USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 831 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 43 ASN :FLIP amide:sc= 0 F(o=-1.2,f=-0.047) USER MOD Set 1.2: A 76 ASN : amide:sc= 0.537 K(o=-0.047,f=-1.1) USER MOD Set 1.3: A 77 ASN : amide:sc= -0.584 K(o=-0.047,f=-6!) USER MOD Set 2.1: A 52 THR OG1 : rot 180:sc= 0.545 USER MOD Set 2.2: A 55 CYS SG : rot 26:sc= 0.39 USER MOD Set 3.1: A 13 ASN : amide:sc= 0.711 K(o=1.6,f=-4.2!) USER MOD Set 3.2: A 16 LYS NZ :NH3+ -166:sc= 0.843 (180deg=0) USER MOD Single : A 2 MET CE :methyl 169:sc= 0 (180deg=-0.145) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -142:sc= 0.437 (180deg=0.142) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 64:sc= 1.02 USER MOD Single : A 34 TYR OH : rot -157:sc= 1.09 USER MOD Single : A 37 GLN : amide:sc= -0.306 K(o=-0.31,f=-1.9!) USER MOD Single : A 41 GLN : amide:sc= 0.262 K(o=0.26,f=-0.6) USER MOD Single : A 42 ASN : amide:sc= -1.83! C(o=-1.8!,f=-12!) USER MOD Single : A 45 LYS NZ :NH3+ 142:sc= 1.2 (180deg=0.00695) USER MOD Single : A 48 MET CE :methyl 175:sc= -0.189 (180deg=-0.306) USER MOD Single : A 49 THR OG1 : rot 100:sc= 1.18 USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 104:sc= 0.417 USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -163:sc= -0.72 (180deg=-1.52!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 89 THR OG1 : rot 65:sc= 1.19 USER MOD Single : A 93 MET CE :methyl -123:sc= -0.0793 (180deg=-0.337) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0388 USER MOD Single : A 100 LYS NZ :NH3+ -149:sc= 0.374 (180deg=0.0628) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 2 19.830 -2.868 -18.114 1.00 0.00 N ATOM 2 CA MET A 2 20.114 -2.919 -16.674 1.00 0.00 C ATOM 3 C MET A 2 19.540 -1.691 -15.996 1.00 0.00 C ATOM 4 O MET A 2 19.474 -0.617 -16.599 1.00 0.00 O ATOM 5 CB MET A 2 21.605 -2.950 -16.352 1.00 0.00 C ATOM 6 CG MET A 2 22.330 -4.220 -16.801 1.00 0.00 C ATOM 7 SD MET A 2 24.079 -4.269 -16.327 1.00 0.00 S ATOM 8 CE MET A 2 23.918 -4.560 -14.543 1.00 0.00 C ATOM 0 HA MET A 2 19.660 -3.842 -16.313 1.00 0.00 H new ATOM 0 HB2 MET A 2 22.082 -2.090 -16.822 1.00 0.00 H new ATOM 0 HB3 MET A 2 21.733 -2.836 -15.275 1.00 0.00 H new ATOM 0 HG2 MET A 2 21.823 -5.086 -16.376 1.00 0.00 H new ATOM 0 HG3 MET A 2 22.254 -4.307 -17.885 1.00 0.00 H new ATOM 0 HE1 MET A 2 24.893 -4.811 -14.126 1.00 0.00 H new ATOM 0 HE2 MET A 2 23.537 -3.660 -14.060 1.00 0.00 H new ATOM 0 HE3 MET A 2 23.226 -5.385 -14.370 1.00 0.00 H new ATOM 18 N SER A 3 19.171 -1.845 -14.729 1.00 0.00 N ATOM 19 CA SER A 3 18.720 -0.805 -13.823 1.00 0.00 C ATOM 20 C SER A 3 18.790 -1.408 -12.417 1.00 0.00 C ATOM 21 O SER A 3 18.665 -2.630 -12.295 1.00 0.00 O ATOM 22 CB SER A 3 17.271 -0.477 -14.201 1.00 0.00 C ATOM 23 OG SER A 3 17.106 0.911 -14.346 1.00 0.00 O ATOM 0 H SER A 3 19.181 -2.762 -14.282 1.00 0.00 H new ATOM 0 HA SER A 3 19.318 0.105 -13.871 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.008 -0.980 -15.131 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.594 -0.852 -13.433 1.00 0.00 H new ATOM 0 HG SER A 3 16.177 1.106 -14.589 1.00 0.00 H new ATOM 29 N LYS A 4 18.967 -0.616 -11.349 1.00 0.00 N ATOM 30 CA LYS A 4 18.906 -1.160 -9.991 1.00 0.00 C ATOM 31 C LYS A 4 18.671 -0.016 -9.017 1.00 0.00 C ATOM 32 O LYS A 4 19.328 0.092 -7.983 1.00 0.00 O ATOM 33 CB LYS A 4 20.145 -2.023 -9.646 1.00 0.00 C ATOM 34 CG LYS A 4 19.892 -2.868 -8.385 1.00 0.00 C ATOM 35 CD LYS A 4 20.890 -4.007 -8.188 1.00 0.00 C ATOM 36 CE LYS A 4 20.566 -5.223 -9.059 1.00 0.00 C ATOM 37 NZ LYS A 4 21.304 -6.413 -8.596 1.00 0.00 N ATOM 0 H LYS A 4 19.150 0.386 -11.400 1.00 0.00 H new ATOM 0 HA LYS A 4 18.067 -1.852 -9.913 1.00 0.00 H new ATOM 0 HB2 LYS A 4 20.383 -2.677 -10.485 1.00 0.00 H new ATOM 0 HB3 LYS A 4 21.010 -1.378 -9.489 1.00 0.00 H new ATOM 0 HG2 LYS A 4 19.923 -2.217 -7.512 1.00 0.00 H new ATOM 0 HG3 LYS A 4 18.886 -3.285 -8.436 1.00 0.00 H new ATOM 0 HD2 LYS A 4 21.893 -3.652 -8.423 1.00 0.00 H new ATOM 0 HD3 LYS A 4 20.895 -4.305 -7.140 1.00 0.00 H new ATOM 0 HE2 LYS A 4 19.494 -5.421 -9.031 1.00 0.00 H new ATOM 0 HE3 LYS A 4 20.824 -5.011 -10.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 21.068 -7.225 -9.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 22.326 -6.229 -8.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 21.038 -6.626 -7.613 1.00 0.00 H new ATOM 51 N LYS A 5 17.702 0.840 -9.313 1.00 0.00 N ATOM 52 CA LYS A 5 17.266 1.866 -8.396 1.00 0.00 C ATOM 53 C LYS A 5 15.752 1.951 -8.432 1.00 0.00 C ATOM 54 O LYS A 5 15.168 2.539 -9.337 1.00 0.00 O ATOM 55 CB LYS A 5 17.959 3.195 -8.686 1.00 0.00 C ATOM 56 CG LYS A 5 17.692 4.157 -7.527 1.00 0.00 C ATOM 57 CD LYS A 5 18.411 3.779 -6.223 1.00 0.00 C ATOM 58 CE LYS A 5 17.401 3.414 -5.125 1.00 0.00 C ATOM 59 NZ LYS A 5 16.715 4.578 -4.517 1.00 0.00 N ATOM 0 H LYS A 5 17.199 0.836 -10.201 1.00 0.00 H new ATOM 0 HA LYS A 5 17.556 1.607 -7.378 1.00 0.00 H new ATOM 0 HB2 LYS A 5 19.031 3.042 -8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 5 17.588 3.618 -9.620 1.00 0.00 H new ATOM 0 HG2 LYS A 5 18.000 5.160 -7.822 1.00 0.00 H new ATOM 0 HG3 LYS A 5 16.619 4.196 -7.340 1.00 0.00 H new ATOM 0 HD2 LYS A 5 19.079 2.937 -6.403 1.00 0.00 H new ATOM 0 HD3 LYS A 5 19.031 4.612 -5.890 1.00 0.00 H new ATOM 0 HE2 LYS A 5 16.651 2.744 -5.545 1.00 0.00 H new ATOM 0 HE3 LYS A 5 17.918 2.861 -4.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 16.595 4.416 -3.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 17.286 5.434 -4.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 15.782 4.702 -4.960 1.00 0.00 H new ATOM 73 N VAL A 6 15.119 1.329 -7.450 1.00 0.00 N ATOM 74 CA VAL A 6 13.692 1.468 -7.240 1.00 0.00 C ATOM 75 C VAL A 6 13.411 2.852 -6.619 1.00 0.00 C ATOM 76 O VAL A 6 14.262 3.426 -5.927 1.00 0.00 O ATOM 77 CB VAL A 6 13.191 0.231 -6.460 1.00 0.00 C ATOM 78 CG1 VAL A 6 11.680 0.314 -6.196 1.00 0.00 C ATOM 79 CG2 VAL A 6 13.498 -1.069 -7.221 1.00 0.00 C ATOM 0 H VAL A 6 15.581 0.716 -6.779 1.00 0.00 H new ATOM 0 HA VAL A 6 13.112 1.467 -8.163 1.00 0.00 H new ATOM 0 HB VAL A 6 13.720 0.221 -5.507 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.358 -0.570 -5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 6 11.462 1.206 -5.609 1.00 0.00 H new ATOM 0 HG13 VAL A 6 11.147 0.365 -7.145 1.00 0.00 H new ATOM 0 HG21 VAL A 6 13.134 -1.921 -6.647 1.00 0.00 H new ATOM 0 HG22 VAL A 6 13.004 -1.047 -8.192 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.575 -1.161 -7.364 1.00 0.00 H new ATOM 89 N THR A 7 12.221 3.405 -6.876 1.00 0.00 N ATOM 90 CA THR A 7 11.781 4.734 -6.450 1.00 0.00 C ATOM 91 C THR A 7 10.315 4.659 -6.053 1.00 0.00 C ATOM 92 O THR A 7 9.620 3.682 -6.357 1.00 0.00 O ATOM 93 CB THR A 7 11.964 5.750 -7.600 1.00 0.00 C ATOM 94 OG1 THR A 7 11.079 5.475 -8.669 1.00 0.00 O ATOM 95 CG2 THR A 7 13.376 5.753 -8.172 1.00 0.00 C ATOM 0 H THR A 7 11.506 2.913 -7.412 1.00 0.00 H new ATOM 0 HA THR A 7 12.379 5.063 -5.600 1.00 0.00 H new ATOM 0 HB THR A 7 11.755 6.724 -7.157 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.214 6.133 -9.383 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.441 6.487 -8.976 1.00 0.00 H new ATOM 0 HG22 THR A 7 14.086 6.011 -7.386 1.00 0.00 H new ATOM 0 HG23 THR A 7 13.612 4.764 -8.564 1.00 0.00 H new ATOM 103 N LYS A 8 9.821 5.691 -5.363 1.00 0.00 N ATOM 104 CA LYS A 8 8.463 5.679 -4.868 1.00 0.00 C ATOM 105 C LYS A 8 7.472 5.721 -6.014 1.00 0.00 C ATOM 106 O LYS A 8 6.384 5.174 -5.887 1.00 0.00 O ATOM 107 CB LYS A 8 8.249 6.801 -3.853 1.00 0.00 C ATOM 108 CG LYS A 8 8.771 8.193 -4.219 1.00 0.00 C ATOM 109 CD LYS A 8 8.087 9.304 -3.402 1.00 0.00 C ATOM 110 CE LYS A 8 8.954 9.879 -2.279 1.00 0.00 C ATOM 111 NZ LYS A 8 9.985 10.808 -2.788 1.00 0.00 N ATOM 0 H LYS A 8 10.347 6.536 -5.141 1.00 0.00 H new ATOM 0 HA LYS A 8 8.286 4.742 -4.340 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.179 6.882 -3.662 1.00 0.00 H new ATOM 0 HB3 LYS A 8 8.718 6.501 -2.916 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.847 8.231 -4.051 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.607 8.373 -5.282 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.801 10.112 -4.076 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.167 8.909 -2.970 1.00 0.00 H new ATOM 0 HE2 LYS A 8 8.319 10.401 -1.563 1.00 0.00 H new ATOM 0 HE3 LYS A 8 9.437 9.063 -1.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 10.547 11.172 -1.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 10.608 10.305 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 9.525 11.601 -3.279 1.00 0.00 H new ATOM 125 N GLU A 9 7.859 6.318 -7.136 1.00 0.00 N ATOM 126 CA GLU A 9 7.011 6.394 -8.314 1.00 0.00 C ATOM 127 C GLU A 9 6.666 4.994 -8.832 1.00 0.00 C ATOM 128 O GLU A 9 5.521 4.723 -9.192 1.00 0.00 O ATOM 129 CB GLU A 9 7.725 7.195 -9.408 1.00 0.00 C ATOM 130 CG GLU A 9 6.733 8.035 -10.214 1.00 0.00 C ATOM 131 CD GLU A 9 6.566 9.414 -9.580 1.00 0.00 C ATOM 132 OE1 GLU A 9 7.288 10.333 -10.027 1.00 0.00 O ATOM 133 OE2 GLU A 9 5.757 9.552 -8.631 1.00 0.00 O ATOM 0 H GLU A 9 8.770 6.762 -7.252 1.00 0.00 H new ATOM 0 HA GLU A 9 6.082 6.894 -8.042 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.474 7.846 -8.956 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.255 6.514 -10.074 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.085 8.140 -11.240 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.769 7.528 -10.258 1.00 0.00 H new ATOM 141 N ASP A 10 7.657 4.097 -8.851 1.00 0.00 N ATOM 142 CA ASP A 10 7.497 2.736 -9.348 1.00 0.00 C ATOM 143 C ASP A 10 6.733 1.950 -8.309 1.00 0.00 C ATOM 144 O ASP A 10 5.795 1.241 -8.641 1.00 0.00 O ATOM 145 CB ASP A 10 8.860 2.066 -9.604 1.00 0.00 C ATOM 146 CG ASP A 10 9.203 1.917 -11.088 1.00 0.00 C ATOM 147 OD1 ASP A 10 10.408 1.884 -11.426 1.00 0.00 O ATOM 148 OD2 ASP A 10 8.296 1.799 -11.946 1.00 0.00 O ATOM 0 H ASP A 10 8.599 4.302 -8.518 1.00 0.00 H new ATOM 0 HA ASP A 10 6.960 2.760 -10.296 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.640 2.651 -9.117 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.864 1.080 -9.139 1.00 0.00 H new ATOM 154 N VAL A 11 7.096 2.113 -7.040 1.00 0.00 N ATOM 155 CA VAL A 11 6.416 1.436 -5.940 1.00 0.00 C ATOM 156 C VAL A 11 4.920 1.758 -5.919 1.00 0.00 C ATOM 157 O VAL A 11 4.111 0.865 -5.673 1.00 0.00 O ATOM 158 CB VAL A 11 7.177 1.744 -4.638 1.00 0.00 C ATOM 159 CG1 VAL A 11 6.421 1.417 -3.346 1.00 0.00 C ATOM 160 CG2 VAL A 11 8.497 0.959 -4.696 1.00 0.00 C ATOM 0 H VAL A 11 7.865 2.715 -6.746 1.00 0.00 H new ATOM 0 HA VAL A 11 6.437 0.354 -6.071 1.00 0.00 H new ATOM 0 HB VAL A 11 7.327 2.823 -4.591 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.042 1.670 -2.487 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.497 1.995 -3.309 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.185 0.353 -3.322 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.072 1.147 -3.790 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.283 -0.107 -4.775 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.073 1.279 -5.564 1.00 0.00 H new ATOM 170 N LEU A 12 4.522 2.977 -6.278 1.00 0.00 N ATOM 171 CA LEU A 12 3.128 3.380 -6.328 1.00 0.00 C ATOM 172 C LEU A 12 2.459 2.596 -7.435 1.00 0.00 C ATOM 173 O LEU A 12 1.418 1.973 -7.244 1.00 0.00 O ATOM 174 CB LEU A 12 3.048 4.889 -6.615 1.00 0.00 C ATOM 175 CG LEU A 12 3.279 5.702 -5.337 1.00 0.00 C ATOM 176 CD1 LEU A 12 3.694 7.143 -5.660 1.00 0.00 C ATOM 177 CD2 LEU A 12 1.999 5.735 -4.505 1.00 0.00 C ATOM 0 H LEU A 12 5.171 3.718 -6.545 1.00 0.00 H new ATOM 0 HA LEU A 12 2.628 3.181 -5.380 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.793 5.161 -7.363 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.072 5.132 -7.034 1.00 0.00 H new ATOM 0 HG LEU A 12 4.082 5.221 -4.778 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.850 7.693 -4.732 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.619 7.135 -6.237 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.908 7.626 -6.241 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.170 6.314 -3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.200 6.196 -5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.713 4.718 -4.237 1.00 0.00 H new ATOM 189 N ASN A 13 3.079 2.625 -8.604 1.00 0.00 N ATOM 190 CA ASN A 13 2.582 1.990 -9.797 1.00 0.00 C ATOM 191 C ASN A 13 2.555 0.461 -9.693 1.00 0.00 C ATOM 192 O ASN A 13 1.724 -0.185 -10.334 1.00 0.00 O ATOM 193 CB ASN A 13 3.474 2.506 -10.922 1.00 0.00 C ATOM 194 CG ASN A 13 2.984 3.837 -11.492 1.00 0.00 C ATOM 195 OD1 ASN A 13 1.791 4.155 -11.495 1.00 0.00 O ATOM 196 ND2 ASN A 13 3.889 4.682 -11.938 1.00 0.00 N ATOM 0 H ASN A 13 3.967 3.107 -8.745 1.00 0.00 H new ATOM 0 HA ASN A 13 1.537 2.240 -9.979 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.491 2.626 -10.549 1.00 0.00 H new ATOM 0 HB3 ASN A 13 3.513 1.765 -11.720 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.604 5.598 -12.285 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.875 4.421 -11.936 1.00 0.00 H new ATOM 203 N ALA A 14 3.393 -0.125 -8.839 1.00 0.00 N ATOM 204 CA ALA A 14 3.435 -1.548 -8.570 1.00 0.00 C ATOM 205 C ALA A 14 2.222 -1.944 -7.743 1.00 0.00 C ATOM 206 O ALA A 14 1.662 -3.025 -7.934 1.00 0.00 O ATOM 207 CB ALA A 14 4.712 -1.878 -7.789 1.00 0.00 C ATOM 0 H ALA A 14 4.081 0.402 -8.301 1.00 0.00 H new ATOM 0 HA ALA A 14 3.428 -2.097 -9.511 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.747 -2.948 -7.585 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.583 -1.592 -8.379 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.715 -1.329 -6.848 1.00 0.00 H new ATOM 213 N LEU A 15 1.833 -1.075 -6.801 1.00 0.00 N ATOM 214 CA LEU A 15 0.733 -1.310 -5.878 1.00 0.00 C ATOM 215 C LEU A 15 -0.617 -1.105 -6.557 1.00 0.00 C ATOM 216 O LEU A 15 -1.549 -1.826 -6.204 1.00 0.00 O ATOM 217 CB LEU A 15 0.833 -0.372 -4.670 1.00 0.00 C ATOM 218 CG LEU A 15 2.034 -0.662 -3.759 1.00 0.00 C ATOM 219 CD1 LEU A 15 2.402 0.598 -2.971 1.00 0.00 C ATOM 220 CD2 LEU A 15 1.863 -1.820 -2.785 1.00 0.00 C ATOM 0 H LEU A 15 2.288 -0.173 -6.663 1.00 0.00 H new ATOM 0 HA LEU A 15 0.806 -2.346 -5.546 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.898 0.657 -5.025 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.083 -0.450 -4.084 1.00 0.00 H new ATOM 0 HG LEU A 15 2.828 -0.967 -4.440 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.255 0.387 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.660 1.398 -3.664 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.553 0.907 -2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.771 -1.934 -2.193 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.021 -1.617 -2.123 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.674 -2.738 -3.341 1.00 0.00 H new ATOM 232 N LYS A 16 -0.707 -0.178 -7.528 1.00 0.00 N ATOM 233 CA LYS A 16 -1.886 0.141 -8.351 1.00 0.00 C ATOM 234 C LYS A 16 -2.241 -1.054 -9.254 1.00 0.00 C ATOM 235 O LYS A 16 -2.112 -0.977 -10.479 1.00 0.00 O ATOM 236 CB LYS A 16 -1.598 1.358 -9.248 1.00 0.00 C ATOM 237 CG LYS A 16 -1.564 2.717 -8.547 1.00 0.00 C ATOM 238 CD LYS A 16 -1.102 3.758 -9.576 1.00 0.00 C ATOM 239 CE LYS A 16 -0.578 5.029 -8.915 1.00 0.00 C ATOM 240 NZ LYS A 16 0.057 5.908 -9.921 1.00 0.00 N ATOM 0 H LYS A 16 0.093 0.405 -7.774 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.717 0.363 -7.681 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.638 1.202 -9.741 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.356 1.394 -10.031 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.550 2.973 -8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.884 2.692 -7.696 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.320 3.327 -10.201 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -1.934 4.009 -10.234 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.397 5.557 -8.426 1.00 0.00 H new ATOM 0 HE3 LYS A 16 0.144 4.772 -8.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 0.612 6.644 -9.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.685 5.344 -10.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -0.678 6.356 -10.504 1.00 0.00 H new ATOM 254 N ASN A 17 -2.543 -2.208 -8.675 1.00 0.00 N ATOM 255 CA ASN A 17 -2.593 -3.512 -9.326 1.00 0.00 C ATOM 256 C ASN A 17 -3.181 -4.508 -8.339 1.00 0.00 C ATOM 257 O ASN A 17 -4.095 -5.251 -8.681 1.00 0.00 O ATOM 258 CB ASN A 17 -1.174 -4.008 -9.668 1.00 0.00 C ATOM 259 CG ASN A 17 -0.795 -3.798 -11.120 1.00 0.00 C ATOM 260 OD1 ASN A 17 -1.312 -4.491 -11.998 1.00 0.00 O ATOM 261 ND2 ASN A 17 0.135 -2.899 -11.392 1.00 0.00 N ATOM 0 H ASN A 17 -2.773 -2.263 -7.683 1.00 0.00 H new ATOM 0 HA ASN A 17 -3.185 -3.426 -10.237 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.454 -3.490 -9.034 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.102 -5.070 -9.432 1.00 0.00 H new ATOM 0 HD21 ASN A 17 0.446 -2.762 -12.354 1.00 0.00 H new ATOM 0 HD22 ASN A 17 0.542 -2.342 -10.640 1.00 0.00 H new ATOM 268 N VAL A 18 -2.599 -4.550 -7.137 1.00 0.00 N ATOM 269 CA VAL A 18 -3.087 -5.355 -6.035 1.00 0.00 C ATOM 270 C VAL A 18 -4.435 -4.782 -5.605 1.00 0.00 C ATOM 271 O VAL A 18 -4.593 -3.566 -5.592 1.00 0.00 O ATOM 272 CB VAL A 18 -2.028 -5.356 -4.910 1.00 0.00 C ATOM 273 CG1 VAL A 18 -2.619 -5.593 -3.505 1.00 0.00 C ATOM 274 CG2 VAL A 18 -1.028 -6.492 -5.150 1.00 0.00 C ATOM 0 H VAL A 18 -1.762 -4.013 -6.908 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.243 -6.397 -6.314 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.568 -4.368 -4.939 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.818 -5.581 -2.766 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -3.337 -4.806 -3.275 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.121 -6.560 -3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.281 -6.493 -4.356 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.555 -7.446 -5.153 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.536 -6.346 -6.112 1.00 0.00 H new ATOM 284 N ILE A 19 -5.385 -5.630 -5.213 1.00 0.00 N ATOM 285 CA ILE A 19 -6.696 -5.218 -4.738 1.00 0.00 C ATOM 286 C ILE A 19 -6.971 -5.935 -3.424 1.00 0.00 C ATOM 287 O ILE A 19 -6.685 -7.125 -3.269 1.00 0.00 O ATOM 288 CB ILE A 19 -7.762 -5.543 -5.804 1.00 0.00 C ATOM 289 CG1 ILE A 19 -7.496 -4.825 -7.144 1.00 0.00 C ATOM 290 CG2 ILE A 19 -9.200 -5.276 -5.321 1.00 0.00 C ATOM 291 CD1 ILE A 19 -7.657 -3.302 -7.131 1.00 0.00 C ATOM 0 H ILE A 19 -5.258 -6.642 -5.219 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.729 -4.142 -4.566 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.674 -6.616 -5.976 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.481 -5.061 -7.465 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.171 -5.236 -7.894 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.903 -5.524 -6.116 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.410 -5.891 -4.446 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.306 -4.223 -5.058 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.446 -2.905 -8.124 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.678 -3.046 -6.848 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -6.962 -2.869 -6.412 1.00 0.00 H new ATOM 303 N ASP A 20 -7.563 -5.210 -2.484 1.00 0.00 N ATOM 304 CA ASP A 20 -8.031 -5.763 -1.223 1.00 0.00 C ATOM 305 C ASP A 20 -9.265 -6.605 -1.498 1.00 0.00 C ATOM 306 O ASP A 20 -10.273 -6.088 -1.989 1.00 0.00 O ATOM 307 CB ASP A 20 -8.397 -4.652 -0.233 1.00 0.00 C ATOM 308 CG ASP A 20 -7.316 -4.465 0.816 1.00 0.00 C ATOM 309 OD1 ASP A 20 -7.660 -4.519 2.015 1.00 0.00 O ATOM 310 OD2 ASP A 20 -6.165 -4.188 0.414 1.00 0.00 O ATOM 0 H ASP A 20 -7.733 -4.209 -2.579 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.235 -6.364 -0.784 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.548 -3.717 -0.773 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.341 -4.894 0.255 1.00 0.00 H new ATOM 316 N PHE A 21 -9.219 -7.890 -1.148 1.00 0.00 N ATOM 317 CA PHE A 21 -10.393 -8.752 -1.224 1.00 0.00 C ATOM 318 C PHE A 21 -11.517 -8.284 -0.292 1.00 0.00 C ATOM 319 O PHE A 21 -12.685 -8.527 -0.581 1.00 0.00 O ATOM 320 CB PHE A 21 -10.006 -10.213 -0.959 1.00 0.00 C ATOM 321 CG PHE A 21 -9.869 -11.004 -2.242 1.00 0.00 C ATOM 322 CD1 PHE A 21 -11.029 -11.390 -2.941 1.00 0.00 C ATOM 323 CD2 PHE A 21 -8.599 -11.300 -2.774 1.00 0.00 C ATOM 324 CE1 PHE A 21 -10.921 -12.078 -4.159 1.00 0.00 C ATOM 325 CE2 PHE A 21 -8.493 -11.996 -3.990 1.00 0.00 C ATOM 326 CZ PHE A 21 -9.652 -12.395 -4.678 1.00 0.00 C ATOM 0 H PHE A 21 -8.378 -8.356 -0.808 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.788 -8.684 -2.238 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.064 -10.245 -0.411 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.760 -10.679 -0.325 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -12.004 -11.156 -2.539 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.707 -10.992 -2.248 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -11.812 -12.364 -4.698 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -7.519 -12.225 -4.397 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.569 -12.944 -5.604 1.00 0.00 H new ATOM 336 N GLU A 22 -11.204 -7.592 0.809 1.00 0.00 N ATOM 337 CA GLU A 22 -12.217 -6.966 1.645 1.00 0.00 C ATOM 338 C GLU A 22 -12.811 -5.776 0.879 1.00 0.00 C ATOM 339 O GLU A 22 -13.958 -5.842 0.429 1.00 0.00 O ATOM 340 CB GLU A 22 -11.601 -6.585 3.002 1.00 0.00 C ATOM 341 CG GLU A 22 -12.607 -6.539 4.162 1.00 0.00 C ATOM 342 CD GLU A 22 -13.878 -5.696 3.974 1.00 0.00 C ATOM 343 OE1 GLU A 22 -13.806 -4.449 3.937 1.00 0.00 O ATOM 344 OE2 GLU A 22 -14.985 -6.286 4.000 1.00 0.00 O ATOM 0 H GLU A 22 -10.248 -7.455 1.138 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.036 -7.650 1.866 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.816 -7.301 3.245 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.125 -5.609 2.910 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -12.913 -7.562 4.381 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -12.085 -6.167 5.044 1.00 0.00 H new ATOM 352 N LEU A 23 -12.020 -4.714 0.704 1.00 0.00 N ATOM 353 CA LEU A 23 -12.481 -3.390 0.298 1.00 0.00 C ATOM 354 C LEU A 23 -12.938 -3.365 -1.149 1.00 0.00 C ATOM 355 O LEU A 23 -14.002 -2.806 -1.418 1.00 0.00 O ATOM 356 CB LEU A 23 -11.370 -2.334 0.458 1.00 0.00 C ATOM 357 CG LEU A 23 -11.069 -1.851 1.886 1.00 0.00 C ATOM 358 CD1 LEU A 23 -12.239 -1.067 2.486 1.00 0.00 C ATOM 359 CD2 LEU A 23 -10.690 -2.986 2.833 1.00 0.00 C ATOM 0 H LEU A 23 -11.011 -4.757 0.846 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.322 -3.155 0.951 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.451 -2.742 0.037 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.638 -1.466 -0.144 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.208 -1.191 1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.982 -0.745 3.495 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.446 -0.193 1.868 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -13.123 -1.704 2.522 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.490 -2.581 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.511 -3.700 2.892 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.798 -3.489 2.460 1.00 0.00 H new ATOM 371 N GLY A 24 -12.135 -3.885 -2.080 1.00 0.00 N ATOM 372 CA GLY A 24 -12.445 -3.893 -3.504 1.00 0.00 C ATOM 373 C GLY A 24 -11.739 -2.826 -4.337 1.00 0.00 C ATOM 374 O GLY A 24 -12.100 -2.679 -5.503 1.00 0.00 O ATOM 0 H GLY A 24 -11.238 -4.318 -1.858 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.189 -4.872 -3.908 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.521 -3.770 -3.624 1.00 0.00 H new ATOM 378 N LEU A 25 -10.756 -2.102 -3.795 1.00 0.00 N ATOM 379 CA LEU A 25 -9.860 -1.218 -4.546 1.00 0.00 C ATOM 380 C LEU A 25 -8.429 -1.456 -4.073 1.00 0.00 C ATOM 381 O LEU A 25 -8.202 -2.248 -3.156 1.00 0.00 O ATOM 382 CB LEU A 25 -10.264 0.270 -4.405 1.00 0.00 C ATOM 383 CG LEU A 25 -10.876 0.928 -5.658 1.00 0.00 C ATOM 384 CD1 LEU A 25 -9.969 0.833 -6.892 1.00 0.00 C ATOM 385 CD2 LEU A 25 -12.268 0.387 -5.999 1.00 0.00 C ATOM 0 H LEU A 25 -10.556 -2.115 -2.795 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.936 -1.453 -5.608 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.981 0.355 -3.588 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.381 0.839 -4.115 1.00 0.00 H new ATOM 0 HG LEU A 25 -10.975 1.980 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -10.457 1.314 -7.740 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.022 1.332 -6.687 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.783 -0.215 -7.127 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -12.645 0.889 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -12.206 -0.685 -6.185 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -12.945 0.572 -5.165 1.00 0.00 H new ATOM 397 N ASP A 26 -7.482 -0.780 -4.725 1.00 0.00 N ATOM 398 CA ASP A 26 -6.064 -0.849 -4.403 1.00 0.00 C ATOM 399 C ASP A 26 -5.703 0.188 -3.325 1.00 0.00 C ATOM 400 O ASP A 26 -6.409 1.186 -3.140 1.00 0.00 O ATOM 401 CB ASP A 26 -5.219 -0.603 -5.661 1.00 0.00 C ATOM 402 CG ASP A 26 -4.798 0.844 -5.854 1.00 0.00 C ATOM 403 OD1 ASP A 26 -3.628 1.149 -5.560 1.00 0.00 O ATOM 404 OD2 ASP A 26 -5.618 1.662 -6.335 1.00 0.00 O ATOM 0 H ASP A 26 -7.688 -0.158 -5.507 1.00 0.00 H new ATOM 0 HA ASP A 26 -5.850 -1.846 -4.018 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -4.326 -1.226 -5.613 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.786 -0.925 -6.535 1.00 0.00 H new ATOM 410 N VAL A 27 -4.562 0.016 -2.659 1.00 0.00 N ATOM 411 CA VAL A 27 -4.080 0.904 -1.607 1.00 0.00 C ATOM 412 C VAL A 27 -3.898 2.361 -2.042 1.00 0.00 C ATOM 413 O VAL A 27 -4.114 3.261 -1.228 1.00 0.00 O ATOM 414 CB VAL A 27 -2.754 0.375 -1.034 1.00 0.00 C ATOM 415 CG1 VAL A 27 -2.877 -1.060 -0.509 1.00 0.00 C ATOM 416 CG2 VAL A 27 -1.593 0.473 -2.032 1.00 0.00 C ATOM 0 H VAL A 27 -3.933 -0.765 -2.842 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.861 0.906 -0.847 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.525 1.028 -0.192 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.915 -1.387 -0.115 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.624 -1.095 0.284 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.180 -1.720 -1.322 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.684 0.085 -1.572 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.827 -0.112 -2.921 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.441 1.515 -2.313 1.00 0.00 H new ATOM 426 N VAL A 28 -3.469 2.620 -3.278 1.00 0.00 N ATOM 427 CA VAL A 28 -3.217 3.957 -3.799 1.00 0.00 C ATOM 428 C VAL A 28 -4.563 4.650 -4.053 1.00 0.00 C ATOM 429 O VAL A 28 -4.668 5.864 -3.852 1.00 0.00 O ATOM 430 CB VAL A 28 -2.266 3.903 -5.031 1.00 0.00 C ATOM 431 CG1 VAL A 28 -1.866 5.327 -5.451 1.00 0.00 C ATOM 432 CG2 VAL A 28 -0.970 3.129 -4.707 1.00 0.00 C ATOM 0 H VAL A 28 -3.283 1.884 -3.959 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.683 4.567 -3.070 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.804 3.397 -5.832 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.201 5.279 -6.313 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.760 5.894 -5.713 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.354 5.820 -4.625 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.328 3.110 -5.588 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.447 3.622 -3.887 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.219 2.108 -4.417 1.00 0.00 H new ATOM 442 N SER A 29 -5.619 3.904 -4.384 1.00 0.00 N ATOM 443 CA SER A 29 -6.983 4.436 -4.400 1.00 0.00 C ATOM 444 C SER A 29 -7.456 4.720 -2.972 1.00 0.00 C ATOM 445 O SER A 29 -7.966 5.810 -2.689 1.00 0.00 O ATOM 446 CB SER A 29 -7.953 3.467 -5.076 1.00 0.00 C ATOM 447 OG SER A 29 -7.636 3.310 -6.443 1.00 0.00 O ATOM 0 H SER A 29 -5.554 2.921 -4.647 1.00 0.00 H new ATOM 0 HA SER A 29 -6.969 5.363 -4.973 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.914 2.499 -4.576 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.973 3.837 -4.975 1.00 0.00 H new ATOM 0 HG SER A 29 -6.748 2.905 -6.528 1.00 0.00 H new ATOM 453 N LEU A 30 -7.315 3.740 -2.073 1.00 0.00 N ATOM 454 CA LEU A 30 -7.768 3.828 -0.687 1.00 0.00 C ATOM 455 C LEU A 30 -6.958 4.813 0.160 1.00 0.00 C ATOM 456 O LEU A 30 -7.410 5.193 1.235 1.00 0.00 O ATOM 457 CB LEU A 30 -7.763 2.426 -0.046 1.00 0.00 C ATOM 458 CG LEU A 30 -9.119 1.702 -0.180 1.00 0.00 C ATOM 459 CD1 LEU A 30 -9.007 0.344 -0.872 1.00 0.00 C ATOM 460 CD2 LEU A 30 -9.762 1.517 1.198 1.00 0.00 C ATOM 0 H LEU A 30 -6.874 2.848 -2.296 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.784 4.222 -0.711 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -6.986 1.821 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.507 2.515 1.010 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.745 2.337 -0.807 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.994 -0.114 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.604 0.479 -1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.343 -0.303 -0.299 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.718 1.005 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -9.103 0.922 1.830 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -9.924 2.492 1.658 1.00 0.00 H new ATOM 472 N GLY A 31 -5.785 5.265 -0.275 1.00 0.00 N ATOM 473 CA GLY A 31 -5.011 6.229 0.491 1.00 0.00 C ATOM 474 C GLY A 31 -4.329 5.608 1.711 1.00 0.00 C ATOM 475 O GLY A 31 -4.107 6.309 2.694 1.00 0.00 O ATOM 0 H GLY A 31 -5.353 4.978 -1.153 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.254 6.675 -0.154 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.666 7.036 0.819 1.00 0.00 H new ATOM 479 N LEU A 32 -4.057 4.300 1.714 1.00 0.00 N ATOM 480 CA LEU A 32 -3.567 3.579 2.904 1.00 0.00 C ATOM 481 C LEU A 32 -2.064 3.749 3.140 1.00 0.00 C ATOM 482 O LEU A 32 -1.547 3.305 4.165 1.00 0.00 O ATOM 483 CB LEU A 32 -3.892 2.087 2.764 1.00 0.00 C ATOM 484 CG LEU A 32 -5.388 1.811 2.961 1.00 0.00 C ATOM 485 CD1 LEU A 32 -5.759 0.541 2.212 1.00 0.00 C ATOM 486 CD2 LEU A 32 -5.784 1.656 4.431 1.00 0.00 C ATOM 0 H LEU A 32 -4.169 3.706 0.893 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.074 4.012 3.766 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.584 1.739 1.778 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -3.318 1.519 3.496 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.928 2.675 2.573 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.821 0.337 2.346 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.545 0.669 1.151 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -5.177 -0.294 2.601 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.854 1.463 4.501 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.235 0.823 4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.545 2.572 4.971 1.00 0.00 H new ATOM 498 N VAL A 33 -1.350 4.351 2.195 1.00 0.00 N ATOM 499 CA VAL A 33 0.068 4.640 2.319 1.00 0.00 C ATOM 500 C VAL A 33 0.213 6.018 2.962 1.00 0.00 C ATOM 501 O VAL A 33 -0.538 6.948 2.650 1.00 0.00 O ATOM 502 CB VAL A 33 0.710 4.592 0.923 1.00 0.00 C ATOM 503 CG1 VAL A 33 2.206 4.926 0.954 1.00 0.00 C ATOM 504 CG2 VAL A 33 0.527 3.213 0.261 1.00 0.00 C ATOM 0 H VAL A 33 -1.750 4.656 1.308 1.00 0.00 H new ATOM 0 HA VAL A 33 0.575 3.906 2.945 1.00 0.00 H new ATOM 0 HB VAL A 33 0.193 5.352 0.337 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.611 4.878 -0.057 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.346 5.930 1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.726 4.208 1.587 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.994 3.217 -0.724 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.994 2.447 0.880 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.536 2.997 0.158 1.00 0.00 H new ATOM 514 N TYR A 34 1.222 6.167 3.811 1.00 0.00 N ATOM 515 CA TYR A 34 1.684 7.427 4.354 1.00 0.00 C ATOM 516 C TYR A 34 2.986 7.811 3.666 1.00 0.00 C ATOM 517 O TYR A 34 3.000 8.807 2.936 1.00 0.00 O ATOM 518 CB TYR A 34 1.804 7.336 5.883 1.00 0.00 C ATOM 519 CG TYR A 34 0.471 7.433 6.591 1.00 0.00 C ATOM 520 CD1 TYR A 34 -0.354 8.539 6.316 1.00 0.00 C ATOM 521 CD2 TYR A 34 0.076 6.468 7.540 1.00 0.00 C ATOM 522 CE1 TYR A 34 -1.591 8.668 6.950 1.00 0.00 C ATOM 523 CE2 TYR A 34 -1.150 6.625 8.222 1.00 0.00 C ATOM 524 CZ TYR A 34 -1.991 7.724 7.914 1.00 0.00 C ATOM 525 OH TYR A 34 -3.182 7.933 8.527 1.00 0.00 O ATOM 0 H TYR A 34 1.762 5.372 4.152 1.00 0.00 H new ATOM 0 HA TYR A 34 0.964 8.221 4.157 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.281 6.393 6.148 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.456 8.134 6.238 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.029 9.291 5.612 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.707 5.615 7.744 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -2.242 9.493 6.700 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.446 5.910 8.976 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.193 7.467 9.389 1.00 0.00 H new ATOM 535 N ASP A 35 4.054 7.029 3.825 1.00 0.00 N ATOM 536 CA ASP A 35 5.372 7.359 3.272 1.00 0.00 C ATOM 537 C ASP A 35 5.966 6.171 2.530 1.00 0.00 C ATOM 538 O ASP A 35 5.457 5.063 2.670 1.00 0.00 O ATOM 539 CB ASP A 35 6.350 7.784 4.370 1.00 0.00 C ATOM 540 CG ASP A 35 7.325 8.876 3.876 1.00 0.00 C ATOM 541 OD1 ASP A 35 7.752 9.718 4.698 1.00 0.00 O ATOM 542 OD2 ASP A 35 7.623 8.945 2.655 1.00 0.00 O ATOM 0 H ASP A 35 4.032 6.149 4.340 1.00 0.00 H new ATOM 0 HA ASP A 35 5.223 8.189 2.581 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.793 8.156 5.230 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.917 6.916 4.708 1.00 0.00 H new ATOM 548 N ILE A 36 7.026 6.408 1.753 1.00 0.00 N ATOM 549 CA ILE A 36 7.689 5.488 0.860 1.00 0.00 C ATOM 550 C ILE A 36 9.173 5.929 0.819 1.00 0.00 C ATOM 551 O ILE A 36 9.546 6.783 0.008 1.00 0.00 O ATOM 552 CB ILE A 36 7.009 5.541 -0.543 1.00 0.00 C ATOM 553 CG1 ILE A 36 5.474 5.744 -0.599 1.00 0.00 C ATOM 554 CG2 ILE A 36 7.359 4.240 -1.271 1.00 0.00 C ATOM 555 CD1 ILE A 36 4.978 6.185 -1.980 1.00 0.00 C ATOM 0 H ILE A 36 7.469 7.327 1.740 1.00 0.00 H new ATOM 0 HA ILE A 36 7.621 4.452 1.193 1.00 0.00 H new ATOM 0 HB ILE A 36 7.401 6.445 -1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.980 4.813 -0.322 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.185 6.491 0.140 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.899 4.241 -2.259 1.00 0.00 H new ATOM 0 HG22 ILE A 36 8.441 4.161 -1.374 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.986 3.391 -0.698 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.896 6.310 -1.955 1.00 0.00 H new ATOM 0 HD12 ILE A 36 5.447 7.131 -2.250 1.00 0.00 H new ATOM 0 HD13 ILE A 36 5.238 5.427 -2.719 1.00 0.00 H new ATOM 567 N GLN A 37 10.021 5.444 1.731 1.00 0.00 N ATOM 568 CA GLN A 37 11.468 5.667 1.732 1.00 0.00 C ATOM 569 C GLN A 37 12.128 4.529 0.992 1.00 0.00 C ATOM 570 O GLN A 37 11.980 3.372 1.395 1.00 0.00 O ATOM 571 CB GLN A 37 12.022 5.662 3.161 1.00 0.00 C ATOM 572 CG GLN A 37 11.445 6.832 3.949 1.00 0.00 C ATOM 573 CD GLN A 37 10.960 6.407 5.334 1.00 0.00 C ATOM 574 OE1 GLN A 37 10.301 5.387 5.521 1.00 0.00 O ATOM 575 NE2 GLN A 37 11.284 7.169 6.352 1.00 0.00 N ATOM 0 H GLN A 37 9.709 4.868 2.513 1.00 0.00 H new ATOM 0 HA GLN A 37 11.669 6.631 1.264 1.00 0.00 H new ATOM 0 HB2 GLN A 37 11.771 4.723 3.654 1.00 0.00 H new ATOM 0 HB3 GLN A 37 13.110 5.730 3.138 1.00 0.00 H new ATOM 0 HG2 GLN A 37 12.203 7.608 4.053 1.00 0.00 H new ATOM 0 HG3 GLN A 37 10.616 7.269 3.393 1.00 0.00 H new ATOM 0 HE21 GLN A 37 11.831 8.017 6.201 1.00 0.00 H new ATOM 0 HE22 GLN A 37 10.989 6.914 7.294 1.00 0.00 H new ATOM 584 N ILE A 38 12.821 4.834 -0.102 1.00 0.00 N ATOM 585 CA ILE A 38 13.467 3.795 -0.885 1.00 0.00 C ATOM 586 C ILE A 38 14.943 4.132 -1.010 1.00 0.00 C ATOM 587 O ILE A 38 15.328 4.963 -1.845 1.00 0.00 O ATOM 588 CB ILE A 38 12.711 3.578 -2.200 1.00 0.00 C ATOM 589 CG1 ILE A 38 11.237 3.240 -1.862 1.00 0.00 C ATOM 590 CG2 ILE A 38 13.403 2.447 -2.987 1.00 0.00 C ATOM 591 CD1 ILE A 38 10.325 3.460 -3.044 1.00 0.00 C ATOM 0 H ILE A 38 12.947 5.781 -0.460 1.00 0.00 H new ATOM 0 HA ILE A 38 13.426 2.823 -0.394 1.00 0.00 H new ATOM 0 HB ILE A 38 12.721 4.471 -2.824 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.168 2.202 -1.538 1.00 0.00 H new ATOM 0 HG13 ILE A 38 10.905 3.857 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 38 12.875 2.281 -3.926 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.435 2.728 -3.196 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.388 1.531 -2.396 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.301 3.211 -2.765 1.00 0.00 H new ATOM 0 HD12 ILE A 38 10.374 4.504 -3.352 1.00 0.00 H new ATOM 0 HD13 ILE A 38 10.640 2.823 -3.870 1.00 0.00 H new ATOM 603 N ASP A 39 15.744 3.506 -0.148 1.00 0.00 N ATOM 604 CA ASP A 39 17.178 3.752 -0.055 1.00 0.00 C ATOM 605 C ASP A 39 17.862 3.373 -1.368 1.00 0.00 C ATOM 606 O ASP A 39 17.274 2.723 -2.235 1.00 0.00 O ATOM 607 CB ASP A 39 17.794 2.952 1.102 1.00 0.00 C ATOM 608 CG ASP A 39 19.249 3.324 1.406 1.00 0.00 C ATOM 609 OD1 ASP A 39 19.984 2.431 1.886 1.00 0.00 O ATOM 610 OD2 ASP A 39 19.675 4.457 1.094 1.00 0.00 O ATOM 0 H ASP A 39 15.408 2.805 0.513 1.00 0.00 H new ATOM 0 HA ASP A 39 17.331 4.814 0.137 1.00 0.00 H new ATOM 0 HB2 ASP A 39 17.194 3.108 1.999 1.00 0.00 H new ATOM 0 HB3 ASP A 39 17.743 1.889 0.864 1.00 0.00 H new ATOM 616 N ASP A 40 19.125 3.746 -1.513 1.00 0.00 N ATOM 617 CA ASP A 40 19.934 3.553 -2.709 1.00 0.00 C ATOM 618 C ASP A 40 20.194 2.075 -2.961 1.00 0.00 C ATOM 619 O ASP A 40 20.255 1.634 -4.105 1.00 0.00 O ATOM 620 CB ASP A 40 21.242 4.342 -2.607 1.00 0.00 C ATOM 621 CG ASP A 40 21.429 5.144 -3.887 1.00 0.00 C ATOM 622 OD1 ASP A 40 20.673 6.133 -4.074 1.00 0.00 O ATOM 623 OD2 ASP A 40 22.269 4.777 -4.730 1.00 0.00 O ATOM 0 H ASP A 40 19.638 4.213 -0.766 1.00 0.00 H new ATOM 0 HA ASP A 40 19.377 3.936 -3.564 1.00 0.00 H new ATOM 0 HB2 ASP A 40 21.215 5.008 -1.744 1.00 0.00 H new ATOM 0 HB3 ASP A 40 22.082 3.663 -2.460 1.00 0.00 H new ATOM 629 N GLN A 41 20.228 1.304 -1.874 1.00 0.00 N ATOM 630 CA GLN A 41 20.364 -0.142 -1.821 1.00 0.00 C ATOM 631 C GLN A 41 19.023 -0.828 -2.118 1.00 0.00 C ATOM 632 O GLN A 41 18.937 -2.049 -2.008 1.00 0.00 O ATOM 633 CB GLN A 41 20.923 -0.543 -0.440 1.00 0.00 C ATOM 634 CG GLN A 41 22.416 -0.222 -0.234 1.00 0.00 C ATOM 635 CD GLN A 41 22.839 1.240 -0.428 1.00 0.00 C ATOM 636 OE1 GLN A 41 23.699 1.544 -1.251 1.00 0.00 O ATOM 637 NE2 GLN A 41 22.259 2.189 0.286 1.00 0.00 N ATOM 0 H GLN A 41 20.155 1.709 -0.941 1.00 0.00 H new ATOM 0 HA GLN A 41 21.062 -0.475 -2.589 1.00 0.00 H new ATOM 0 HB2 GLN A 41 20.346 -0.035 0.332 1.00 0.00 H new ATOM 0 HB3 GLN A 41 20.772 -1.613 -0.298 1.00 0.00 H new ATOM 0 HG2 GLN A 41 22.693 -0.525 0.776 1.00 0.00 H new ATOM 0 HG3 GLN A 41 22.995 -0.838 -0.922 1.00 0.00 H new ATOM 0 HE21 GLN A 41 21.544 1.946 0.972 1.00 0.00 H new ATOM 0 HE22 GLN A 41 22.526 3.164 0.151 1.00 0.00 H new ATOM 646 N ASN A 42 17.992 -0.062 -2.492 1.00 0.00 N ATOM 647 CA ASN A 42 16.639 -0.459 -2.871 1.00 0.00 C ATOM 648 C ASN A 42 15.892 -1.140 -1.727 1.00 0.00 C ATOM 649 O ASN A 42 15.021 -1.982 -1.950 1.00 0.00 O ATOM 650 CB ASN A 42 16.633 -1.357 -4.102 1.00 0.00 C ATOM 651 CG ASN A 42 17.154 -0.668 -5.308 1.00 0.00 C ATOM 652 OD1 ASN A 42 16.960 0.526 -5.482 1.00 0.00 O ATOM 653 ND2 ASN A 42 17.736 -1.420 -6.199 1.00 0.00 N ATOM 0 H ASN A 42 18.099 0.951 -2.540 1.00 0.00 H new ATOM 0 HA ASN A 42 16.115 0.465 -3.114 1.00 0.00 H new ATOM 0 HB2 ASN A 42 17.236 -2.243 -3.905 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.616 -1.699 -4.294 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.049 -1.016 -7.082 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.879 -2.413 -6.014 1.00 0.00 H new ATOM 660 N ASN A 43 16.259 -0.792 -0.497 1.00 0.00 N ATOM 661 CA ASN A 43 15.481 -1.077 0.698 1.00 0.00 C ATOM 662 C ASN A 43 14.159 -0.335 0.510 1.00 0.00 C ATOM 663 O ASN A 43 14.150 0.879 0.719 1.00 0.00 O ATOM 664 CB ASN A 43 16.192 -0.493 1.942 1.00 0.00 C ATOM 665 CG ASN A 43 17.584 -0.993 2.331 1.00 0.00 C ATOM 666 OD1 ASN A 43 18.323 -1.663 1.470 1.00 0.00 O flip ATOM 667 ND2 ASN A 43 18.025 -0.735 3.446 1.00 0.00 N flip ATOM 0 H ASN A 43 17.127 -0.292 -0.302 1.00 0.00 H new ATOM 0 HA ASN A 43 15.350 -2.150 0.841 1.00 0.00 H new ATOM 0 HB2 ASN A 43 16.263 0.585 1.799 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.537 -0.658 2.797 1.00 0.00 H new ATOM 0 HD21 ASN A 43 17.454 -0.216 4.113 1.00 0.00 H new ATOM 0 HD22 ASN A 43 18.963 -1.039 3.706 1.00 0.00 H new ATOM 674 N VAL A 44 13.080 -0.972 0.040 1.00 0.00 N ATOM 675 CA VAL A 44 11.803 -0.266 -0.034 1.00 0.00 C ATOM 676 C VAL A 44 11.147 -0.394 1.327 1.00 0.00 C ATOM 677 O VAL A 44 10.843 -1.504 1.769 1.00 0.00 O ATOM 678 CB VAL A 44 10.948 -0.832 -1.180 1.00 0.00 C ATOM 679 CG1 VAL A 44 9.500 -0.318 -1.202 1.00 0.00 C ATOM 680 CG2 VAL A 44 11.557 -0.535 -2.557 1.00 0.00 C ATOM 0 H VAL A 44 13.065 -1.939 -0.283 1.00 0.00 H new ATOM 0 HA VAL A 44 11.933 0.792 -0.263 1.00 0.00 H new ATOM 0 HB VAL A 44 10.935 -1.904 -0.981 1.00 0.00 H new ATOM 0 HG11 VAL A 44 8.967 -0.766 -2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.004 -0.589 -0.270 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.501 0.767 -1.311 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.919 -0.954 -3.335 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.637 0.543 -2.695 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.548 -0.983 -2.621 1.00 0.00 H new ATOM 690 N LYS A 45 10.914 0.737 1.990 1.00 0.00 N ATOM 691 CA LYS A 45 10.207 0.799 3.243 1.00 0.00 C ATOM 692 C LYS A 45 9.018 1.691 3.045 1.00 0.00 C ATOM 693 O LYS A 45 9.154 2.815 2.554 1.00 0.00 O ATOM 694 CB LYS A 45 11.120 1.318 4.348 1.00 0.00 C ATOM 695 CG LYS A 45 10.399 1.172 5.703 1.00 0.00 C ATOM 696 CD LYS A 45 11.180 1.694 6.911 1.00 0.00 C ATOM 697 CE LYS A 45 10.452 2.847 7.615 1.00 0.00 C ATOM 698 NZ LYS A 45 10.625 2.786 9.077 1.00 0.00 N ATOM 0 H LYS A 45 11.223 1.649 1.654 1.00 0.00 H new ATOM 0 HA LYS A 45 9.877 -0.193 3.551 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.056 0.759 4.357 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.374 2.362 4.167 1.00 0.00 H new ATOM 0 HG2 LYS A 45 9.447 1.700 5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.171 0.118 5.864 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.339 0.880 7.619 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.165 2.031 6.587 1.00 0.00 H new ATOM 0 HE2 LYS A 45 10.831 3.799 7.243 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.390 2.810 7.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.732 3.749 9.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.792 2.336 9.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.474 2.229 9.303 1.00 0.00 H new ATOM 712 N VAL A 46 7.861 1.207 3.453 1.00 0.00 N ATOM 713 CA VAL A 46 6.615 1.909 3.255 1.00 0.00 C ATOM 714 C VAL A 46 5.885 1.952 4.585 1.00 0.00 C ATOM 715 O VAL A 46 5.585 0.912 5.171 1.00 0.00 O ATOM 716 CB VAL A 46 5.802 1.284 2.108 1.00 0.00 C ATOM 717 CG1 VAL A 46 4.757 2.311 1.662 1.00 0.00 C ATOM 718 CG2 VAL A 46 6.693 0.929 0.902 1.00 0.00 C ATOM 0 H VAL A 46 7.762 0.312 3.933 1.00 0.00 H new ATOM 0 HA VAL A 46 6.789 2.937 2.936 1.00 0.00 H new ATOM 0 HB VAL A 46 5.340 0.363 2.465 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.163 1.896 0.848 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.104 2.553 2.500 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.259 3.216 1.320 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.081 0.490 0.114 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.175 1.832 0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.455 0.213 1.211 1.00 0.00 H new ATOM 728 N LEU A 47 5.576 3.164 5.036 1.00 0.00 N ATOM 729 CA LEU A 47 4.683 3.422 6.150 1.00 0.00 C ATOM 730 C LEU A 47 3.298 3.260 5.559 1.00 0.00 C ATOM 731 O LEU A 47 2.781 4.177 4.920 1.00 0.00 O ATOM 732 CB LEU A 47 4.930 4.835 6.721 1.00 0.00 C ATOM 733 CG LEU A 47 5.777 4.798 8.001 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.167 4.208 7.737 1.00 0.00 C ATOM 735 CD2 LEU A 47 5.913 6.212 8.572 1.00 0.00 C ATOM 0 H LEU A 47 5.954 4.016 4.621 1.00 0.00 H new ATOM 0 HA LEU A 47 4.832 2.748 6.993 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.432 5.446 5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.973 5.313 6.933 1.00 0.00 H new ATOM 0 HG LEU A 47 5.271 4.156 8.722 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.740 4.197 8.664 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.065 3.190 7.361 1.00 0.00 H new ATOM 0 HD13 LEU A 47 7.686 4.817 6.997 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.515 6.181 9.480 1.00 0.00 H new ATOM 0 HD22 LEU A 47 6.397 6.856 7.838 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.924 6.607 8.805 1.00 0.00 H new ATOM 747 N MET A 48 2.735 2.064 5.690 1.00 0.00 N ATOM 748 CA MET A 48 1.357 1.772 5.341 1.00 0.00 C ATOM 749 C MET A 48 0.573 1.611 6.646 1.00 0.00 C ATOM 750 O MET A 48 1.137 1.569 7.744 1.00 0.00 O ATOM 751 CB MET A 48 1.311 0.522 4.440 1.00 0.00 C ATOM 752 CG MET A 48 0.011 0.409 3.630 1.00 0.00 C ATOM 753 SD MET A 48 -0.200 -1.156 2.747 1.00 0.00 S ATOM 754 CE MET A 48 -2.014 -1.251 2.673 1.00 0.00 C ATOM 0 H MET A 48 3.239 1.254 6.051 1.00 0.00 H new ATOM 0 HA MET A 48 0.898 2.578 4.768 1.00 0.00 H new ATOM 0 HB2 MET A 48 2.158 0.545 3.754 1.00 0.00 H new ATOM 0 HB3 MET A 48 1.425 -0.368 5.058 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.834 0.546 4.305 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.023 1.225 2.908 1.00 0.00 H new ATOM 0 HE1 MET A 48 -2.309 -2.117 2.080 1.00 0.00 H new ATOM 0 HE2 MET A 48 -2.415 -1.349 3.682 1.00 0.00 H new ATOM 0 HE3 MET A 48 -2.407 -0.345 2.213 1.00 0.00 H new ATOM 764 N THR A 49 -0.741 1.534 6.539 1.00 0.00 N ATOM 765 CA THR A 49 -1.641 1.108 7.586 1.00 0.00 C ATOM 766 C THR A 49 -2.719 0.256 6.905 1.00 0.00 C ATOM 767 O THR A 49 -2.805 0.218 5.672 1.00 0.00 O ATOM 768 CB THR A 49 -2.133 2.357 8.352 1.00 0.00 C ATOM 769 OG1 THR A 49 -3.092 1.989 9.328 1.00 0.00 O ATOM 770 CG2 THR A 49 -2.700 3.473 7.461 1.00 0.00 C ATOM 0 H THR A 49 -1.229 1.779 5.677 1.00 0.00 H new ATOM 0 HA THR A 49 -1.186 0.483 8.355 1.00 0.00 H new ATOM 0 HB THR A 49 -1.244 2.774 8.825 1.00 0.00 H new ATOM 0 HG1 THR A 49 -2.661 1.938 10.207 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.020 4.308 8.084 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.930 3.811 6.768 1.00 0.00 H new ATOM 0 HG23 THR A 49 -3.553 3.092 6.899 1.00 0.00 H new ATOM 778 N MET A 50 -3.528 -0.465 7.675 1.00 0.00 N ATOM 779 CA MET A 50 -4.679 -1.191 7.160 1.00 0.00 C ATOM 780 C MET A 50 -5.893 -0.527 7.796 1.00 0.00 C ATOM 781 O MET A 50 -5.809 -0.083 8.947 1.00 0.00 O ATOM 782 CB MET A 50 -4.556 -2.693 7.483 1.00 0.00 C ATOM 783 CG MET A 50 -5.560 -3.536 6.686 1.00 0.00 C ATOM 784 SD MET A 50 -5.381 -3.428 4.887 1.00 0.00 S ATOM 785 CE MET A 50 -4.057 -4.628 4.579 1.00 0.00 C ATOM 0 H MET A 50 -3.400 -0.561 8.682 1.00 0.00 H new ATOM 0 HA MET A 50 -4.761 -1.147 6.074 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.543 -3.030 7.261 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.718 -2.849 8.550 1.00 0.00 H new ATOM 0 HG2 MET A 50 -5.456 -4.579 6.986 1.00 0.00 H new ATOM 0 HG3 MET A 50 -6.569 -3.226 6.956 1.00 0.00 H new ATOM 0 HE1 MET A 50 -3.842 -4.666 3.511 1.00 0.00 H new ATOM 0 HE2 MET A 50 -3.160 -4.326 5.119 1.00 0.00 H new ATOM 0 HE3 MET A 50 -4.372 -5.614 4.921 1.00 0.00 H new ATOM 795 N THR A 51 -7.011 -0.428 7.072 1.00 0.00 N ATOM 796 CA THR A 51 -8.205 0.241 7.586 1.00 0.00 C ATOM 797 C THR A 51 -8.607 -0.362 8.932 1.00 0.00 C ATOM 798 O THR A 51 -8.833 0.372 9.899 1.00 0.00 O ATOM 799 CB THR A 51 -9.354 0.212 6.554 1.00 0.00 C ATOM 800 OG1 THR A 51 -10.542 0.696 7.133 1.00 0.00 O ATOM 801 CG2 THR A 51 -9.606 -1.154 5.911 1.00 0.00 C ATOM 0 H THR A 51 -7.112 -0.803 6.129 1.00 0.00 H new ATOM 0 HA THR A 51 -7.975 1.293 7.754 1.00 0.00 H new ATOM 0 HB THR A 51 -9.028 0.863 5.743 1.00 0.00 H new ATOM 0 HG1 THR A 51 -10.709 1.610 6.821 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.430 -1.076 5.202 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.707 -1.482 5.389 1.00 0.00 H new ATOM 0 HG23 THR A 51 -9.861 -1.879 6.684 1.00 0.00 H new ATOM 809 N THR A 52 -8.658 -1.695 9.013 1.00 0.00 N ATOM 810 CA THR A 52 -9.278 -2.385 10.125 1.00 0.00 C ATOM 811 C THR A 52 -8.375 -3.531 10.586 1.00 0.00 C ATOM 812 O THR A 52 -7.856 -4.261 9.735 1.00 0.00 O ATOM 813 CB THR A 52 -10.667 -2.887 9.701 1.00 0.00 C ATOM 814 OG1 THR A 52 -10.614 -3.807 8.623 1.00 0.00 O ATOM 815 CG2 THR A 52 -11.581 -1.741 9.245 1.00 0.00 C ATOM 0 H THR A 52 -8.268 -2.317 8.305 1.00 0.00 H new ATOM 0 HA THR A 52 -9.408 -1.705 10.967 1.00 0.00 H new ATOM 0 HB THR A 52 -11.062 -3.372 10.594 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.522 -4.096 8.394 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.552 -2.143 8.955 1.00 0.00 H new ATOM 0 HG22 THR A 52 -11.712 -1.032 10.063 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.130 -1.233 8.393 1.00 0.00 H new ATOM 823 N PRO A 53 -8.210 -3.750 11.901 1.00 0.00 N ATOM 824 CA PRO A 53 -7.606 -4.962 12.442 1.00 0.00 C ATOM 825 C PRO A 53 -8.353 -6.210 11.952 1.00 0.00 C ATOM 826 O PRO A 53 -7.744 -7.204 11.566 1.00 0.00 O ATOM 827 CB PRO A 53 -7.690 -4.817 13.967 1.00 0.00 C ATOM 828 CG PRO A 53 -7.880 -3.324 14.207 1.00 0.00 C ATOM 829 CD PRO A 53 -8.611 -2.850 12.965 1.00 0.00 C ATOM 0 HA PRO A 53 -6.574 -5.084 12.114 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.522 -5.392 14.374 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.784 -5.183 14.450 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.460 -3.134 15.110 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -6.925 -2.813 14.329 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.691 -2.876 13.113 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -8.347 -1.820 12.726 1.00 0.00 H new ATOM 837 N MET A 54 -9.687 -6.138 11.919 1.00 0.00 N ATOM 838 CA MET A 54 -10.596 -7.222 11.552 1.00 0.00 C ATOM 839 C MET A 54 -10.596 -7.571 10.049 1.00 0.00 C ATOM 840 O MET A 54 -11.597 -8.112 9.563 1.00 0.00 O ATOM 841 CB MET A 54 -12.013 -6.854 12.028 1.00 0.00 C ATOM 842 CG MET A 54 -12.580 -5.632 11.288 1.00 0.00 C ATOM 843 SD MET A 54 -14.344 -5.728 10.906 1.00 0.00 S ATOM 844 CE MET A 54 -14.489 -4.223 9.909 1.00 0.00 C ATOM 0 H MET A 54 -10.184 -5.280 12.159 1.00 0.00 H new ATOM 0 HA MET A 54 -10.239 -8.125 12.047 1.00 0.00 H new ATOM 0 HB2 MET A 54 -12.676 -7.706 11.879 1.00 0.00 H new ATOM 0 HB3 MET A 54 -11.992 -6.650 13.099 1.00 0.00 H new ATOM 0 HG2 MET A 54 -12.402 -4.743 11.893 1.00 0.00 H new ATOM 0 HG3 MET A 54 -12.028 -5.500 10.358 1.00 0.00 H new ATOM 0 HE1 MET A 54 -15.520 -4.106 9.575 1.00 0.00 H new ATOM 0 HE2 MET A 54 -14.202 -3.360 10.509 1.00 0.00 H new ATOM 0 HE3 MET A 54 -13.833 -4.296 9.042 1.00 0.00 H new ATOM 854 N CYS A 55 -9.565 -7.218 9.272 1.00 0.00 N ATOM 855 CA CYS A 55 -9.496 -7.646 7.876 1.00 0.00 C ATOM 856 C CYS A 55 -9.547 -9.179 7.823 1.00 0.00 C ATOM 857 O CYS A 55 -8.902 -9.834 8.640 1.00 0.00 O ATOM 858 CB CYS A 55 -8.233 -7.128 7.193 1.00 0.00 C ATOM 859 SG CYS A 55 -8.439 -5.379 6.758 1.00 0.00 S ATOM 0 H CYS A 55 -8.780 -6.646 9.583 1.00 0.00 H new ATOM 0 HA CYS A 55 -10.347 -7.228 7.337 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.376 -7.248 7.855 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -8.028 -7.713 6.296 1.00 0.00 H new ATOM 0 HG CYS A 55 -9.304 -4.832 7.559 1.00 0.00 H new ATOM 865 N PRO A 56 -10.308 -9.759 6.882 1.00 0.00 N ATOM 866 CA PRO A 56 -10.828 -11.106 7.029 1.00 0.00 C ATOM 867 C PRO A 56 -9.695 -12.117 6.926 1.00 0.00 C ATOM 868 O PRO A 56 -9.392 -12.840 7.872 1.00 0.00 O ATOM 869 CB PRO A 56 -11.893 -11.258 5.935 1.00 0.00 C ATOM 870 CG PRO A 56 -11.490 -10.238 4.865 1.00 0.00 C ATOM 871 CD PRO A 56 -10.773 -9.142 5.656 1.00 0.00 C ATOM 0 HA PRO A 56 -11.280 -11.288 8.004 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -11.907 -12.271 5.533 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.892 -11.054 6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.836 -10.683 4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.360 -9.847 4.338 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.938 -8.734 5.086 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.448 -8.313 5.870 1.00 0.00 H new ATOM 879 N LEU A 57 -9.018 -12.097 5.786 1.00 0.00 N ATOM 880 CA LEU A 57 -7.813 -12.831 5.467 1.00 0.00 C ATOM 881 C LEU A 57 -6.697 -11.789 5.411 1.00 0.00 C ATOM 882 O LEU A 57 -6.059 -11.618 4.374 1.00 0.00 O ATOM 883 CB LEU A 57 -8.008 -13.671 4.172 1.00 0.00 C ATOM 884 CG LEU A 57 -9.023 -13.147 3.126 1.00 0.00 C ATOM 885 CD1 LEU A 57 -8.602 -11.825 2.471 1.00 0.00 C ATOM 886 CD2 LEU A 57 -9.264 -14.186 2.033 1.00 0.00 C ATOM 0 H LEU A 57 -9.326 -11.520 5.003 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.550 -13.580 6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.039 -13.764 3.683 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.315 -14.675 4.465 1.00 0.00 H new ATOM 0 HG LEU A 57 -9.942 -12.960 3.682 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.360 -11.519 1.750 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.498 -11.056 3.237 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.649 -11.959 1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -9.980 -13.795 1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.324 -14.408 1.528 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -9.660 -15.098 2.479 1.00 0.00 H new ATOM 898 N ALA A 58 -6.484 -11.051 6.518 1.00 0.00 N ATOM 899 CA ALA A 58 -5.509 -9.960 6.567 1.00 0.00 C ATOM 900 C ALA A 58 -4.157 -10.456 6.055 1.00 0.00 C ATOM 901 O ALA A 58 -3.574 -9.806 5.201 1.00 0.00 O ATOM 902 CB ALA A 58 -5.322 -9.406 7.984 1.00 0.00 C ATOM 0 H ALA A 58 -6.983 -11.198 7.395 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.895 -9.158 5.938 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.589 -8.599 7.966 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.273 -9.023 8.354 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -4.970 -10.201 8.642 1.00 0.00 H new ATOM 908 N GLY A 59 -3.687 -11.612 6.534 1.00 0.00 N ATOM 909 CA GLY A 59 -2.397 -12.177 6.152 1.00 0.00 C ATOM 910 C GLY A 59 -2.284 -12.494 4.666 1.00 0.00 C ATOM 911 O GLY A 59 -1.183 -12.509 4.124 1.00 0.00 O ATOM 0 H GLY A 59 -4.200 -12.185 7.205 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.608 -11.477 6.426 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.226 -13.089 6.723 1.00 0.00 H new ATOM 915 N MET A 60 -3.403 -12.746 3.991 1.00 0.00 N ATOM 916 CA MET A 60 -3.418 -12.978 2.558 1.00 0.00 C ATOM 917 C MET A 60 -3.230 -11.650 1.835 1.00 0.00 C ATOM 918 O MET A 60 -2.406 -11.572 0.935 1.00 0.00 O ATOM 919 CB MET A 60 -4.720 -13.689 2.179 1.00 0.00 C ATOM 920 CG MET A 60 -4.501 -14.635 1.002 1.00 0.00 C ATOM 921 SD MET A 60 -5.968 -15.540 0.456 1.00 0.00 S ATOM 922 CE MET A 60 -5.194 -16.571 -0.822 1.00 0.00 C ATOM 0 H MET A 60 -4.324 -12.794 4.427 1.00 0.00 H new ATOM 0 HA MET A 60 -2.597 -13.628 2.254 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.096 -14.249 3.035 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.480 -12.951 1.921 1.00 0.00 H new ATOM 0 HG2 MET A 60 -4.116 -14.059 0.161 1.00 0.00 H new ATOM 0 HG3 MET A 60 -3.730 -15.356 1.275 1.00 0.00 H new ATOM 0 HE1 MET A 60 -5.949 -17.209 -1.282 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.747 -15.932 -1.583 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.421 -17.192 -0.370 1.00 0.00 H new ATOM 932 N ILE A 61 -3.917 -10.590 2.274 1.00 0.00 N ATOM 933 CA ILE A 61 -3.729 -9.235 1.754 1.00 0.00 C ATOM 934 C ILE A 61 -2.291 -8.769 2.053 1.00 0.00 C ATOM 935 O ILE A 61 -1.676 -8.095 1.232 1.00 0.00 O ATOM 936 CB ILE A 61 -4.804 -8.279 2.338 1.00 0.00 C ATOM 937 CG1 ILE A 61 -6.246 -8.808 2.110 1.00 0.00 C ATOM 938 CG2 ILE A 61 -4.676 -6.876 1.718 1.00 0.00 C ATOM 939 CD1 ILE A 61 -7.322 -8.062 2.911 1.00 0.00 C ATOM 0 H ILE A 61 -4.624 -10.651 3.006 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.860 -9.226 0.672 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.626 -8.227 3.412 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.484 -8.737 1.049 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -6.280 -9.865 2.374 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.438 -6.221 2.140 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.688 -6.471 1.936 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.811 -6.942 0.638 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.300 -8.492 2.695 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -7.112 -8.154 3.977 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -7.319 -7.009 2.631 1.00 0.00 H new ATOM 951 N LEU A 62 -1.729 -9.128 3.211 1.00 0.00 N ATOM 952 CA LEU A 62 -0.377 -8.750 3.623 1.00 0.00 C ATOM 953 C LEU A 62 0.675 -9.457 2.761 1.00 0.00 C ATOM 954 O LEU A 62 1.666 -8.816 2.400 1.00 0.00 O ATOM 955 CB LEU A 62 -0.173 -9.062 5.115 1.00 0.00 C ATOM 956 CG LEU A 62 -0.988 -8.162 6.071 1.00 0.00 C ATOM 957 CD1 LEU A 62 -1.144 -8.794 7.458 1.00 0.00 C ATOM 958 CD2 LEU A 62 -0.358 -6.789 6.255 1.00 0.00 C ATOM 0 H LEU A 62 -2.213 -9.702 3.902 1.00 0.00 H new ATOM 0 HA LEU A 62 -0.255 -7.677 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.442 -10.102 5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 62 0.886 -8.961 5.354 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.964 -8.054 5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.723 -8.128 8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.660 -9.749 7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.160 -8.954 7.898 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.969 -6.196 6.935 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.643 -6.901 6.671 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.296 -6.285 5.291 1.00 0.00 H new ATOM 970 N SER A 63 0.467 -10.733 2.404 1.00 0.00 N ATOM 971 CA SER A 63 1.247 -11.399 1.365 1.00 0.00 C ATOM 972 C SER A 63 1.099 -10.634 0.051 1.00 0.00 C ATOM 973 O SER A 63 2.102 -10.247 -0.538 1.00 0.00 O ATOM 974 CB SER A 63 0.788 -12.846 1.147 1.00 0.00 C ATOM 975 OG SER A 63 1.213 -13.733 2.167 1.00 0.00 O ATOM 0 H SER A 63 -0.246 -11.326 2.829 1.00 0.00 H new ATOM 0 HA SER A 63 2.287 -11.414 1.690 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.300 -12.869 1.087 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.168 -13.199 0.188 1.00 0.00 H new ATOM 0 HG SER A 63 0.888 -14.637 1.971 1.00 0.00 H new ATOM 981 N ASP A 64 -0.137 -10.399 -0.396 1.00 0.00 N ATOM 982 CA ASP A 64 -0.456 -9.782 -1.686 1.00 0.00 C ATOM 983 C ASP A 64 0.233 -8.432 -1.829 1.00 0.00 C ATOM 984 O ASP A 64 0.768 -8.097 -2.884 1.00 0.00 O ATOM 985 CB ASP A 64 -1.980 -9.625 -1.833 1.00 0.00 C ATOM 986 CG ASP A 64 -2.493 -10.050 -3.203 1.00 0.00 C ATOM 987 OD1 ASP A 64 -2.112 -11.140 -3.681 1.00 0.00 O ATOM 988 OD2 ASP A 64 -3.430 -9.403 -3.720 1.00 0.00 O ATOM 0 H ASP A 64 -0.967 -10.640 0.145 1.00 0.00 H new ATOM 0 HA ASP A 64 -0.089 -10.433 -2.479 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.477 -10.218 -1.065 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.251 -8.584 -1.657 1.00 0.00 H new ATOM 994 N ALA A 65 0.268 -7.659 -0.745 1.00 0.00 N ATOM 995 CA ALA A 65 0.944 -6.384 -0.724 1.00 0.00 C ATOM 996 C ALA A 65 2.437 -6.568 -0.988 1.00 0.00 C ATOM 997 O ALA A 65 2.975 -5.885 -1.863 1.00 0.00 O ATOM 998 CB ALA A 65 0.680 -5.654 0.598 1.00 0.00 C ATOM 0 H ALA A 65 -0.175 -7.908 0.139 1.00 0.00 H new ATOM 0 HA ALA A 65 0.545 -5.759 -1.523 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.198 -4.695 0.594 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -0.391 -5.487 0.714 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.045 -6.260 1.427 1.00 0.00 H new ATOM 1004 N GLU A 66 3.088 -7.494 -0.276 1.00 0.00 N ATOM 1005 CA GLU A 66 4.479 -7.843 -0.488 1.00 0.00 C ATOM 1006 C GLU A 66 4.711 -8.313 -1.928 1.00 0.00 C ATOM 1007 O GLU A 66 5.731 -7.959 -2.510 1.00 0.00 O ATOM 1008 CB GLU A 66 4.923 -8.928 0.514 1.00 0.00 C ATOM 1009 CG GLU A 66 6.424 -8.777 0.810 1.00 0.00 C ATOM 1010 CD GLU A 66 7.145 -10.075 1.196 1.00 0.00 C ATOM 1011 OE1 GLU A 66 8.320 -10.248 0.797 1.00 0.00 O ATOM 1012 OE2 GLU A 66 6.521 -11.038 1.688 1.00 0.00 O ATOM 0 H GLU A 66 2.647 -8.026 0.474 1.00 0.00 H new ATOM 0 HA GLU A 66 5.082 -6.951 -0.321 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.350 -8.841 1.437 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.721 -9.918 0.106 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.911 -8.357 -0.070 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.548 -8.056 1.618 1.00 0.00 H new ATOM 1020 N GLU A 67 3.790 -9.083 -2.518 1.00 0.00 N ATOM 1021 CA GLU A 67 3.909 -9.642 -3.871 1.00 0.00 C ATOM 1022 C GLU A 67 4.089 -8.534 -4.912 1.00 0.00 C ATOM 1023 O GLU A 67 4.851 -8.690 -5.862 1.00 0.00 O ATOM 1024 CB GLU A 67 2.709 -10.536 -4.228 1.00 0.00 C ATOM 1025 CG GLU A 67 2.548 -11.756 -3.296 1.00 0.00 C ATOM 1026 CD GLU A 67 2.850 -13.131 -3.899 1.00 0.00 C ATOM 1027 OE1 GLU A 67 3.088 -14.059 -3.095 1.00 0.00 O ATOM 1028 OE2 GLU A 67 2.822 -13.333 -5.135 1.00 0.00 O ATOM 0 H GLU A 67 2.918 -9.342 -2.056 1.00 0.00 H new ATOM 0 HA GLU A 67 4.800 -10.269 -3.882 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.798 -9.939 -4.191 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.820 -10.886 -5.254 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.199 -11.613 -2.434 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.524 -11.766 -2.924 1.00 0.00 H new ATOM 1036 N ALA A 68 3.448 -7.379 -4.709 1.00 0.00 N ATOM 1037 CA ALA A 68 3.564 -6.254 -5.631 1.00 0.00 C ATOM 1038 C ALA A 68 4.941 -5.624 -5.525 1.00 0.00 C ATOM 1039 O ALA A 68 5.519 -5.179 -6.512 1.00 0.00 O ATOM 1040 CB ALA A 68 2.525 -5.189 -5.290 1.00 0.00 C ATOM 0 H ALA A 68 2.841 -7.202 -3.909 1.00 0.00 H new ATOM 0 HA ALA A 68 3.403 -6.628 -6.642 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.619 -4.353 -5.983 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.526 -5.617 -5.371 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.687 -4.835 -4.272 1.00 0.00 H new ATOM 1046 N ILE A 69 5.445 -5.527 -4.303 1.00 0.00 N ATOM 1047 CA ILE A 69 6.687 -4.847 -4.017 1.00 0.00 C ATOM 1048 C ILE A 69 7.872 -5.745 -4.393 1.00 0.00 C ATOM 1049 O ILE A 69 8.851 -5.272 -4.963 1.00 0.00 O ATOM 1050 CB ILE A 69 6.616 -4.395 -2.544 1.00 0.00 C ATOM 1051 CG1 ILE A 69 5.451 -3.408 -2.294 1.00 0.00 C ATOM 1052 CG2 ILE A 69 7.931 -3.771 -2.097 1.00 0.00 C ATOM 1053 CD1 ILE A 69 5.397 -2.228 -3.269 1.00 0.00 C ATOM 0 H ILE A 69 4.994 -5.924 -3.479 1.00 0.00 H new ATOM 0 HA ILE A 69 6.843 -3.951 -4.618 1.00 0.00 H new ATOM 0 HB ILE A 69 6.430 -5.290 -1.951 1.00 0.00 H new ATOM 0 HG12 ILE A 69 4.510 -3.955 -2.353 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.532 -3.020 -1.278 1.00 0.00 H new ATOM 0 HG21 ILE A 69 7.851 -3.462 -1.055 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.733 -4.502 -2.198 1.00 0.00 H new ATOM 0 HG23 ILE A 69 8.151 -2.902 -2.717 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.550 -1.588 -3.020 1.00 0.00 H new ATOM 0 HD12 ILE A 69 6.320 -1.653 -3.196 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.282 -2.602 -4.286 1.00 0.00 H new ATOM 1065 N LYS A 70 7.790 -7.054 -4.162 1.00 0.00 N ATOM 1066 CA LYS A 70 8.866 -7.982 -4.496 1.00 0.00 C ATOM 1067 C LYS A 70 8.957 -8.285 -5.996 1.00 0.00 C ATOM 1068 O LYS A 70 9.869 -9.025 -6.372 1.00 0.00 O ATOM 1069 CB LYS A 70 8.723 -9.263 -3.655 1.00 0.00 C ATOM 1070 CG LYS A 70 7.640 -10.211 -4.187 1.00 0.00 C ATOM 1071 CD LYS A 70 7.472 -11.456 -3.313 1.00 0.00 C ATOM 1072 CE LYS A 70 6.609 -11.170 -2.081 1.00 0.00 C ATOM 1073 NZ LYS A 70 7.005 -12.012 -0.939 1.00 0.00 N ATOM 0 H LYS A 70 6.976 -7.500 -3.738 1.00 0.00 H new ATOM 0 HA LYS A 70 9.811 -7.499 -4.247 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.679 -9.787 -3.635 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.487 -8.991 -2.626 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.690 -9.679 -4.242 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.894 -10.515 -5.202 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.016 -12.254 -3.900 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.452 -11.813 -2.996 1.00 0.00 H new ATOM 0 HE2 LYS A 70 6.699 -10.119 -1.808 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.561 -11.348 -2.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.245 -12.013 -0.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.174 -12.984 -1.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.876 -11.634 -0.514 1.00 0.00 H new ATOM 1087 N LYS A 71 8.046 -7.783 -6.845 1.00 0.00 N ATOM 1088 CA LYS A 71 8.062 -8.068 -8.280 1.00 0.00 C ATOM 1089 C LYS A 71 8.810 -7.001 -9.077 1.00 0.00 C ATOM 1090 O LYS A 71 8.904 -7.123 -10.296 1.00 0.00 O ATOM 1091 CB LYS A 71 6.647 -8.336 -8.819 1.00 0.00 C ATOM 1092 CG LYS A 71 5.780 -7.074 -8.842 1.00 0.00 C ATOM 1093 CD LYS A 71 5.065 -6.851 -10.173 1.00 0.00 C ATOM 1094 CE LYS A 71 4.400 -5.469 -10.174 1.00 0.00 C ATOM 1095 NZ LYS A 71 3.684 -5.210 -11.438 1.00 0.00 N ATOM 0 H LYS A 71 7.283 -7.172 -6.553 1.00 0.00 H new ATOM 0 HA LYS A 71 8.628 -8.989 -8.419 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.717 -8.743 -9.828 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.164 -9.094 -8.202 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.038 -7.138 -8.046 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.406 -6.208 -8.625 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.776 -6.924 -10.996 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.315 -7.627 -10.329 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.702 -5.400 -9.340 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.157 -4.700 -10.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.247 -4.267 -11.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.355 -5.251 -12.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.945 -5.929 -11.572 1.00 0.00 H new ATOM 1109 N ILE A 72 9.301 -5.939 -8.426 1.00 0.00 N ATOM 1110 CA ILE A 72 9.932 -4.809 -9.104 1.00 0.00 C ATOM 1111 C ILE A 72 11.427 -5.087 -9.359 1.00 0.00 C ATOM 1112 O ILE A 72 12.205 -4.152 -9.551 1.00 0.00 O ATOM 1113 CB ILE A 72 9.625 -3.453 -8.406 1.00 0.00 C ATOM 1114 CG1 ILE A 72 8.234 -3.393 -7.727 1.00 0.00 C ATOM 1115 CG2 ILE A 72 9.706 -2.304 -9.430 1.00 0.00 C ATOM 1116 CD1 ILE A 72 8.020 -2.140 -6.867 1.00 0.00 C ATOM 0 H ILE A 72 9.270 -5.843 -7.411 1.00 0.00 H new ATOM 0 HA ILE A 72 9.482 -4.701 -10.091 1.00 0.00 H new ATOM 0 HB ILE A 72 10.377 -3.352 -7.623 1.00 0.00 H new ATOM 0 HG12 ILE A 72 7.462 -3.431 -8.496 1.00 0.00 H new ATOM 0 HG13 ILE A 72 8.106 -4.277 -7.103 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.490 -1.358 -8.933 1.00 0.00 H new ATOM 0 HG22 ILE A 72 10.708 -2.268 -9.858 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.978 -2.472 -10.224 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.024 -2.168 -6.424 1.00 0.00 H new ATOM 0 HD12 ILE A 72 8.769 -2.110 -6.075 1.00 0.00 H new ATOM 0 HD13 ILE A 72 8.115 -1.251 -7.490 1.00 0.00 H new ATOM 1128 N GLU A 73 11.844 -6.362 -9.311 1.00 0.00 N ATOM 1129 CA GLU A 73 13.157 -6.891 -9.653 1.00 0.00 C ATOM 1130 C GLU A 73 14.297 -5.970 -9.227 1.00 0.00 C ATOM 1131 O GLU A 73 15.194 -5.634 -10.009 1.00 0.00 O ATOM 1132 CB GLU A 73 13.156 -7.282 -11.141 1.00 0.00 C ATOM 1133 CG GLU A 73 14.167 -8.398 -11.407 1.00 0.00 C ATOM 1134 CD GLU A 73 14.237 -8.761 -12.890 1.00 0.00 C ATOM 1135 OE1 GLU A 73 13.399 -9.554 -13.380 1.00 0.00 O ATOM 1136 OE2 GLU A 73 15.195 -8.334 -13.574 1.00 0.00 O ATOM 0 H GLU A 73 11.213 -7.103 -9.006 1.00 0.00 H new ATOM 0 HA GLU A 73 13.354 -7.796 -9.078 1.00 0.00 H new ATOM 0 HB2 GLU A 73 12.159 -7.610 -11.435 1.00 0.00 H new ATOM 0 HB3 GLU A 73 13.398 -6.412 -11.751 1.00 0.00 H new ATOM 0 HG2 GLU A 73 15.153 -8.085 -11.063 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.894 -9.281 -10.829 1.00 0.00 H new ATOM 1144 N GLY A 74 14.236 -5.502 -7.979 1.00 0.00 N ATOM 1145 CA GLY A 74 14.957 -4.305 -7.603 1.00 0.00 C ATOM 1146 C GLY A 74 14.947 -4.133 -6.106 1.00 0.00 C ATOM 1147 O GLY A 74 15.995 -3.886 -5.525 1.00 0.00 O ATOM 0 H GLY A 74 13.699 -5.934 -7.227 1.00 0.00 H new ATOM 0 HA2 GLY A 74 15.985 -4.364 -7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 74 14.503 -3.435 -8.078 1.00 0.00 H new ATOM 1151 N VAL A 75 13.770 -4.297 -5.517 1.00 0.00 N ATOM 1152 CA VAL A 75 13.384 -4.319 -4.111 1.00 0.00 C ATOM 1153 C VAL A 75 14.154 -5.256 -3.218 1.00 0.00 C ATOM 1154 O VAL A 75 13.680 -6.355 -2.925 1.00 0.00 O ATOM 1155 CB VAL A 75 11.890 -4.362 -3.876 1.00 0.00 C ATOM 1156 CG1 VAL A 75 11.662 -3.953 -2.434 1.00 0.00 C ATOM 1157 CG2 VAL A 75 11.271 -3.366 -4.829 1.00 0.00 C ATOM 0 H VAL A 75 12.945 -4.438 -6.100 1.00 0.00 H new ATOM 0 HA VAL A 75 13.712 -3.335 -3.776 1.00 0.00 H new ATOM 0 HB VAL A 75 11.451 -5.345 -4.046 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.594 -3.969 -2.216 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.178 -4.649 -1.772 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.050 -2.947 -2.276 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.189 -3.360 -4.697 1.00 0.00 H new ATOM 0 HG22 VAL A 75 11.667 -2.371 -4.624 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.510 -3.647 -5.855 1.00 0.00 H new ATOM 1167 N ASN A 76 15.422 -4.933 -3.048 1.00 0.00 N ATOM 1168 CA ASN A 76 16.399 -5.740 -2.352 1.00 0.00 C ATOM 1169 C ASN A 76 15.794 -6.409 -1.132 1.00 0.00 C ATOM 1170 O ASN A 76 15.829 -7.625 -0.977 1.00 0.00 O ATOM 1171 CB ASN A 76 17.558 -4.851 -1.894 1.00 0.00 C ATOM 1172 CG ASN A 76 18.526 -5.590 -0.979 1.00 0.00 C ATOM 1173 OD1 ASN A 76 19.130 -6.575 -1.380 1.00 0.00 O ATOM 1174 ND2 ASN A 76 18.703 -5.146 0.255 1.00 0.00 N ATOM 0 H ASN A 76 15.813 -4.063 -3.408 1.00 0.00 H new ATOM 0 HA ASN A 76 16.749 -6.511 -3.039 1.00 0.00 H new ATOM 0 HB2 ASN A 76 18.097 -4.482 -2.767 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.161 -3.980 -1.372 1.00 0.00 H new ATOM 0 HD21 ASN A 76 19.348 -5.626 0.882 1.00 0.00 H new ATOM 0 HD22 ASN A 76 18.194 -4.324 0.579 1.00 0.00 H new ATOM 1181 N ASN A 77 15.218 -5.564 -0.287 1.00 0.00 N ATOM 1182 CA ASN A 77 14.429 -5.926 0.861 1.00 0.00 C ATOM 1183 C ASN A 77 13.172 -5.078 0.945 1.00 0.00 C ATOM 1184 O ASN A 77 13.103 -3.981 0.384 1.00 0.00 O ATOM 1185 CB ASN A 77 15.249 -5.763 2.125 1.00 0.00 C ATOM 1186 CG ASN A 77 15.750 -4.362 2.388 1.00 0.00 C ATOM 1187 OD1 ASN A 77 16.560 -3.851 1.625 1.00 0.00 O ATOM 1188 ND2 ASN A 77 15.310 -3.749 3.473 1.00 0.00 N ATOM 0 H ASN A 77 15.299 -4.553 -0.399 1.00 0.00 H new ATOM 0 HA ASN A 77 14.132 -6.969 0.757 1.00 0.00 H new ATOM 0 HB2 ASN A 77 14.645 -6.082 2.975 1.00 0.00 H new ATOM 0 HB3 ASN A 77 16.106 -6.435 2.073 1.00 0.00 H new ATOM 0 HD21 ASN A 77 15.646 -2.813 3.702 1.00 0.00 H new ATOM 0 HD22 ASN A 77 14.635 -4.211 4.082 1.00 0.00 H new ATOM 1195 N VAL A 78 12.185 -5.613 1.661 1.00 0.00 N ATOM 1196 CA VAL A 78 10.789 -5.244 1.564 1.00 0.00 C ATOM 1197 C VAL A 78 10.300 -4.994 2.984 1.00 0.00 C ATOM 1198 O VAL A 78 10.076 -5.943 3.738 1.00 0.00 O ATOM 1199 CB VAL A 78 9.997 -6.379 0.867 1.00 0.00 C ATOM 1200 CG1 VAL A 78 8.529 -5.976 0.700 1.00 0.00 C ATOM 1201 CG2 VAL A 78 10.551 -6.788 -0.503 1.00 0.00 C ATOM 0 H VAL A 78 12.352 -6.345 2.351 1.00 0.00 H new ATOM 0 HA VAL A 78 10.645 -4.346 0.964 1.00 0.00 H new ATOM 0 HB VAL A 78 10.099 -7.244 1.523 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.984 -6.782 0.209 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.090 -5.785 1.679 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.466 -5.073 0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 78 9.938 -7.587 -0.920 1.00 0.00 H new ATOM 0 HG22 VAL A 78 10.533 -5.929 -1.174 1.00 0.00 H new ATOM 0 HG23 VAL A 78 11.577 -7.139 -0.391 1.00 0.00 H new ATOM 1211 N GLU A 79 10.210 -3.734 3.390 1.00 0.00 N ATOM 1212 CA GLU A 79 9.894 -3.340 4.751 1.00 0.00 C ATOM 1213 C GLU A 79 8.526 -2.654 4.721 1.00 0.00 C ATOM 1214 O GLU A 79 8.414 -1.431 4.774 1.00 0.00 O ATOM 1215 CB GLU A 79 11.037 -2.477 5.303 1.00 0.00 C ATOM 1216 CG GLU A 79 12.429 -3.110 5.104 1.00 0.00 C ATOM 1217 CD GLU A 79 13.357 -2.983 6.310 1.00 0.00 C ATOM 1218 OE1 GLU A 79 14.254 -3.845 6.434 1.00 0.00 O ATOM 1219 OE2 GLU A 79 13.230 -2.041 7.123 1.00 0.00 O ATOM 0 H GLU A 79 10.359 -2.942 2.765 1.00 0.00 H new ATOM 0 HA GLU A 79 9.816 -4.185 5.435 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.015 -1.502 4.815 1.00 0.00 H new ATOM 0 HB3 GLU A 79 10.872 -2.305 6.367 1.00 0.00 H new ATOM 0 HG2 GLU A 79 12.304 -4.166 4.867 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.907 -2.644 4.242 1.00 0.00 H new ATOM 1227 N VAL A 80 7.467 -3.429 4.489 1.00 0.00 N ATOM 1228 CA VAL A 80 6.103 -2.911 4.489 1.00 0.00 C ATOM 1229 C VAL A 80 5.705 -2.812 5.962 1.00 0.00 C ATOM 1230 O VAL A 80 5.405 -3.827 6.596 1.00 0.00 O ATOM 1231 CB VAL A 80 5.156 -3.811 3.661 1.00 0.00 C ATOM 1232 CG1 VAL A 80 3.768 -3.169 3.534 1.00 0.00 C ATOM 1233 CG2 VAL A 80 5.684 -4.061 2.239 1.00 0.00 C ATOM 0 H VAL A 80 7.532 -4.429 4.297 1.00 0.00 H new ATOM 0 HA VAL A 80 6.033 -1.934 4.010 1.00 0.00 H new ATOM 0 HB VAL A 80 5.098 -4.759 4.196 1.00 0.00 H new ATOM 0 HG11 VAL A 80 3.119 -3.819 2.948 1.00 0.00 H new ATOM 0 HG12 VAL A 80 3.340 -3.028 4.527 1.00 0.00 H new ATOM 0 HG13 VAL A 80 3.858 -2.203 3.037 1.00 0.00 H new ATOM 0 HG21 VAL A 80 4.984 -4.698 1.698 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.787 -3.110 1.717 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.655 -4.553 2.293 1.00 0.00 H new ATOM 1243 N GLU A 81 5.802 -1.625 6.548 1.00 0.00 N ATOM 1244 CA GLU A 81 5.485 -1.400 7.950 1.00 0.00 C ATOM 1245 C GLU A 81 3.956 -1.287 8.079 1.00 0.00 C ATOM 1246 O GLU A 81 3.262 -0.964 7.103 1.00 0.00 O ATOM 1247 CB GLU A 81 6.281 -0.163 8.418 1.00 0.00 C ATOM 1248 CG GLU A 81 6.591 -0.166 9.924 1.00 0.00 C ATOM 1249 CD GLU A 81 7.793 0.719 10.304 1.00 0.00 C ATOM 1250 OE1 GLU A 81 8.493 0.411 11.296 1.00 0.00 O ATOM 1251 OE2 GLU A 81 8.112 1.716 9.617 1.00 0.00 O ATOM 0 H GLU A 81 6.106 -0.784 6.057 1.00 0.00 H new ATOM 0 HA GLU A 81 5.781 -2.219 8.606 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.218 -0.112 7.863 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.716 0.736 8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.711 0.176 10.469 1.00 0.00 H new ATOM 0 HG3 GLU A 81 6.787 -1.189 10.245 1.00 0.00 H new ATOM 1259 N LEU A 82 3.406 -1.595 9.258 1.00 0.00 N ATOM 1260 CA LEU A 82 1.963 -1.665 9.480 1.00 0.00 C ATOM 1261 C LEU A 82 1.589 -0.823 10.685 1.00 0.00 C ATOM 1262 O LEU A 82 1.457 -1.310 11.811 1.00 0.00 O ATOM 1263 CB LEU A 82 1.483 -3.120 9.573 1.00 0.00 C ATOM 1264 CG LEU A 82 -0.011 -3.282 9.896 1.00 0.00 C ATOM 1265 CD1 LEU A 82 -0.935 -2.264 9.211 1.00 0.00 C ATOM 1266 CD2 LEU A 82 -0.438 -4.692 9.498 1.00 0.00 C ATOM 0 H LEU A 82 3.957 -1.804 10.091 1.00 0.00 H new ATOM 0 HA LEU A 82 1.440 -1.244 8.621 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.693 -3.619 8.627 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.065 -3.632 10.339 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.117 -3.100 10.966 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.968 -2.458 9.500 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.656 -1.256 9.517 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.837 -2.354 8.129 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.497 -4.828 9.719 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -0.269 -4.836 8.431 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.146 -5.421 10.059 1.00 0.00 H new ATOM 1278 N THR A 83 1.371 0.453 10.411 1.00 0.00 N ATOM 1279 CA THR A 83 1.164 1.446 11.436 1.00 0.00 C ATOM 1280 C THR A 83 -0.277 1.342 11.931 1.00 0.00 C ATOM 1281 O THR A 83 -1.209 1.665 11.187 1.00 0.00 O ATOM 1282 CB THR A 83 1.468 2.851 10.874 1.00 0.00 C ATOM 1283 OG1 THR A 83 2.340 2.901 9.757 1.00 0.00 O ATOM 1284 CG2 THR A 83 2.102 3.662 11.990 1.00 0.00 C ATOM 0 H THR A 83 1.334 0.825 9.462 1.00 0.00 H new ATOM 0 HA THR A 83 1.838 1.274 12.275 1.00 0.00 H new ATOM 0 HB THR A 83 0.514 3.240 10.518 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.864 2.597 8.956 1.00 0.00 H new ATOM 0 HG21 THR A 83 2.331 4.664 11.627 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.410 3.729 12.829 1.00 0.00 H new ATOM 0 HG23 THR A 83 3.021 3.176 12.316 1.00 0.00 H new ATOM 1292 N PHE A 84 -0.491 0.891 13.170 1.00 0.00 N ATOM 1293 CA PHE A 84 -1.840 0.686 13.705 1.00 0.00 C ATOM 1294 C PHE A 84 -2.154 1.595 14.888 1.00 0.00 C ATOM 1295 O PHE A 84 -3.297 1.633 15.349 1.00 0.00 O ATOM 1296 CB PHE A 84 -2.064 -0.797 14.035 1.00 0.00 C ATOM 1297 CG PHE A 84 -3.044 -1.474 13.096 1.00 0.00 C ATOM 1298 CD1 PHE A 84 -4.368 -1.009 12.964 1.00 0.00 C ATOM 1299 CD2 PHE A 84 -2.618 -2.575 12.338 1.00 0.00 C ATOM 1300 CE1 PHE A 84 -5.243 -1.629 12.058 1.00 0.00 C ATOM 1301 CE2 PHE A 84 -3.491 -3.199 11.435 1.00 0.00 C ATOM 1302 CZ PHE A 84 -4.808 -2.728 11.299 1.00 0.00 C ATOM 0 H PHE A 84 0.257 0.660 13.824 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.547 0.972 12.926 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -1.109 -1.321 13.993 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.431 -0.884 15.058 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.709 -0.176 13.560 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.610 -2.945 12.451 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.252 -1.261 11.944 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.152 -4.039 10.846 1.00 0.00 H new ATOM 0 HZ PHE A 84 -5.486 -3.211 10.611 1.00 0.00 H new ATOM 1312 N ASP A 85 -1.171 2.358 15.361 1.00 0.00 N ATOM 1313 CA ASP A 85 -1.394 3.397 16.358 1.00 0.00 C ATOM 1314 C ASP A 85 -2.157 4.549 15.718 1.00 0.00 C ATOM 1315 O ASP A 85 -3.201 4.908 16.257 1.00 0.00 O ATOM 1316 CB ASP A 85 -0.107 3.930 17.009 1.00 0.00 C ATOM 1317 CG ASP A 85 1.062 2.965 16.889 1.00 0.00 C ATOM 1318 OD1 ASP A 85 1.125 2.008 17.691 1.00 0.00 O ATOM 1319 OD2 ASP A 85 1.813 3.078 15.895 1.00 0.00 O ATOM 0 H ASP A 85 -0.199 2.272 15.063 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.970 2.937 17.161 1.00 0.00 H new ATOM 0 HB2 ASP A 85 0.163 4.879 16.545 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -0.297 4.133 18.063 1.00 0.00 H new ATOM 1325 N PRO A 86 -1.691 5.160 14.608 1.00 0.00 N ATOM 1326 CA PRO A 86 -2.387 6.289 14.033 1.00 0.00 C ATOM 1327 C PRO A 86 -3.729 5.878 13.432 1.00 0.00 C ATOM 1328 O PRO A 86 -3.910 4.730 12.997 1.00 0.00 O ATOM 1329 CB PRO A 86 -1.479 6.889 12.955 1.00 0.00 C ATOM 1330 CG PRO A 86 -0.112 6.293 13.259 1.00 0.00 C ATOM 1331 CD PRO A 86 -0.465 4.938 13.865 1.00 0.00 C ATOM 0 HA PRO A 86 -2.604 7.021 14.811 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -1.818 6.623 11.954 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.461 7.978 13.007 1.00 0.00 H new ATOM 0 HG2 PRO A 86 0.494 6.189 12.359 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.454 6.913 13.954 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.606 4.185 13.090 1.00 0.00 H new ATOM 0 HD3 PRO A 86 0.331 4.579 14.517 1.00 0.00 H new ATOM 1339 N PRO A 87 -4.646 6.843 13.319 1.00 0.00 N ATOM 1340 CA PRO A 87 -5.782 6.764 12.422 1.00 0.00 C ATOM 1341 C PRO A 87 -5.340 6.551 10.970 1.00 0.00 C ATOM 1342 O PRO A 87 -4.171 6.724 10.618 1.00 0.00 O ATOM 1343 CB PRO A 87 -6.531 8.091 12.604 1.00 0.00 C ATOM 1344 CG PRO A 87 -5.997 8.680 13.911 1.00 0.00 C ATOM 1345 CD PRO A 87 -4.581 8.132 13.980 1.00 0.00 C ATOM 0 HA PRO A 87 -6.420 5.911 12.652 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -6.349 8.764 11.766 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -7.608 7.931 12.656 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.008 9.770 13.897 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.593 8.367 14.768 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -3.876 8.797 13.481 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -4.247 8.030 15.013 1.00 0.00 H new ATOM 1353 N TRP A 88 -6.296 6.222 10.105 1.00 0.00 N ATOM 1354 CA TRP A 88 -6.170 6.275 8.656 1.00 0.00 C ATOM 1355 C TRP A 88 -7.112 7.392 8.209 1.00 0.00 C ATOM 1356 O TRP A 88 -6.743 8.554 8.390 1.00 0.00 O ATOM 1357 CB TRP A 88 -6.355 4.869 8.061 1.00 0.00 C ATOM 1358 CG TRP A 88 -6.699 4.791 6.608 1.00 0.00 C ATOM 1359 CD1 TRP A 88 -5.951 5.198 5.555 1.00 0.00 C ATOM 1360 CD2 TRP A 88 -7.958 4.334 6.050 1.00 0.00 C ATOM 1361 NE1 TRP A 88 -6.680 5.034 4.389 1.00 0.00 N ATOM 1362 CE2 TRP A 88 -7.938 4.535 4.644 1.00 0.00 C ATOM 1363 CE3 TRP A 88 -9.141 3.824 6.621 1.00 0.00 C ATOM 1364 CZ2 TRP A 88 -9.057 4.275 3.844 1.00 0.00 C ATOM 1365 CZ3 TRP A 88 -10.263 3.548 5.825 1.00 0.00 C ATOM 1366 CH2 TRP A 88 -10.223 3.791 4.442 1.00 0.00 C ATOM 0 H TRP A 88 -7.214 5.899 10.409 1.00 0.00 H new ATOM 0 HA TRP A 88 -5.183 6.538 8.277 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -5.434 4.308 8.223 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -7.140 4.363 8.623 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.946 5.588 5.615 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -6.329 5.255 3.457 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -9.185 3.643 7.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.019 4.446 2.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -11.159 3.148 6.276 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -11.098 3.603 3.838 1.00 0.00 H new ATOM 1377 N THR A 89 -8.311 7.065 7.711 1.00 0.00 N ATOM 1378 CA THR A 89 -9.537 7.860 7.546 1.00 0.00 C ATOM 1379 C THR A 89 -10.390 7.178 6.448 1.00 0.00 C ATOM 1380 O THR A 89 -9.887 7.013 5.337 1.00 0.00 O ATOM 1381 CB THR A 89 -9.260 9.357 7.267 1.00 0.00 C ATOM 1382 OG1 THR A 89 -8.885 10.036 8.453 1.00 0.00 O ATOM 1383 CG2 THR A 89 -10.470 10.108 6.753 1.00 0.00 C ATOM 0 H THR A 89 -8.464 6.116 7.371 1.00 0.00 H new ATOM 0 HA THR A 89 -10.094 7.877 8.483 1.00 0.00 H new ATOM 0 HB THR A 89 -8.470 9.348 6.516 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.027 9.687 8.772 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.204 11.151 6.579 1.00 0.00 H new ATOM 0 HG22 THR A 89 -10.807 9.659 5.819 1.00 0.00 H new ATOM 0 HG23 THR A 89 -11.271 10.056 7.491 1.00 0.00 H new ATOM 1391 N PRO A 90 -11.673 6.833 6.656 1.00 0.00 N ATOM 1392 CA PRO A 90 -12.497 6.205 5.610 1.00 0.00 C ATOM 1393 C PRO A 90 -12.753 7.114 4.403 1.00 0.00 C ATOM 1394 O PRO A 90 -12.927 6.645 3.277 1.00 0.00 O ATOM 1395 CB PRO A 90 -13.797 5.807 6.306 1.00 0.00 C ATOM 1396 CG PRO A 90 -13.901 6.775 7.486 1.00 0.00 C ATOM 1397 CD PRO A 90 -12.442 7.008 7.879 1.00 0.00 C ATOM 0 HA PRO A 90 -11.979 5.347 5.182 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.652 5.901 5.637 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.768 4.771 6.642 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -14.394 7.704 7.202 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.476 6.347 8.308 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.302 8.008 8.290 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -12.125 6.301 8.646 1.00 0.00 H new ATOM 1405 N GLU A 91 -12.700 8.424 4.617 1.00 0.00 N ATOM 1406 CA GLU A 91 -12.858 9.474 3.611 1.00 0.00 C ATOM 1407 C GLU A 91 -11.726 9.403 2.594 1.00 0.00 C ATOM 1408 O GLU A 91 -11.844 10.005 1.526 1.00 0.00 O ATOM 1409 CB GLU A 91 -12.842 10.898 4.228 1.00 0.00 C ATOM 1410 CG GLU A 91 -13.450 10.970 5.631 1.00 0.00 C ATOM 1411 CD GLU A 91 -13.120 12.223 6.443 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -13.303 12.166 7.681 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -12.761 13.286 5.890 1.00 0.00 O ATOM 0 H GLU A 91 -12.537 8.806 5.549 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.826 9.302 3.141 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -11.813 11.254 4.269 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -13.388 11.575 3.571 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.534 10.896 5.540 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -13.117 10.098 6.194 1.00 0.00 H new ATOM 1421 N ARG A 92 -10.625 8.694 2.902 1.00 0.00 N ATOM 1422 CA ARG A 92 -9.453 8.768 2.055 1.00 0.00 C ATOM 1423 C ARG A 92 -9.761 8.256 0.647 1.00 0.00 C ATOM 1424 O ARG A 92 -9.168 8.734 -0.323 1.00 0.00 O ATOM 1425 CB ARG A 92 -8.263 7.961 2.601 1.00 0.00 C ATOM 1426 CG ARG A 92 -7.522 8.611 3.777 1.00 0.00 C ATOM 1427 CD ARG A 92 -6.002 8.441 3.668 1.00 0.00 C ATOM 1428 NE ARG A 92 -5.248 9.578 4.215 1.00 0.00 N ATOM 1429 CZ ARG A 92 -3.920 9.733 4.101 1.00 0.00 C ATOM 1430 NH1 ARG A 92 -3.139 8.755 3.656 1.00 0.00 N ATOM 1431 NH2 ARG A 92 -3.373 10.896 4.420 1.00 0.00 N ATOM 0 H ARG A 92 -10.536 8.082 3.713 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.178 9.823 2.032 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.622 6.981 2.915 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.553 7.796 1.791 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.765 9.673 3.816 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.869 8.170 4.711 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -5.707 7.532 4.193 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -5.733 8.306 2.620 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.770 10.298 4.715 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -3.546 7.858 3.391 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -2.132 8.901 3.580 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -3.960 11.663 4.749 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -2.365 11.025 4.337 1.00 0.00 H new ATOM 1445 N MET A 93 -10.657 7.275 0.555 1.00 0.00 N ATOM 1446 CA MET A 93 -11.072 6.602 -0.667 1.00 0.00 C ATOM 1447 C MET A 93 -11.606 7.573 -1.726 1.00 0.00 C ATOM 1448 O MET A 93 -11.963 8.717 -1.439 1.00 0.00 O ATOM 1449 CB MET A 93 -12.169 5.583 -0.324 1.00 0.00 C ATOM 1450 CG MET A 93 -11.678 4.449 0.571 1.00 0.00 C ATOM 1451 SD MET A 93 -12.843 3.061 0.698 1.00 0.00 S ATOM 1452 CE MET A 93 -14.203 3.831 1.618 1.00 0.00 C ATOM 0 H MET A 93 -11.137 6.911 1.378 1.00 0.00 H new ATOM 0 HA MET A 93 -10.193 6.113 -1.087 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.992 6.098 0.172 1.00 0.00 H new ATOM 0 HB3 MET A 93 -12.566 5.162 -1.248 1.00 0.00 H new ATOM 0 HG2 MET A 93 -10.728 4.080 0.186 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.486 4.843 1.569 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.393 3.264 2.529 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.933 4.855 1.877 1.00 0.00 H new ATOM 0 HE3 MET A 93 -15.102 3.838 1.001 1.00 0.00 H new ATOM 1462 N SER A 94 -11.727 7.071 -2.958 1.00 0.00 N ATOM 1463 CA SER A 94 -12.364 7.742 -4.083 1.00 0.00 C ATOM 1464 C SER A 94 -13.775 8.215 -3.720 1.00 0.00 C ATOM 1465 O SER A 94 -14.440 7.575 -2.898 1.00 0.00 O ATOM 1466 CB SER A 94 -12.389 6.770 -5.264 1.00 0.00 C ATOM 1467 OG SER A 94 -11.109 6.163 -5.411 1.00 0.00 O ATOM 0 H SER A 94 -11.368 6.149 -3.204 1.00 0.00 H new ATOM 0 HA SER A 94 -11.798 8.634 -4.352 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.149 6.005 -5.102 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.659 7.299 -6.178 1.00 0.00 H new ATOM 0 HG SER A 94 -11.127 5.539 -6.167 1.00 0.00 H new ATOM 1473 N PRO A 95 -14.269 9.289 -4.353 1.00 0.00 N ATOM 1474 CA PRO A 95 -15.528 9.907 -3.962 1.00 0.00 C ATOM 1475 C PRO A 95 -16.703 8.957 -4.202 1.00 0.00 C ATOM 1476 O PRO A 95 -17.652 8.924 -3.420 1.00 0.00 O ATOM 1477 CB PRO A 95 -15.610 11.186 -4.796 1.00 0.00 C ATOM 1478 CG PRO A 95 -14.790 10.873 -6.042 1.00 0.00 C ATOM 1479 CD PRO A 95 -13.666 10.021 -5.462 1.00 0.00 C ATOM 0 HA PRO A 95 -15.575 10.136 -2.897 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -16.642 11.431 -5.049 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -15.203 12.041 -4.256 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -15.370 10.332 -6.790 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -14.414 11.776 -6.523 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -13.264 9.339 -6.211 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -12.839 10.642 -5.119 1.00 0.00 H new ATOM 1487 N GLU A 96 -16.603 8.119 -5.231 1.00 0.00 N ATOM 1488 CA GLU A 96 -17.587 7.120 -5.563 1.00 0.00 C ATOM 1489 C GLU A 96 -17.638 6.024 -4.505 1.00 0.00 C ATOM 1490 O GLU A 96 -18.704 5.479 -4.235 1.00 0.00 O ATOM 1491 CB GLU A 96 -17.277 6.587 -6.962 1.00 0.00 C ATOM 1492 CG GLU A 96 -15.848 6.069 -7.146 1.00 0.00 C ATOM 1493 CD GLU A 96 -15.590 5.615 -8.583 1.00 0.00 C ATOM 1494 OE1 GLU A 96 -15.085 4.481 -8.774 1.00 0.00 O ATOM 1495 OE2 GLU A 96 -15.839 6.398 -9.528 1.00 0.00 O ATOM 0 H GLU A 96 -15.807 8.125 -5.869 1.00 0.00 H new ATOM 0 HA GLU A 96 -18.585 7.558 -5.574 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -17.974 5.781 -7.192 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -17.458 7.381 -7.687 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -15.140 6.854 -6.880 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -15.672 5.237 -6.465 1.00 0.00 H new ATOM 1503 N LEU A 97 -16.517 5.735 -3.838 1.00 0.00 N ATOM 1504 CA LEU A 97 -16.516 4.775 -2.750 1.00 0.00 C ATOM 1505 C LEU A 97 -17.052 5.393 -1.476 1.00 0.00 C ATOM 1506 O LEU A 97 -17.699 4.681 -0.718 1.00 0.00 O ATOM 1507 CB LEU A 97 -15.131 4.196 -2.497 1.00 0.00 C ATOM 1508 CG LEU A 97 -14.633 3.294 -3.633 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -13.258 2.791 -3.202 1.00 0.00 C ATOM 1510 CD2 LEU A 97 -15.571 2.136 -3.988 1.00 0.00 C ATOM 0 H LEU A 97 -15.608 6.153 -4.037 1.00 0.00 H new ATOM 0 HA LEU A 97 -17.172 3.960 -3.055 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -14.424 5.013 -2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -15.148 3.624 -1.569 1.00 0.00 H new ATOM 0 HG LEU A 97 -14.591 3.874 -4.555 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -12.850 2.140 -3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -12.590 3.640 -3.053 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -13.350 2.234 -2.270 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -15.138 1.553 -4.800 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -15.707 1.497 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -16.537 2.533 -4.301 1.00 0.00 H new ATOM 1522 N ARG A 98 -16.843 6.688 -1.230 1.00 0.00 N ATOM 1523 CA ARG A 98 -17.504 7.327 -0.092 1.00 0.00 C ATOM 1524 C ARG A 98 -19.021 7.189 -0.242 1.00 0.00 C ATOM 1525 O ARG A 98 -19.697 6.864 0.729 1.00 0.00 O ATOM 1526 CB ARG A 98 -17.083 8.790 0.068 1.00 0.00 C ATOM 1527 CG ARG A 98 -15.593 8.956 0.424 1.00 0.00 C ATOM 1528 CD ARG A 98 -15.152 10.427 0.439 1.00 0.00 C ATOM 1529 NE ARG A 98 -15.729 11.205 1.555 1.00 0.00 N ATOM 1530 CZ ARG A 98 -16.897 11.860 1.561 1.00 0.00 C ATOM 1531 NH1 ARG A 98 -17.700 11.865 0.505 1.00 0.00 N ATOM 1532 NH2 ARG A 98 -17.262 12.554 2.625 1.00 0.00 N ATOM 0 H ARG A 98 -16.241 7.298 -1.784 1.00 0.00 H new ATOM 0 HA ARG A 98 -17.191 6.820 0.821 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -17.290 9.325 -0.859 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -17.690 9.253 0.846 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -15.405 8.514 1.402 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -14.987 8.406 -0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -14.065 10.471 0.500 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -15.438 10.893 -0.504 1.00 0.00 H new ATOM 0 HE ARG A 98 -15.179 11.248 2.413 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -17.434 11.361 -0.341 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -18.584 12.373 0.539 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -16.654 12.591 3.443 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -18.152 13.052 2.628 1.00 0.00 H new ATOM 1546 N GLU A 99 -19.538 7.354 -1.459 1.00 0.00 N ATOM 1547 CA GLU A 99 -20.939 7.158 -1.785 1.00 0.00 C ATOM 1548 C GLU A 99 -21.342 5.678 -1.640 1.00 0.00 C ATOM 1549 O GLU A 99 -22.304 5.360 -0.944 1.00 0.00 O ATOM 1550 CB GLU A 99 -21.147 7.715 -3.206 1.00 0.00 C ATOM 1551 CG GLU A 99 -22.494 8.412 -3.384 1.00 0.00 C ATOM 1552 CD GLU A 99 -23.652 7.425 -3.475 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -24.402 7.288 -2.484 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -23.811 6.761 -4.522 1.00 0.00 O ATOM 0 H GLU A 99 -18.975 7.635 -2.262 1.00 0.00 H new ATOM 0 HA GLU A 99 -21.591 7.690 -1.092 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -20.347 8.419 -3.435 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.069 6.899 -3.925 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -22.663 9.090 -2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -22.468 9.022 -4.287 1.00 0.00 H new ATOM 1562 N LYS A 100 -20.603 4.749 -2.259 1.00 0.00 N ATOM 1563 CA LYS A 100 -20.905 3.313 -2.269 1.00 0.00 C ATOM 1564 C LYS A 100 -20.861 2.686 -0.883 1.00 0.00 C ATOM 1565 O LYS A 100 -21.747 1.898 -0.554 1.00 0.00 O ATOM 1566 CB LYS A 100 -19.964 2.619 -3.261 1.00 0.00 C ATOM 1567 CG LYS A 100 -19.969 1.079 -3.267 1.00 0.00 C ATOM 1568 CD LYS A 100 -18.948 0.445 -2.301 1.00 0.00 C ATOM 1569 CE LYS A 100 -18.506 -0.908 -2.862 1.00 0.00 C ATOM 1570 NZ LYS A 100 -17.577 -1.658 -1.988 1.00 0.00 N ATOM 0 H LYS A 100 -19.757 4.981 -2.780 1.00 0.00 H new ATOM 0 HA LYS A 100 -21.935 3.175 -2.598 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -20.216 2.963 -4.264 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -18.947 2.954 -3.055 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -20.967 0.728 -3.006 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -19.763 0.729 -4.278 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -18.087 1.102 -2.179 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -19.393 0.316 -1.314 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -19.390 -1.520 -3.042 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -18.027 -0.748 -3.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -16.939 -2.234 -2.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -17.017 -0.989 -1.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -18.121 -2.278 -1.355 1.00 0.00 H new ATOM 1584 N PHE A 101 -19.824 2.959 -0.095 1.00 0.00 N ATOM 1585 CA PHE A 101 -19.799 2.539 1.299 1.00 0.00 C ATOM 1586 C PHE A 101 -20.865 3.315 2.083 1.00 0.00 C ATOM 1587 O PHE A 101 -21.443 2.766 3.022 1.00 0.00 O ATOM 1588 CB PHE A 101 -18.400 2.729 1.902 1.00 0.00 C ATOM 1589 CG PHE A 101 -17.351 1.712 1.470 1.00 0.00 C ATOM 1590 CD1 PHE A 101 -16.861 1.676 0.148 1.00 0.00 C ATOM 1591 CD2 PHE A 101 -16.812 0.820 2.414 1.00 0.00 C ATOM 1592 CE1 PHE A 101 -15.848 0.770 -0.215 1.00 0.00 C ATOM 1593 CE2 PHE A 101 -15.779 -0.059 2.056 1.00 0.00 C ATOM 1594 CZ PHE A 101 -15.306 -0.101 0.739 1.00 0.00 C ATOM 0 H PHE A 101 -18.994 3.468 -0.399 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.030 1.476 1.361 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.044 3.725 1.640 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -18.485 2.697 2.988 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -17.267 2.350 -0.592 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -17.197 0.812 3.423 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -15.487 0.746 -1.233 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -15.345 -0.708 2.802 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.530 -0.799 0.461 1.00 0.00 H new ATOM 1604 N GLY A 102 -21.176 4.550 1.678 1.00 0.00 N ATOM 1605 CA GLY A 102 -22.129 5.424 2.335 1.00 0.00 C ATOM 1606 C GLY A 102 -21.528 5.820 3.664 1.00 0.00 C ATOM 1607 O GLY A 102 -21.945 5.305 4.705 1.00 0.00 O ATOM 0 H GLY A 102 -20.751 4.975 0.854 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.328 6.305 1.725 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -23.082 4.915 2.480 1.00 0.00 H new ATOM 1611 N VAL A 103 -20.460 6.612 3.593 1.00 0.00 N ATOM 1612 CA VAL A 103 -19.625 7.007 4.714 1.00 0.00 C ATOM 1613 C VAL A 103 -20.341 8.142 5.428 1.00 0.00 C ATOM 1614 O VAL A 103 -20.810 7.933 6.569 1.00 0.00 O ATOM 1615 CB VAL A 103 -18.215 7.368 4.185 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -17.263 7.756 5.318 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -17.557 6.195 3.436 1.00 0.00 C ATOM 0 H VAL A 103 -20.143 7.011 2.710 1.00 0.00 H new ATOM 0 HA VAL A 103 -19.472 6.209 5.440 1.00 0.00 H new ATOM 0 HB VAL A 103 -18.373 8.209 3.510 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.285 8.002 4.904 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -17.661 8.622 5.847 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -17.164 6.921 6.012 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -16.570 6.496 3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.458 5.343 4.109 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.176 5.914 2.584 1.00 0.00 H new TER 1627 VAL A 103