 -13.889 7.799 1.00 0.00 C ATOM 1451 CG1 VAL A 97 -2.082 -14.234 7.774 1.00 0.00 C ATOM 1452 CG2 VAL A 97 -4.086 -13.897 6.358 1.00 0.00 C ATOM 0 H VAL A 97 -5.937 -13.586 8.290 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.234 -15.893 8.224 1.00 0.00 H new ATOM 0 HB VAL A 97 -3.709 -12.905 8.247 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.549 -13.503 7.165 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.687 -14.217 8.790 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.946 -15.229 7.349 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.521 -13.177 5.765 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.963 -14.893 5.933 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.142 -13.626 6.348 1.00 0.00 H new ATOM 1462 N LYS A 98 -4.447 -14.159 10.969 1.00 0.00 N ATOM 1463 CA LYS A 98 -4.049 -14.085 12.363 1.00 0.00 C ATOM 1464 C LYS A 98 -4.752 -15.172 13.174 1.00 0.00 C ATOM 1465 O LYS A 98 -5.847 -15.601 12.822 1.00 0.00 O ATOM 1466 CB LYS A 98 -4.368 -12.691 12.911 1.00 0.00 C ATOM 1467 CG LYS A 98 -3.652 -11.583 12.128 1.00 0.00 C ATOM 1468 CD LYS A 98 -2.133 -11.768 12.070 1.00 0.00 C ATOM 1469 CE LYS A 98 -1.534 -11.816 13.474 1.00 0.00 C ATOM 1470 NZ LYS A 98 -0.083 -12.080 13.420 1.00 0.00 N ATOM 0 H LYS A 98 -5.249 -13.572 10.738 1.00 0.00 H new ATOM 0 HA LYS A 98 -2.975 -14.253 12.445 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.444 -12.524 12.871 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -4.076 -12.639 13.960 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.046 -11.552 11.112 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -3.877 -10.620 12.587 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -1.895 -12.689 11.538 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.684 -10.949 11.507 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.717 -10.870 13.984 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.027 -12.593 14.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.325 -11.974 14.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.081 -13.049 13.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.369 -11.404 12.772 1.00 0.00 H new ATOM 1484 N ARG A 99 -4.107 -15.610 14.261 1.00 0.00 N ATOM 1485 CA ARG A 99 -4.628 -16.646 15.145 1.00 0.00 C ATOM 1486 C ARG A 99 -5.013 -16.053 16.495 1.00 0.00 C ATOM 1487 O ARG A 99 -4.563 -14.966 16.858 1.00 0.00 O ATOM 1488 CB ARG A 99 -3.589 -17.761 15.321 1.00 0.00 C ATOM 1489 CG ARG A 99 -3.757 -18.903 14.316 1.00 0.00 C ATOM 1490 CD ARG A 99 -3.571 -18.440 12.869 1.00 0.00 C ATOM 1491 NE ARG A 99 -3.646 -19.584 11.952 1.00 0.00 N ATOM 1492 CZ ARG A 99 -3.283 -19.558 10.668 1.00 0.00 C ATOM 1493 NH1 ARG A 99 -2.820 -18.444 10.107 1.00 0.00 N ATOM 1494 NH2 ARG A 99 -3.383 -20.658 9.930 1.00 0.00 N ATOM 0 H ARG A 99 -3.199 -15.248 14.551 1.00 0.00 H new ATOM 0 HA ARG A 99 -5.523 -17.073 14.693 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -2.590 -17.338 15.217 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -3.662 -18.161 16.332 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -3.035 -19.688 14.539 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -4.749 -19.340 14.430 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -4.338 -17.709 12.613 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -2.608 -17.942 12.761 1.00 0.00 H new ATOM 0 HE ARG A 99 -4.002 -20.464 12.324 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -2.738 -17.591 10.660 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -2.547 -18.443 9.124 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -3.737 -21.520 10.345 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -3.106 -20.641 8.948 1.00 0.00 H new ATOM 1508 N SER A 100 -5.850 -16.782 17.233 1.00 0.00 N ATOM 1509 CA SER A 100 -6.275 -16.394 18.572 1.00 0.00 C ATOM 1510 C SER A 100 -5.198 -16.774 19.579 1.00 0.00 C ATOM 1511 O SER A 100 -4.435 -17.708 19.340 1.00 0.00 O ATOM 1512 CB SER A 100 -7.586 -17.103 18.913 1.00 0.00 C ATOM 1513 OG SER A 100 -8.588 -16.736 17.985 1.00 0.00 O ATOM 0 H SER A 100 -6.253 -17.663 16.914 1.00 0.00 H new ATOM 0 HA SER A 100 -6.431 -15.316 18.610 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.440 -18.183 18.896 1.00 0.00 H new ATOM 0 HB3 SER A 100 -7.900 -16.840 19.923 1.00 0.00 H new ATOM 0 HG SER A 100 -9.425 -17.195 18.208 1.00 0.00 H new ATOM 1519 N ALA A 101 -5.130 -16.066 20.708 1.00 0.00 N ATOM 1520 CA ALA A 101 -4.126 -16.327 21.730 1.00 0.00 C ATOM 1521 C ALA A 101 -4.345 -17.684 22.406 1.00 0.00 C ATOM 1522 O ALA A 101 -3.506 -18.125 23.189 1.00 0.00 O ATOM 1523 CB ALA A 101 -4.157 -15.192 22.754 1.00 0.00 C ATOM 0 H ALA A 101 -5.766 -15.302 20.935 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.144 -16.368 21.259 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.409 -15.377 23.525 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.940 -14.247 22.256 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.145 -15.142 23.212 1.00 0.00 H new ATOM 1529 N ALA A 102 -5.468 -18.344 22.105 1.00 0.00 N ATOM 1530 CA ALA A 102 -5.799 -19.659 22.636 1.00 0.00 C ATOM 1531 C ALA A 102 -5.630 -20.749 21.576 1.00 0.00 C ATOM 1532 O ALA A 102 -5.777 -21.934 21.869 1.00 0.00 O ATOM 1533 CB ALA A 102 -7.236 -19.623 23.142 1.00 0.00 C ATOM 0 H ALA A 102 -6.179 -17.970 21.476 1.00 0.00 H new ATOM 0 HA ALA A 102 -5.118 -19.900 23.452 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -7.505 -20.600 23.545 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.327 -18.870 23.925 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -7.905 -19.373 22.319 1.00 0.00 H new ATOM 1539 N GLU A 103 -5.325 -20.343 20.340 1.00 0.00 N ATOM 1540 CA GLU A 103 -5.166 -21.246 19.209 1.00 0.00 C ATOM 1541 C GLU A 103 -3.767 -21.124 18.605 1.00 0.00 C ATOM 1542 O GLU A 103 -3.537 -21.580 17.482 1.00 0.00 O ATOM 1543 CB GLU A 103 -6.255 -20.979 18.166 1.00 0.00 C ATOM 1544 CG GLU A 103 -7.642 -21.240 18.754 1.00 0.00 C ATOM 1545 CD GLU A 103 -8.731 -21.043 17.704 1.00 0.00 C ATOM 1546 OE1 GLU A 103 -8.841 -21.919 16.815 1.00 0.00 O ATOM 1547 OE2 GLU A 103 -9.451 -20.023 17.795 1.00 0.00 O ATOM 0 H GLU A 103 -5.181 -19.362 20.099 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.277 -22.272 19.560 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.189 -19.947 17.820 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -6.097 -21.617 17.297 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.689 -22.257 19.145 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.817 -20.567 19.594 1.00 0.00 H new ATOM 1554 N MET A 104 -2.832 -20.513 19.337 1.00 0.00 N ATOM 1555 CA MET A 104 -1.460 -20.369 18.869 1.00 0.00 C ATOM 1556 C MET A 104 -0.729 -21.711 18.876 1.00 0.00 C ATOM 1557 O MET A 104 -1.247 -22.724 19.344 1.00 0.00 O ATOM 1558 CB MET A 104 -0.706 -19.346 19.721 1.00 0.00 C ATOM 1559 CG MET A 104 -1.091 -17.925 19.340 1.00 0.00 C ATOM 1560 SD MET A 104 -0.656 -17.508 17.633 1.00 0.00 S ATOM 1561 CE MET A 104 -1.092 -15.758 17.685 1.00 0.00 C ATOM 0 H MET A 104 -3.005 -20.111 20.258 1.00 0.00 H new ATOM 0 HA MET A 104 -1.494 -20.010 17.840 1.00 0.00 H new ATOM 0 HB2 MET A 104 -0.925 -19.515 20.775 1.00 0.00 H new ATOM 0 HB3 MET A 104 0.368 -19.482 19.592 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.165 -17.796 19.477 1.00 0.00 H new ATOM 0 HG3 MET A 104 -0.597 -17.227 20.016 1.00 0.00 H new ATOM 0 HE1 MET A 104 -0.896 -15.305 16.713 1.00 0.00 H new ATOM 0 HE2 MET A 104 -2.150 -15.654 17.927 1.00 0.00 H new ATOM 0 HE3 MET A 104 -0.494 -15.257 18.446 1.00 0.00 H new ATOM 1571 N TYR A 105 0.497 -21.697 18.347 1.00 0.00 N ATOM 1572 CA TYR A 105 1.340 -22.872 18.191 1.00 0.00 C ATOM 1573 C TYR A 105 1.798 -23.450 19.532 1.00 0.00 C ATOM 1574 O TYR A 105 2.298 -24.573 19.580 1.00 0.00 O ATOM 1575 CB TYR A 105 2.554 -22.469 17.355 1.00 0.00 C ATOM 1576 CG TYR A 105 2.190 -21.696 16.105 1.00 0.00 C ATOM 1577 CD1 TYR A 105 2.015 -20.306 16.174 1.00 0.00 C ATOM 1578 CD2 TYR A 105 2.021 -22.367 14.884 1.00 0.00 C ATOM 1579 CE1 TYR A 105 1.653 -19.585 15.028 1.00 0.00 C ATOM 1580 CE2 TYR A 105 1.668 -21.650 13.729 1.00 0.00 C ATOM 1581 CZ TYR A 105 1.480 -20.254 13.799 1.00 0.00 C ATOM 1582 OH TYR A 105 1.133 -19.559 12.679 1.00 0.00 O ATOM 0 H TYR A 105 0.937 -20.842 18.008 1.00 0.00 H new ATOM 0 HA TYR A 105 0.761 -23.654 17.699 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.223 -21.863 17.967 1.00 0.00 H new ATOM 0 HB3 TYR A 105 3.105 -23.366 17.072 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.159 -19.790 17.112 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.163 -23.436 14.832 1.00 0.00 H new ATOM 0 HE1 TYR A 105 1.507 -18.517 15.086 1.00 0.00 H new ATOM 0 HE2 TYR A 105 1.541 -22.167 12.789 1.00 0.00 H new ATOM 0 HH TYR A 105 1.057 -20.176 11.921 1.00 0.00 H new ATOM 1592 N GLY A 106 1.626 -22.687 20.616 1.00 0.00 N ATOM 1593 CA GLY A 106 2.007 -23.106 21.958 1.00 0.00 C ATOM 1594 C GLY A 106 3.524 -23.149 22.119 1.00 0.00 C ATOM 1595 O GLY A 106 4.254 -22.849 21.177 1.00 0.00 O ATOM 1596 OXT GLY A 106 4.041 -23.478 23.173 1.00 0.00 O ATOM 0 H GLY A 106 1.215 -21.754 20.581 1.00 0.00 H new ATOM 0 HA2 GLY A 106 1.581 -22.419 22.690 1.00 0.00 H new ATOM 0 HA3 GLY A 106 1.590 -24.091 22.165 1.00 0.00 H new TER 1600 GLY A 106 ATOM 1601 O5' A B 1 3.411 -14.081 9.625 1.00 0.00 O ATOM 1602 C5' A B 1 3.002 -12.938 8.907 1.00 0.00 C ATOM 1603 C4' A B 1 3.382 -11.671 9.676 1.00 0.00 C ATOM 1604 O4' A B 1 4.773 -11.409 9.570 1.00 0.00 O ATOM 1605 C3' A B 1 2.717 -10.454 9.038 1.00 0.00 C ATOM 1606 O3' A B 1 2.720 -9.361 9.934 1.00 0.00 O ATOM 1607 C2' A B 1 3.656 -10.194 7.865 1.00 0.00 C ATOM 1608 O2' A B 1 3.694 -8.818 7.542 1.00 0.00 O ATOM 1609 C1' A B 1 5.012 -10.693 8.367 1.00 0.00 C ATOM 1610 N9 A B 1 5.691 -11.499 7.325 1.00 0.00 N ATOM 1611 C8 A B 1 5.798 -11.213 5.987 1.00 0.00 C ATOM 1612 N7 A B 1 6.446 -12.106 5.295 1.00 0.00 N ATOM 1613 C5 A B 1 6.810 -13.055 6.246 1.00 0.00 C ATOM 1614 C6 A B 1 7.530 -14.264 6.170 1.00 0.00 C ATOM 1615 N6 A B 1 8.031 -14.757 5.037 1.00 0.00 N ATOM 1616 N1 A B 1 7.732 -14.961 7.295 1.00 0.00 N ATOM 1617 C2 A B 1 7.245 -14.488 8.434 1.00 0.00 C ATOM 1618 N3 A B 1 6.558 -13.377 8.645 1.00 0.00 N ATOM 1619 C4 A B 1 6.364 -12.691 7.491 1.00 0.00 C ATOM 0 H5' A B 1 1.924 -12.966 8.747 1.00 0.00 H new ATOM 0 H5'' A B 1 3.471 -12.930 7.923 1.00 0.00 H new ATOM 0 H4' A B 1 3.075 -11.831 10.710 1.00 0.00 H new ATOM 0 H3' A B 1 1.674 -10.599 8.758 1.00 0.00 H new ATOM 0 H2' A B 1 3.343 -10.696 6.950 1.00 0.00 H new ATOM 0 HO2' A B 1 3.308 -8.298 8.278 1.00 0.00 H new ATOM 0 HO5' A B 1 4.379 -14.198 9.530 1.00 0.00 H new ATOM 0 H1' A B 1 5.693 -9.869 8.577 1.00 0.00 H new ATOM 0 H8 A B 1 5.379 -10.321 5.544 1.00 0.00 H new ATOM 0 H61 A B 1 8.544 -15.639 5.047 1.00 0.00 H new ATOM 0 H62 A B 1 7.901 -14.252 4.160 1.00 0.00 H new ATOM 0 H2 A B 1 7.435 -15.092 9.309 1.00 0.00 H new ATOM 1631 P U B 2 1.594 -9.225 11.070 1.00 0.00 P ATOM 1632 OP1 U B 2 2.011 -8.163 12.013 1.00 0.00 O ATOM 1633 OP2 U B 2 1.278 -10.575 11.583 1.00 0.00 O ATOM 1634 O5' U B 2 0.315 -8.696 10.244 1.00 0.00 O ATOM 1635 C5' U B 2 0.187 -7.330 9.901 1.00 0.00 C ATOM 1636 C4' U B 2 -1.138 -7.057 9.183 1.00 0.00 C ATOM 1637 O4' U B 2 -1.048 -7.429 7.813 1.00 0.00 O ATOM 1638 C3' U B 2 -2.282 -7.862 9.803 1.00 0.00 C ATOM 1639 O3' U B 2 -3.499 -7.150 9.709 1.00 0.00 O ATOM 1640 C2' U B 2 -2.311 -9.078 8.894 1.00 0.00 C ATOM 1641 O2' U B 2 -3.562 -9.730 8.926 1.00 0.00 O ATOM 1642 C1' U B 2 -2.005 -8.443 7.548 1.00 0.00 C ATOM 1643 N1 U B 2 -1.472 -9.472 6.636 1.00 0.00 N ATOM 1644 C2 U B 2 -2.293 -9.952 5.627 1.00 0.00 C ATOM 1645 O2 U B 2 -3.424 -9.507 5.423 1.00 0.00 O ATOM 1646 N3 U B 2 -1.774 -10.972 4.845 1.00 0.00 N ATOM 1647 C4 U B 2 -0.531 -11.559 5.002 1.00 0.00 C ATOM 1648 O4 U B 2 -0.182 -12.491 4.282 1.00 0.00 O ATOM 1649 C5 U B 2 0.264 -10.976 6.059 1.00 0.00 C ATOM 1650 C6 U B 2 -0.209 -9.961 6.813 1.00 0.00 C ATOM 0 H5' U B 2 1.018 -7.035 9.260 1.00 0.00 H new ATOM 0 H5'' U B 2 0.247 -6.720 10.802 1.00 0.00 H new ATOM 0 H4' U B 2 -1.338 -5.990 9.281 1.00 0.00 H new ATOM 0 H3' U B 2 -2.151 -8.089 10.861 1.00 0.00 H new ATOM 0 H2' U B 2 -1.614 -9.869 9.171 1.00 0.00 H new ATOM 0 HO2' U B 2 -4.238 -9.122 9.292 1.00 0.00 H new ATOM 0 H1' U B 2 -2.887 -8.019 7.068 1.00 0.00 H new ATOM 0 H3 U B 2 -2.360 -11.321 4.087 1.00 0.00 H new ATOM 0 H5 U B 2 1.255 -11.360 6.249 1.00 0.00 H new ATOM 0 H6 U B 2 0.425 -9.527 7.572 1.00 0.00 H new ATOM 1661 P U B 3 -3.898 -6.073 10.835 1.00 0.00 P ATOM 1662 OP1 U B 3 -2.655 -5.445 11.335 1.00 0.00 O ATOM 1663 OP2 U B 3 -4.821 -6.725 11.794 1.00 0.00 O ATOM 1664 O5' U B 3 -4.721 -4.955 10.028 1.00 0.00 O ATOM 1665 C5' U B 3 -5.962 -5.258 9.429 1.00 0.00 C ATOM 1666 C4' U B 3 -6.670 -3.950 9.078 1.00 0.00 C ATOM 1667 O4' U B 3 -7.716 -4.206 8.151 1.00 0.00 O ATOM 1668 C3' U B 3 -7.275 -3.339 10.342 1.00 0.00 C ATOM 1669 O3' U B 3 -7.153 -1.931 10.333 1.00 0.00 O ATOM 1670 C2' U B 3 -8.725 -3.791 10.219 1.00 0.00 C ATOM 1671 O2' U B 3 -9.629 -2.920 10.855 1.00 0.00 O ATOM 1672 C1' U B 3 -8.944 -3.786 8.717 1.00 0.00 C ATOM 1673 N1 U B 3 -10.061 -4.687 8.358 1.00 0.00 N ATOM 1674 C2 U B 3 -11.162 -4.155 7.702 1.00 0.00 C ATOM 1675 O2 U B 3 -11.242 -2.969 7.392 1.00 0.00 O ATOM 1676 N3 U B 3 -12.189 -5.037 7.406 1.00 0.00 N ATOM 1677 C4 U B 3 -12.218 -6.384 7.719 1.00 0.00 C ATOM 1678 O4 U B 3 -13.184 -7.077 7.414 1.00 0.00 O ATOM 1679 C5 U B 3 -11.036 -6.850 8.411 1.00 0.00 C ATOM 1680 C6 U B 3 -10.013 -6.012 8.692 1.00 0.00 C ATOM 0 H5' U B 3 -6.575 -5.849 10.109 1.00 0.00 H new ATOM 0 H5'' U B 3 -5.812 -5.859 8.532 1.00 0.00 H new ATOM 0 H4' U B 3 -5.947 -3.262 8.641 1.00 0.00 H new ATOM 0 H3' U B 3 -6.797 -3.644 11.273 1.00 0.00 H new ATOM 0 H2' U B 3 -8.898 -4.755 10.698 1.00 0.00 H new ATOM 0 HO2' U B 3 -9.265 -2.648 11.724 1.00 0.00 H new ATOM 0 H1' U B 3 -9.222 -2.801 8.341 1.00 0.00 H new ATOM 0 H3 U B 3 -12.997 -4.658 6.912 1.00 0.00 H new ATOM 0 H5 U B 3 -10.970 -7.886 8.708 1.00 0.00 H new ATOM 0 H6 U B 3 -9.137 -6.398 9.192 1.00 0.00 H new ATOM 1691 P U B 4 -7.110 -1.125 11.727 1.00 0.00 P ATOM 1692 OP1 U B 4 -5.732 -1.219 12.265 1.00 0.00 O ATOM 1693 OP2 U B 4 -8.244 -1.583 12.561 1.00 0.00 O ATOM 1694 O5' U B 4 -7.393 0.404 11.313 1.00 0.00 O ATOM 1695 C5' U B 4 -6.419 1.154 10.617 1.00 0.00 C ATOM 1696 C4' U B 4 -6.805 2.632 10.574 1.00 0.00 C ATOM 1697 O4' U B 4 -7.931 2.840 9.737 1.00 0.00 O ATOM 1698 C3' U B 4 -7.155 3.169 11.971 1.00 0.00 C ATOM 1699 O3' U B 4 -6.463 4.371 12.255 1.00 0.00 O ATOM 1700 C2' U B 4 -8.645 3.473 11.848 1.00 0.00 C ATOM 1701 O2' U B 4 -9.061 4.543 12.678 1.00 0.00 O ATOM 1702 C1' U B 4 -8.747 3.806 10.370 1.00 0.00 C ATOM 1703 N1 U B 4 -10.148 3.772 9.897 1.00 0.00 N ATOM 1704 C2 U B 4 -10.699 4.956 9.432 1.00 0.00 C ATOM 1705 O2 U B 4 -10.075 6.015 9.397 1.00 0.00 O ATOM 1706 N3 U B 4 -12.013 4.895 8.998 1.00 0.00 N ATOM 1707 C4 U B 4 -12.801 3.762 8.965 1.00 0.00 C ATOM 1708 O4 U B 4 -13.945 3.811 8.521 1.00 0.00 O ATOM 1709 C5 U B 4 -12.156 2.576 9.485 1.00 0.00 C ATOM 1710 C6 U B 4 -10.876 2.613 9.927 1.00 0.00 C ATOM 0 H5' U B 4 -6.314 0.771 9.602 1.00 0.00 H new ATOM 0 H5'' U B 4 -5.450 1.040 11.102 1.00 0.00 H new ATOM 0 H4' U B 4 -5.938 3.163 10.183 1.00 0.00 H new ATOM 0 H3' U B 4 -6.894 2.467 12.763 1.00 0.00 H new ATOM 0 H2' U B 4 -9.293 2.658 12.171 1.00 0.00 H new ATOM 0 HO2' U B 4 -8.276 5.038 12.992 1.00 0.00 H new ATOM 0 H1' U B 4 -8.415 4.819 10.144 1.00 0.00 H new ATOM 0 H3 U B 4 -12.436 5.765 8.674 1.00 0.00 H new ATOM 0 H5 U B 4 -12.704 1.646 9.521 1.00 0.00 H new ATOM 0 H6 U B 4 -10.421 1.711 10.310 1.00 0.00 H new ATOM 1721 P U B 5 -4.986 4.371 12.906 1.00 0.00 P ATOM 1722 OP1 U B 5 -4.604 2.971 13.202 1.00 0.00 O ATOM 1723 OP2 U B 5 -4.974 5.373 13.995 1.00 0.00 O ATOM 1724 O5' U B 5 -4.040 4.922 11.727 1.00 0.00 O ATOM 1725 C5' U B 5 -3.335 4.041 10.878 1.00 0.00 C ATOM 1726 C4' U B 5 -2.538 4.803 9.818 1.00 0.00 C ATOM 1727 O4' U B 5 -3.388 5.256 8.773 1.00 0.00 O ATOM 1728 C3' U B 5 -1.840 6.025 10.415 1.00 0.00 C ATOM 1729 O3' U B 5 -0.611 6.217 9.745 1.00 0.00 O ATOM 1730 C2' U B 5 -2.840 7.140 10.118 1.00 0.00 C ATOM 1731 O2' U B 5 -2.218 8.400 9.973 1.00 0.00 O ATOM 1732 C1' U B 5 -3.465 6.674 8.805 1.00 0.00 C ATOM 1733 N1 U B 5 -4.869 7.126 8.681 1.00 0.00 N ATOM 1734 C2 U B 5 -5.191 7.936 7.606 1.00 0.00 C ATOM 1735 O2 U B 5 -4.368 8.260 6.754 1.00 0.00 O ATOM 1736 N3 U B 5 -6.502 8.373 7.532 1.00 0.00 N ATOM 1737 C4 U B 5 -7.507 8.067 8.432 1.00 0.00 C ATOM 1738 O4 U B 5 -8.638 8.519 8.271 1.00 0.00 O ATOM 1739 C5 U B 5 -7.089 7.206 9.516 1.00 0.00 C ATOM 1740 C6 U B 5 -5.811 6.768 9.606 1.00 0.00 C ATOM 0 H5' U B 5 -4.037 3.364 10.391 1.00 0.00 H new ATOM 0 H5'' U B 5 -2.658 3.426 11.471 1.00 0.00 H new ATOM 0 H4' U B 5 -1.795 4.108 9.427 1.00 0.00 H new ATOM 0 H3' U B 5 -1.598 5.958 11.476 1.00 0.00 H new ATOM 0 H2' U B 5 -3.559 7.290 10.923 1.00 0.00 H new ATOM 0 HO2' U B 5 -1.493 8.484 10.627 1.00 0.00 H new ATOM 0 H1' U B 5 -2.924 7.107 7.964 1.00 0.00 H new ATOM 0 H3 U B 5 -6.749 8.973 6.745 1.00 0.00 H new ATOM 0 H5 U B 5 -7.807 6.908 10.265 1.00 0.00 H new ATOM 0 H6 U B 5 -5.530 6.123 10.425 1.00 0.00 H new ATOM 1751 P U B 6 0.644 6.896 10.492 1.00 0.00 P ATOM 1752 OP1 U B 6 1.199 5.918 11.457 1.00 0.00 O ATOM 1753 OP2 U B 6 0.243 8.240 10.960 1.00 0.00 O ATOM 1754 O5' U B 6 1.692 7.068 9.281 1.00 0.00 O ATOM 1755 C5' U B 6 2.252 5.933 8.657 1.00 0.00 C ATOM 1756 C4' U B 6 2.982 6.298 7.361 1.00 0.00 C ATOM 1757 O4' U B 6 2.111 6.987 6.473 1.00 0.00 O ATOM 1758 C3' U B 6 4.180 7.199 7.630 1.00 0.00 C ATOM 1759 O3' U B 6 5.167 6.946 6.647 1.00 0.00 O ATOM 1760 C2' U B 6 3.566 8.586 7.456 1.00 0.00 C ATOM 1761 O2' U B 6 4.537 9.549 7.098 1.00 0.00 O ATOM 1762 C1' U B 6 2.535 8.342 6.356 1.00 0.00 C ATOM 1763 N1 U B 6 1.407 9.289 6.490 1.00 0.00 N ATOM 1764 C2 U B 6 1.584 10.570 5.987 1.00 0.00 C ATOM 1765 O2 U B 6 2.629 10.947 5.461 1.00 0.00 O ATOM 1766 N3 U B 6 0.504 11.427 6.103 1.00 0.00 N ATOM 1767 C4 U B 6 -0.721 11.117 6.663 1.00 0.00 C ATOM 1768 O4 U B 6 -1.625 11.948 6.677 1.00 0.00 O ATOM 1769 C5 U B 6 -0.804 9.778 7.200 1.00 0.00 C ATOM 1770 C6 U B 6 0.237 8.921 7.101 1.00 0.00 C ATOM 0 H5' U B 6 1.464 5.212 8.440 1.00 0.00 H new ATOM 0 H5'' U B 6 2.948 5.448 9.342 1.00 0.00 H new ATOM 0 H4' U B 6 3.320 5.362 6.916 1.00 0.00 H new ATOM 0 H3' U B 6 4.663 7.063 8.598 1.00 0.00 H new ATOM 0 H2' U B 6 3.128 8.996 8.366 1.00 0.00 H new ATOM 0 HO2' U B 6 4.137 10.208 6.493 1.00 0.00 H new ATOM 0 H1' U B 6 2.962 8.509 5.367 1.00 0.00 H new ATOM 0 H3 U B 6 0.623 12.374 5.742 1.00 0.00 H new ATOM 0 H5 U B 6 -1.712 9.457 7.688 1.00 0.00 H new ATOM 0 H6 U B 6 0.145 7.926 7.512 1.00 0.00 H new ATOM 1781 P C B 7 6.730 7.117 6.994 1.00 0.00 P ATOM 1782 OP1 C B 7 6.860 8.047 8.139 1.00 0.00 O ATOM 1783 OP2 C B 7 7.464 7.394 5.735 1.00 0.00 O ATOM 1784 O5' C B 7 7.135 5.642 7.497 1.00 0.00 O ATOM 1785 C5' C B 7 7.666 4.694 6.595 1.00 0.00 C ATOM 1786 C4' C B 7 7.912 3.361 7.307 1.00 0.00 C ATOM 1787 O4' C B 7 6.780 2.512 7.141 1.00 0.00 O ATOM 1788 C3' C B 7 9.109 2.638 6.687 1.00 0.00 C ATOM 1789 O3' C B 7 9.765 1.882 7.689 1.00 0.00 O ATOM 1790 C2' C B 7 8.428 1.727 5.677 1.00 0.00 C ATOM 1791 O2' C B 7 9.250 0.630 5.323 1.00 0.00 O ATOM 1792 C1' C B 7 7.194 1.324 6.481 1.00 0.00 C ATOM 1793 N1 C B 7 6.107 0.706 5.674 1.00 0.00 N ATOM 1794 C2 C B 7 5.023 0.178 6.366 1.00 0.00 C ATOM 1795 O2 C B 7 4.954 0.259 7.594 1.00 0.00 O ATOM 1796 N3 C B 7 4.032 -0.437 5.666 1.00 0.00 N ATOM 1797 C4 C B 7 4.096 -0.526 4.337 1.00 0.00 C ATOM 1798 N4 C B 7 3.111 -1.149 3.696 1.00 0.00 N ATOM 1799 C5 C B 7 5.190 0.018 3.599 1.00 0.00 C ATOM 1800 C6 C B 7 6.169 0.626 4.307 1.00 0.00 C ATOM 0 H5' C B 7 8.600 5.066 6.174 1.00 0.00 H new ATOM 0 H5'' C B 7 6.977 4.548 5.763 1.00 0.00 H new ATOM 0 H4' C B 7 8.096 3.572 8.360 1.00 0.00 H new ATOM 0 H3' C B 7 9.864 3.288 6.245 1.00 0.00 H new ATOM 0 H2' C B 7 8.202 2.179 4.711 1.00 0.00 H new ATOM 0 HO2' C B 7 8.741 0.007 4.764 1.00 0.00 H new ATOM 0 HO3' C B 7 10.080 1.036 7.307 1.00 0.00 H new ATOM 0 H1' C B 7 7.442 0.528 7.183 1.00 0.00 H new ATOM 0 H41 C B 7 3.136 -1.231 2.680 1.00 0.00 H new ATOM 0 H42 C B 7 2.331 -1.545 4.221 1.00 0.00 H new ATOM 0 H5 C B 7 5.234 -0.053 2.522 1.00 0.00 H new ATOM 0 H6 C B 7 7.013 1.055 3.787 1.00 0.00 H new TER 1812 C B 7