USER MOD reduce.3.24.130724 H: found=0, std=0, add=1384, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1382 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 19 HIS : no HD1:sc= -0.978 K(o=-1.1,f=-5.4!) USER MOD Set 1.2: A 96 THR OG1 : rot -106:sc= -0.0974 USER MOD Set 2.1: A 16 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-6.4!) USER MOD Set 2.2: A 95 GLN :FLIP amide:sc= 0 F(o=-2.8,f=-2.3) USER MOD Set 3.1: A 12 THR OG1 : rot 100:sc= -0.0352 USER MOD Set 3.2: A 71 MET CE :methyl 166:sc= -0.212 (180deg=-0.739) USER MOD Set 4.1: A 31 SER OG : rot -130:sc= 0.944 USER MOD Set 4.2: A 155 LYS NZ :NH3+ -170:sc= 1.84 (180deg=0.323) USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.0745 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl -170:sc= -0.0168 (180deg=-0.182) USER MOD Single : A 14 MET CE :methyl 175:sc= 0 (180deg=-0.0646) USER MOD Single : A 21 LYS NZ :NH3+ -167:sc= 1.31 (180deg=0.961) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0168 USER MOD Single : A 30 HIS : no HD1:sc= -0.247 K(o=-0.25,f=-1) USER MOD Single : A 32 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.107) USER MOD Single : A 34 THR OG1 : rot -68:sc= 0.777 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 44 HIS :FLIP no HD1:sc= -0.225 F(o=-2.4!,f=-0.22) USER MOD Single : A 48 TYR OH : rot 75:sc= -1.6 USER MOD Single : A 49 GLN :FLIP amide:sc= 0.204 F(o=-1.7!,f=0.2) USER MOD Single : A 51 THR OG1 : rot 5:sc= 0.956 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 1.19 (180deg=1.19) USER MOD Single : A 56 LYS NZ :NH3+ -173:sc= 2.41 (180deg=2.3) USER MOD Single : A 58 THR OG1 : rot -20:sc= -1.04 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 69 THR OG1 : rot 94:sc= 1.29 USER MOD Single : A 70 THR OG1 : rot 22:sc= 0.524 USER MOD Single : A 77 GLN : amide:sc= -1.44 K(o=-1.4,f=-4.6!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl 150:sc= -0.472 (180deg=-1.64!) USER MOD Single : A 101 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 102 HIS : no HE2:sc= -0.0267 K(o=-0.027,f=-6.3!) USER MOD Single : A 104 LYS NZ :NH3+ -146:sc= 1.24 (180deg=0.084) USER MOD Single : A 107 ASN : amide:sc= -0.0171 X(o=-0.017,f=-0.0058) USER MOD Single : A 115 ASN : amide:sc= -0.601 K(o=-0.6,f=-3.8!) USER MOD Single : A 116 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0603) USER MOD Single : A 117 MET CE :methyl 143:sc= -0.539 (180deg=-3.05) USER MOD Single : A 119 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00678) USER MOD Single : A 123 ASN : amide:sc= -0.729! C(o=-0.73!,f=-2.3!) USER MOD Single : A 128 MET CE :methyl -154:sc= -4.57! (180deg=-5.67!) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 132 MET CE :methyl 157:sc= -1.88! (180deg=-4.9!) USER MOD Single : A 134 TYR OH : rot 130:sc= -0.142 USER MOD Single : A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 THR OG1 : rot -50:sc= -2.38 USER MOD Single : A 148 CYS SG : rot 120:sc= -0.605 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 SER OG : rot 120:sc= 0.968 USER MOD Single : A 153 LYS NZ :NH3+ -177:sc= 1.29 (180deg=1.22) USER MOD Single : A 154 THR OG1 : rot 180:sc= -1.91! USER MOD Single : A 160 HIS : no HD1:sc= -0.0136 X(o=-0.014,f=-0.12) USER MOD Single : A 164 MET CE :methyl -130:sc= -3.89! (180deg=-5.33!) USER MOD Single : A 169 SER OG : rot 77:sc= 1.3 USER MOD Single : A 171 MET CE :methyl 148:sc= -3.34! (180deg=-6.31!) USER MOD Single : A 175 LYS NZ :NH3+ -169:sc= -0.0546 (180deg=-0.267) USER MOD Single : A 177 ASN : amide:sc= 0 K(o=0,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -30.384 18.156 -18.265 1.00 16.35 N ATOM 2 CA GLY A 1 -30.705 17.147 -19.301 1.00 15.80 C ATOM 3 C GLY A 1 -30.197 15.774 -18.926 1.00 15.04 C ATOM 4 O GLY A 1 -29.959 15.499 -17.750 1.00 14.90 O ATOM 0 H1 GLY A 1 -31.257 18.632 -17.962 1.00 16.35 H new ATOM 0 H2 GLY A 1 -29.944 17.687 -17.448 1.00 16.35 H new ATOM 0 H3 GLY A 1 -29.725 18.858 -18.657 1.00 16.35 H new ATOM 0 HA2 GLY A 1 -31.784 17.107 -19.447 1.00 15.80 H new ATOM 0 HA3 GLY A 1 -30.265 17.450 -20.251 1.00 15.80 H new ATOM 10 N SER A 2 -30.016 14.916 -19.918 1.00 14.69 N ATOM 11 CA SER A 2 -29.571 13.553 -19.675 1.00 14.11 C ATOM 12 C SER A 2 -28.067 13.487 -19.395 1.00 13.37 C ATOM 13 O SER A 2 -27.290 12.951 -20.188 1.00 13.12 O ATOM 14 CB SER A 2 -29.936 12.663 -20.862 1.00 14.38 C ATOM 15 OG SER A 2 -31.344 12.583 -21.019 1.00 14.60 O ATOM 0 H SER A 2 -30.171 15.140 -20.901 1.00 14.69 H new ATOM 0 HA SER A 2 -30.083 13.188 -18.784 1.00 14.11 H new ATOM 0 HB2 SER A 2 -29.486 13.061 -21.772 1.00 14.38 H new ATOM 0 HB3 SER A 2 -29.525 11.664 -20.713 1.00 14.38 H new ATOM 0 HG SER A 2 -31.556 12.010 -21.785 1.00 14.60 H new ATOM 21 N HIS A 3 -27.669 14.052 -18.263 1.00 13.19 N ATOM 22 CA HIS A 3 -26.309 13.919 -17.755 1.00 12.67 C ATOM 23 C HIS A 3 -26.369 13.298 -16.370 1.00 11.99 C ATOM 24 O HIS A 3 -26.125 13.967 -15.366 1.00 12.05 O ATOM 25 CB HIS A 3 -25.591 15.273 -17.685 1.00 13.18 C ATOM 26 CG HIS A 3 -25.112 15.783 -19.008 1.00 13.68 C ATOM 27 ND1 HIS A 3 -23.811 15.638 -19.445 1.00 14.14 N ATOM 28 CD2 HIS A 3 -25.760 16.457 -19.984 1.00 13.99 C ATOM 29 CE1 HIS A 3 -23.685 16.201 -20.631 1.00 14.68 C ATOM 30 NE2 HIS A 3 -24.851 16.704 -20.980 1.00 14.60 N ATOM 0 H HIS A 3 -28.279 14.615 -17.671 1.00 13.19 H new ATOM 0 HA HIS A 3 -25.743 13.285 -18.438 1.00 12.67 H new ATOM 0 HB2 HIS A 3 -26.267 16.008 -17.248 1.00 13.18 H new ATOM 0 HB3 HIS A 3 -24.738 15.185 -17.012 1.00 13.18 H new ATOM 0 HD2 HIS A 3 -26.800 16.747 -19.980 1.00 13.99 H new ATOM 0 HE1 HIS A 3 -22.779 16.243 -21.217 1.00 14.68 H new ATOM 0 HE2 HIS A 3 -25.046 17.198 -21.851 1.00 14.60 H new ATOM 39 N MET A 4 -26.701 12.018 -16.321 1.00 11.52 N ATOM 40 CA MET A 4 -26.969 11.350 -15.059 1.00 11.00 C ATOM 41 C MET A 4 -25.677 10.843 -14.436 1.00 10.19 C ATOM 42 O MET A 4 -25.435 9.638 -14.363 1.00 10.08 O ATOM 43 CB MET A 4 -27.950 10.188 -15.255 1.00 11.26 C ATOM 44 CG MET A 4 -29.220 10.573 -16.000 1.00 11.60 C ATOM 45 SD MET A 4 -30.060 12.010 -15.295 1.00 12.31 S ATOM 46 CE MET A 4 -30.393 11.442 -13.629 1.00 12.73 C ATOM 0 H MET A 4 -26.791 11.420 -17.143 1.00 11.52 H new ATOM 0 HA MET A 4 -27.422 12.076 -14.384 1.00 11.00 H new ATOM 0 HB2 MET A 4 -27.448 9.389 -15.801 1.00 11.26 H new ATOM 0 HB3 MET A 4 -28.221 9.785 -14.279 1.00 11.26 H new ATOM 0 HG2 MET A 4 -28.973 10.781 -17.041 1.00 11.60 H new ATOM 0 HG3 MET A 4 -29.904 9.725 -15.998 1.00 11.60 H new ATOM 0 HE1 MET A 4 -31.060 12.146 -13.131 1.00 12.73 H new ATOM 0 HE2 MET A 4 -30.865 10.460 -13.667 1.00 12.73 H new ATOM 0 HE3 MET A 4 -29.457 11.374 -13.074 1.00 12.73 H new ATOM 56 N VAL A 5 -24.852 11.773 -13.976 1.00 9.82 N ATOM 57 CA VAL A 5 -23.573 11.433 -13.360 1.00 9.21 C ATOM 58 C VAL A 5 -23.754 11.042 -11.891 1.00 8.39 C ATOM 59 O VAL A 5 -22.901 11.325 -11.047 1.00 8.39 O ATOM 60 CB VAL A 5 -22.565 12.598 -13.470 1.00 9.62 C ATOM 61 CG1 VAL A 5 -22.170 12.825 -14.922 1.00 10.18 C ATOM 62 CG2 VAL A 5 -23.135 13.876 -12.867 1.00 10.12 C ATOM 0 H VAL A 5 -25.045 12.774 -14.017 1.00 9.82 H new ATOM 0 HA VAL A 5 -23.174 10.578 -13.905 1.00 9.21 H new ATOM 0 HB VAL A 5 -21.674 12.327 -12.904 1.00 9.62 H new ATOM 0 HG11 VAL A 5 -21.459 13.649 -14.981 1.00 10.18 H new ATOM 0 HG12 VAL A 5 -21.710 11.920 -15.320 1.00 10.18 H new ATOM 0 HG13 VAL A 5 -23.057 13.068 -15.507 1.00 10.18 H new ATOM 0 HG21 VAL A 5 -22.404 14.679 -12.959 1.00 10.12 H new ATOM 0 HG22 VAL A 5 -24.047 14.153 -13.397 1.00 10.12 H new ATOM 0 HG23 VAL A 5 -23.363 13.711 -11.814 1.00 10.12 H new ATOM 72 N GLU A 6 -24.866 10.377 -11.604 1.00 7.91 N ATOM 73 CA GLU A 6 -25.187 9.941 -10.251 1.00 7.32 C ATOM 74 C GLU A 6 -24.200 8.884 -9.781 1.00 6.47 C ATOM 75 O GLU A 6 -23.699 8.941 -8.658 1.00 6.49 O ATOM 76 CB GLU A 6 -26.597 9.354 -10.199 1.00 7.80 C ATOM 77 CG GLU A 6 -27.686 10.282 -10.707 1.00 8.31 C ATOM 78 CD GLU A 6 -29.055 9.635 -10.639 1.00 8.82 C ATOM 79 OE1 GLU A 6 -29.447 8.962 -11.615 1.00 9.12 O ATOM 80 OE2 GLU A 6 -29.759 9.828 -9.626 1.00 9.14 O ATOM 0 H GLU A 6 -25.568 10.125 -12.300 1.00 7.91 H new ATOM 0 HA GLU A 6 -25.127 10.812 -9.598 1.00 7.32 H new ATOM 0 HB2 GLU A 6 -26.616 8.436 -10.787 1.00 7.80 H new ATOM 0 HB3 GLU A 6 -26.824 9.078 -9.169 1.00 7.80 H new ATOM 0 HG2 GLU A 6 -27.687 11.198 -10.116 1.00 8.31 H new ATOM 0 HG3 GLU A 6 -27.470 10.567 -11.737 1.00 8.31 H new ATOM 87 N ARG A 7 -23.924 7.924 -10.657 1.00 5.97 N ATOM 88 CA ARG A 7 -23.091 6.782 -10.308 1.00 5.27 C ATOM 89 C ARG A 7 -21.644 7.197 -10.070 1.00 4.71 C ATOM 90 O ARG A 7 -20.993 7.753 -10.953 1.00 4.95 O ATOM 91 CB ARG A 7 -23.149 5.715 -11.402 1.00 5.61 C ATOM 92 CG ARG A 7 -23.715 4.388 -10.925 1.00 5.93 C ATOM 93 CD ARG A 7 -25.206 4.487 -10.650 1.00 6.48 C ATOM 94 NE ARG A 7 -25.714 3.332 -9.906 1.00 6.96 N ATOM 95 CZ ARG A 7 -26.466 2.365 -10.440 1.00 7.68 C ATOM 96 NH1 ARG A 7 -26.694 2.332 -11.751 1.00 7.98 N ATOM 97 NH2 ARG A 7 -26.966 1.410 -9.663 1.00 8.35 N ATOM 0 H ARG A 7 -24.267 7.916 -11.617 1.00 5.97 H new ATOM 0 HA ARG A 7 -23.485 6.365 -9.381 1.00 5.27 H new ATOM 0 HB2 ARG A 7 -23.757 6.085 -12.227 1.00 5.61 H new ATOM 0 HB3 ARG A 7 -22.145 5.553 -11.794 1.00 5.61 H new ATOM 0 HG2 ARG A 7 -23.533 3.621 -11.678 1.00 5.93 H new ATOM 0 HG3 ARG A 7 -23.197 4.074 -10.019 1.00 5.93 H new ATOM 0 HD2 ARG A 7 -25.409 5.397 -10.086 1.00 6.48 H new ATOM 0 HD3 ARG A 7 -25.742 4.572 -11.595 1.00 6.48 H new ATOM 0 HE ARG A 7 -25.478 3.261 -8.916 1.00 6.96 H new ATOM 0 HH11 ARG A 7 -26.293 3.048 -12.356 1.00 7.98 H new ATOM 0 HH12 ARG A 7 -27.269 1.590 -12.150 1.00 7.98 H new ATOM 0 HH21 ARG A 7 -26.776 1.416 -8.661 1.00 8.35 H new ATOM 0 HH22 ARG A 7 -27.540 0.671 -10.069 1.00 8.35 H new ATOM 111 N PRO A 8 -21.146 6.973 -8.852 1.00 4.27 N ATOM 112 CA PRO A 8 -19.749 7.159 -8.508 1.00 3.88 C ATOM 113 C PRO A 8 -18.979 5.840 -8.578 1.00 3.07 C ATOM 114 O PRO A 8 -19.531 4.775 -8.289 1.00 2.74 O ATOM 115 CB PRO A 8 -19.829 7.666 -7.061 1.00 4.13 C ATOM 116 CG PRO A 8 -21.201 7.295 -6.561 1.00 4.60 C ATOM 117 CD PRO A 8 -21.904 6.561 -7.675 1.00 4.51 C ATOM 0 HA PRO A 8 -19.225 7.836 -9.183 1.00 3.88 H new ATOM 0 HB2 PRO A 8 -19.054 7.210 -6.445 1.00 4.13 H new ATOM 0 HB3 PRO A 8 -19.677 8.745 -7.017 1.00 4.13 H new ATOM 0 HG2 PRO A 8 -21.129 6.667 -5.673 1.00 4.60 H new ATOM 0 HG3 PRO A 8 -21.760 8.187 -6.276 1.00 4.60 H new ATOM 0 HD2 PRO A 8 -21.875 5.481 -7.531 1.00 4.51 H new ATOM 0 HD3 PRO A 8 -22.954 6.845 -7.749 1.00 4.51 H new ATOM 125 N PRO A 9 -17.704 5.885 -8.987 1.00 3.13 N ATOM 126 CA PRO A 9 -16.866 4.690 -9.060 1.00 2.76 C ATOM 127 C PRO A 9 -16.612 4.087 -7.684 1.00 1.86 C ATOM 128 O PRO A 9 -16.214 4.789 -6.748 1.00 2.21 O ATOM 129 CB PRO A 9 -15.558 5.194 -9.681 1.00 3.66 C ATOM 130 CG PRO A 9 -15.546 6.660 -9.420 1.00 4.29 C ATOM 131 CD PRO A 9 -16.983 7.096 -9.416 1.00 4.00 C ATOM 0 HA PRO A 9 -17.338 3.896 -9.639 1.00 2.76 H new ATOM 0 HB2 PRO A 9 -14.694 4.706 -9.230 1.00 3.66 H new ATOM 0 HB3 PRO A 9 -15.522 4.983 -10.750 1.00 3.66 H new ATOM 0 HG2 PRO A 9 -15.069 6.882 -8.465 1.00 4.29 H new ATOM 0 HG3 PRO A 9 -14.981 7.188 -10.188 1.00 4.29 H new ATOM 0 HD2 PRO A 9 -17.149 7.927 -8.731 1.00 4.00 H new ATOM 0 HD3 PRO A 9 -17.305 7.428 -10.403 1.00 4.00 H new ATOM 139 N VAL A 10 -16.863 2.790 -7.558 1.00 1.31 N ATOM 140 CA VAL A 10 -16.643 2.089 -6.304 1.00 1.04 C ATOM 141 C VAL A 10 -15.158 1.798 -6.104 1.00 0.88 C ATOM 142 O VAL A 10 -14.666 0.703 -6.378 1.00 1.10 O ATOM 143 CB VAL A 10 -17.471 0.788 -6.210 1.00 1.75 C ATOM 144 CG1 VAL A 10 -18.931 1.116 -5.942 1.00 2.58 C ATOM 145 CG2 VAL A 10 -17.339 -0.038 -7.481 1.00 2.47 C ATOM 0 H VAL A 10 -17.220 2.203 -8.312 1.00 1.31 H new ATOM 0 HA VAL A 10 -16.984 2.746 -5.504 1.00 1.04 H new ATOM 0 HB VAL A 10 -17.082 0.195 -5.382 1.00 1.75 H new ATOM 0 HG11 VAL A 10 -19.506 0.192 -5.878 1.00 2.58 H new ATOM 0 HG12 VAL A 10 -19.015 1.662 -5.002 1.00 2.58 H new ATOM 0 HG13 VAL A 10 -19.321 1.730 -6.754 1.00 2.58 H new ATOM 0 HG21 VAL A 10 -17.932 -0.948 -7.387 1.00 2.47 H new ATOM 0 HG22 VAL A 10 -17.697 0.543 -8.331 1.00 2.47 H new ATOM 0 HG23 VAL A 10 -16.293 -0.301 -7.637 1.00 2.47 H new ATOM 155 N VAL A 11 -14.457 2.805 -5.627 1.00 0.67 N ATOM 156 CA VAL A 11 -13.035 2.713 -5.377 1.00 0.60 C ATOM 157 C VAL A 11 -12.783 1.841 -4.147 1.00 0.56 C ATOM 158 O VAL A 11 -12.898 2.292 -3.005 1.00 0.74 O ATOM 159 CB VAL A 11 -12.451 4.130 -5.188 1.00 0.61 C ATOM 160 CG1 VAL A 11 -10.951 4.103 -5.012 1.00 1.00 C ATOM 161 CG2 VAL A 11 -12.816 5.007 -6.371 1.00 0.98 C ATOM 0 H VAL A 11 -14.860 3.714 -5.401 1.00 0.67 H new ATOM 0 HA VAL A 11 -12.538 2.249 -6.229 1.00 0.60 H new ATOM 0 HB VAL A 11 -12.885 4.544 -4.278 1.00 0.61 H new ATOM 0 HG11 VAL A 11 -10.582 5.120 -4.882 1.00 1.00 H new ATOM 0 HG12 VAL A 11 -10.698 3.510 -4.133 1.00 1.00 H new ATOM 0 HG13 VAL A 11 -10.489 3.659 -5.894 1.00 1.00 H new ATOM 0 HG21 VAL A 11 -12.399 6.004 -6.227 1.00 0.98 H new ATOM 0 HG22 VAL A 11 -12.411 4.572 -7.285 1.00 0.98 H new ATOM 0 HG23 VAL A 11 -13.901 5.076 -6.452 1.00 0.98 H new ATOM 171 N THR A 12 -12.461 0.580 -4.400 1.00 0.46 N ATOM 172 CA THR A 12 -12.363 -0.418 -3.352 1.00 0.45 C ATOM 173 C THR A 12 -11.029 -0.327 -2.618 1.00 0.39 C ATOM 174 O THR A 12 -9.962 -0.326 -3.238 1.00 0.43 O ATOM 175 CB THR A 12 -12.530 -1.831 -3.940 1.00 0.55 C ATOM 176 OG1 THR A 12 -13.693 -1.869 -4.777 1.00 0.66 O ATOM 177 CG2 THR A 12 -12.661 -2.873 -2.839 1.00 0.62 C ATOM 0 H THR A 12 -12.262 0.224 -5.335 1.00 0.46 H new ATOM 0 HA THR A 12 -13.163 -0.223 -2.638 1.00 0.45 H new ATOM 0 HB THR A 12 -11.642 -2.063 -4.527 1.00 0.55 H new ATOM 0 HG1 THR A 12 -13.423 -1.793 -5.716 1.00 0.66 H new ATOM 0 HG21 THR A 12 -12.778 -3.861 -3.285 1.00 0.62 H new ATOM 0 HG22 THR A 12 -11.766 -2.859 -2.217 1.00 0.62 H new ATOM 0 HG23 THR A 12 -13.533 -2.647 -2.226 1.00 0.62 H new ATOM 185 N ILE A 13 -11.096 -0.249 -1.298 1.00 0.39 N ATOM 186 CA ILE A 13 -9.898 -0.189 -0.485 1.00 0.38 C ATOM 187 C ILE A 13 -9.517 -1.584 -0.002 1.00 0.37 C ATOM 188 O ILE A 13 -10.350 -2.316 0.528 1.00 0.51 O ATOM 189 CB ILE A 13 -10.072 0.753 0.729 1.00 0.50 C ATOM 190 CG1 ILE A 13 -10.451 2.161 0.262 1.00 0.86 C ATOM 191 CG2 ILE A 13 -8.793 0.797 1.556 1.00 0.80 C ATOM 192 CD1 ILE A 13 -10.587 3.162 1.392 1.00 1.03 C ATOM 0 H ILE A 13 -11.968 -0.226 -0.770 1.00 0.39 H new ATOM 0 HA ILE A 13 -9.101 0.213 -1.110 1.00 0.38 H new ATOM 0 HB ILE A 13 -10.876 0.365 1.354 1.00 0.50 H new ATOM 0 HG12 ILE A 13 -9.696 2.517 -0.438 1.00 0.86 H new ATOM 0 HG13 ILE A 13 -11.393 2.112 -0.283 1.00 0.86 H new ATOM 0 HG21 ILE A 13 -8.932 1.464 2.406 1.00 0.80 H new ATOM 0 HG22 ILE A 13 -8.558 -0.205 1.916 1.00 0.80 H new ATOM 0 HG23 ILE A 13 -7.973 1.163 0.938 1.00 0.80 H new ATOM 0 HD11 ILE A 13 -10.857 4.136 0.985 1.00 1.03 H new ATOM 0 HD12 ILE A 13 -11.363 2.829 2.081 1.00 1.03 H new ATOM 0 HD13 ILE A 13 -9.639 3.241 1.924 1.00 1.03 H new ATOM 204 N MET A 14 -8.267 -1.955 -0.221 1.00 0.31 N ATOM 205 CA MET A 14 -7.752 -3.241 0.247 1.00 0.35 C ATOM 206 C MET A 14 -6.502 -3.037 1.099 1.00 0.29 C ATOM 207 O MET A 14 -6.098 -1.903 1.343 1.00 0.46 O ATOM 208 CB MET A 14 -7.456 -4.179 -0.927 1.00 0.56 C ATOM 209 CG MET A 14 -8.711 -4.735 -1.588 1.00 0.75 C ATOM 210 SD MET A 14 -8.343 -5.960 -2.862 1.00 1.04 S ATOM 211 CE MET A 14 -9.985 -6.508 -3.320 1.00 0.77 C ATOM 0 H MET A 14 -7.584 -1.386 -0.721 1.00 0.31 H new ATOM 0 HA MET A 14 -8.521 -3.708 0.863 1.00 0.35 H new ATOM 0 HB2 MET A 14 -6.869 -3.642 -1.672 1.00 0.56 H new ATOM 0 HB3 MET A 14 -6.842 -5.008 -0.574 1.00 0.56 H new ATOM 0 HG2 MET A 14 -9.347 -5.188 -0.827 1.00 0.75 H new ATOM 0 HG3 MET A 14 -9.277 -3.915 -2.031 1.00 0.75 H new ATOM 0 HE1 MET A 14 -9.917 -7.200 -4.159 1.00 0.77 H new ATOM 0 HE2 MET A 14 -10.451 -7.011 -2.472 1.00 0.77 H new ATOM 0 HE3 MET A 14 -10.589 -5.647 -3.608 1.00 0.77 H new ATOM 221 N GLY A 15 -5.891 -4.124 1.565 1.00 0.34 N ATOM 222 CA GLY A 15 -4.763 -4.005 2.447 1.00 0.45 C ATOM 223 C GLY A 15 -5.067 -4.606 3.797 1.00 0.62 C ATOM 224 O GLY A 15 -6.130 -4.353 4.370 1.00 1.55 O ATOM 0 H GLY A 15 -6.164 -5.081 1.342 1.00 0.34 H new ATOM 0 HA2 GLY A 15 -3.899 -4.505 2.008 1.00 0.45 H new ATOM 0 HA3 GLY A 15 -4.498 -2.954 2.564 1.00 0.45 H new ATOM 228 N HIS A 16 -4.167 -5.449 4.267 1.00 0.51 N ATOM 229 CA HIS A 16 -4.264 -6.027 5.608 1.00 0.45 C ATOM 230 C HIS A 16 -4.487 -4.925 6.650 1.00 0.49 C ATOM 231 O HIS A 16 -3.869 -3.861 6.595 1.00 0.64 O ATOM 232 CB HIS A 16 -3.008 -6.847 5.935 1.00 0.43 C ATOM 233 CG HIS A 16 -3.048 -7.497 7.285 1.00 0.48 C ATOM 234 ND1 HIS A 16 -3.784 -8.631 7.511 1.00 0.62 N ATOM 235 CD2 HIS A 16 -2.450 -7.123 8.437 1.00 0.50 C ATOM 236 CE1 HIS A 16 -3.622 -8.920 8.792 1.00 0.66 C ATOM 237 NE2 HIS A 16 -2.823 -8.032 9.393 1.00 0.59 N ATOM 0 H HIS A 16 -3.350 -5.756 3.739 1.00 0.51 H new ATOM 0 HA HIS A 16 -5.121 -6.700 5.635 1.00 0.45 H new ATOM 0 HB2 HIS A 16 -2.879 -7.617 5.174 1.00 0.43 H new ATOM 0 HB3 HIS A 16 -2.135 -6.196 5.881 1.00 0.43 H new ATOM 0 HD2 HIS A 16 -1.802 -6.271 8.578 1.00 0.50 H new ATOM 0 HE1 HIS A 16 -4.077 -9.765 9.288 1.00 0.66 H new ATOM 0 HE2 HIS A 16 -2.545 -8.031 10.374 1.00 0.59 H new ATOM 245 N VAL A 17 -5.374 -5.207 7.600 1.00 0.53 N ATOM 246 CA VAL A 17 -5.904 -4.196 8.518 1.00 0.67 C ATOM 247 C VAL A 17 -4.838 -3.538 9.397 1.00 0.64 C ATOM 248 O VAL A 17 -5.002 -2.391 9.811 1.00 0.78 O ATOM 249 CB VAL A 17 -7.007 -4.786 9.425 1.00 0.87 C ATOM 250 CG1 VAL A 17 -8.197 -5.243 8.594 1.00 1.55 C ATOM 251 CG2 VAL A 17 -6.469 -5.940 10.262 1.00 1.62 C ATOM 0 H VAL A 17 -5.748 -6.143 7.758 1.00 0.53 H new ATOM 0 HA VAL A 17 -6.320 -3.422 7.873 1.00 0.67 H new ATOM 0 HB VAL A 17 -7.338 -4.000 10.104 1.00 0.87 H new ATOM 0 HG11 VAL A 17 -8.963 -5.655 9.251 1.00 1.55 H new ATOM 0 HG12 VAL A 17 -8.607 -4.394 8.047 1.00 1.55 H new ATOM 0 HG13 VAL A 17 -7.875 -6.008 7.887 1.00 1.55 H new ATOM 0 HG21 VAL A 17 -7.266 -6.336 10.891 1.00 1.62 H new ATOM 0 HG22 VAL A 17 -6.101 -6.727 9.603 1.00 1.62 H new ATOM 0 HG23 VAL A 17 -5.654 -5.584 10.892 1.00 1.62 H new ATOM 261 N ASP A 18 -3.753 -4.252 9.674 1.00 0.57 N ATOM 262 CA ASP A 18 -2.721 -3.753 10.585 1.00 0.61 C ATOM 263 C ASP A 18 -1.872 -2.661 9.944 1.00 0.56 C ATOM 264 O ASP A 18 -1.217 -1.886 10.644 1.00 0.69 O ATOM 265 CB ASP A 18 -1.812 -4.892 11.066 1.00 0.69 C ATOM 266 CG ASP A 18 -2.456 -5.760 12.130 1.00 1.06 C ATOM 267 OD1 ASP A 18 -2.483 -5.346 13.306 1.00 1.17 O ATOM 268 OD2 ASP A 18 -2.922 -6.873 11.800 1.00 1.78 O ATOM 0 H ASP A 18 -3.562 -5.175 9.284 1.00 0.57 H new ATOM 0 HA ASP A 18 -3.242 -3.323 11.440 1.00 0.61 H new ATOM 0 HB2 ASP A 18 -1.539 -5.515 10.214 1.00 0.69 H new ATOM 0 HB3 ASP A 18 -0.888 -4.469 11.461 1.00 0.69 H new ATOM 273 N HIS A 19 -1.887 -2.585 8.621 1.00 0.46 N ATOM 274 CA HIS A 19 -1.051 -1.631 7.909 1.00 0.48 C ATOM 275 C HIS A 19 -1.556 -0.200 8.077 1.00 0.58 C ATOM 276 O HIS A 19 -0.764 0.742 8.151 1.00 0.65 O ATOM 277 CB HIS A 19 -0.959 -2.012 6.432 1.00 0.46 C ATOM 278 CG HIS A 19 -0.079 -3.203 6.189 1.00 0.40 C ATOM 279 ND1 HIS A 19 -0.390 -4.160 5.255 1.00 0.60 N ATOM 280 CD2 HIS A 19 1.095 -3.533 6.783 1.00 0.56 C ATOM 281 CE1 HIS A 19 0.594 -5.040 5.302 1.00 0.53 C ATOM 282 NE2 HIS A 19 1.516 -4.705 6.213 1.00 0.48 N ATOM 0 H HIS A 19 -2.467 -3.171 8.021 1.00 0.46 H new ATOM 0 HA HIS A 19 -0.052 -1.669 8.343 1.00 0.48 H new ATOM 0 HB2 HIS A 19 -1.959 -2.223 6.054 1.00 0.46 H new ATOM 0 HB3 HIS A 19 -0.576 -1.163 5.866 1.00 0.46 H new ATOM 0 HD2 HIS A 19 1.602 -2.977 7.558 1.00 0.56 H new ATOM 0 HE1 HIS A 19 0.648 -5.922 4.681 1.00 0.53 H new ATOM 0 HE2 HIS A 19 2.366 -5.222 6.439 1.00 0.48 H new ATOM 290 N GLY A 20 -2.869 -0.037 8.159 1.00 0.76 N ATOM 291 CA GLY A 20 -3.433 1.283 8.368 1.00 0.90 C ATOM 292 C GLY A 20 -4.664 1.533 7.526 1.00 0.81 C ATOM 293 O GLY A 20 -4.647 2.358 6.613 1.00 0.93 O ATOM 0 H GLY A 20 -3.552 -0.791 8.085 1.00 0.76 H new ATOM 0 HA2 GLY A 20 -3.688 1.402 9.421 1.00 0.90 H new ATOM 0 HA3 GLY A 20 -2.680 2.036 8.136 1.00 0.90 H new ATOM 297 N LYS A 21 -5.734 0.819 7.829 1.00 0.79 N ATOM 298 CA LYS A 21 -6.971 0.943 7.074 1.00 0.87 C ATOM 299 C LYS A 21 -7.861 2.030 7.655 1.00 0.89 C ATOM 300 O LYS A 21 -8.245 2.971 6.965 1.00 0.93 O ATOM 301 CB LYS A 21 -7.726 -0.375 7.076 1.00 1.09 C ATOM 302 CG LYS A 21 -6.932 -1.535 6.499 1.00 1.20 C ATOM 303 CD LYS A 21 -6.666 -1.352 5.014 1.00 1.39 C ATOM 304 CE LYS A 21 -7.953 -1.422 4.210 1.00 1.73 C ATOM 305 NZ LYS A 21 -8.659 -2.715 4.402 1.00 2.11 N ATOM 0 H LYS A 21 -5.772 0.146 8.594 1.00 0.79 H new ATOM 0 HA LYS A 21 -6.708 1.213 6.051 1.00 0.87 H new ATOM 0 HB2 LYS A 21 -8.014 -0.617 8.099 1.00 1.09 H new ATOM 0 HB3 LYS A 21 -8.647 -0.257 6.505 1.00 1.09 H new ATOM 0 HG2 LYS A 21 -5.984 -1.627 7.030 1.00 1.20 H new ATOM 0 HG3 LYS A 21 -7.478 -2.465 6.659 1.00 1.20 H new ATOM 0 HD2 LYS A 21 -6.181 -0.391 4.845 1.00 1.39 H new ATOM 0 HD3 LYS A 21 -5.976 -2.122 4.668 1.00 1.39 H new ATOM 0 HE2 LYS A 21 -8.609 -0.603 4.504 1.00 1.73 H new ATOM 0 HE3 LYS A 21 -7.728 -1.285 3.152 1.00 1.73 H new ATOM 0 HZ1 LYS A 21 -9.402 -2.815 3.682 1.00 2.11 H new ATOM 0 HZ2 LYS A 21 -7.981 -3.498 4.310 1.00 2.11 H new ATOM 0 HZ3 LYS A 21 -9.089 -2.739 5.349 1.00 2.11 H new ATOM 319 N THR A 22 -8.174 1.893 8.937 1.00 0.92 N ATOM 320 CA THR A 22 -9.087 2.805 9.608 1.00 1.00 C ATOM 321 C THR A 22 -8.489 4.210 9.689 1.00 0.99 C ATOM 322 O THR A 22 -9.204 5.193 9.891 1.00 1.03 O ATOM 323 CB THR A 22 -9.442 2.288 11.024 1.00 1.10 C ATOM 324 OG1 THR A 22 -10.468 3.096 11.614 1.00 1.80 O ATOM 325 CG2 THR A 22 -8.219 2.276 11.929 1.00 1.65 C ATOM 0 H THR A 22 -7.805 1.153 9.535 1.00 0.92 H new ATOM 0 HA THR A 22 -10.004 2.854 9.020 1.00 1.00 H new ATOM 0 HB THR A 22 -9.806 1.266 10.918 1.00 1.10 H new ATOM 0 HG1 THR A 22 -10.681 2.754 12.507 1.00 1.80 H new ATOM 0 HG21 THR A 22 -8.500 1.908 12.916 1.00 1.65 H new ATOM 0 HG22 THR A 22 -7.457 1.624 11.502 1.00 1.65 H new ATOM 0 HG23 THR A 22 -7.822 3.287 12.018 1.00 1.65 H new ATOM 333 N THR A 23 -7.178 4.298 9.509 1.00 0.99 N ATOM 334 CA THR A 23 -6.498 5.578 9.510 1.00 1.02 C ATOM 335 C THR A 23 -6.761 6.338 8.214 1.00 0.96 C ATOM 336 O THR A 23 -6.607 7.556 8.162 1.00 0.96 O ATOM 337 CB THR A 23 -4.984 5.396 9.710 1.00 1.12 C ATOM 338 OG1 THR A 23 -4.507 4.341 8.864 1.00 1.77 O ATOM 339 CG2 THR A 23 -4.662 5.072 11.162 1.00 1.41 C ATOM 0 H THR A 23 -6.567 3.495 9.361 1.00 0.99 H new ATOM 0 HA THR A 23 -6.894 6.159 10.342 1.00 1.02 H new ATOM 0 HB THR A 23 -4.488 6.330 9.447 1.00 1.12 H new ATOM 0 HG1 THR A 23 -3.542 4.229 8.993 1.00 1.77 H new ATOM 0 HG21 THR A 23 -3.585 4.948 11.277 1.00 1.41 H new ATOM 0 HG22 THR A 23 -5.004 5.886 11.801 1.00 1.41 H new ATOM 0 HG23 THR A 23 -5.166 4.149 11.449 1.00 1.41 H new ATOM 347 N LEU A 24 -7.175 5.618 7.169 1.00 0.96 N ATOM 348 CA LEU A 24 -7.484 6.260 5.899 1.00 0.96 C ATOM 349 C LEU A 24 -8.737 7.107 6.028 1.00 0.89 C ATOM 350 O LEU A 24 -8.728 8.291 5.699 1.00 0.91 O ATOM 351 CB LEU A 24 -7.670 5.227 4.786 1.00 1.06 C ATOM 352 CG LEU A 24 -6.434 4.397 4.453 1.00 0.88 C ATOM 353 CD1 LEU A 24 -6.719 3.486 3.271 1.00 1.78 C ATOM 354 CD2 LEU A 24 -5.246 5.302 4.158 1.00 1.57 C ATOM 0 H LEU A 24 -7.301 4.606 7.180 1.00 0.96 H new ATOM 0 HA LEU A 24 -6.642 6.900 5.636 1.00 0.96 H new ATOM 0 HB2 LEU A 24 -8.475 4.550 5.072 1.00 1.06 H new ATOM 0 HB3 LEU A 24 -7.994 5.745 3.883 1.00 1.06 H new ATOM 0 HG LEU A 24 -6.185 3.780 5.316 1.00 0.88 H new ATOM 0 HD11 LEU A 24 -5.830 2.898 3.042 1.00 1.78 H new ATOM 0 HD12 LEU A 24 -7.543 2.817 3.518 1.00 1.78 H new ATOM 0 HD13 LEU A 24 -6.989 4.089 2.404 1.00 1.78 H new ATOM 0 HD21 LEU A 24 -4.374 4.692 3.923 1.00 1.57 H new ATOM 0 HD22 LEU A 24 -5.480 5.944 3.309 1.00 1.57 H new ATOM 0 HD23 LEU A 24 -5.033 5.919 5.031 1.00 1.57 H new ATOM 366 N LEU A 25 -9.803 6.494 6.535 1.00 0.88 N ATOM 367 CA LEU A 25 -11.070 7.191 6.721 1.00 0.91 C ATOM 368 C LEU A 25 -10.908 8.374 7.669 1.00 0.89 C ATOM 369 O LEU A 25 -11.560 9.399 7.509 1.00 0.92 O ATOM 370 CB LEU A 25 -12.142 6.241 7.276 1.00 1.02 C ATOM 371 CG LEU A 25 -13.017 5.537 6.234 1.00 1.21 C ATOM 372 CD1 LEU A 25 -12.205 4.584 5.371 1.00 1.76 C ATOM 373 CD2 LEU A 25 -14.153 4.793 6.918 1.00 1.96 C ATOM 0 H LEU A 25 -9.814 5.516 6.824 1.00 0.88 H new ATOM 0 HA LEU A 25 -11.387 7.557 5.744 1.00 0.91 H new ATOM 0 HB2 LEU A 25 -11.648 5.480 7.881 1.00 1.02 H new ATOM 0 HB3 LEU A 25 -12.791 6.807 7.944 1.00 1.02 H new ATOM 0 HG LEU A 25 -13.434 6.302 5.579 1.00 1.21 H new ATOM 0 HD11 LEU A 25 -12.860 4.104 4.644 1.00 1.76 H new ATOM 0 HD12 LEU A 25 -11.428 5.140 4.847 1.00 1.76 H new ATOM 0 HD13 LEU A 25 -11.745 3.824 6.002 1.00 1.76 H new ATOM 0 HD21 LEU A 25 -14.768 4.297 6.167 1.00 1.96 H new ATOM 0 HD22 LEU A 25 -13.742 4.048 7.600 1.00 1.96 H new ATOM 0 HD23 LEU A 25 -14.765 5.499 7.479 1.00 1.96 H new ATOM 385 N ASP A 26 -10.032 8.229 8.654 1.00 0.91 N ATOM 386 CA ASP A 26 -9.820 9.283 9.639 1.00 0.96 C ATOM 387 C ASP A 26 -9.145 10.509 9.025 1.00 0.92 C ATOM 388 O ASP A 26 -9.634 11.633 9.169 1.00 0.95 O ATOM 389 CB ASP A 26 -9.005 8.761 10.801 1.00 1.05 C ATOM 390 CG ASP A 26 -8.782 9.804 11.875 1.00 1.21 C ATOM 391 OD1 ASP A 26 -9.773 10.299 12.444 1.00 1.35 O ATOM 392 OD2 ASP A 26 -7.609 10.144 12.149 1.00 1.38 O ATOM 0 H ASP A 26 -9.459 7.397 8.793 1.00 0.91 H new ATOM 0 HA ASP A 26 -10.800 9.595 10.001 1.00 0.96 H new ATOM 0 HB2 ASP A 26 -9.512 7.900 11.237 1.00 1.05 H new ATOM 0 HB3 ASP A 26 -8.040 8.411 10.434 1.00 1.05 H new ATOM 397 N ALA A 27 -8.033 10.293 8.328 1.00 0.89 N ATOM 398 CA ALA A 27 -7.304 11.395 7.701 1.00 0.89 C ATOM 399 C ALA A 27 -8.087 11.973 6.539 1.00 0.85 C ATOM 400 O ALA A 27 -8.028 13.171 6.269 1.00 0.90 O ATOM 401 CB ALA A 27 -5.946 10.936 7.209 1.00 0.91 C ATOM 0 H ALA A 27 -7.618 9.373 8.183 1.00 0.89 H new ATOM 0 HA ALA A 27 -7.168 12.167 8.459 1.00 0.89 H new ATOM 0 HB1 ALA A 27 -5.424 11.774 6.747 1.00 0.91 H new ATOM 0 HB2 ALA A 27 -5.361 10.564 8.050 1.00 0.91 H new ATOM 0 HB3 ALA A 27 -6.075 10.140 6.476 1.00 0.91 H new ATOM 407 N ILE A 28 -8.822 11.118 5.855 1.00 0.82 N ATOM 408 CA ILE A 28 -9.572 11.516 4.681 1.00 0.83 C ATOM 409 C ILE A 28 -10.691 12.494 5.063 1.00 0.88 C ATOM 410 O ILE A 28 -11.122 13.309 4.251 1.00 0.94 O ATOM 411 CB ILE A 28 -10.129 10.263 3.969 1.00 0.86 C ATOM 412 CG1 ILE A 28 -10.074 10.418 2.452 1.00 0.99 C ATOM 413 CG2 ILE A 28 -11.550 9.957 4.415 1.00 1.56 C ATOM 414 CD1 ILE A 28 -9.861 9.098 1.741 1.00 0.95 C ATOM 0 H ILE A 28 -8.916 10.131 6.097 1.00 0.82 H new ATOM 0 HA ILE A 28 -8.910 12.035 3.988 1.00 0.83 H new ATOM 0 HB ILE A 28 -9.494 9.424 4.252 1.00 0.86 H new ATOM 0 HG12 ILE A 28 -11.002 10.870 2.102 1.00 0.99 H new ATOM 0 HG13 ILE A 28 -9.268 11.103 2.189 1.00 0.99 H new ATOM 0 HG21 ILE A 28 -11.911 9.070 3.895 1.00 1.56 H new ATOM 0 HG22 ILE A 28 -11.563 9.778 5.490 1.00 1.56 H new ATOM 0 HG23 ILE A 28 -12.195 10.803 4.180 1.00 1.56 H new ATOM 0 HD11 ILE A 28 -9.830 9.266 0.664 1.00 0.95 H new ATOM 0 HD12 ILE A 28 -8.919 8.657 2.067 1.00 0.95 H new ATOM 0 HD13 ILE A 28 -10.681 8.420 1.979 1.00 0.95 H new ATOM 426 N ARG A 29 -11.121 12.432 6.323 1.00 0.93 N ATOM 427 CA ARG A 29 -12.137 13.348 6.837 1.00 1.04 C ATOM 428 C ARG A 29 -11.521 14.700 7.171 1.00 1.08 C ATOM 429 O ARG A 29 -12.211 15.716 7.237 1.00 1.17 O ATOM 430 CB ARG A 29 -12.800 12.773 8.079 1.00 1.16 C ATOM 431 CG ARG A 29 -13.624 11.539 7.797 1.00 1.33 C ATOM 432 CD ARG A 29 -14.334 11.053 9.048 1.00 1.58 C ATOM 433 NE ARG A 29 -15.181 12.094 9.628 1.00 2.13 N ATOM 434 CZ ARG A 29 -15.193 12.413 10.920 1.00 2.85 C ATOM 435 NH1 ARG A 29 -14.382 11.796 11.775 1.00 3.29 N ATOM 436 NH2 ARG A 29 -16.003 13.370 11.351 1.00 3.56 N ATOM 0 H ARG A 29 -10.781 11.756 7.007 1.00 0.93 H new ATOM 0 HA ARG A 29 -12.890 13.481 6.060 1.00 1.04 H new ATOM 0 HB2 ARG A 29 -12.032 12.529 8.813 1.00 1.16 H new ATOM 0 HB3 ARG A 29 -13.439 13.534 8.527 1.00 1.16 H new ATOM 0 HG2 ARG A 29 -14.358 11.758 7.022 1.00 1.33 H new ATOM 0 HG3 ARG A 29 -12.980 10.749 7.412 1.00 1.33 H new ATOM 0 HD2 ARG A 29 -14.943 10.182 8.806 1.00 1.58 H new ATOM 0 HD3 ARG A 29 -13.596 10.732 9.784 1.00 1.58 H new ATOM 0 HE ARG A 29 -15.802 12.608 9.003 1.00 2.13 H new ATOM 0 HH11 ARG A 29 -13.745 11.073 11.442 1.00 3.29 H new ATOM 0 HH12 ARG A 29 -14.397 12.046 12.764 1.00 3.29 H new ATOM 0 HH21 ARG A 29 -16.612 13.857 10.694 1.00 3.56 H new ATOM 0 HH22 ARG A 29 -16.017 13.619 12.340 1.00 3.56 H new ATOM 450 N HIS A 30 -10.212 14.696 7.381 1.00 1.05 N ATOM 451 CA HIS A 30 -9.458 15.921 7.650 1.00 1.13 C ATOM 452 C HIS A 30 -9.357 16.752 6.374 1.00 1.15 C ATOM 453 O HIS A 30 -8.903 17.895 6.381 1.00 1.32 O ATOM 454 CB HIS A 30 -8.074 15.577 8.181 1.00 1.23 C ATOM 455 CG HIS A 30 -7.294 16.728 8.722 1.00 1.70 C ATOM 456 ND1 HIS A 30 -6.598 17.635 7.945 1.00 2.44 N ATOM 457 CD2 HIS A 30 -7.090 17.092 9.990 1.00 2.01 C ATOM 458 CE1 HIS A 30 -6.000 18.510 8.732 1.00 2.88 C ATOM 459 NE2 HIS A 30 -6.285 18.200 9.982 1.00 2.60 N ATOM 0 H HIS A 30 -9.642 13.850 7.371 1.00 1.05 H new ATOM 0 HA HIS A 30 -9.978 16.507 8.408 1.00 1.13 H new ATOM 0 HB2 HIS A 30 -8.180 14.830 8.967 1.00 1.23 H new ATOM 0 HB3 HIS A 30 -7.499 15.115 7.378 1.00 1.23 H new ATOM 0 HD2 HIS A 30 -7.488 16.601 10.865 1.00 2.01 H new ATOM 0 HE1 HIS A 30 -5.384 19.336 8.409 1.00 2.88 H new ATOM 0 HE2 HIS A 30 -5.959 18.703 10.807 1.00 2.60 H new ATOM 468 N SER A 31 -9.804 16.156 5.284 1.00 1.07 N ATOM 469 CA SER A 31 -9.782 16.787 3.979 1.00 1.19 C ATOM 470 C SER A 31 -11.196 17.174 3.558 1.00 1.32 C ATOM 471 O SER A 31 -11.453 17.433 2.380 1.00 1.76 O ATOM 472 CB SER A 31 -9.161 15.825 2.964 1.00 1.15 C ATOM 473 OG SER A 31 -7.809 16.146 2.719 1.00 1.50 O ATOM 0 H SER A 31 -10.195 15.214 5.280 1.00 1.07 H new ATOM 0 HA SER A 31 -9.181 17.695 4.023 1.00 1.19 H new ATOM 0 HB2 SER A 31 -9.233 14.803 3.336 1.00 1.15 H new ATOM 0 HB3 SER A 31 -9.722 15.865 2.030 1.00 1.15 H new ATOM 0 HG SER A 31 -7.654 16.192 1.752 1.00 1.50 H new ATOM 479 N LYS A 32 -12.099 17.237 4.544 1.00 1.43 N ATOM 480 CA LYS A 32 -13.517 17.456 4.284 1.00 1.81 C ATOM 481 C LYS A 32 -13.995 16.424 3.278 1.00 1.37 C ATOM 482 O LYS A 32 -13.722 15.236 3.449 1.00 1.78 O ATOM 483 CB LYS A 32 -13.754 18.873 3.756 1.00 2.82 C ATOM 484 CG LYS A 32 -13.255 19.966 4.685 1.00 3.53 C ATOM 485 CD LYS A 32 -13.531 21.344 4.113 1.00 4.33 C ATOM 486 CE LYS A 32 -12.960 22.444 4.995 1.00 5.18 C ATOM 487 NZ LYS A 32 -11.477 22.455 4.968 1.00 5.71 N ATOM 0 H LYS A 32 -11.866 17.138 5.532 1.00 1.43 H new ATOM 0 HA LYS A 32 -14.079 17.349 5.212 1.00 1.81 H new ATOM 0 HB2 LYS A 32 -13.261 18.978 2.790 1.00 2.82 H new ATOM 0 HB3 LYS A 32 -14.821 19.013 3.586 1.00 2.82 H new ATOM 0 HG2 LYS A 32 -13.739 19.870 5.657 1.00 3.53 H new ATOM 0 HG3 LYS A 32 -12.184 19.846 4.849 1.00 3.53 H new ATOM 0 HD2 LYS A 32 -13.099 21.417 3.115 1.00 4.33 H new ATOM 0 HD3 LYS A 32 -14.607 21.485 4.006 1.00 4.33 H new ATOM 0 HE2 LYS A 32 -13.337 23.411 4.661 1.00 5.18 H new ATOM 0 HE3 LYS A 32 -13.304 22.304 6.020 1.00 5.18 H new ATOM 0 HZ1 LYS A 32 -11.128 23.330 5.409 1.00 5.71 H new ATOM 0 HZ2 LYS A 32 -11.114 21.634 5.493 1.00 5.71 H new ATOM 0 HZ3 LYS A 32 -11.147 22.409 3.983 1.00 5.71 H new ATOM 501 N VAL A 33 -14.736 16.885 2.266 1.00 1.59 N ATOM 502 CA VAL A 33 -15.060 16.103 1.064 1.00 1.75 C ATOM 503 C VAL A 33 -15.688 14.740 1.387 1.00 1.88 C ATOM 504 O VAL A 33 -15.727 13.839 0.552 1.00 2.52 O ATOM 505 CB VAL A 33 -13.799 15.929 0.169 1.00 2.22 C ATOM 506 CG1 VAL A 33 -12.892 14.816 0.669 1.00 2.95 C ATOM 507 CG2 VAL A 33 -14.170 15.702 -1.273 1.00 2.99 C ATOM 0 H VAL A 33 -15.134 17.824 2.256 1.00 1.59 H new ATOM 0 HA VAL A 33 -15.813 16.669 0.516 1.00 1.75 H new ATOM 0 HB VAL A 33 -13.241 16.863 0.234 1.00 2.22 H new ATOM 0 HG11 VAL A 33 -12.025 14.731 0.014 1.00 2.95 H new ATOM 0 HG12 VAL A 33 -12.560 15.044 1.682 1.00 2.95 H new ATOM 0 HG13 VAL A 33 -13.440 13.873 0.670 1.00 2.95 H new ATOM 0 HG21 VAL A 33 -13.264 15.585 -1.868 1.00 2.99 H new ATOM 0 HG22 VAL A 33 -14.777 14.800 -1.355 1.00 2.99 H new ATOM 0 HG23 VAL A 33 -14.738 16.556 -1.641 1.00 2.99 H new ATOM 517 N THR A 34 -16.206 14.599 2.591 1.00 1.80 N ATOM 518 CA THR A 34 -16.792 13.347 3.006 1.00 2.15 C ATOM 519 C THR A 34 -18.298 13.456 3.136 1.00 1.77 C ATOM 520 O THR A 34 -18.818 14.206 3.964 1.00 2.24 O ATOM 521 CB THR A 34 -16.195 12.858 4.329 1.00 3.04 C ATOM 522 OG1 THR A 34 -15.682 13.969 5.078 1.00 3.73 O ATOM 523 CG2 THR A 34 -15.093 11.845 4.078 1.00 3.93 C ATOM 0 H THR A 34 -16.232 15.336 3.295 1.00 1.80 H new ATOM 0 HA THR A 34 -16.560 12.619 2.229 1.00 2.15 H new ATOM 0 HB THR A 34 -16.983 12.374 4.905 1.00 3.04 H new ATOM 0 HG1 THR A 34 -14.905 14.345 4.614 1.00 3.73 H new ATOM 0 HG21 THR A 34 -14.682 11.510 5.031 1.00 3.93 H new ATOM 0 HG22 THR A 34 -15.501 10.990 3.538 1.00 3.93 H new ATOM 0 HG23 THR A 34 -14.303 12.306 3.484 1.00 3.93 H new ATOM 531 N GLU A 35 -18.985 12.707 2.300 1.00 1.44 N ATOM 532 CA GLU A 35 -20.428 12.679 2.312 1.00 1.66 C ATOM 533 C GLU A 35 -20.922 11.631 3.302 1.00 1.86 C ATOM 534 O GLU A 35 -21.873 11.859 4.048 1.00 2.52 O ATOM 535 CB GLU A 35 -20.955 12.378 0.912 1.00 2.22 C ATOM 536 CG GLU A 35 -20.472 13.354 -0.157 1.00 3.01 C ATOM 537 CD GLU A 35 -20.653 14.810 0.233 1.00 3.69 C ATOM 538 OE1 GLU A 35 -21.795 15.211 0.541 1.00 4.20 O ATOM 539 OE2 GLU A 35 -19.654 15.564 0.223 1.00 4.12 O ATOM 0 H GLU A 35 -18.559 12.104 1.597 1.00 1.44 H new ATOM 0 HA GLU A 35 -20.800 13.655 2.623 1.00 1.66 H new ATOM 0 HB2 GLU A 35 -20.654 11.369 0.631 1.00 2.22 H new ATOM 0 HB3 GLU A 35 -22.045 12.390 0.935 1.00 2.22 H new ATOM 0 HG2 GLU A 35 -19.417 13.168 -0.359 1.00 3.01 H new ATOM 0 HG3 GLU A 35 -21.013 13.163 -1.084 1.00 3.01 H new ATOM 546 N GLN A 36 -20.252 10.477 3.282 1.00 1.82 N ATOM 547 CA GLN A 36 -20.440 9.425 4.286 1.00 2.41 C ATOM 548 C GLN A 36 -21.781 8.713 4.157 1.00 2.32 C ATOM 549 O GLN A 36 -22.154 7.933 5.030 1.00 2.74 O ATOM 550 CB GLN A 36 -20.273 9.984 5.703 1.00 3.30 C ATOM 551 CG GLN A 36 -18.825 10.147 6.127 1.00 3.71 C ATOM 552 CD GLN A 36 -18.681 10.879 7.445 1.00 4.77 C ATOM 553 OE1 GLN A 36 -18.505 12.095 7.474 1.00 5.34 O ATOM 554 NE2 GLN A 36 -18.786 10.148 8.542 1.00 5.38 N ATOM 0 H GLN A 36 -19.562 10.244 2.568 1.00 1.82 H new ATOM 0 HA GLN A 36 -19.664 8.683 4.099 1.00 2.41 H new ATOM 0 HB2 GLN A 36 -20.771 10.952 5.764 1.00 3.30 H new ATOM 0 HB3 GLN A 36 -20.776 9.322 6.407 1.00 3.30 H new ATOM 0 HG2 GLN A 36 -18.362 9.164 6.210 1.00 3.71 H new ATOM 0 HG3 GLN A 36 -18.283 10.690 5.353 1.00 3.71 H new ATOM 0 HE21 GLN A 36 -18.932 9.141 8.472 1.00 5.38 H new ATOM 0 HE22 GLN A 36 -18.721 10.591 9.458 1.00 5.38 H new ATOM 563 N GLU A 37 -22.490 8.955 3.066 1.00 2.52 N ATOM 564 CA GLU A 37 -23.771 8.304 2.845 1.00 2.96 C ATOM 565 C GLU A 37 -23.612 7.095 1.925 1.00 3.08 C ATOM 566 O GLU A 37 -23.451 7.252 0.714 1.00 3.74 O ATOM 567 CB GLU A 37 -24.778 9.286 2.250 1.00 3.77 C ATOM 568 CG GLU A 37 -26.181 8.712 2.133 1.00 4.29 C ATOM 569 CD GLU A 37 -27.161 9.685 1.517 1.00 5.23 C ATOM 570 OE1 GLU A 37 -27.293 10.813 2.034 1.00 5.79 O ATOM 571 OE2 GLU A 37 -27.779 9.340 0.488 1.00 5.67 O ATOM 0 H GLU A 37 -22.203 9.593 2.324 1.00 2.52 H new ATOM 0 HA GLU A 37 -24.145 7.960 3.809 1.00 2.96 H new ATOM 0 HB2 GLU A 37 -24.810 10.182 2.869 1.00 3.77 H new ATOM 0 HB3 GLU A 37 -24.435 9.593 1.262 1.00 3.77 H new ATOM 0 HG2 GLU A 37 -26.149 7.805 1.530 1.00 4.29 H new ATOM 0 HG3 GLU A 37 -26.535 8.424 3.123 1.00 4.29 H new ATOM 578 N ALA A 38 -23.635 5.902 2.525 1.00 2.92 N ATOM 579 CA ALA A 38 -23.607 4.635 1.785 1.00 3.44 C ATOM 580 C ALA A 38 -22.411 4.540 0.840 1.00 3.42 C ATOM 581 O ALA A 38 -22.545 4.702 -0.373 1.00 3.69 O ATOM 582 CB ALA A 38 -24.911 4.438 1.016 1.00 4.24 C ATOM 0 H ALA A 38 -23.674 5.786 3.538 1.00 2.92 H new ATOM 0 HA ALA A 38 -23.500 3.837 2.519 1.00 3.44 H new ATOM 0 HB1 ALA A 38 -24.874 3.494 0.473 1.00 4.24 H new ATOM 0 HB2 ALA A 38 -25.747 4.422 1.715 1.00 4.24 H new ATOM 0 HB3 ALA A 38 -25.045 5.258 0.310 1.00 4.24 H new ATOM 588 N GLY A 39 -21.242 4.253 1.396 1.00 3.60 N ATOM 589 CA GLY A 39 -20.049 4.120 0.581 1.00 3.96 C ATOM 590 C GLY A 39 -19.923 2.743 -0.042 1.00 4.53 C ATOM 591 O GLY A 39 -18.918 2.066 0.145 1.00 4.95 O ATOM 0 H GLY A 39 -21.098 4.110 2.396 1.00 3.60 H new ATOM 0 HA2 GLY A 39 -20.066 4.872 -0.208 1.00 3.96 H new ATOM 0 HA3 GLY A 39 -19.170 4.320 1.194 1.00 3.96 H new ATOM 595 N GLY A 40 -20.939 2.327 -0.783 1.00 4.95 N ATOM 596 CA GLY A 40 -20.902 1.027 -1.417 1.00 5.80 C ATOM 597 C GLY A 40 -22.174 0.719 -2.177 1.00 6.36 C ATOM 598 O GLY A 40 -23.108 1.520 -2.181 1.00 6.66 O ATOM 0 H GLY A 40 -21.787 2.866 -0.956 1.00 4.95 H new ATOM 0 HA2 GLY A 40 -20.054 0.983 -2.100 1.00 5.80 H new ATOM 0 HA3 GLY A 40 -20.740 0.261 -0.659 1.00 5.80 H new ATOM 602 N ILE A 41 -22.205 -0.441 -2.825 1.00 6.77 N ATOM 603 CA ILE A 41 -23.374 -0.865 -3.588 1.00 7.49 C ATOM 604 C ILE A 41 -24.489 -1.312 -2.649 1.00 7.34 C ATOM 605 O ILE A 41 -25.659 -0.970 -2.842 1.00 7.90 O ATOM 606 CB ILE A 41 -23.026 -2.016 -4.567 1.00 8.32 C ATOM 607 CG1 ILE A 41 -21.927 -1.571 -5.539 1.00 8.45 C ATOM 608 CG2 ILE A 41 -24.263 -2.472 -5.333 1.00 9.17 C ATOM 609 CD1 ILE A 41 -22.305 -0.371 -6.385 1.00 9.07 C ATOM 0 H ILE A 41 -21.432 -1.106 -2.837 1.00 6.77 H new ATOM 0 HA ILE A 41 -23.712 -0.009 -4.171 1.00 7.49 H new ATOM 0 HB ILE A 41 -22.659 -2.861 -3.985 1.00 8.32 H new ATOM 0 HG12 ILE A 41 -21.027 -1.334 -4.971 1.00 8.45 H new ATOM 0 HG13 ILE A 41 -21.679 -2.404 -6.197 1.00 8.45 H new ATOM 0 HG21 ILE A 41 -23.993 -3.280 -6.013 1.00 9.17 H new ATOM 0 HG22 ILE A 41 -25.016 -2.827 -4.630 1.00 9.17 H new ATOM 0 HG23 ILE A 41 -24.666 -1.636 -5.905 1.00 9.17 H new ATOM 0 HD11 ILE A 41 -21.477 -0.117 -7.047 1.00 9.07 H new ATOM 0 HD12 ILE A 41 -23.186 -0.609 -6.981 1.00 9.07 H new ATOM 0 HD13 ILE A 41 -22.524 0.477 -5.736 1.00 9.07 H new ATOM 621 N THR A 42 -24.120 -2.073 -1.635 1.00 6.77 N ATOM 622 CA THR A 42 -25.065 -2.495 -0.621 1.00 6.78 C ATOM 623 C THR A 42 -25.271 -1.363 0.383 1.00 6.26 C ATOM 624 O THR A 42 -24.338 -0.981 1.090 1.00 6.12 O ATOM 625 CB THR A 42 -24.565 -3.755 0.106 1.00 6.87 C ATOM 626 OG1 THR A 42 -24.051 -4.694 -0.850 1.00 7.36 O ATOM 627 CG2 THR A 42 -25.686 -4.408 0.898 1.00 7.24 C ATOM 0 H THR A 42 -23.169 -2.412 -1.493 1.00 6.77 H new ATOM 0 HA THR A 42 -26.012 -2.735 -1.105 1.00 6.78 H new ATOM 0 HB THR A 42 -23.776 -3.459 0.798 1.00 6.87 H new ATOM 0 HG1 THR A 42 -23.732 -5.494 -0.383 1.00 7.36 H new ATOM 0 HG21 THR A 42 -25.306 -5.296 1.402 1.00 7.24 H new ATOM 0 HG22 THR A 42 -26.065 -3.705 1.639 1.00 7.24 H new ATOM 0 HG23 THR A 42 -26.492 -4.692 0.221 1.00 7.24 H new ATOM 635 N GLN A 43 -26.484 -0.821 0.421 1.00 6.30 N ATOM 636 CA GLN A 43 -26.789 0.338 1.254 1.00 6.20 C ATOM 637 C GLN A 43 -26.617 0.023 2.743 1.00 5.65 C ATOM 638 O GLN A 43 -27.526 -0.486 3.401 1.00 6.00 O ATOM 639 CB GLN A 43 -28.208 0.828 0.963 1.00 7.05 C ATOM 640 CG GLN A 43 -28.579 2.113 1.687 1.00 7.68 C ATOM 641 CD GLN A 43 -29.907 2.675 1.222 1.00 8.40 C ATOM 642 OE1 GLN A 43 -30.292 2.517 0.062 1.00 8.83 O ATOM 643 NE2 GLN A 43 -30.620 3.334 2.119 1.00 8.79 N ATOM 0 H GLN A 43 -27.277 -1.168 -0.119 1.00 6.30 H new ATOM 0 HA GLN A 43 -26.082 1.130 1.008 1.00 6.20 H new ATOM 0 HB2 GLN A 43 -28.315 0.984 -0.110 1.00 7.05 H new ATOM 0 HB3 GLN A 43 -28.916 0.048 1.243 1.00 7.05 H new ATOM 0 HG2 GLN A 43 -28.624 1.923 2.759 1.00 7.68 H new ATOM 0 HG3 GLN A 43 -27.797 2.856 1.527 1.00 7.68 H new ATOM 0 HE21 GLN A 43 -30.268 3.444 3.070 1.00 8.79 H new ATOM 0 HE22 GLN A 43 -31.523 3.733 1.860 1.00 8.79 H new ATOM 652 N HIS A 44 -25.427 0.313 3.250 1.00 5.11 N ATOM 653 CA HIS A 44 -25.100 0.151 4.663 1.00 4.88 C ATOM 654 C HIS A 44 -24.211 1.303 5.097 1.00 4.31 C ATOM 655 O HIS A 44 -23.483 1.868 4.280 1.00 4.61 O ATOM 656 CB HIS A 44 -24.368 -1.175 4.908 1.00 5.23 C ATOM 657 CG HIS A 44 -25.270 -2.358 5.063 1.00 5.70 C ATOM 658 ND1 HIS A 44 -25.801 -3.190 4.141 1.00 6.04 N flip ATOM 659 CD2 HIS A 44 -25.700 -2.821 6.287 1.00 6.21 C flip ATOM 660 CE1 HIS A 44 -26.534 -4.133 4.817 1.00 6.66 C flip ATOM 661 NE2 HIS A 44 -26.457 -3.888 6.111 1.00 6.76 N flip ATOM 0 H HIS A 44 -24.654 0.670 2.689 1.00 5.11 H new ATOM 0 HA HIS A 44 -26.025 0.145 5.240 1.00 4.88 H new ATOM 0 HB2 HIS A 44 -23.687 -1.359 4.077 1.00 5.23 H new ATOM 0 HB3 HIS A 44 -23.757 -1.079 5.806 1.00 5.23 H new ATOM 0 HD2 HIS A 44 -25.456 -2.380 7.242 1.00 6.21 H new ATOM 0 HE1 HIS A 44 -27.084 -4.944 4.363 1.00 6.66 H new ATOM 0 HE2 HIS A 44 -26.906 -4.430 6.849 1.00 6.76 H new ATOM 670 N ILE A 45 -24.272 1.662 6.371 1.00 3.86 N ATOM 671 CA ILE A 45 -23.443 2.744 6.872 1.00 3.48 C ATOM 672 C ILE A 45 -22.083 2.222 7.307 1.00 3.02 C ATOM 673 O ILE A 45 -21.843 1.010 7.334 1.00 3.28 O ATOM 674 CB ILE A 45 -24.094 3.503 8.046 1.00 3.98 C ATOM 675 CG1 ILE A 45 -24.306 2.578 9.242 1.00 4.52 C ATOM 676 CG2 ILE A 45 -25.411 4.127 7.607 1.00 4.50 C ATOM 677 CD1 ILE A 45 -24.548 3.321 10.534 1.00 5.19 C ATOM 0 H ILE A 45 -24.878 1.226 7.066 1.00 3.86 H new ATOM 0 HA ILE A 45 -23.327 3.445 6.046 1.00 3.48 H new ATOM 0 HB ILE A 45 -23.419 4.301 8.355 1.00 3.98 H new ATOM 0 HG12 ILE A 45 -25.155 1.925 9.042 1.00 4.52 H new ATOM 0 HG13 ILE A 45 -23.432 1.938 9.357 1.00 4.52 H new ATOM 0 HG21 ILE A 45 -25.859 4.659 8.446 1.00 4.50 H new ATOM 0 HG22 ILE A 45 -25.228 4.825 6.790 1.00 4.50 H new ATOM 0 HG23 ILE A 45 -26.090 3.344 7.270 1.00 4.50 H new ATOM 0 HD11 ILE A 45 -24.691 2.606 11.344 1.00 5.19 H new ATOM 0 HD12 ILE A 45 -23.689 3.954 10.756 1.00 5.19 H new ATOM 0 HD13 ILE A 45 -25.439 3.941 10.436 1.00 5.19 H new ATOM 689 N GLY A 46 -21.205 3.143 7.655 1.00 2.83 N ATOM 690 CA GLY A 46 -19.838 2.789 7.984 1.00 2.96 C ATOM 691 C GLY A 46 -18.906 3.116 6.838 1.00 2.37 C ATOM 692 O GLY A 46 -17.848 3.712 7.029 1.00 2.97 O ATOM 0 H GLY A 46 -21.413 4.140 7.717 1.00 2.83 H new ATOM 0 HA2 GLY A 46 -19.524 3.327 8.879 1.00 2.96 H new ATOM 0 HA3 GLY A 46 -19.779 1.725 8.214 1.00 2.96 H new ATOM 696 N ALA A 47 -19.316 2.726 5.637 1.00 1.69 N ATOM 697 CA ALA A 47 -18.620 3.122 4.425 1.00 1.33 C ATOM 698 C ALA A 47 -19.076 4.523 4.035 1.00 1.25 C ATOM 699 O ALA A 47 -20.060 5.024 4.585 1.00 1.45 O ATOM 700 CB ALA A 47 -18.889 2.123 3.312 1.00 1.71 C ATOM 0 H ALA A 47 -20.131 2.133 5.479 1.00 1.69 H new ATOM 0 HA ALA A 47 -17.544 3.134 4.598 1.00 1.33 H new ATOM 0 HB1 ALA A 47 -18.361 2.432 2.410 1.00 1.71 H new ATOM 0 HB2 ALA A 47 -18.540 1.136 3.616 1.00 1.71 H new ATOM 0 HB3 ALA A 47 -19.959 2.083 3.110 1.00 1.71 H new ATOM 706 N TYR A 48 -18.405 5.156 3.083 1.00 1.05 N ATOM 707 CA TYR A 48 -18.647 6.566 2.840 1.00 1.04 C ATOM 708 C TYR A 48 -18.334 6.932 1.404 1.00 0.91 C ATOM 709 O TYR A 48 -17.501 6.305 0.749 1.00 0.86 O ATOM 710 CB TYR A 48 -17.810 7.417 3.804 1.00 1.16 C ATOM 711 CG TYR A 48 -16.326 7.335 3.562 1.00 1.12 C ATOM 712 CD1 TYR A 48 -15.707 6.113 3.384 1.00 1.34 C ATOM 713 CD2 TYR A 48 -15.551 8.479 3.498 1.00 1.31 C ATOM 714 CE1 TYR A 48 -14.364 6.024 3.149 1.00 1.77 C ATOM 715 CE2 TYR A 48 -14.197 8.404 3.263 1.00 1.73 C ATOM 716 CZ TYR A 48 -13.606 7.172 3.085 1.00 1.96 C ATOM 717 OH TYR A 48 -12.256 7.085 2.848 1.00 2.54 O ATOM 0 H TYR A 48 -17.704 4.725 2.480 1.00 1.05 H new ATOM 0 HA TYR A 48 -19.704 6.768 3.015 1.00 1.04 H new ATOM 0 HB2 TYR A 48 -18.124 8.457 3.721 1.00 1.16 H new ATOM 0 HB3 TYR A 48 -18.019 7.102 4.826 1.00 1.16 H new ATOM 0 HD1 TYR A 48 -16.297 5.209 3.432 1.00 1.34 H new ATOM 0 HD2 TYR A 48 -16.015 9.445 3.634 1.00 1.31 H new ATOM 0 HE1 TYR A 48 -13.899 5.058 3.014 1.00 1.77 H new ATOM 0 HE2 TYR A 48 -13.602 9.304 3.218 1.00 1.73 H new ATOM 0 HH TYR A 48 -12.103 6.879 1.902 1.00 2.54 H new ATOM 727 N GLN A 49 -19.026 7.935 0.915 1.00 1.01 N ATOM 728 CA GLN A 49 -18.751 8.473 -0.393 1.00 1.00 C ATOM 729 C GLN A 49 -18.080 9.815 -0.237 1.00 1.11 C ATOM 730 O GLN A 49 -18.245 10.488 0.786 1.00 1.34 O ATOM 731 CB GLN A 49 -20.028 8.622 -1.216 1.00 1.16 C ATOM 732 CG GLN A 49 -20.622 7.302 -1.673 1.00 1.18 C ATOM 733 CD GLN A 49 -21.760 7.496 -2.658 1.00 1.42 C ATOM 734 OE1 GLN A 49 -21.694 8.568 -3.431 1.00 1.80 O flip ATOM 735 NE2 GLN A 49 -22.686 6.693 -2.729 1.00 1.96 N flip ATOM 0 H GLN A 49 -19.789 8.397 1.410 1.00 1.01 H new ATOM 0 HA GLN A 49 -18.096 7.783 -0.924 1.00 1.00 H new ATOM 0 HB2 GLN A 49 -20.770 9.158 -0.624 1.00 1.16 H new ATOM 0 HB3 GLN A 49 -19.815 9.236 -2.091 1.00 1.16 H new ATOM 0 HG2 GLN A 49 -19.843 6.696 -2.135 1.00 1.18 H new ATOM 0 HG3 GLN A 49 -20.984 6.749 -0.806 1.00 1.18 H new ATOM 0 HE21 GLN A 49 -22.702 5.878 -2.116 1.00 1.96 H new ATOM 0 HE22 GLN A 49 -23.439 6.841 -3.401 1.00 1.96 H new ATOM 744 N VAL A 50 -17.313 10.180 -1.233 1.00 1.04 N ATOM 745 CA VAL A 50 -16.613 11.440 -1.246 1.00 1.18 C ATOM 746 C VAL A 50 -17.473 12.489 -1.961 1.00 1.28 C ATOM 747 O VAL A 50 -18.512 12.141 -2.529 1.00 1.38 O ATOM 748 CB VAL A 50 -15.208 11.241 -1.882 1.00 1.24 C ATOM 749 CG1 VAL A 50 -14.450 12.534 -2.093 1.00 1.93 C ATOM 750 CG2 VAL A 50 -14.396 10.337 -0.990 1.00 1.59 C ATOM 0 H VAL A 50 -17.156 9.608 -2.063 1.00 1.04 H new ATOM 0 HA VAL A 50 -16.446 11.811 -0.235 1.00 1.18 H new ATOM 0 HB VAL A 50 -15.364 10.803 -2.868 1.00 1.24 H new ATOM 0 HG11 VAL A 50 -13.479 12.318 -2.540 1.00 1.93 H new ATOM 0 HG12 VAL A 50 -15.019 13.185 -2.757 1.00 1.93 H new ATOM 0 HG13 VAL A 50 -14.305 13.032 -1.134 1.00 1.93 H new ATOM 0 HG21 VAL A 50 -13.408 10.189 -1.425 1.00 1.59 H new ATOM 0 HG22 VAL A 50 -14.295 10.793 -0.005 1.00 1.59 H new ATOM 0 HG23 VAL A 50 -14.898 9.374 -0.894 1.00 1.59 H new ATOM 760 N THR A 51 -17.052 13.746 -1.922 1.00 1.42 N ATOM 761 CA THR A 51 -17.889 14.877 -2.325 1.00 1.57 C ATOM 762 C THR A 51 -18.516 14.713 -3.720 1.00 1.83 C ATOM 763 O THR A 51 -18.066 13.937 -4.554 1.00 2.06 O ATOM 764 CB THR A 51 -17.103 16.211 -2.188 1.00 1.67 C ATOM 765 OG1 THR A 51 -17.642 16.957 -1.087 1.00 1.94 O ATOM 766 CG2 THR A 51 -17.135 17.069 -3.455 1.00 1.88 C ATOM 0 H THR A 51 -16.119 14.015 -1.610 1.00 1.42 H new ATOM 0 HA THR A 51 -18.735 14.904 -1.639 1.00 1.57 H new ATOM 0 HB THR A 51 -16.058 15.954 -2.016 1.00 1.67 H new ATOM 0 HG1 THR A 51 -18.326 16.422 -0.633 1.00 1.94 H new ATOM 0 HG21 THR A 51 -16.567 17.984 -3.289 1.00 1.88 H new ATOM 0 HG22 THR A 51 -16.694 16.513 -4.282 1.00 1.88 H new ATOM 0 HG23 THR A 51 -18.167 17.321 -3.698 1.00 1.88 H new ATOM 774 N VAL A 52 -19.554 15.483 -3.962 1.00 2.18 N ATOM 775 CA VAL A 52 -20.465 15.227 -5.058 1.00 2.71 C ATOM 776 C VAL A 52 -20.176 16.136 -6.216 1.00 2.73 C ATOM 777 O VAL A 52 -20.068 17.349 -6.040 1.00 2.83 O ATOM 778 CB VAL A 52 -21.932 15.404 -4.629 1.00 3.49 C ATOM 779 CG1 VAL A 52 -22.174 16.782 -4.025 1.00 4.12 C ATOM 780 CG2 VAL A 52 -22.870 15.158 -5.805 1.00 3.97 C ATOM 0 H VAL A 52 -19.791 16.304 -3.405 1.00 2.18 H new ATOM 0 HA VAL A 52 -20.313 14.191 -5.362 1.00 2.71 H new ATOM 0 HB VAL A 52 -22.143 14.663 -3.858 1.00 3.49 H new ATOM 0 HG11 VAL A 52 -23.220 16.873 -3.733 1.00 4.12 H new ATOM 0 HG12 VAL A 52 -21.540 16.911 -3.148 1.00 4.12 H new ATOM 0 HG13 VAL A 52 -21.935 17.549 -4.762 1.00 4.12 H new ATOM 0 HG21 VAL A 52 -23.902 15.288 -5.480 1.00 3.97 H new ATOM 0 HG22 VAL A 52 -22.648 15.868 -6.602 1.00 3.97 H new ATOM 0 HG23 VAL A 52 -22.731 14.142 -6.175 1.00 3.97 H new ATOM 790 N ASN A 53 -20.010 15.535 -7.386 1.00 2.87 N ATOM 791 CA ASN A 53 -19.723 16.271 -8.608 1.00 2.97 C ATOM 792 C ASN A 53 -18.317 16.865 -8.567 1.00 2.55 C ATOM 793 O ASN A 53 -17.655 16.979 -9.594 1.00 2.91 O ATOM 794 CB ASN A 53 -20.774 17.346 -8.841 1.00 3.48 C ATOM 795 CG ASN A 53 -21.556 17.136 -10.124 1.00 3.97 C ATOM 796 OD1 ASN A 53 -22.570 16.437 -10.133 1.00 4.43 O ATOM 797 ND2 ASN A 53 -21.101 17.738 -11.210 1.00 4.21 N ATOM 0 H ASN A 53 -20.070 14.525 -7.514 1.00 2.87 H new ATOM 0 HA ASN A 53 -19.762 15.577 -9.448 1.00 2.97 H new ATOM 0 HB2 ASN A 53 -21.465 17.361 -7.998 1.00 3.48 H new ATOM 0 HB3 ASN A 53 -20.289 18.321 -8.872 1.00 3.48 H new ATOM 0 HD21 ASN A 53 -21.594 17.632 -12.097 1.00 4.21 H new ATOM 0 HD22 ASN A 53 -20.257 18.309 -11.161 1.00 4.21 H new ATOM 804 N ASP A 54 -17.850 17.209 -7.368 1.00 2.17 N ATOM 805 CA ASP A 54 -16.493 17.702 -7.202 1.00 2.21 C ATOM 806 C ASP A 54 -15.514 16.555 -7.039 1.00 2.44 C ATOM 807 O ASP A 54 -14.460 16.548 -7.672 1.00 3.17 O ATOM 808 CB ASP A 54 -16.362 18.670 -6.043 1.00 2.57 C ATOM 809 CG ASP A 54 -14.923 19.124 -5.833 1.00 3.06 C ATOM 810 OD1 ASP A 54 -14.384 19.835 -6.705 1.00 3.37 O ATOM 811 OD2 ASP A 54 -14.319 18.768 -4.798 1.00 3.62 O ATOM 0 H ASP A 54 -18.391 17.154 -6.505 1.00 2.17 H new ATOM 0 HA ASP A 54 -16.251 18.251 -8.112 1.00 2.21 H new ATOM 0 HB2 ASP A 54 -16.993 19.540 -6.225 1.00 2.57 H new ATOM 0 HB3 ASP A 54 -16.728 18.196 -5.132 1.00 2.57 H new ATOM 816 N LYS A 55 -15.853 15.581 -6.197 1.00 2.26 N ATOM 817 CA LYS A 55 -14.960 14.438 -5.996 1.00 2.71 C ATOM 818 C LYS A 55 -15.719 13.115 -6.044 1.00 2.17 C ATOM 819 O LYS A 55 -15.913 12.466 -5.020 1.00 2.81 O ATOM 820 CB LYS A 55 -14.226 14.567 -4.663 1.00 3.83 C ATOM 821 CG LYS A 55 -13.319 15.782 -4.559 1.00 4.80 C ATOM 822 CD LYS A 55 -12.134 15.688 -5.504 1.00 5.76 C ATOM 823 CE LYS A 55 -11.169 16.841 -5.289 1.00 6.66 C ATOM 824 NZ LYS A 55 -11.766 18.155 -5.654 1.00 7.44 N ATOM 0 H LYS A 55 -16.716 15.556 -5.655 1.00 2.26 H new ATOM 0 HA LYS A 55 -14.235 14.440 -6.810 1.00 2.71 H new ATOM 0 HB2 LYS A 55 -14.962 14.609 -3.860 1.00 3.83 H new ATOM 0 HB3 LYS A 55 -13.629 13.669 -4.503 1.00 3.83 H new ATOM 0 HG2 LYS A 55 -13.891 16.682 -4.783 1.00 4.80 H new ATOM 0 HG3 LYS A 55 -12.959 15.880 -3.535 1.00 4.80 H new ATOM 0 HD2 LYS A 55 -11.615 14.742 -5.348 1.00 5.76 H new ATOM 0 HD3 LYS A 55 -12.486 15.692 -6.535 1.00 5.76 H new ATOM 0 HE2 LYS A 55 -10.860 16.863 -4.244 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -10.271 16.675 -5.884 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -11.070 18.910 -5.490 1.00 7.44 H new ATOM 0 HZ2 LYS A 55 -12.037 18.146 -6.658 1.00 7.44 H new ATOM 0 HZ3 LYS A 55 -12.608 18.328 -5.069 1.00 7.44 H new ATOM 838 N LYS A 56 -16.130 12.719 -7.243 1.00 1.66 N ATOM 839 CA LYS A 56 -16.913 11.495 -7.432 1.00 1.89 C ATOM 840 C LYS A 56 -16.104 10.241 -7.096 1.00 1.55 C ATOM 841 O LYS A 56 -15.524 9.610 -7.979 1.00 1.86 O ATOM 842 CB LYS A 56 -17.413 11.413 -8.878 1.00 2.73 C ATOM 843 CG LYS A 56 -18.503 12.422 -9.213 1.00 3.49 C ATOM 844 CD LYS A 56 -18.819 12.430 -10.701 1.00 4.29 C ATOM 845 CE LYS A 56 -19.123 11.033 -11.228 1.00 4.99 C ATOM 846 NZ LYS A 56 -20.363 10.456 -10.640 1.00 5.43 N ATOM 0 H LYS A 56 -15.935 13.228 -8.105 1.00 1.66 H new ATOM 0 HA LYS A 56 -17.760 11.539 -6.748 1.00 1.89 H new ATOM 0 HB2 LYS A 56 -16.570 11.566 -9.552 1.00 2.73 H new ATOM 0 HB3 LYS A 56 -17.792 10.408 -9.064 1.00 2.73 H new ATOM 0 HG2 LYS A 56 -19.405 12.184 -8.650 1.00 3.49 H new ATOM 0 HG3 LYS A 56 -18.186 13.418 -8.902 1.00 3.49 H new ATOM 0 HD2 LYS A 56 -19.673 13.081 -10.887 1.00 4.29 H new ATOM 0 HD3 LYS A 56 -17.974 12.848 -11.249 1.00 4.29 H new ATOM 0 HE2 LYS A 56 -19.224 11.072 -12.313 1.00 4.99 H new ATOM 0 HE3 LYS A 56 -18.282 10.375 -11.009 1.00 4.99 H new ATOM 0 HZ1 LYS A 56 -20.460 9.465 -10.939 1.00 5.43 H new ATOM 0 HZ2 LYS A 56 -20.309 10.501 -9.602 1.00 5.43 H new ATOM 0 HZ3 LYS A 56 -21.188 10.999 -10.967 1.00 5.43 H new ATOM 860 N ILE A 57 -16.068 9.893 -5.814 1.00 1.14 N ATOM 861 CA ILE A 57 -15.365 8.702 -5.349 1.00 0.88 C ATOM 862 C ILE A 57 -16.183 7.995 -4.269 1.00 0.85 C ATOM 863 O ILE A 57 -16.605 8.615 -3.296 1.00 0.97 O ATOM 864 CB ILE A 57 -13.984 9.045 -4.747 1.00 0.80 C ATOM 865 CG1 ILE A 57 -13.155 9.910 -5.705 1.00 0.86 C ATOM 866 CG2 ILE A 57 -13.236 7.763 -4.421 1.00 0.87 C ATOM 867 CD1 ILE A 57 -11.841 10.376 -5.112 1.00 0.86 C ATOM 0 H ILE A 57 -16.522 10.425 -5.072 1.00 1.14 H new ATOM 0 HA ILE A 57 -15.227 8.059 -6.218 1.00 0.88 H new ATOM 0 HB ILE A 57 -14.143 9.618 -3.834 1.00 0.80 H new ATOM 0 HG12 ILE A 57 -12.954 9.342 -6.613 1.00 0.86 H new ATOM 0 HG13 ILE A 57 -13.742 10.781 -5.997 1.00 0.86 H new ATOM 0 HG21 ILE A 57 -12.262 8.008 -3.997 1.00 0.87 H new ATOM 0 HG22 ILE A 57 -13.810 7.180 -3.700 1.00 0.87 H new ATOM 0 HG23 ILE A 57 -13.099 7.180 -5.332 1.00 0.87 H new ATOM 0 HD11 ILE A 57 -11.307 10.982 -5.843 1.00 0.86 H new ATOM 0 HD12 ILE A 57 -12.035 10.971 -4.220 1.00 0.86 H new ATOM 0 HD13 ILE A 57 -11.235 9.510 -4.846 1.00 0.86 H new ATOM 879 N THR A 58 -16.413 6.709 -4.445 1.00 0.80 N ATOM 880 CA THR A 58 -17.042 5.899 -3.414 1.00 0.80 C ATOM 881 C THR A 58 -15.989 5.012 -2.763 1.00 0.73 C ATOM 882 O THR A 58 -15.211 4.379 -3.468 1.00 0.85 O ATOM 883 CB THR A 58 -18.162 5.020 -4.008 1.00 0.88 C ATOM 884 OG1 THR A 58 -19.157 5.848 -4.616 1.00 1.11 O ATOM 885 CG2 THR A 58 -18.813 4.153 -2.944 1.00 1.28 C ATOM 0 H THR A 58 -16.174 6.198 -5.295 1.00 0.80 H new ATOM 0 HA THR A 58 -17.485 6.562 -2.671 1.00 0.80 H new ATOM 0 HB THR A 58 -17.712 4.366 -4.755 1.00 0.88 H new ATOM 0 HG1 THR A 58 -19.090 6.757 -4.257 1.00 1.11 H new ATOM 0 HG21 THR A 58 -19.597 3.547 -3.398 1.00 1.28 H new ATOM 0 HG22 THR A 58 -18.063 3.500 -2.497 1.00 1.28 H new ATOM 0 HG23 THR A 58 -19.247 4.789 -2.172 1.00 1.28 H new ATOM 893 N PHE A 59 -15.939 4.971 -1.436 1.00 0.65 N ATOM 894 CA PHE A 59 -14.923 4.172 -0.772 1.00 0.64 C ATOM 895 C PHE A 59 -15.549 3.056 0.035 1.00 0.73 C ATOM 896 O PHE A 59 -16.200 3.298 1.054 1.00 0.83 O ATOM 897 CB PHE A 59 -14.042 5.030 0.132 1.00 0.64 C ATOM 898 CG PHE A 59 -13.012 5.840 -0.598 1.00 0.60 C ATOM 899 CD1 PHE A 59 -11.962 5.216 -1.250 1.00 0.75 C ATOM 900 CD2 PHE A 59 -13.079 7.220 -0.614 1.00 0.80 C ATOM 901 CE1 PHE A 59 -11.001 5.955 -1.906 1.00 0.79 C ATOM 902 CE2 PHE A 59 -12.120 7.965 -1.271 1.00 0.84 C ATOM 903 CZ PHE A 59 -11.078 7.331 -1.918 1.00 0.70 C ATOM 0 H PHE A 59 -16.575 5.470 -0.814 1.00 0.65 H new ATOM 0 HA PHE A 59 -14.298 3.736 -1.552 1.00 0.64 H new ATOM 0 HB2 PHE A 59 -14.678 5.704 0.705 1.00 0.64 H new ATOM 0 HB3 PHE A 59 -13.537 4.382 0.848 1.00 0.64 H new ATOM 0 HD1 PHE A 59 -11.895 4.138 -1.245 1.00 0.75 H new ATOM 0 HD2 PHE A 59 -13.890 7.721 -0.107 1.00 0.80 H new ATOM 0 HE1 PHE A 59 -10.187 5.456 -2.411 1.00 0.79 H new ATOM 0 HE2 PHE A 59 -12.185 9.043 -1.279 1.00 0.84 H new ATOM 0 HZ PHE A 59 -10.326 7.911 -2.432 1.00 0.70 H new ATOM 913 N LEU A 60 -15.355 1.834 -0.428 1.00 0.85 N ATOM 914 CA LEU A 60 -15.834 0.672 0.290 1.00 1.00 C ATOM 915 C LEU A 60 -14.664 -0.198 0.715 1.00 1.96 C ATOM 916 O LEU A 60 -13.937 -0.738 -0.122 1.00 2.78 O ATOM 917 CB LEU A 60 -16.810 -0.144 -0.563 1.00 1.51 C ATOM 918 CG LEU A 60 -17.387 -1.388 0.127 1.00 2.10 C ATOM 919 CD1 LEU A 60 -18.066 -1.012 1.435 1.00 2.68 C ATOM 920 CD2 LEU A 60 -18.366 -2.105 -0.788 1.00 3.00 C ATOM 0 H LEU A 60 -14.868 1.623 -1.299 1.00 0.85 H new ATOM 0 HA LEU A 60 -16.366 1.019 1.176 1.00 1.00 H new ATOM 0 HB2 LEU A 60 -17.635 0.502 -0.864 1.00 1.51 H new ATOM 0 HB3 LEU A 60 -16.300 -0.456 -1.475 1.00 1.51 H new ATOM 0 HG LEU A 60 -16.562 -2.065 0.348 1.00 2.10 H new ATOM 0 HD11 LEU A 60 -18.468 -1.908 1.907 1.00 2.68 H new ATOM 0 HD12 LEU A 60 -17.340 -0.545 2.101 1.00 2.68 H new ATOM 0 HD13 LEU A 60 -18.878 -0.312 1.236 1.00 2.68 H new ATOM 0 HD21 LEU A 60 -18.763 -2.984 -0.279 1.00 3.00 H new ATOM 0 HD22 LEU A 60 -19.185 -1.432 -1.043 1.00 3.00 H new ATOM 0 HD23 LEU A 60 -17.853 -2.414 -1.699 1.00 3.00 H new ATOM 932 N ASP A 61 -14.468 -0.296 2.014 1.00 2.55 N ATOM 933 CA ASP A 61 -13.505 -1.225 2.571 1.00 3.74 C ATOM 934 C ASP A 61 -14.258 -2.364 3.226 1.00 3.82 C ATOM 935 O ASP A 61 -15.206 -2.138 3.982 1.00 3.97 O ATOM 936 CB ASP A 61 -12.591 -0.538 3.583 1.00 4.77 C ATOM 937 CG ASP A 61 -11.593 -1.501 4.197 1.00 5.89 C ATOM 938 OD1 ASP A 61 -11.040 -2.343 3.457 1.00 6.37 O ATOM 939 OD2 ASP A 61 -11.341 -1.410 5.415 1.00 6.48 O ATOM 0 H ASP A 61 -14.967 0.260 2.708 1.00 2.55 H new ATOM 0 HA ASP A 61 -12.871 -1.606 1.771 1.00 3.74 H new ATOM 0 HB2 ASP A 61 -12.055 0.275 3.093 1.00 4.77 H new ATOM 0 HB3 ASP A 61 -13.196 -0.091 4.372 1.00 4.77 H new ATOM 944 N THR A 62 -13.862 -3.581 2.918 1.00 4.12 N ATOM 945 CA THR A 62 -14.579 -4.744 3.400 1.00 4.33 C ATOM 946 C THR A 62 -13.678 -5.620 4.265 1.00 4.42 C ATOM 947 O THR A 62 -12.903 -6.430 3.751 1.00 4.82 O ATOM 948 CB THR A 62 -15.125 -5.571 2.222 1.00 5.07 C ATOM 949 OG1 THR A 62 -15.819 -4.709 1.312 1.00 5.52 O ATOM 950 CG2 THR A 62 -16.071 -6.661 2.708 1.00 5.57 C ATOM 0 H THR A 62 -13.050 -3.791 2.338 1.00 4.12 H new ATOM 0 HA THR A 62 -15.413 -4.392 4.006 1.00 4.33 H new ATOM 0 HB THR A 62 -14.283 -6.046 1.718 1.00 5.07 H new ATOM 0 HG1 THR A 62 -16.165 -5.236 0.562 1.00 5.52 H new ATOM 0 HG21 THR A 62 -16.441 -7.229 1.854 1.00 5.57 H new ATOM 0 HG22 THR A 62 -15.539 -7.329 3.385 1.00 5.57 H new ATOM 0 HG23 THR A 62 -16.911 -6.206 3.233 1.00 5.57 H new ATOM 958 N PRO A 63 -13.767 -5.463 5.598 1.00 4.51 N ATOM 959 CA PRO A 63 -13.027 -6.288 6.555 1.00 5.03 C ATOM 960 C PRO A 63 -13.645 -7.680 6.686 1.00 5.20 C ATOM 961 O PRO A 63 -13.816 -8.202 7.788 1.00 5.77 O ATOM 962 CB PRO A 63 -13.145 -5.516 7.883 1.00 5.50 C ATOM 963 CG PRO A 63 -13.813 -4.220 7.547 1.00 5.27 C ATOM 964 CD PRO A 63 -14.584 -4.459 6.283 1.00 4.66 C ATOM 0 HA PRO A 63 -11.994 -6.449 6.247 1.00 5.03 H new ATOM 0 HB2 PRO A 63 -13.729 -6.079 8.611 1.00 5.50 H new ATOM 0 HB3 PRO A 63 -12.163 -5.346 8.324 1.00 5.50 H new ATOM 0 HG2 PRO A 63 -14.476 -3.904 8.353 1.00 5.27 H new ATOM 0 HG3 PRO A 63 -13.077 -3.428 7.410 1.00 5.27 H new ATOM 0 HD2 PRO A 63 -15.591 -4.824 6.485 1.00 4.66 H new ATOM 0 HD3 PRO A 63 -14.688 -3.549 5.693 1.00 4.66 H new ATOM 972 N GLY A 64 -13.978 -8.265 5.547 1.00 5.00 N ATOM 973 CA GLY A 64 -14.566 -9.583 5.517 1.00 5.40 C ATOM 974 C GLY A 64 -13.812 -10.497 4.582 1.00 5.25 C ATOM 975 O GLY A 64 -14.318 -10.862 3.521 1.00 5.54 O ATOM 0 H GLY A 64 -13.848 -7.840 4.629 1.00 5.00 H new ATOM 0 HA2 GLY A 64 -14.567 -10.006 6.521 1.00 5.40 H new ATOM 0 HA3 GLY A 64 -15.607 -9.513 5.200 1.00 5.40 H new ATOM 979 N HIS A 65 -12.594 -10.852 4.988 1.00 5.14 N ATOM 980 CA HIS A 65 -11.695 -11.704 4.204 1.00 5.24 C ATOM 981 C HIS A 65 -11.178 -10.965 2.969 1.00 4.67 C ATOM 982 O HIS A 65 -10.011 -10.578 2.911 1.00 4.91 O ATOM 983 CB HIS A 65 -12.377 -13.017 3.789 1.00 5.90 C ATOM 984 CG HIS A 65 -13.041 -13.735 4.922 1.00 6.66 C ATOM 985 ND1 HIS A 65 -14.336 -14.191 4.858 1.00 7.35 N ATOM 986 CD2 HIS A 65 -12.590 -14.059 6.158 1.00 7.14 C ATOM 987 CE1 HIS A 65 -14.658 -14.760 6.004 1.00 8.09 C ATOM 988 NE2 HIS A 65 -13.616 -14.695 6.814 1.00 7.99 N ATOM 0 H HIS A 65 -12.197 -10.554 5.879 1.00 5.14 H new ATOM 0 HA HIS A 65 -10.848 -11.951 4.844 1.00 5.24 H new ATOM 0 HB2 HIS A 65 -13.120 -12.803 3.021 1.00 5.90 H new ATOM 0 HB3 HIS A 65 -11.634 -13.675 3.339 1.00 5.90 H new ATOM 0 HD2 HIS A 65 -11.606 -13.855 6.554 1.00 7.14 H new ATOM 0 HE1 HIS A 65 -15.613 -15.205 6.240 1.00 8.09 H new ATOM 0 HE2 HIS A 65 -13.580 -15.057 7.767 1.00 7.99 H new ATOM 997 N GLU A 66 -12.055 -10.754 1.998 1.00 4.31 N ATOM 998 CA GLU A 66 -11.682 -10.106 0.749 1.00 4.06 C ATOM 999 C GLU A 66 -12.693 -9.017 0.401 1.00 3.33 C ATOM 1000 O GLU A 66 -13.901 -9.244 0.429 1.00 3.69 O ATOM 1001 CB GLU A 66 -11.602 -11.140 -0.378 1.00 4.70 C ATOM 1002 CG GLU A 66 -10.521 -12.188 -0.161 1.00 5.39 C ATOM 1003 CD GLU A 66 -10.586 -13.308 -1.177 1.00 5.92 C ATOM 1004 OE1 GLU A 66 -11.321 -14.289 -0.947 1.00 6.21 O ATOM 1005 OE2 GLU A 66 -9.888 -13.218 -2.205 1.00 6.36 O ATOM 0 H GLU A 66 -13.037 -11.025 2.052 1.00 4.31 H new ATOM 0 HA GLU A 66 -10.701 -9.646 0.869 1.00 4.06 H new ATOM 0 HB2 GLU A 66 -12.567 -11.638 -0.473 1.00 4.70 H new ATOM 0 HB3 GLU A 66 -11.415 -10.625 -1.320 1.00 4.70 H new ATOM 0 HG2 GLU A 66 -9.542 -11.711 -0.213 1.00 5.39 H new ATOM 0 HG3 GLU A 66 -10.620 -12.605 0.841 1.00 5.39 H new ATOM 1012 N ALA A 67 -12.181 -7.833 0.078 1.00 2.88 N ATOM 1013 CA ALA A 67 -13.024 -6.671 -0.197 1.00 2.74 C ATOM 1014 C ALA A 67 -13.794 -6.821 -1.506 1.00 2.07 C ATOM 1015 O ALA A 67 -14.868 -6.247 -1.671 1.00 2.63 O ATOM 1016 CB ALA A 67 -12.180 -5.404 -0.220 1.00 3.51 C ATOM 0 H ALA A 67 -11.180 -7.651 -0.000 1.00 2.88 H new ATOM 0 HA ALA A 67 -13.758 -6.599 0.605 1.00 2.74 H new ATOM 0 HB1 ALA A 67 -12.819 -4.545 -0.426 1.00 3.51 H new ATOM 0 HB2 ALA A 67 -11.695 -5.272 0.747 1.00 3.51 H new ATOM 0 HB3 ALA A 67 -11.421 -5.486 -0.998 1.00 3.51 H new ATOM 1022 N PHE A 68 -13.250 -7.595 -2.433 1.00 1.52 N ATOM 1023 CA PHE A 68 -13.914 -7.828 -3.710 1.00 1.22 C ATOM 1024 C PHE A 68 -14.929 -8.958 -3.589 1.00 1.89 C ATOM 1025 O PHE A 68 -14.747 -10.033 -4.161 1.00 2.61 O ATOM 1026 CB PHE A 68 -12.896 -8.167 -4.799 1.00 1.13 C ATOM 1027 CG PHE A 68 -12.513 -7.015 -5.682 1.00 0.93 C ATOM 1028 CD1 PHE A 68 -13.098 -5.771 -5.495 1.00 1.43 C ATOM 1029 CD2 PHE A 68 -11.566 -7.163 -6.683 1.00 0.87 C ATOM 1030 CE1 PHE A 68 -12.742 -4.698 -6.290 1.00 1.62 C ATOM 1031 CE2 PHE A 68 -11.211 -6.095 -7.483 1.00 1.14 C ATOM 1032 CZ PHE A 68 -11.814 -4.903 -7.347 1.00 1.40 C ATOM 0 H PHE A 68 -12.354 -8.071 -2.327 1.00 1.52 H new ATOM 0 HA PHE A 68 -14.434 -6.911 -3.987 1.00 1.22 H new ATOM 0 HB2 PHE A 68 -11.996 -8.559 -4.326 1.00 1.13 H new ATOM 0 HB3 PHE A 68 -13.302 -8.964 -5.421 1.00 1.13 H new ATOM 0 HD1 PHE A 68 -13.839 -5.640 -4.720 1.00 1.43 H new ATOM 0 HD2 PHE A 68 -11.100 -8.125 -6.839 1.00 0.87 H new ATOM 0 HE1 PHE A 68 -13.162 -3.719 -6.111 1.00 1.62 H new ATOM 0 HE2 PHE A 68 -10.439 -6.220 -8.227 1.00 1.14 H new ATOM 0 HZ PHE A 68 -11.595 -4.103 -8.038 1.00 1.40 H new ATOM 1042 N THR A 69 -15.993 -8.714 -2.842 1.00 2.35 N ATOM 1043 CA THR A 69 -17.022 -9.717 -2.636 1.00 3.23 C ATOM 1044 C THR A 69 -18.400 -9.163 -2.994 1.00 3.47 C ATOM 1045 O THR A 69 -18.825 -8.144 -2.450 1.00 3.95 O ATOM 1046 CB THR A 69 -17.024 -10.218 -1.176 1.00 4.06 C ATOM 1047 OG1 THR A 69 -15.735 -10.757 -0.844 1.00 4.44 O ATOM 1048 CG2 THR A 69 -18.089 -11.283 -0.966 1.00 4.74 C ATOM 0 H THR A 69 -16.166 -7.828 -2.368 1.00 2.35 H new ATOM 0 HA THR A 69 -16.798 -10.558 -3.293 1.00 3.23 H new ATOM 0 HB THR A 69 -17.248 -9.372 -0.526 1.00 4.06 H new ATOM 0 HG1 THR A 69 -15.190 -10.063 -0.418 1.00 4.44 H new ATOM 0 HG21 THR A 69 -18.069 -11.618 0.071 1.00 4.74 H new ATOM 0 HG22 THR A 69 -19.070 -10.866 -1.193 1.00 4.74 H new ATOM 0 HG23 THR A 69 -17.893 -12.129 -1.625 1.00 4.74 H new ATOM 1056 N THR A 70 -19.083 -9.844 -3.917 1.00 3.68 N ATOM 1057 CA THR A 70 -20.434 -9.478 -4.359 1.00 4.33 C ATOM 1058 C THR A 70 -20.551 -8.002 -4.747 1.00 4.42 C ATOM 1059 O THR A 70 -21.580 -7.360 -4.507 1.00 5.01 O ATOM 1060 CB THR A 70 -21.506 -9.831 -3.294 1.00 5.25 C ATOM 1061 OG1 THR A 70 -21.126 -9.345 -1.998 1.00 5.60 O ATOM 1062 CG2 THR A 70 -21.725 -11.335 -3.228 1.00 5.89 C ATOM 0 H THR A 70 -18.712 -10.672 -4.383 1.00 3.68 H new ATOM 0 HA THR A 70 -20.621 -10.072 -5.254 1.00 4.33 H new ATOM 0 HB THR A 70 -22.436 -9.347 -3.592 1.00 5.25 H new ATOM 0 HG1 THR A 70 -20.478 -8.617 -2.099 1.00 5.60 H new ATOM 0 HG21 THR A 70 -22.480 -11.560 -2.475 1.00 5.89 H new ATOM 0 HG22 THR A 70 -22.062 -11.697 -4.199 1.00 5.89 H new ATOM 0 HG23 THR A 70 -20.790 -11.828 -2.962 1.00 5.89 H new ATOM 1070 N MET A 71 -19.506 -7.465 -5.363 1.00 4.24 N ATOM 1071 CA MET A 71 -19.524 -6.080 -5.799 1.00 4.73 C ATOM 1072 C MET A 71 -18.944 -5.928 -7.196 1.00 5.29 C ATOM 1073 O MET A 71 -17.748 -6.115 -7.410 1.00 5.64 O ATOM 1074 CB MET A 71 -18.762 -5.182 -4.822 1.00 4.83 C ATOM 1075 CG MET A 71 -18.722 -3.725 -5.261 1.00 4.67 C ATOM 1076 SD MET A 71 -17.935 -2.643 -4.054 1.00 4.68 S ATOM 1077 CE MET A 71 -16.334 -3.429 -3.885 1.00 4.52 C ATOM 0 H MET A 71 -18.642 -7.966 -5.570 1.00 4.24 H new ATOM 0 HA MET A 71 -20.568 -5.768 -5.822 1.00 4.73 H new ATOM 0 HB2 MET A 71 -19.228 -5.247 -3.839 1.00 4.83 H new ATOM 0 HB3 MET A 71 -17.742 -5.552 -4.717 1.00 4.83 H new ATOM 0 HG2 MET A 71 -18.188 -3.652 -6.208 1.00 4.67 H new ATOM 0 HG3 MET A 71 -19.739 -3.378 -5.442 1.00 4.67 H new ATOM 0 HE1 MET A 71 -15.649 -2.753 -3.373 1.00 4.52 H new ATOM 0 HE2 MET A 71 -16.438 -4.347 -3.306 1.00 4.52 H new ATOM 0 HE3 MET A 71 -15.939 -3.666 -4.873 1.00 4.52 H new ATOM 1087 N ARG A 72 -19.811 -5.608 -8.144 1.00 5.68 N ATOM 1088 CA ARG A 72 -19.386 -5.262 -9.494 1.00 6.44 C ATOM 1089 C ARG A 72 -20.217 -4.099 -10.010 1.00 6.64 C ATOM 1090 O ARG A 72 -20.294 -3.860 -11.217 1.00 7.15 O ATOM 1091 CB ARG A 72 -19.514 -6.458 -10.438 1.00 7.03 C ATOM 1092 CG ARG A 72 -20.923 -7.021 -10.542 1.00 7.56 C ATOM 1093 CD ARG A 72 -21.002 -8.128 -11.580 1.00 8.19 C ATOM 1094 NE ARG A 72 -19.972 -9.149 -11.373 1.00 8.54 N ATOM 1095 CZ ARG A 72 -20.154 -10.454 -11.587 1.00 9.20 C ATOM 1096 NH1 ARG A 72 -21.325 -10.909 -12.017 1.00 9.56 N ATOM 1097 NH2 ARG A 72 -19.159 -11.308 -11.380 1.00 9.71 N ATOM 0 H ARG A 72 -20.821 -5.580 -8.003 1.00 5.68 H new ATOM 0 HA ARG A 72 -18.336 -4.972 -9.459 1.00 6.44 H new ATOM 0 HB2 ARG A 72 -19.179 -6.160 -11.432 1.00 7.03 H new ATOM 0 HB3 ARG A 72 -18.843 -7.248 -10.099 1.00 7.03 H new ATOM 0 HG2 ARG A 72 -21.235 -7.407 -9.572 1.00 7.56 H new ATOM 0 HG3 ARG A 72 -21.617 -6.223 -10.805 1.00 7.56 H new ATOM 0 HD2 ARG A 72 -21.987 -8.593 -11.540 1.00 8.19 H new ATOM 0 HD3 ARG A 72 -20.893 -7.699 -12.576 1.00 8.19 H new ATOM 0 HE ARG A 72 -19.056 -8.843 -11.044 1.00 8.54 H new ATOM 0 HH11 ARG A 72 -22.093 -10.260 -12.186 1.00 9.56 H new ATOM 0 HH12 ARG A 72 -21.456 -11.908 -12.178 1.00 9.56 H new ATOM 0 HH21 ARG A 72 -18.253 -10.967 -11.057 1.00 9.71 H new ATOM 0 HH22 ARG A 72 -19.300 -12.305 -11.544 1.00 9.71 H new ATOM 1111 N ALA A 73 -20.831 -3.379 -9.071 1.00 6.52 N ATOM 1112 CA ALA A 73 -21.709 -2.261 -9.392 1.00 6.92 C ATOM 1113 C ALA A 73 -22.864 -2.728 -10.266 1.00 6.65 C ATOM 1114 O ALA A 73 -23.148 -3.922 -10.357 1.00 6.71 O ATOM 1115 CB ALA A 73 -20.928 -1.139 -10.068 1.00 7.52 C ATOM 0 H ALA A 73 -20.732 -3.556 -8.071 1.00 6.52 H new ATOM 0 HA ALA A 73 -22.123 -1.867 -8.464 1.00 6.92 H new ATOM 0 HB1 ALA A 73 -21.602 -0.314 -10.299 1.00 7.52 H new ATOM 0 HB2 ALA A 73 -20.142 -0.789 -9.399 1.00 7.52 H new ATOM 0 HB3 ALA A 73 -20.481 -1.511 -10.990 1.00 7.52 H new ATOM 1121 N ARG A 74 -23.547 -1.786 -10.884 1.00 6.69 N ATOM 1122 CA ARG A 74 -24.648 -2.109 -11.772 1.00 6.76 C ATOM 1123 C ARG A 74 -24.427 -1.436 -13.118 1.00 6.62 C ATOM 1124 O ARG A 74 -25.380 -1.100 -13.827 1.00 6.89 O ATOM 1125 CB ARG A 74 -25.985 -1.674 -11.163 1.00 7.36 C ATOM 1126 CG ARG A 74 -26.285 -2.312 -9.813 1.00 7.67 C ATOM 1127 CD ARG A 74 -26.263 -3.832 -9.890 1.00 8.48 C ATOM 1128 NE ARG A 74 -26.565 -4.453 -8.603 1.00 8.99 N ATOM 1129 CZ ARG A 74 -26.451 -5.757 -8.360 1.00 9.80 C ATOM 1130 NH1 ARG A 74 -26.030 -6.581 -9.312 1.00 10.19 N ATOM 1131 NH2 ARG A 74 -26.761 -6.233 -7.160 1.00 10.42 N ATOM 0 H ARG A 74 -23.359 -0.788 -10.788 1.00 6.69 H new ATOM 0 HA ARG A 74 -24.684 -3.189 -11.914 1.00 6.76 H new ATOM 0 HB2 ARG A 74 -25.986 -0.590 -11.050 1.00 7.36 H new ATOM 0 HB3 ARG A 74 -26.787 -1.922 -11.858 1.00 7.36 H new ATOM 0 HG2 ARG A 74 -25.552 -1.974 -9.080 1.00 7.67 H new ATOM 0 HG3 ARG A 74 -27.262 -1.980 -9.463 1.00 7.67 H new ATOM 0 HD2 ARG A 74 -26.987 -4.167 -10.632 1.00 8.48 H new ATOM 0 HD3 ARG A 74 -25.282 -4.163 -10.230 1.00 8.48 H new ATOM 0 HE ARG A 74 -26.883 -3.851 -7.844 1.00 8.99 H new ATOM 0 HH11 ARG A 74 -25.792 -6.216 -10.234 1.00 10.19 H new ATOM 0 HH12 ARG A 74 -25.944 -7.579 -9.121 1.00 10.19 H new ATOM 0 HH21 ARG A 74 -27.085 -5.600 -6.429 1.00 10.42 H new ATOM 0 HH22 ARG A 74 -26.675 -7.231 -6.970 1.00 10.42 H new ATOM 1145 N GLY A 75 -23.158 -1.241 -13.459 1.00 6.47 N ATOM 1146 CA GLY A 75 -22.803 -0.610 -14.714 1.00 6.51 C ATOM 1147 C GLY A 75 -22.362 0.827 -14.526 1.00 6.34 C ATOM 1148 O GLY A 75 -22.210 1.286 -13.389 1.00 6.75 O ATOM 0 H GLY A 75 -22.362 -1.512 -12.881 1.00 6.47 H new ATOM 0 HA2 GLY A 75 -22.001 -1.175 -15.189 1.00 6.51 H new ATOM 0 HA3 GLY A 75 -23.658 -0.641 -15.389 1.00 6.51 H new ATOM 1152 N ALA A 76 -22.140 1.519 -15.647 1.00 6.08 N ATOM 1153 CA ALA A 76 -21.788 2.946 -15.670 1.00 6.24 C ATOM 1154 C ALA A 76 -20.338 3.203 -15.255 1.00 5.83 C ATOM 1155 O ALA A 76 -19.560 3.757 -16.027 1.00 6.16 O ATOM 1156 CB ALA A 76 -22.745 3.767 -14.814 1.00 6.69 C ATOM 0 H ALA A 76 -22.200 1.102 -16.576 1.00 6.08 H new ATOM 0 HA ALA A 76 -21.886 3.269 -16.707 1.00 6.24 H new ATOM 0 HB1 ALA A 76 -22.457 4.818 -14.852 1.00 6.69 H new ATOM 0 HB2 ALA A 76 -23.760 3.655 -15.194 1.00 6.69 H new ATOM 0 HB3 ALA A 76 -22.703 3.417 -13.783 1.00 6.69 H new ATOM 1162 N GLN A 77 -19.977 2.811 -14.043 1.00 5.40 N ATOM 1163 CA GLN A 77 -18.653 3.113 -13.510 1.00 5.18 C ATOM 1164 C GLN A 77 -17.814 1.849 -13.373 1.00 4.21 C ATOM 1165 O GLN A 77 -18.348 0.751 -13.207 1.00 4.21 O ATOM 1166 CB GLN A 77 -18.784 3.806 -12.153 1.00 5.87 C ATOM 1167 CG GLN A 77 -19.519 5.134 -12.220 1.00 6.56 C ATOM 1168 CD GLN A 77 -18.791 6.166 -13.061 1.00 7.26 C ATOM 1169 OE1 GLN A 77 -17.990 6.949 -12.553 1.00 7.65 O ATOM 1170 NE2 GLN A 77 -19.057 6.169 -14.356 1.00 7.72 N ATOM 0 H GLN A 77 -20.579 2.284 -13.410 1.00 5.40 H new ATOM 0 HA GLN A 77 -18.148 3.780 -14.209 1.00 5.18 H new ATOM 0 HB2 GLN A 77 -19.309 3.144 -11.465 1.00 5.87 H new ATOM 0 HB3 GLN A 77 -17.789 3.971 -11.740 1.00 5.87 H new ATOM 0 HG2 GLN A 77 -20.515 4.973 -12.632 1.00 6.56 H new ATOM 0 HG3 GLN A 77 -19.651 5.522 -11.210 1.00 6.56 H new ATOM 0 HE21 GLN A 77 -19.728 5.504 -14.740 1.00 7.72 H new ATOM 0 HE22 GLN A 77 -18.591 6.837 -14.971 1.00 7.72 H new ATOM 1179 N VAL A 78 -16.497 2.018 -13.448 1.00 3.82 N ATOM 1180 CA VAL A 78 -15.571 0.899 -13.346 1.00 3.25 C ATOM 1181 C VAL A 78 -15.434 0.424 -11.904 1.00 3.06 C ATOM 1182 O VAL A 78 -15.538 1.212 -10.960 1.00 3.67 O ATOM 1183 CB VAL A 78 -14.169 1.260 -13.897 1.00 3.79 C ATOM 1184 CG1 VAL A 78 -14.245 1.608 -15.377 1.00 4.27 C ATOM 1185 CG2 VAL A 78 -13.542 2.404 -13.103 1.00 4.38 C ATOM 0 H VAL A 78 -16.047 2.924 -13.580 1.00 3.82 H new ATOM 0 HA VAL A 78 -15.989 0.095 -13.952 1.00 3.25 H new ATOM 0 HB VAL A 78 -13.529 0.385 -13.783 1.00 3.79 H new ATOM 0 HG11 VAL A 78 -13.249 1.858 -15.743 1.00 4.27 H new ATOM 0 HG12 VAL A 78 -14.632 0.754 -15.932 1.00 4.27 H new ATOM 0 HG13 VAL A 78 -14.908 2.462 -15.516 1.00 4.27 H new ATOM 0 HG21 VAL A 78 -12.559 2.635 -13.513 1.00 4.38 H new ATOM 0 HG22 VAL A 78 -14.179 3.286 -13.170 1.00 4.38 H new ATOM 0 HG23 VAL A 78 -13.440 2.109 -12.059 1.00 4.38 H new ATOM 1195 N THR A 79 -15.214 -0.870 -11.744 1.00 2.63 N ATOM 1196 CA THR A 79 -15.043 -1.464 -10.427 1.00 2.70 C ATOM 1197 C THR A 79 -13.608 -1.933 -10.231 1.00 1.92 C ATOM 1198 O THR A 79 -13.247 -2.458 -9.180 1.00 2.39 O ATOM 1199 CB THR A 79 -15.991 -2.659 -10.249 1.00 3.62 C ATOM 1200 OG1 THR A 79 -15.818 -3.587 -11.332 1.00 4.18 O ATOM 1201 CG2 THR A 79 -17.436 -2.194 -10.210 1.00 4.13 C ATOM 0 H THR A 79 -15.149 -1.534 -12.515 1.00 2.63 H new ATOM 0 HA THR A 79 -15.277 -0.701 -9.684 1.00 2.70 H new ATOM 0 HB THR A 79 -15.752 -3.149 -9.305 1.00 3.62 H new ATOM 0 HG1 THR A 79 -16.424 -4.347 -11.211 1.00 4.18 H new ATOM 0 HG21 THR A 79 -18.092 -3.055 -10.083 1.00 4.13 H new ATOM 0 HG22 THR A 79 -17.575 -1.506 -9.376 1.00 4.13 H new ATOM 0 HG23 THR A 79 -17.680 -1.686 -11.143 1.00 4.13 H new ATOM 1209 N ASP A 80 -12.791 -1.722 -11.253 1.00 1.32 N ATOM 1210 CA ASP A 80 -11.429 -2.234 -11.268 1.00 1.15 C ATOM 1211 C ASP A 80 -10.469 -1.264 -10.593 1.00 0.93 C ATOM 1212 O ASP A 80 -9.545 -0.746 -11.218 1.00 1.30 O ATOM 1213 CB ASP A 80 -10.984 -2.516 -12.706 1.00 1.82 C ATOM 1214 CG ASP A 80 -11.892 -3.515 -13.395 1.00 2.56 C ATOM 1215 OD1 ASP A 80 -11.957 -4.680 -12.945 1.00 3.12 O ATOM 1216 OD2 ASP A 80 -12.536 -3.142 -14.396 1.00 3.06 O ATOM 0 H ASP A 80 -13.050 -1.196 -12.088 1.00 1.32 H new ATOM 0 HA ASP A 80 -11.412 -3.167 -10.705 1.00 1.15 H new ATOM 0 HB2 ASP A 80 -10.974 -1.584 -13.272 1.00 1.82 H new ATOM 0 HB3 ASP A 80 -9.963 -2.897 -12.702 1.00 1.82 H new ATOM 1221 N ILE A 81 -10.699 -1.019 -9.312 1.00 0.74 N ATOM 1222 CA ILE A 81 -9.826 -0.162 -8.522 1.00 0.55 C ATOM 1223 C ILE A 81 -9.499 -0.824 -7.192 1.00 0.47 C ATOM 1224 O ILE A 81 -10.374 -0.992 -6.342 1.00 0.63 O ATOM 1225 CB ILE A 81 -10.456 1.227 -8.259 1.00 0.63 C ATOM 1226 CG1 ILE A 81 -10.521 2.045 -9.548 1.00 0.72 C ATOM 1227 CG2 ILE A 81 -9.659 1.979 -7.201 1.00 0.67 C ATOM 1228 CD1 ILE A 81 -9.159 2.446 -10.065 1.00 0.73 C ATOM 0 H ILE A 81 -11.489 -1.404 -8.794 1.00 0.74 H new ATOM 0 HA ILE A 81 -8.914 -0.017 -9.100 1.00 0.55 H new ATOM 0 HB ILE A 81 -11.472 1.076 -7.894 1.00 0.63 H new ATOM 0 HG12 ILE A 81 -11.037 1.466 -10.313 1.00 0.72 H new ATOM 0 HG13 ILE A 81 -11.115 2.942 -9.372 1.00 0.72 H new ATOM 0 HG21 ILE A 81 -10.114 2.954 -7.027 1.00 0.67 H new ATOM 0 HG22 ILE A 81 -9.658 1.408 -6.272 1.00 0.67 H new ATOM 0 HG23 ILE A 81 -8.634 2.114 -7.545 1.00 0.67 H new ATOM 0 HD11 ILE A 81 -9.274 3.024 -10.982 1.00 0.73 H new ATOM 0 HD12 ILE A 81 -8.649 3.051 -9.316 1.00 0.73 H new ATOM 0 HD13 ILE A 81 -8.570 1.552 -10.271 1.00 0.73 H new ATOM 1240 N VAL A 82 -8.249 -1.223 -7.027 1.00 0.32 N ATOM 1241 CA VAL A 82 -7.806 -1.835 -5.798 1.00 0.30 C ATOM 1242 C VAL A 82 -6.741 -0.990 -5.129 1.00 0.25 C ATOM 1243 O VAL A 82 -5.607 -0.937 -5.590 1.00 0.28 O ATOM 1244 CB VAL A 82 -7.231 -3.227 -6.076 1.00 0.39 C ATOM 1245 CG1 VAL A 82 -6.552 -3.779 -4.844 1.00 0.97 C ATOM 1246 CG2 VAL A 82 -8.328 -4.159 -6.554 1.00 1.19 C ATOM 0 H VAL A 82 -7.523 -1.131 -7.738 1.00 0.32 H new ATOM 0 HA VAL A 82 -8.668 -1.917 -5.136 1.00 0.30 H new ATOM 0 HB VAL A 82 -6.481 -3.145 -6.863 1.00 0.39 H new ATOM 0 HG11 VAL A 82 -6.150 -4.768 -5.062 1.00 0.97 H new ATOM 0 HG12 VAL A 82 -5.740 -3.115 -4.548 1.00 0.97 H new ATOM 0 HG13 VAL A 82 -7.275 -3.852 -4.032 1.00 0.97 H new ATOM 0 HG21 VAL A 82 -7.908 -5.146 -6.749 1.00 1.19 H new ATOM 0 HG22 VAL A 82 -9.099 -4.237 -5.787 1.00 1.19 H new ATOM 0 HG23 VAL A 82 -8.767 -3.764 -7.470 1.00 1.19 H new ATOM 1256 N ILE A 83 -7.101 -0.319 -4.052 1.00 0.25 N ATOM 1257 CA ILE A 83 -6.118 0.442 -3.302 1.00 0.25 C ATOM 1258 C ILE A 83 -5.519 -0.437 -2.235 1.00 0.27 C ATOM 1259 O ILE A 83 -6.156 -0.713 -1.227 1.00 0.45 O ATOM 1260 CB ILE A 83 -6.707 1.676 -2.595 1.00 0.34 C ATOM 1261 CG1 ILE A 83 -7.977 2.148 -3.290 1.00 0.48 C ATOM 1262 CG2 ILE A 83 -5.676 2.795 -2.536 1.00 0.84 C ATOM 1263 CD1 ILE A 83 -8.544 3.425 -2.710 1.00 1.32 C ATOM 0 H ILE A 83 -8.050 -0.284 -3.680 1.00 0.25 H new ATOM 0 HA ILE A 83 -5.380 0.783 -4.028 1.00 0.25 H new ATOM 0 HB ILE A 83 -6.969 1.393 -1.576 1.00 0.34 H new ATOM 0 HG12 ILE A 83 -7.767 2.301 -4.349 1.00 0.48 H new ATOM 0 HG13 ILE A 83 -8.730 1.363 -3.225 1.00 0.48 H new ATOM 0 HG21 ILE A 83 -6.107 3.661 -2.033 1.00 0.84 H new ATOM 0 HG22 ILE A 83 -4.800 2.454 -1.984 1.00 0.84 H new ATOM 0 HG23 ILE A 83 -5.382 3.072 -3.548 1.00 0.84 H new ATOM 0 HD11 ILE A 83 -9.447 3.702 -3.254 1.00 1.32 H new ATOM 0 HD12 ILE A 83 -8.786 3.271 -1.658 1.00 1.32 H new ATOM 0 HD13 ILE A 83 -7.808 4.224 -2.800 1.00 1.32 H new ATOM 1275 N LEU A 84 -4.311 -0.869 -2.455 1.00 0.22 N ATOM 1276 CA LEU A 84 -3.657 -1.770 -1.528 1.00 0.27 C ATOM 1277 C LEU A 84 -2.873 -1.004 -0.469 1.00 0.27 C ATOM 1278 O LEU A 84 -1.843 -0.403 -0.763 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.713 -2.685 -2.283 1.00 0.35 C ATOM 1280 CG LEU A 84 -2.063 -3.756 -1.443 1.00 0.49 C ATOM 1281 CD1 LEU A 84 -3.004 -4.935 -1.311 1.00 1.33 C ATOM 1282 CD2 LEU A 84 -0.737 -4.151 -2.056 1.00 1.33 C ATOM 0 H LEU A 84 -3.751 -0.616 -3.269 1.00 0.22 H new ATOM 0 HA LEU A 84 -4.429 -2.356 -1.029 1.00 0.27 H new ATOM 0 HB2 LEU A 84 -3.263 -3.163 -3.093 1.00 0.35 H new ATOM 0 HB3 LEU A 84 -1.932 -2.079 -2.742 1.00 0.35 H new ATOM 0 HG LEU A 84 -1.861 -3.378 -0.441 1.00 0.49 H new ATOM 0 HD11 LEU A 84 -2.534 -5.709 -0.704 1.00 1.33 H new ATOM 0 HD12 LEU A 84 -3.929 -4.611 -0.834 1.00 1.33 H new ATOM 0 HD13 LEU A 84 -3.227 -5.335 -2.300 1.00 1.33 H new ATOM 0 HD21 LEU A 84 -0.270 -4.925 -1.446 1.00 1.33 H new ATOM 0 HD22 LEU A 84 -0.901 -4.533 -3.064 1.00 1.33 H new ATOM 0 HD23 LEU A 84 -0.083 -3.280 -2.100 1.00 1.33 H new ATOM 1294 N VAL A 85 -3.356 -1.031 0.761 1.00 0.28 N ATOM 1295 CA VAL A 85 -2.655 -0.379 1.856 1.00 0.28 C ATOM 1296 C VAL A 85 -1.522 -1.255 2.376 1.00 0.27 C ATOM 1297 O VAL A 85 -1.707 -2.446 2.634 1.00 0.34 O ATOM 1298 CB VAL A 85 -3.600 -0.031 3.023 1.00 0.32 C ATOM 1299 CG1 VAL A 85 -2.854 0.725 4.114 1.00 1.17 C ATOM 1300 CG2 VAL A 85 -4.781 0.782 2.521 1.00 1.20 C ATOM 0 H VAL A 85 -4.225 -1.494 1.027 1.00 0.28 H new ATOM 0 HA VAL A 85 -2.246 0.548 1.454 1.00 0.28 H new ATOM 0 HB VAL A 85 -3.976 -0.961 3.451 1.00 0.32 H new ATOM 0 HG11 VAL A 85 -3.540 0.960 4.928 1.00 1.17 H new ATOM 0 HG12 VAL A 85 -2.040 0.107 4.493 1.00 1.17 H new ATOM 0 HG13 VAL A 85 -2.447 1.649 3.703 1.00 1.17 H new ATOM 0 HG21 VAL A 85 -5.440 1.020 3.356 1.00 1.20 H new ATOM 0 HG22 VAL A 85 -4.421 1.706 2.068 1.00 1.20 H new ATOM 0 HG23 VAL A 85 -5.331 0.204 1.778 1.00 1.20 H new ATOM 1310 N VAL A 86 -0.352 -0.651 2.508 1.00 0.25 N ATOM 1311 CA VAL A 86 0.812 -1.309 3.075 1.00 0.27 C ATOM 1312 C VAL A 86 1.423 -0.394 4.123 1.00 0.24 C ATOM 1313 O VAL A 86 0.859 0.655 4.429 1.00 0.26 O ATOM 1314 CB VAL A 86 1.874 -1.641 2.001 1.00 0.36 C ATOM 1315 CG1 VAL A 86 1.329 -2.644 1.003 1.00 1.12 C ATOM 1316 CG2 VAL A 86 2.345 -0.384 1.290 1.00 0.95 C ATOM 0 H VAL A 86 -0.183 0.314 2.223 1.00 0.25 H new ATOM 0 HA VAL A 86 0.490 -2.251 3.518 1.00 0.27 H new ATOM 0 HB VAL A 86 2.733 -2.085 2.505 1.00 0.36 H new ATOM 0 HG11 VAL A 86 2.091 -2.865 0.256 1.00 1.12 H new ATOM 0 HG12 VAL A 86 1.054 -3.562 1.523 1.00 1.12 H new ATOM 0 HG13 VAL A 86 0.449 -2.228 0.512 1.00 1.12 H new ATOM 0 HG21 VAL A 86 3.091 -0.648 0.541 1.00 0.95 H new ATOM 0 HG22 VAL A 86 1.497 0.098 0.804 1.00 0.95 H new ATOM 0 HG23 VAL A 86 2.785 0.301 2.015 1.00 0.95 H new ATOM 1326 N ALA A 87 2.558 -0.768 4.676 1.00 0.28 N ATOM 1327 CA ALA A 87 3.172 0.057 5.704 1.00 0.32 C ATOM 1328 C ALA A 87 4.688 -0.016 5.681 1.00 0.46 C ATOM 1329 O ALA A 87 5.254 -1.104 5.628 1.00 0.75 O ATOM 1330 CB ALA A 87 2.644 -0.330 7.074 1.00 0.42 C ATOM 0 H ALA A 87 3.068 -1.619 4.440 1.00 0.28 H new ATOM 0 HA ALA A 87 2.900 1.091 5.490 1.00 0.32 H new ATOM 0 HB1 ALA A 87 3.112 0.295 7.834 1.00 0.42 H new ATOM 0 HB2 ALA A 87 1.564 -0.187 7.101 1.00 0.42 H new ATOM 0 HB3 ALA A 87 2.877 -1.376 7.271 1.00 0.42 H new ATOM 1336 N ALA A 88 5.303 1.175 5.678 1.00 0.37 N ATOM 1337 CA ALA A 88 6.752 1.390 5.873 1.00 0.59 C ATOM 1338 C ALA A 88 7.630 0.167 5.595 1.00 0.53 C ATOM 1339 O ALA A 88 8.093 -0.039 4.474 1.00 1.14 O ATOM 1340 CB ALA A 88 7.004 1.877 7.291 1.00 1.18 C ATOM 0 H ALA A 88 4.793 2.047 5.535 1.00 0.37 H new ATOM 0 HA ALA A 88 7.041 2.136 5.133 1.00 0.59 H new ATOM 0 HB1 ALA A 88 8.072 2.036 7.437 1.00 1.18 H new ATOM 0 HB2 ALA A 88 6.472 2.814 7.454 1.00 1.18 H new ATOM 0 HB3 ALA A 88 6.648 1.130 8.001 1.00 1.18 H new ATOM 1346 N ASP A 89 7.854 -0.631 6.636 1.00 0.56 N ATOM 1347 CA ASP A 89 8.813 -1.734 6.584 1.00 0.93 C ATOM 1348 C ASP A 89 8.125 -3.087 6.504 1.00 0.85 C ATOM 1349 O ASP A 89 8.783 -4.125 6.411 1.00 1.24 O ATOM 1350 CB ASP A 89 9.703 -1.707 7.831 1.00 1.44 C ATOM 1351 CG ASP A 89 8.909 -1.871 9.117 1.00 1.68 C ATOM 1352 OD1 ASP A 89 8.669 -3.025 9.525 1.00 2.01 O ATOM 1353 OD2 ASP A 89 8.521 -0.852 9.723 1.00 1.90 O ATOM 0 H ASP A 89 7.380 -0.534 7.534 1.00 0.56 H new ATOM 0 HA ASP A 89 9.410 -1.600 5.682 1.00 0.93 H new ATOM 0 HB2 ASP A 89 10.444 -2.503 7.762 1.00 1.44 H new ATOM 0 HB3 ASP A 89 10.250 -0.764 7.863 1.00 1.44 H new ATOM 1358 N ASP A 90 6.805 -3.081 6.546 1.00 0.48 N ATOM 1359 CA ASP A 90 6.055 -4.327 6.595 1.00 0.46 C ATOM 1360 C ASP A 90 5.859 -4.890 5.202 1.00 0.45 C ATOM 1361 O ASP A 90 5.835 -6.106 5.005 1.00 0.69 O ATOM 1362 CB ASP A 90 4.696 -4.122 7.252 1.00 0.52 C ATOM 1363 CG ASP A 90 4.267 -5.341 8.030 1.00 0.74 C ATOM 1364 OD1 ASP A 90 4.687 -5.483 9.192 1.00 0.93 O ATOM 1365 OD2 ASP A 90 3.490 -6.155 7.486 1.00 1.09 O ATOM 0 H ASP A 90 6.233 -2.237 6.547 1.00 0.48 H new ATOM 0 HA ASP A 90 6.633 -5.034 7.191 1.00 0.46 H new ATOM 0 HB2 ASP A 90 4.739 -3.261 7.919 1.00 0.52 H new ATOM 0 HB3 ASP A 90 3.952 -3.897 6.488 1.00 0.52 H new ATOM 1370 N GLY A 91 5.734 -3.992 4.238 1.00 0.36 N ATOM 1371 CA GLY A 91 5.495 -4.396 2.873 1.00 0.36 C ATOM 1372 C GLY A 91 4.108 -4.971 2.692 1.00 0.35 C ATOM 1373 O GLY A 91 3.116 -4.304 2.977 1.00 0.52 O ATOM 0 H GLY A 91 5.795 -2.984 4.380 1.00 0.36 H new ATOM 0 HA2 GLY A 91 5.622 -3.538 2.213 1.00 0.36 H new ATOM 0 HA3 GLY A 91 6.237 -5.138 2.578 1.00 0.36 H new ATOM 1377 N VAL A 92 4.039 -6.213 2.250 1.00 0.38 N ATOM 1378 CA VAL A 92 2.789 -6.848 1.908 1.00 0.37 C ATOM 1379 C VAL A 92 2.610 -8.149 2.695 1.00 0.36 C ATOM 1380 O VAL A 92 3.325 -9.127 2.470 1.00 0.47 O ATOM 1381 CB VAL A 92 2.783 -7.129 0.395 1.00 0.47 C ATOM 1382 CG1 VAL A 92 1.610 -7.984 0.006 1.00 1.08 C ATOM 1383 CG2 VAL A 92 2.779 -5.830 -0.390 1.00 1.06 C ATOM 0 H VAL A 92 4.856 -6.809 2.119 1.00 0.38 H new ATOM 0 HA VAL A 92 1.960 -6.189 2.166 1.00 0.37 H new ATOM 0 HB VAL A 92 3.693 -7.677 0.153 1.00 0.47 H new ATOM 0 HG11 VAL A 92 1.633 -8.166 -1.069 1.00 1.08 H new ATOM 0 HG12 VAL A 92 1.661 -8.935 0.536 1.00 1.08 H new ATOM 0 HG13 VAL A 92 0.684 -7.472 0.268 1.00 1.08 H new ATOM 0 HG21 VAL A 92 2.775 -6.050 -1.458 1.00 1.06 H new ATOM 0 HG22 VAL A 92 1.890 -5.253 -0.135 1.00 1.06 H new ATOM 0 HG23 VAL A 92 3.669 -5.252 -0.142 1.00 1.06 H new ATOM 1393 N MET A 93 1.673 -8.138 3.636 1.00 0.29 N ATOM 1394 CA MET A 93 1.342 -9.327 4.417 1.00 0.31 C ATOM 1395 C MET A 93 0.479 -10.286 3.596 1.00 0.31 C ATOM 1396 O MET A 93 0.018 -9.917 2.520 1.00 0.31 O ATOM 1397 CB MET A 93 0.616 -8.922 5.697 1.00 0.36 C ATOM 1398 CG MET A 93 1.504 -8.188 6.683 1.00 0.67 C ATOM 1399 SD MET A 93 0.719 -7.967 8.286 1.00 1.32 S ATOM 1400 CE MET A 93 0.380 -9.675 8.692 1.00 0.65 C ATOM 0 H MET A 93 1.125 -7.313 3.879 1.00 0.29 H new ATOM 0 HA MET A 93 2.266 -9.841 4.682 1.00 0.31 H new ATOM 0 HB2 MET A 93 -0.232 -8.287 5.440 1.00 0.36 H new ATOM 0 HB3 MET A 93 0.213 -9.814 6.176 1.00 0.36 H new ATOM 0 HG2 MET A 93 2.434 -8.742 6.811 1.00 0.67 H new ATOM 0 HG3 MET A 93 1.767 -7.213 6.274 1.00 0.67 H new ATOM 0 HE1 MET A 93 0.404 -9.803 9.774 1.00 0.65 H new ATOM 0 HE2 MET A 93 -0.605 -9.950 8.316 1.00 0.65 H new ATOM 0 HE3 MET A 93 1.135 -10.315 8.234 1.00 0.65 H new ATOM 1410 N PRO A 94 0.266 -11.528 4.070 1.00 0.38 N ATOM 1411 CA PRO A 94 -0.587 -12.511 3.387 1.00 0.42 C ATOM 1412 C PRO A 94 -1.911 -11.927 2.892 1.00 0.39 C ATOM 1413 O PRO A 94 -2.260 -12.082 1.722 1.00 0.42 O ATOM 1414 CB PRO A 94 -0.829 -13.562 4.466 1.00 0.52 C ATOM 1415 CG PRO A 94 0.405 -13.528 5.296 1.00 0.61 C ATOM 1416 CD PRO A 94 0.873 -12.097 5.294 1.00 0.46 C ATOM 0 HA PRO A 94 -0.114 -12.896 2.484 1.00 0.42 H new ATOM 0 HB2 PRO A 94 -1.713 -13.327 5.058 1.00 0.52 H new ATOM 0 HB3 PRO A 94 -0.989 -14.549 4.031 1.00 0.52 H new ATOM 0 HG2 PRO A 94 0.201 -13.869 6.311 1.00 0.61 H new ATOM 0 HG3 PRO A 94 1.169 -14.188 4.885 1.00 0.61 H new ATOM 0 HD2 PRO A 94 0.543 -11.567 6.188 1.00 0.46 H new ATOM 0 HD3 PRO A 94 1.961 -12.032 5.268 1.00 0.46 H new ATOM 1424 N GLN A 95 -2.640 -11.250 3.769 1.00 0.40 N ATOM 1425 CA GLN A 95 -3.901 -10.635 3.385 1.00 0.43 C ATOM 1426 C GLN A 95 -3.684 -9.492 2.393 1.00 0.36 C ATOM 1427 O GLN A 95 -4.544 -9.215 1.558 1.00 0.39 O ATOM 1428 CB GLN A 95 -4.665 -10.141 4.612 1.00 0.53 C ATOM 1429 CG GLN A 95 -4.872 -11.220 5.660 1.00 0.64 C ATOM 1430 CD GLN A 95 -6.132 -11.013 6.485 1.00 0.88 C ATOM 1431 OE1 GLN A 95 -6.525 -9.763 6.669 1.00 1.41 O flip ATOM 1432 NE2 GLN A 95 -6.746 -11.971 6.956 1.00 1.47 N flip ATOM 0 H GLN A 95 -2.381 -11.114 4.746 1.00 0.40 H new ATOM 0 HA GLN A 95 -4.501 -11.400 2.891 1.00 0.43 H new ATOM 0 HB2 GLN A 95 -4.122 -9.308 5.059 1.00 0.53 H new ATOM 0 HB3 GLN A 95 -5.636 -9.757 4.298 1.00 0.53 H new ATOM 0 HG2 GLN A 95 -4.922 -12.192 5.168 1.00 0.64 H new ATOM 0 HG3 GLN A 95 -4.009 -11.243 6.325 1.00 0.64 H new ATOM 0 HE21 GLN A 95 -6.412 -12.921 6.793 1.00 1.47 H new ATOM 0 HE22 GLN A 95 -7.588 -11.815 7.509 1.00 1.47 H new ATOM 1441 N THR A 96 -2.533 -8.830 2.481 1.00 0.33 N ATOM 1442 CA THR A 96 -2.169 -7.807 1.517 1.00 0.31 C ATOM 1443 C THR A 96 -1.878 -8.464 0.158 1.00 0.29 C ATOM 1444 O THR A 96 -2.076 -7.870 -0.899 1.00 0.34 O ATOM 1445 CB THR A 96 -0.946 -7.013 2.013 1.00 0.34 C ATOM 1446 OG1 THR A 96 -1.091 -6.731 3.413 1.00 0.37 O ATOM 1447 CG2 THR A 96 -0.797 -5.703 1.263 1.00 0.46 C ATOM 0 H THR A 96 -1.839 -8.987 3.212 1.00 0.33 H new ATOM 0 HA THR A 96 -2.998 -7.109 1.402 1.00 0.31 H new ATOM 0 HB THR A 96 -0.058 -7.620 1.836 1.00 0.34 H new ATOM 0 HG1 THR A 96 -1.313 -5.784 3.535 1.00 0.37 H new ATOM 0 HG21 THR A 96 0.075 -5.167 1.637 1.00 0.46 H new ATOM 0 HG22 THR A 96 -0.670 -5.905 0.199 1.00 0.46 H new ATOM 0 HG23 THR A 96 -1.689 -5.094 1.413 1.00 0.46 H new ATOM 1455 N VAL A 97 -1.438 -9.717 0.210 1.00 0.33 N ATOM 1456 CA VAL A 97 -1.150 -10.508 -0.974 1.00 0.39 C ATOM 1457 C VAL A 97 -2.439 -11.015 -1.624 1.00 0.34 C ATOM 1458 O VAL A 97 -2.663 -10.812 -2.815 1.00 0.37 O ATOM 1459 CB VAL A 97 -0.247 -11.708 -0.594 1.00 0.60 C ATOM 1460 CG1 VAL A 97 -0.289 -12.797 -1.640 1.00 1.00 C ATOM 1461 CG2 VAL A 97 1.186 -11.261 -0.376 1.00 1.05 C ATOM 0 H VAL A 97 -1.271 -10.214 1.085 1.00 0.33 H new ATOM 0 HA VAL A 97 -0.632 -9.873 -1.693 1.00 0.39 H new ATOM 0 HB VAL A 97 -0.639 -12.117 0.337 1.00 0.60 H new ATOM 0 HG11 VAL A 97 0.358 -13.620 -1.335 1.00 1.00 H new ATOM 0 HG12 VAL A 97 -1.311 -13.160 -1.747 1.00 1.00 H new ATOM 0 HG13 VAL A 97 0.056 -12.399 -2.594 1.00 1.00 H new ATOM 0 HG21 VAL A 97 1.799 -12.122 -0.110 1.00 1.05 H new ATOM 0 HG22 VAL A 97 1.570 -10.811 -1.291 1.00 1.05 H new ATOM 0 HG23 VAL A 97 1.220 -10.529 0.431 1.00 1.05 H new ATOM 1471 N GLU A 98 -3.293 -11.658 -0.828 1.00 0.35 N ATOM 1472 CA GLU A 98 -4.515 -12.283 -1.339 1.00 0.40 C ATOM 1473 C GLU A 98 -5.492 -11.257 -1.894 1.00 0.34 C ATOM 1474 O GLU A 98 -6.372 -11.588 -2.689 1.00 0.45 O ATOM 1475 CB GLU A 98 -5.195 -13.104 -0.247 1.00 0.54 C ATOM 1476 CG GLU A 98 -4.364 -14.280 0.227 1.00 0.72 C ATOM 1477 CD GLU A 98 -5.159 -15.253 1.071 1.00 1.14 C ATOM 1478 OE1 GLU A 98 -5.842 -16.130 0.502 1.00 1.55 O ATOM 1479 OE2 GLU A 98 -5.113 -15.142 2.314 1.00 1.62 O ATOM 0 H GLU A 98 -3.161 -11.760 0.178 1.00 0.35 H new ATOM 0 HA GLU A 98 -4.219 -12.941 -2.156 1.00 0.40 H new ATOM 0 HB2 GLU A 98 -5.412 -12.456 0.602 1.00 0.54 H new ATOM 0 HB3 GLU A 98 -6.151 -13.471 -0.621 1.00 0.54 H new ATOM 0 HG2 GLU A 98 -3.956 -14.804 -0.638 1.00 0.72 H new ATOM 0 HG3 GLU A 98 -3.517 -13.912 0.805 1.00 0.72 H new ATOM 1486 N ALA A 99 -5.317 -10.009 -1.500 1.00 0.28 N ATOM 1487 CA ALA A 99 -6.175 -8.940 -1.982 1.00 0.27 C ATOM 1488 C ALA A 99 -5.802 -8.646 -3.420 1.00 0.25 C ATOM 1489 O ALA A 99 -6.652 -8.403 -4.276 1.00 0.34 O ATOM 1490 CB ALA A 99 -6.016 -7.700 -1.116 1.00 0.31 C ATOM 0 H ALA A 99 -4.591 -9.710 -0.849 1.00 0.28 H new ATOM 0 HA ALA A 99 -7.220 -9.244 -1.928 1.00 0.27 H new ATOM 0 HB1 ALA A 99 -6.665 -6.909 -1.491 1.00 0.31 H new ATOM 0 HB2 ALA A 99 -6.289 -7.937 -0.088 1.00 0.31 H new ATOM 0 HB3 ALA A 99 -4.980 -7.364 -1.148 1.00 0.31 H new ATOM 1496 N ILE A 100 -4.512 -8.728 -3.665 1.00 0.25 N ATOM 1497 CA ILE A 100 -3.947 -8.545 -4.979 1.00 0.24 C ATOM 1498 C ILE A 100 -4.170 -9.781 -5.838 1.00 0.28 C ATOM 1499 O ILE A 100 -4.476 -9.669 -7.014 1.00 0.34 O ATOM 1500 CB ILE A 100 -2.448 -8.244 -4.850 1.00 0.25 C ATOM 1501 CG1 ILE A 100 -2.233 -6.738 -4.755 1.00 0.36 C ATOM 1502 CG2 ILE A 100 -1.644 -8.859 -5.981 1.00 0.37 C ATOM 1503 CD1 ILE A 100 -0.790 -6.333 -4.576 1.00 0.38 C ATOM 0 H ILE A 100 -3.818 -8.927 -2.944 1.00 0.25 H new ATOM 0 HA ILE A 100 -4.443 -7.705 -5.466 1.00 0.24 H new ATOM 0 HB ILE A 100 -2.082 -8.706 -3.933 1.00 0.25 H new ATOM 0 HG12 ILE A 100 -2.622 -6.268 -5.658 1.00 0.36 H new ATOM 0 HG13 ILE A 100 -2.815 -6.351 -3.919 1.00 0.36 H new ATOM 0 HG21 ILE A 100 -0.589 -8.620 -5.849 1.00 0.37 H new ATOM 0 HG22 ILE A 100 -1.775 -9.941 -5.974 1.00 0.37 H new ATOM 0 HG23 ILE A 100 -1.990 -8.458 -6.934 1.00 0.37 H new ATOM 0 HD11 ILE A 100 -0.722 -5.247 -4.517 1.00 0.38 H new ATOM 0 HD12 ILE A 100 -0.400 -6.771 -3.657 1.00 0.38 H new ATOM 0 HD13 ILE A 100 -0.205 -6.688 -5.424 1.00 0.38 H new ATOM 1515 N ASN A 101 -4.003 -10.952 -5.244 1.00 0.31 N ATOM 1516 CA ASN A 101 -4.305 -12.211 -5.916 1.00 0.38 C ATOM 1517 C ASN A 101 -5.730 -12.199 -6.447 1.00 0.37 C ATOM 1518 O ASN A 101 -6.011 -12.691 -7.541 1.00 0.46 O ATOM 1519 CB ASN A 101 -4.115 -13.383 -4.950 1.00 0.46 C ATOM 1520 CG ASN A 101 -2.655 -13.705 -4.693 1.00 1.08 C ATOM 1521 OD1 ASN A 101 -1.780 -12.846 -4.816 1.00 1.85 O ATOM 1522 ND2 ASN A 101 -2.384 -14.944 -4.326 1.00 1.55 N ATOM 0 H ASN A 101 -3.657 -11.059 -4.290 1.00 0.31 H new ATOM 0 HA ASN A 101 -3.620 -12.330 -6.756 1.00 0.38 H new ATOM 0 HB2 ASN A 101 -4.603 -13.150 -4.003 1.00 0.46 H new ATOM 0 HB3 ASN A 101 -4.611 -14.265 -5.355 1.00 0.46 H new ATOM 0 HD21 ASN A 101 -1.421 -15.220 -4.133 1.00 1.55 H new ATOM 0 HD22 ASN A 101 -3.138 -15.626 -4.236 1.00 1.55 H new ATOM 1529 N HIS A 102 -6.619 -11.605 -5.666 1.00 0.33 N ATOM 1530 CA HIS A 102 -8.011 -11.464 -6.053 1.00 0.38 C ATOM 1531 C HIS A 102 -8.164 -10.374 -7.113 1.00 0.38 C ATOM 1532 O HIS A 102 -9.034 -10.457 -7.983 1.00 0.47 O ATOM 1533 CB HIS A 102 -8.860 -11.133 -4.821 1.00 0.43 C ATOM 1534 CG HIS A 102 -10.330 -11.339 -5.027 1.00 0.55 C ATOM 1535 ND1 HIS A 102 -11.059 -12.281 -4.339 1.00 0.75 N ATOM 1536 CD2 HIS A 102 -11.202 -10.723 -5.854 1.00 0.61 C ATOM 1537 CE1 HIS A 102 -12.315 -12.243 -4.739 1.00 0.85 C ATOM 1538 NE2 HIS A 102 -12.430 -11.305 -5.660 1.00 0.77 N ATOM 0 H HIS A 102 -6.396 -11.210 -4.752 1.00 0.33 H new ATOM 0 HA HIS A 102 -8.356 -12.406 -6.480 1.00 0.38 H new ATOM 0 HB2 HIS A 102 -8.529 -11.751 -3.987 1.00 0.43 H new ATOM 0 HB3 HIS A 102 -8.684 -10.095 -4.538 1.00 0.43 H new ATOM 0 HD1 HIS A 102 -10.686 -12.911 -3.629 1.00 0.75 H new ATOM 0 HD2 HIS A 102 -10.975 -9.921 -6.541 1.00 0.61 H new ATOM 0 HE1 HIS A 102 -13.114 -12.872 -4.375 1.00 0.85 H new ATOM 1547 N ALA A 103 -7.310 -9.361 -7.044 1.00 0.32 N ATOM 1548 CA ALA A 103 -7.419 -8.211 -7.933 1.00 0.38 C ATOM 1549 C ALA A 103 -6.770 -8.474 -9.287 1.00 0.40 C ATOM 1550 O ALA A 103 -7.372 -8.242 -10.335 1.00 0.48 O ATOM 1551 CB ALA A 103 -6.772 -7.003 -7.288 1.00 0.43 C ATOM 0 H ALA A 103 -6.535 -9.312 -6.383 1.00 0.32 H new ATOM 0 HA ALA A 103 -8.479 -8.024 -8.102 1.00 0.38 H new ATOM 0 HB1 ALA A 103 -6.856 -6.146 -7.956 1.00 0.43 H new ATOM 0 HB2 ALA A 103 -7.274 -6.780 -6.347 1.00 0.43 H new ATOM 0 HB3 ALA A 103 -5.720 -7.213 -7.097 1.00 0.43 H new ATOM 1557 N LYS A 104 -5.549 -8.984 -9.242 1.00 0.40 N ATOM 1558 CA LYS A 104 -4.703 -9.117 -10.413 1.00 0.51 C ATOM 1559 C LYS A 104 -5.372 -9.941 -11.511 1.00 0.50 C ATOM 1560 O LYS A 104 -5.208 -9.655 -12.698 1.00 0.60 O ATOM 1561 CB LYS A 104 -3.372 -9.757 -9.990 1.00 0.64 C ATOM 1562 CG LYS A 104 -3.470 -11.248 -9.697 1.00 1.11 C ATOM 1563 CD LYS A 104 -2.265 -11.750 -8.922 1.00 1.57 C ATOM 1564 CE LYS A 104 -0.966 -11.484 -9.663 1.00 1.92 C ATOM 1565 NZ LYS A 104 0.189 -12.179 -9.037 1.00 2.56 N ATOM 0 H LYS A 104 -5.115 -9.320 -8.382 1.00 0.40 H new ATOM 0 HA LYS A 104 -4.525 -8.126 -10.830 1.00 0.51 H new ATOM 0 HB2 LYS A 104 -2.637 -9.599 -10.780 1.00 0.64 H new ATOM 0 HB3 LYS A 104 -3.000 -9.246 -9.102 1.00 0.64 H new ATOM 0 HG2 LYS A 104 -4.378 -11.448 -9.127 1.00 1.11 H new ATOM 0 HG3 LYS A 104 -3.554 -11.798 -10.634 1.00 1.11 H new ATOM 0 HD2 LYS A 104 -2.233 -11.265 -7.946 1.00 1.57 H new ATOM 0 HD3 LYS A 104 -2.368 -12.820 -8.743 1.00 1.57 H new ATOM 0 HE2 LYS A 104 -1.067 -11.810 -10.698 1.00 1.92 H new ATOM 0 HE3 LYS A 104 -0.775 -10.411 -9.684 1.00 1.92 H new ATOM 0 HZ1 LYS A 104 1.043 -11.595 -9.141 1.00 2.56 H new ATOM 0 HZ2 LYS A 104 -0.004 -12.333 -8.027 1.00 2.56 H new ATOM 0 HZ3 LYS A 104 0.337 -13.096 -9.505 1.00 2.56 H new ATOM 1579 N ALA A 105 -6.155 -10.937 -11.119 1.00 0.51 N ATOM 1580 CA ALA A 105 -6.710 -11.871 -12.085 1.00 0.61 C ATOM 1581 C ALA A 105 -8.111 -11.483 -12.525 1.00 0.66 C ATOM 1582 O ALA A 105 -8.801 -12.257 -13.190 1.00 0.76 O ATOM 1583 CB ALA A 105 -6.687 -13.289 -11.539 1.00 0.72 C ATOM 0 H ALA A 105 -6.417 -11.117 -10.150 1.00 0.51 H new ATOM 0 HA ALA A 105 -6.076 -11.829 -12.971 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -7.107 -13.971 -12.279 1.00 0.72 H new ATOM 0 HB2 ALA A 105 -5.659 -13.578 -11.321 1.00 0.72 H new ATOM 0 HB3 ALA A 105 -7.279 -13.336 -10.625 1.00 0.72 H new ATOM 1589 N ALA A 106 -8.530 -10.292 -12.153 1.00 0.62 N ATOM 1590 CA ALA A 106 -9.749 -9.721 -12.692 1.00 0.70 C ATOM 1591 C ALA A 106 -9.365 -8.658 -13.708 1.00 0.72 C ATOM 1592 O ALA A 106 -10.211 -7.940 -14.239 1.00 0.90 O ATOM 1593 CB ALA A 106 -10.618 -9.142 -11.583 1.00 0.75 C ATOM 0 H ALA A 106 -8.045 -9.699 -11.479 1.00 0.62 H new ATOM 0 HA ALA A 106 -10.340 -10.496 -13.180 1.00 0.70 H new ATOM 0 HB1 ALA A 106 -11.526 -8.720 -12.015 1.00 0.75 H new ATOM 0 HB2 ALA A 106 -10.883 -9.931 -10.879 1.00 0.75 H new ATOM 0 HB3 ALA A 106 -10.068 -8.360 -11.060 1.00 0.75 H new ATOM 1599 N ASN A 107 -8.053 -8.581 -13.960 1.00 0.67 N ATOM 1600 CA ASN A 107 -7.469 -7.636 -14.906 1.00 0.73 C ATOM 1601 C ASN A 107 -7.675 -6.211 -14.423 1.00 0.67 C ATOM 1602 O ASN A 107 -7.952 -5.297 -15.202 1.00 0.80 O ATOM 1603 CB ASN A 107 -8.053 -7.822 -16.298 1.00 0.92 C ATOM 1604 CG ASN A 107 -7.129 -7.325 -17.400 1.00 1.44 C ATOM 1605 OD1 ASN A 107 -6.296 -8.073 -17.913 1.00 1.99 O ATOM 1606 ND2 ASN A 107 -7.270 -6.065 -17.781 1.00 2.06 N ATOM 0 H ASN A 107 -7.364 -9.181 -13.506 1.00 0.67 H new ATOM 0 HA ASN A 107 -6.398 -7.832 -14.966 1.00 0.73 H new ATOM 0 HB2 ASN A 107 -8.266 -8.879 -16.459 1.00 0.92 H new ATOM 0 HB3 ASN A 107 -9.003 -7.292 -16.361 1.00 0.92 H new ATOM 0 HD21 ASN A 107 -6.678 -5.687 -18.521 1.00 2.06 H new ATOM 0 HD22 ASN A 107 -7.970 -5.473 -17.335 1.00 2.06 H new ATOM 1613 N VAL A 108 -7.558 -6.028 -13.119 1.00 0.55 N ATOM 1614 CA VAL A 108 -7.702 -4.707 -12.537 1.00 0.49 C ATOM 1615 C VAL A 108 -6.348 -4.145 -12.119 1.00 0.40 C ATOM 1616 O VAL A 108 -5.436 -4.897 -11.763 1.00 0.42 O ATOM 1617 CB VAL A 108 -8.653 -4.706 -11.314 1.00 0.54 C ATOM 1618 CG1 VAL A 108 -9.395 -6.022 -11.174 1.00 1.00 C ATOM 1619 CG2 VAL A 108 -7.909 -4.369 -10.030 1.00 1.08 C ATOM 0 H VAL A 108 -7.365 -6.772 -12.448 1.00 0.55 H new ATOM 0 HA VAL A 108 -8.138 -4.075 -13.310 1.00 0.49 H new ATOM 0 HB VAL A 108 -9.393 -3.926 -11.491 1.00 0.54 H new ATOM 0 HG11 VAL A 108 -10.051 -5.979 -10.304 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -9.991 -6.201 -12.069 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -8.677 -6.833 -11.048 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -8.607 -4.377 -9.192 1.00 1.08 H new ATOM 0 HG22 VAL A 108 -7.127 -5.108 -9.858 1.00 1.08 H new ATOM 0 HG23 VAL A 108 -7.460 -3.380 -10.119 1.00 1.08 H new ATOM 1629 N PRO A 109 -6.203 -2.815 -12.190 1.00 0.39 N ATOM 1630 CA PRO A 109 -5.042 -2.111 -11.658 1.00 0.35 C ATOM 1631 C PRO A 109 -5.001 -2.092 -10.139 1.00 0.30 C ATOM 1632 O PRO A 109 -6.033 -2.130 -9.459 1.00 0.34 O ATOM 1633 CB PRO A 109 -5.209 -0.681 -12.149 1.00 0.43 C ATOM 1634 CG PRO A 109 -6.257 -0.733 -13.195 1.00 0.51 C ATOM 1635 CD PRO A 109 -7.139 -1.896 -12.843 1.00 0.48 C ATOM 0 HA PRO A 109 -4.125 -2.601 -11.984 1.00 0.35 H new ATOM 0 HB2 PRO A 109 -5.503 -0.020 -11.334 1.00 0.43 H new ATOM 0 HB3 PRO A 109 -4.273 -0.294 -12.552 1.00 0.43 H new ATOM 0 HG2 PRO A 109 -6.828 0.195 -13.221 1.00 0.51 H new ATOM 0 HG3 PRO A 109 -5.815 -0.864 -14.183 1.00 0.51 H new ATOM 0 HD2 PRO A 109 -7.951 -1.603 -12.178 1.00 0.48 H new ATOM 0 HD3 PRO A 109 -7.596 -2.342 -13.727 1.00 0.48 H new ATOM 1643 N ILE A 110 -3.806 -1.949 -9.616 1.00 0.27 N ATOM 1644 CA ILE A 110 -3.587 -2.031 -8.184 1.00 0.25 C ATOM 1645 C ILE A 110 -2.865 -0.783 -7.688 1.00 0.23 C ATOM 1646 O ILE A 110 -2.051 -0.198 -8.403 1.00 0.26 O ATOM 1647 CB ILE A 110 -2.781 -3.300 -7.818 1.00 0.30 C ATOM 1648 CG1 ILE A 110 -3.491 -4.551 -8.357 1.00 0.46 C ATOM 1649 CG2 ILE A 110 -2.599 -3.404 -6.309 1.00 0.45 C ATOM 1650 CD1 ILE A 110 -2.691 -5.826 -8.200 1.00 0.96 C ATOM 0 H ILE A 110 -2.962 -1.774 -10.162 1.00 0.27 H new ATOM 0 HA ILE A 110 -4.559 -2.094 -7.694 1.00 0.25 H new ATOM 0 HB ILE A 110 -1.795 -3.229 -8.278 1.00 0.30 H new ATOM 0 HG12 ILE A 110 -4.444 -4.666 -7.841 1.00 0.46 H new ATOM 0 HG13 ILE A 110 -3.716 -4.402 -9.413 1.00 0.46 H new ATOM 0 HG21 ILE A 110 -2.030 -4.303 -6.072 1.00 0.45 H new ATOM 0 HG22 ILE A 110 -2.061 -2.528 -5.946 1.00 0.45 H new ATOM 0 HG23 ILE A 110 -3.575 -3.456 -5.827 1.00 0.45 H new ATOM 0 HD11 ILE A 110 -3.259 -6.664 -8.604 1.00 0.96 H new ATOM 0 HD12 ILE A 110 -1.748 -5.733 -8.739 1.00 0.96 H new ATOM 0 HD13 ILE A 110 -2.488 -6.001 -7.143 1.00 0.96 H new ATOM 1662 N ILE A 111 -3.185 -0.361 -6.475 1.00 0.23 N ATOM 1663 CA ILE A 111 -2.589 0.831 -5.898 1.00 0.25 C ATOM 1664 C ILE A 111 -1.873 0.462 -4.628 1.00 0.32 C ATOM 1665 O ILE A 111 -2.182 -0.548 -4.028 1.00 0.71 O ATOM 1666 CB ILE A 111 -3.672 1.869 -5.565 1.00 0.29 C ATOM 1667 CG1 ILE A 111 -4.538 2.136 -6.782 1.00 0.35 C ATOM 1668 CG2 ILE A 111 -3.064 3.161 -5.048 1.00 0.34 C ATOM 1669 CD1 ILE A 111 -5.981 2.278 -6.407 1.00 0.53 C ATOM 0 H ILE A 111 -3.858 -0.830 -5.869 1.00 0.23 H new ATOM 0 HA ILE A 111 -1.893 1.256 -6.621 1.00 0.25 H new ATOM 0 HB ILE A 111 -4.297 1.458 -4.772 1.00 0.29 H new ATOM 0 HG12 ILE A 111 -4.199 3.045 -7.279 1.00 0.35 H new ATOM 0 HG13 ILE A 111 -4.425 1.321 -7.497 1.00 0.35 H new ATOM 0 HG21 ILE A 111 -3.859 3.872 -4.823 1.00 0.34 H new ATOM 0 HG22 ILE A 111 -2.492 2.957 -4.143 1.00 0.34 H new ATOM 0 HG23 ILE A 111 -2.405 3.582 -5.807 1.00 0.34 H new ATOM 0 HD11 ILE A 111 -6.573 2.469 -7.302 1.00 0.53 H new ATOM 0 HD12 ILE A 111 -6.326 1.359 -5.933 1.00 0.53 H new ATOM 0 HD13 ILE A 111 -6.096 3.110 -5.712 1.00 0.53 H new ATOM 1681 N VAL A 112 -0.906 1.253 -4.239 1.00 0.21 N ATOM 1682 CA VAL A 112 -0.240 1.055 -2.994 1.00 0.20 C ATOM 1683 C VAL A 112 -0.393 2.268 -2.119 1.00 0.20 C ATOM 1684 O VAL A 112 -0.252 3.402 -2.577 1.00 0.23 O ATOM 1685 CB VAL A 112 1.241 0.809 -3.198 1.00 0.20 C ATOM 1686 CG1 VAL A 112 1.711 -0.241 -2.256 1.00 0.20 C ATOM 1687 CG2 VAL A 112 1.529 0.381 -4.615 1.00 0.22 C ATOM 0 H VAL A 112 -0.565 2.048 -4.780 1.00 0.21 H new ATOM 0 HA VAL A 112 -0.694 0.184 -2.521 1.00 0.20 H new ATOM 0 HB VAL A 112 1.771 1.742 -3.005 1.00 0.20 H new ATOM 0 HG11 VAL A 112 2.777 -0.414 -2.407 1.00 0.20 H new ATOM 0 HG12 VAL A 112 1.538 0.086 -1.231 1.00 0.20 H new ATOM 0 HG13 VAL A 112 1.164 -1.166 -2.439 1.00 0.20 H new ATOM 0 HG21 VAL A 112 2.599 0.211 -4.733 1.00 0.22 H new ATOM 0 HG22 VAL A 112 0.989 -0.540 -4.834 1.00 0.22 H new ATOM 0 HG23 VAL A 112 1.207 1.162 -5.304 1.00 0.22 H new ATOM 1697 N ALA A 113 -0.655 2.021 -0.866 1.00 0.19 N ATOM 1698 CA ALA A 113 -0.719 3.064 0.113 1.00 0.21 C ATOM 1699 C ALA A 113 0.253 2.727 1.213 1.00 0.21 C ATOM 1700 O ALA A 113 -0.090 2.063 2.186 1.00 0.23 O ATOM 1701 CB ALA A 113 -2.130 3.206 0.656 1.00 0.25 C ATOM 0 H ALA A 113 -0.830 1.087 -0.496 1.00 0.19 H new ATOM 0 HA ALA A 113 -0.453 4.020 -0.337 1.00 0.21 H new ATOM 0 HB1 ALA A 113 -2.156 4.004 1.398 1.00 0.25 H new ATOM 0 HB2 ALA A 113 -2.811 3.447 -0.160 1.00 0.25 H new ATOM 0 HB3 ALA A 113 -2.437 2.269 1.120 1.00 0.25 H new ATOM 1707 N ILE A 114 1.478 3.169 1.026 1.00 0.21 N ATOM 1708 CA ILE A 114 2.527 2.963 1.998 1.00 0.24 C ATOM 1709 C ILE A 114 2.307 3.853 3.218 1.00 0.25 C ATOM 1710 O ILE A 114 2.664 5.029 3.207 1.00 0.30 O ATOM 1711 CB ILE A 114 3.901 3.267 1.375 1.00 0.28 C ATOM 1712 CG1 ILE A 114 4.049 2.560 0.022 1.00 0.32 C ATOM 1713 CG2 ILE A 114 4.996 2.831 2.320 1.00 0.36 C ATOM 1714 CD1 ILE A 114 5.337 2.888 -0.704 1.00 0.85 C ATOM 0 H ILE A 114 1.774 3.681 0.195 1.00 0.21 H new ATOM 0 HA ILE A 114 2.501 1.920 2.312 1.00 0.24 H new ATOM 0 HB ILE A 114 3.982 4.341 1.207 1.00 0.28 H new ATOM 0 HG12 ILE A 114 3.996 1.483 0.178 1.00 0.32 H new ATOM 0 HG13 ILE A 114 3.206 2.832 -0.613 1.00 0.32 H new ATOM 0 HG21 ILE A 114 5.968 3.048 1.876 1.00 0.36 H new ATOM 0 HG22 ILE A 114 4.899 3.370 3.262 1.00 0.36 H new ATOM 0 HG23 ILE A 114 4.912 1.760 2.505 1.00 0.36 H new ATOM 0 HD11 ILE A 114 5.368 2.350 -1.652 1.00 0.85 H new ATOM 0 HD12 ILE A 114 5.385 3.960 -0.894 1.00 0.85 H new ATOM 0 HD13 ILE A 114 6.187 2.590 -0.090 1.00 0.85 H new ATOM 1726 N ASN A 115 1.705 3.291 4.258 1.00 0.26 N ATOM 1727 CA ASN A 115 1.412 4.043 5.471 1.00 0.31 C ATOM 1728 C ASN A 115 2.610 3.987 6.412 1.00 0.37 C ATOM 1729 O ASN A 115 3.516 3.176 6.208 1.00 0.39 O ATOM 1730 CB ASN A 115 0.163 3.466 6.151 1.00 0.39 C ATOM 1731 CG ASN A 115 -0.295 4.273 7.354 1.00 0.47 C ATOM 1732 OD1 ASN A 115 -0.132 5.495 7.406 1.00 0.60 O ATOM 1733 ND2 ASN A 115 -0.863 3.588 8.335 1.00 0.69 N ATOM 0 H ASN A 115 1.410 2.315 4.286 1.00 0.26 H new ATOM 0 HA ASN A 115 1.218 5.085 5.216 1.00 0.31 H new ATOM 0 HB2 ASN A 115 -0.648 3.418 5.424 1.00 0.39 H new ATOM 0 HB3 ASN A 115 0.369 2.443 6.466 1.00 0.39 H new ATOM 0 HD21 ASN A 115 -1.185 4.070 9.174 1.00 0.69 H new ATOM 0 HD22 ASN A 115 -0.979 2.578 8.251 1.00 0.69 H new ATOM 1740 N LYS A 116 2.622 4.860 7.421 1.00 0.49 N ATOM 1741 CA LYS A 116 3.697 4.902 8.420 1.00 0.62 C ATOM 1742 C LYS A 116 5.028 5.286 7.773 1.00 0.57 C ATOM 1743 O LYS A 116 6.100 5.072 8.339 1.00 0.67 O ATOM 1744 CB LYS A 116 3.822 3.545 9.131 1.00 0.78 C ATOM 1745 CG LYS A 116 2.542 3.084 9.815 1.00 1.15 C ATOM 1746 CD LYS A 116 2.662 1.649 10.302 1.00 1.50 C ATOM 1747 CE LYS A 116 1.365 1.148 10.923 1.00 2.05 C ATOM 1748 NZ LYS A 116 1.011 1.896 12.158 1.00 2.61 N ATOM 0 H LYS A 116 1.891 5.556 7.570 1.00 0.49 H new ATOM 0 HA LYS A 116 3.444 5.663 9.159 1.00 0.62 H new ATOM 0 HB2 LYS A 116 4.125 2.792 8.404 1.00 0.78 H new ATOM 0 HB3 LYS A 116 4.617 3.608 9.874 1.00 0.78 H new ATOM 0 HG2 LYS A 116 2.321 3.739 10.658 1.00 1.15 H new ATOM 0 HG3 LYS A 116 1.706 3.166 9.120 1.00 1.15 H new ATOM 0 HD2 LYS A 116 2.937 1.004 9.467 1.00 1.50 H new ATOM 0 HD3 LYS A 116 3.465 1.581 11.036 1.00 1.50 H new ATOM 0 HE2 LYS A 116 0.556 1.242 10.198 1.00 2.05 H new ATOM 0 HE3 LYS A 116 1.461 0.088 11.157 1.00 2.05 H new ATOM 0 HZ1 LYS A 116 0.179 1.458 12.603 1.00 2.61 H new ATOM 0 HZ2 LYS A 116 1.812 1.871 12.821 1.00 2.61 H new ATOM 0 HZ3 LYS A 116 0.794 2.884 11.915 1.00 2.61 H new ATOM 1762 N MET A 117 4.941 5.884 6.593 1.00 0.58 N ATOM 1763 CA MET A 117 6.108 6.225 5.802 1.00 0.69 C ATOM 1764 C MET A 117 6.648 7.608 6.189 1.00 0.81 C ATOM 1765 O MET A 117 7.704 8.028 5.727 1.00 1.03 O ATOM 1766 CB MET A 117 5.723 6.145 4.319 1.00 0.85 C ATOM 1767 CG MET A 117 6.432 7.138 3.428 1.00 0.81 C ATOM 1768 SD MET A 117 8.121 6.639 3.008 1.00 1.37 S ATOM 1769 CE MET A 117 7.812 5.113 2.124 1.00 0.65 C ATOM 0 H MET A 117 4.056 6.146 6.159 1.00 0.58 H new ATOM 0 HA MET A 117 6.916 5.520 5.996 1.00 0.69 H new ATOM 0 HB2 MET A 117 5.933 5.138 3.957 1.00 0.85 H new ATOM 0 HB3 MET A 117 4.648 6.299 4.228 1.00 0.85 H new ATOM 0 HG2 MET A 117 5.859 7.266 2.510 1.00 0.81 H new ATOM 0 HG3 MET A 117 6.459 8.108 3.925 1.00 0.81 H new ATOM 0 HE1 MET A 117 8.517 5.022 1.298 1.00 0.65 H new ATOM 0 HE2 MET A 117 7.936 4.268 2.802 1.00 0.65 H new ATOM 0 HE3 MET A 117 6.794 5.118 1.734 1.00 0.65 H new ATOM 1779 N ASP A 118 5.929 8.283 7.085 1.00 0.84 N ATOM 1780 CA ASP A 118 6.322 9.614 7.593 1.00 1.06 C ATOM 1781 C ASP A 118 7.690 9.596 8.288 1.00 1.10 C ATOM 1782 O ASP A 118 8.153 10.615 8.800 1.00 1.49 O ATOM 1783 CB ASP A 118 5.262 10.165 8.553 1.00 1.25 C ATOM 1784 CG ASP A 118 4.981 9.241 9.721 1.00 1.61 C ATOM 1785 OD1 ASP A 118 4.307 8.207 9.529 1.00 2.45 O ATOM 1786 OD2 ASP A 118 5.450 9.537 10.841 1.00 1.73 O ATOM 0 H ASP A 118 5.059 7.931 7.484 1.00 0.84 H new ATOM 0 HA ASP A 118 6.400 10.267 6.724 1.00 1.06 H new ATOM 0 HB2 ASP A 118 5.592 11.132 8.933 1.00 1.25 H new ATOM 0 HB3 ASP A 118 4.337 10.338 8.003 1.00 1.25 H new ATOM 1791 N LYS A 119 8.317 8.431 8.322 1.00 1.11 N ATOM 1792 CA LYS A 119 9.718 8.302 8.692 1.00 1.34 C ATOM 1793 C LYS A 119 10.575 8.822 7.527 1.00 1.43 C ATOM 1794 O LYS A 119 10.028 9.330 6.547 1.00 1.78 O ATOM 1795 CB LYS A 119 10.022 6.823 8.968 1.00 1.81 C ATOM 1796 CG LYS A 119 9.225 6.241 10.125 1.00 1.99 C ATOM 1797 CD LYS A 119 9.105 4.726 10.024 1.00 2.61 C ATOM 1798 CE LYS A 119 10.462 4.039 9.979 1.00 3.15 C ATOM 1799 NZ LYS A 119 11.235 4.223 11.234 1.00 3.70 N ATOM 0 H LYS A 119 7.867 7.545 8.093 1.00 1.11 H new ATOM 0 HA LYS A 119 9.941 8.880 9.589 1.00 1.34 H new ATOM 0 HB2 LYS A 119 9.814 6.244 8.068 1.00 1.81 H new ATOM 0 HB3 LYS A 119 11.086 6.713 9.179 1.00 1.81 H new ATOM 0 HG2 LYS A 119 9.706 6.505 11.067 1.00 1.99 H new ATOM 0 HG3 LYS A 119 8.229 6.684 10.140 1.00 1.99 H new ATOM 0 HD2 LYS A 119 8.539 4.351 10.877 1.00 2.61 H new ATOM 0 HD3 LYS A 119 8.540 4.468 9.128 1.00 2.61 H new ATOM 0 HE2 LYS A 119 10.320 2.974 9.796 1.00 3.15 H new ATOM 0 HE3 LYS A 119 11.037 4.432 9.141 1.00 3.15 H new ATOM 0 HZ1 LYS A 119 12.136 3.708 11.165 1.00 3.70 H new ATOM 0 HZ2 LYS A 119 11.425 5.235 11.380 1.00 3.70 H new ATOM 0 HZ3 LYS A 119 10.686 3.855 12.037 1.00 3.70 H new ATOM 1813 N PRO A 120 11.914 8.743 7.593 1.00 1.71 N ATOM 1814 CA PRO A 120 12.738 9.010 6.414 1.00 2.15 C ATOM 1815 C PRO A 120 12.342 8.078 5.274 1.00 2.06 C ATOM 1816 O PRO A 120 12.071 8.519 4.158 1.00 2.57 O ATOM 1817 CB PRO A 120 14.165 8.710 6.874 1.00 2.65 C ATOM 1818 CG PRO A 120 14.129 8.758 8.365 1.00 2.67 C ATOM 1819 CD PRO A 120 12.719 8.439 8.787 1.00 2.11 C ATOM 0 HA PRO A 120 12.624 10.029 6.044 1.00 2.15 H new ATOM 0 HB2 PRO A 120 14.492 7.732 6.522 1.00 2.65 H new ATOM 0 HB3 PRO A 120 14.867 9.443 6.476 1.00 2.65 H new ATOM 0 HG2 PRO A 120 14.830 8.039 8.790 1.00 2.67 H new ATOM 0 HG3 PRO A 120 14.425 9.743 8.725 1.00 2.67 H new ATOM 0 HD2 PRO A 120 12.617 7.395 9.082 1.00 2.11 H new ATOM 0 HD3 PRO A 120 12.411 9.043 9.641 1.00 2.11 H new ATOM 1827 N GLU A 121 12.275 6.787 5.616 1.00 1.72 N ATOM 1828 CA GLU A 121 11.890 5.710 4.725 1.00 1.80 C ATOM 1829 C GLU A 121 12.408 4.424 5.328 1.00 1.43 C ATOM 1830 O GLU A 121 13.555 4.345 5.771 1.00 2.12 O ATOM 1831 CB GLU A 121 12.468 5.863 3.304 1.00 2.45 C ATOM 1832 CG GLU A 121 13.946 5.521 3.189 1.00 2.79 C ATOM 1833 CD GLU A 121 14.405 5.338 1.757 1.00 3.60 C ATOM 1834 OE1 GLU A 121 14.768 6.341 1.112 1.00 3.92 O ATOM 1835 OE2 GLU A 121 14.419 4.181 1.272 1.00 4.03 O ATOM 0 H GLU A 121 12.497 6.462 6.557 1.00 1.72 H new ATOM 0 HA GLU A 121 10.805 5.719 4.624 1.00 1.80 H new ATOM 0 HB2 GLU A 121 11.905 5.223 2.625 1.00 2.45 H new ATOM 0 HB3 GLU A 121 12.318 6.890 2.972 1.00 2.45 H new ATOM 0 HG2 GLU A 121 14.533 6.313 3.654 1.00 2.79 H new ATOM 0 HG3 GLU A 121 14.146 4.607 3.748 1.00 2.79 H new ATOM 1842 N ALA A 122 11.542 3.450 5.422 1.00 0.99 N ATOM 1843 CA ALA A 122 11.984 2.101 5.707 1.00 1.09 C ATOM 1844 C ALA A 122 12.795 1.612 4.520 1.00 0.90 C ATOM 1845 O ALA A 122 13.981 1.307 4.645 1.00 1.24 O ATOM 1846 CB ALA A 122 10.803 1.188 5.977 1.00 1.47 C ATOM 0 H ALA A 122 10.534 3.558 5.307 1.00 0.99 H new ATOM 0 HA ALA A 122 12.601 2.092 6.606 1.00 1.09 H new ATOM 0 HB1 ALA A 122 11.162 0.181 6.188 1.00 1.47 H new ATOM 0 HB2 ALA A 122 10.243 1.561 6.835 1.00 1.47 H new ATOM 0 HB3 ALA A 122 10.153 1.165 5.102 1.00 1.47 H new ATOM 1852 N ASN A 123 12.122 1.561 3.370 1.00 0.59 N ATOM 1853 CA ASN A 123 12.755 1.407 2.063 1.00 0.57 C ATOM 1854 C ASN A 123 11.700 1.110 1.011 1.00 0.46 C ATOM 1855 O ASN A 123 11.339 -0.048 0.800 1.00 0.52 O ATOM 1856 CB ASN A 123 13.793 0.286 2.042 1.00 0.85 C ATOM 1857 CG ASN A 123 14.591 0.281 0.749 1.00 1.28 C ATOM 1858 OD1 ASN A 123 14.988 -0.773 0.255 1.00 1.77 O ATOM 1859 ND2 ASN A 123 14.855 1.461 0.200 1.00 1.84 N ATOM 0 H ASN A 123 11.105 1.627 3.321 1.00 0.59 H new ATOM 0 HA ASN A 123 13.266 2.345 1.848 1.00 0.57 H new ATOM 0 HB2 ASN A 123 14.471 0.403 2.887 1.00 0.85 H new ATOM 0 HB3 ASN A 123 13.293 -0.675 2.164 1.00 0.85 H new ATOM 0 HD21 ASN A 123 15.403 1.513 -0.659 1.00 1.84 H new ATOM 0 HD22 ASN A 123 14.510 2.316 0.637 1.00 1.84 H new ATOM 1866 N PRO A 124 11.167 2.167 0.366 1.00 0.41 N ATOM 1867 CA PRO A 124 10.263 2.053 -0.774 1.00 0.47 C ATOM 1868 C PRO A 124 10.664 0.938 -1.737 1.00 0.42 C ATOM 1869 O PRO A 124 9.902 0.008 -1.924 1.00 0.40 O ATOM 1870 CB PRO A 124 10.367 3.427 -1.461 1.00 0.66 C ATOM 1871 CG PRO A 124 11.310 4.237 -0.628 1.00 0.70 C ATOM 1872 CD PRO A 124 11.355 3.575 0.716 1.00 0.46 C ATOM 0 HA PRO A 124 9.251 1.797 -0.459 1.00 0.47 H new ATOM 0 HB2 PRO A 124 10.737 3.326 -2.481 1.00 0.66 H new ATOM 0 HB3 PRO A 124 9.390 3.907 -1.522 1.00 0.66 H new ATOM 0 HG2 PRO A 124 12.301 4.267 -1.080 1.00 0.70 H new ATOM 0 HG3 PRO A 124 10.967 5.268 -0.543 1.00 0.70 H new ATOM 0 HD2 PRO A 124 12.304 3.746 1.224 1.00 0.46 H new ATOM 0 HD3 PRO A 124 10.569 3.940 1.377 1.00 0.46 H new ATOM 1880 N ASP A 125 11.870 1.025 -2.304 1.00 0.45 N ATOM 1881 CA ASP A 125 12.358 0.049 -3.297 1.00 0.45 C ATOM 1882 C ASP A 125 12.064 -1.376 -2.868 1.00 0.38 C ATOM 1883 O ASP A 125 11.465 -2.133 -3.621 1.00 0.33 O ATOM 1884 CB ASP A 125 13.868 0.187 -3.490 1.00 0.56 C ATOM 1885 CG ASP A 125 14.315 1.613 -3.708 1.00 1.16 C ATOM 1886 OD1 ASP A 125 14.574 2.313 -2.705 1.00 2.00 O ATOM 1887 OD2 ASP A 125 14.437 2.037 -4.876 1.00 1.28 O ATOM 0 H ASP A 125 12.537 1.768 -2.093 1.00 0.45 H new ATOM 0 HA ASP A 125 11.837 0.260 -4.231 1.00 0.45 H new ATOM 0 HB2 ASP A 125 14.377 -0.216 -2.615 1.00 0.56 H new ATOM 0 HB3 ASP A 125 14.175 -0.417 -4.344 1.00 0.56 H new ATOM 1892 N ARG A 126 12.474 -1.732 -1.652 1.00 0.40 N ATOM 1893 CA ARG A 126 12.239 -3.073 -1.132 1.00 0.40 C ATOM 1894 C ARG A 126 10.758 -3.405 -1.197 1.00 0.34 C ATOM 1895 O ARG A 126 10.354 -4.351 -1.864 1.00 0.32 O ATOM 1896 CB ARG A 126 12.739 -3.184 0.313 1.00 0.47 C ATOM 1897 CG ARG A 126 12.556 -4.569 0.920 1.00 0.58 C ATOM 1898 CD ARG A 126 11.222 -4.686 1.645 1.00 1.25 C ATOM 1899 NE ARG A 126 10.894 -6.065 1.999 1.00 1.38 N ATOM 1900 CZ ARG A 126 10.710 -6.489 3.247 1.00 2.08 C ATOM 1901 NH1 ARG A 126 10.944 -5.673 4.270 1.00 2.99 N ATOM 1902 NH2 ARG A 126 10.319 -7.739 3.468 1.00 2.15 N ATOM 0 H ARG A 126 12.969 -1.111 -1.012 1.00 0.40 H new ATOM 0 HA ARG A 126 12.790 -3.785 -1.746 1.00 0.40 H new ATOM 0 HB2 ARG A 126 13.796 -2.921 0.343 1.00 0.47 H new ATOM 0 HB3 ARG A 126 12.211 -2.455 0.928 1.00 0.47 H new ATOM 0 HG2 ARG A 126 12.612 -5.323 0.134 1.00 0.58 H new ATOM 0 HG3 ARG A 126 13.369 -4.773 1.616 1.00 0.58 H new ATOM 0 HD2 ARG A 126 11.250 -4.079 2.550 1.00 1.25 H new ATOM 0 HD3 ARG A 126 10.432 -4.279 1.013 1.00 1.25 H new ATOM 0 HE ARG A 126 10.800 -6.744 1.244 1.00 1.38 H new ATOM 0 HH11 ARG A 126 11.265 -4.720 4.099 1.00 2.99 H new ATOM 0 HH12 ARG A 126 10.802 -6.000 5.226 1.00 2.99 H new ATOM 0 HH21 ARG A 126 10.161 -8.370 2.683 1.00 2.15 H new ATOM 0 HH22 ARG A 126 10.177 -8.068 4.423 1.00 2.15 H new ATOM 1916 N VAL A 127 9.966 -2.594 -0.511 1.00 0.34 N ATOM 1917 CA VAL A 127 8.516 -2.775 -0.458 1.00 0.34 C ATOM 1918 C VAL A 127 7.925 -2.844 -1.866 1.00 0.31 C ATOM 1919 O VAL A 127 7.108 -3.704 -2.173 1.00 0.33 O ATOM 1920 CB VAL A 127 7.841 -1.621 0.311 1.00 0.37 C ATOM 1921 CG1 VAL A 127 6.336 -1.830 0.401 1.00 0.39 C ATOM 1922 CG2 VAL A 127 8.446 -1.481 1.699 1.00 0.40 C ATOM 0 H VAL A 127 10.305 -1.794 0.024 1.00 0.34 H new ATOM 0 HA VAL A 127 8.326 -3.714 0.063 1.00 0.34 H new ATOM 0 HB VAL A 127 8.019 -0.698 -0.240 1.00 0.37 H new ATOM 0 HG11 VAL A 127 5.886 -1.002 0.948 1.00 0.39 H new ATOM 0 HG12 VAL A 127 5.914 -1.874 -0.603 1.00 0.39 H new ATOM 0 HG13 VAL A 127 6.129 -2.764 0.922 1.00 0.39 H new ATOM 0 HG21 VAL A 127 7.958 -0.662 2.228 1.00 0.40 H new ATOM 0 HG22 VAL A 127 8.302 -2.408 2.254 1.00 0.40 H new ATOM 0 HG23 VAL A 127 9.512 -1.272 1.612 1.00 0.40 H new ATOM 1932 N MET A 128 8.378 -1.946 -2.720 1.00 0.28 N ATOM 1933 CA MET A 128 7.876 -1.835 -4.081 1.00 0.26 C ATOM 1934 C MET A 128 8.274 -3.048 -4.916 1.00 0.25 C ATOM 1935 O MET A 128 7.535 -3.465 -5.812 1.00 0.25 O ATOM 1936 CB MET A 128 8.400 -0.548 -4.721 1.00 0.25 C ATOM 1937 CG MET A 128 8.005 0.705 -3.953 1.00 0.27 C ATOM 1938 SD MET A 128 8.812 2.198 -4.551 1.00 0.30 S ATOM 1939 CE MET A 128 8.139 2.297 -6.201 1.00 0.29 C ATOM 0 H MET A 128 9.107 -1.270 -2.491 1.00 0.28 H new ATOM 0 HA MET A 128 6.787 -1.800 -4.046 1.00 0.26 H new ATOM 0 HB2 MET A 128 9.487 -0.599 -4.787 1.00 0.25 H new ATOM 0 HB3 MET A 128 8.022 -0.476 -5.741 1.00 0.25 H new ATOM 0 HG2 MET A 128 6.925 0.835 -4.017 1.00 0.27 H new ATOM 0 HG3 MET A 128 8.248 0.567 -2.899 1.00 0.27 H new ATOM 0 HE1 MET A 128 8.832 2.840 -6.844 1.00 0.29 H new ATOM 0 HE2 MET A 128 7.990 1.291 -6.594 1.00 0.29 H new ATOM 0 HE3 MET A 128 7.183 2.821 -6.173 1.00 0.29 H new ATOM 1949 N GLN A 129 9.432 -3.621 -4.612 1.00 0.25 N ATOM 1950 CA GLN A 129 9.904 -4.803 -5.319 1.00 0.26 C ATOM 1951 C GLN A 129 9.116 -6.029 -4.896 1.00 0.29 C ATOM 1952 O GLN A 129 8.975 -6.976 -5.666 1.00 0.31 O ATOM 1953 CB GLN A 129 11.401 -5.018 -5.096 1.00 0.29 C ATOM 1954 CG GLN A 129 12.271 -4.130 -5.972 1.00 0.31 C ATOM 1955 CD GLN A 129 13.744 -4.258 -5.647 1.00 0.46 C ATOM 1956 OE1 GLN A 129 14.278 -3.525 -4.819 1.00 1.16 O ATOM 1957 NE2 GLN A 129 14.407 -5.209 -6.286 1.00 1.28 N ATOM 0 H GLN A 129 10.060 -3.286 -3.881 1.00 0.25 H new ATOM 0 HA GLN A 129 9.745 -4.643 -6.385 1.00 0.26 H new ATOM 0 HB2 GLN A 129 11.637 -4.827 -4.049 1.00 0.29 H new ATOM 0 HB3 GLN A 129 11.645 -6.062 -5.293 1.00 0.29 H new ATOM 0 HG2 GLN A 129 12.110 -4.388 -7.019 1.00 0.31 H new ATOM 0 HG3 GLN A 129 11.964 -3.091 -5.849 1.00 0.31 H new ATOM 0 HE21 GLN A 129 13.926 -5.797 -6.967 1.00 1.28 H new ATOM 0 HE22 GLN A 129 15.399 -5.354 -6.097 1.00 1.28 H new ATOM 1966 N GLU A 130 8.589 -6.004 -3.678 1.00 0.33 N ATOM 1967 CA GLU A 130 7.685 -7.054 -3.230 1.00 0.38 C ATOM 1968 C GLU A 130 6.454 -7.038 -4.111 1.00 0.33 C ATOM 1969 O GLU A 130 5.950 -8.083 -4.516 1.00 0.36 O ATOM 1970 CB GLU A 130 7.258 -6.848 -1.776 1.00 0.48 C ATOM 1971 CG GLU A 130 8.359 -6.317 -0.888 1.00 0.71 C ATOM 1972 CD GLU A 130 9.489 -7.303 -0.671 1.00 1.18 C ATOM 1973 OE1 GLU A 130 10.332 -7.468 -1.574 1.00 2.02 O ATOM 1974 OE2 GLU A 130 9.556 -7.896 0.426 1.00 1.46 O ATOM 0 H GLU A 130 8.770 -5.275 -2.989 1.00 0.33 H new ATOM 0 HA GLU A 130 8.205 -8.010 -3.297 1.00 0.38 H new ATOM 0 HB2 GLU A 130 6.416 -6.156 -1.749 1.00 0.48 H new ATOM 0 HB3 GLU A 130 6.904 -7.797 -1.373 1.00 0.48 H new ATOM 0 HG2 GLU A 130 8.762 -5.405 -1.329 1.00 0.71 H new ATOM 0 HG3 GLU A 130 7.935 -6.043 0.078 1.00 0.71 H new ATOM 1981 N LEU A 131 5.996 -5.834 -4.447 1.00 0.29 N ATOM 1982 CA LEU A 131 4.782 -5.687 -5.234 1.00 0.29 C ATOM 1983 C LEU A 131 5.009 -6.193 -6.632 1.00 0.24 C ATOM 1984 O LEU A 131 4.189 -6.913 -7.196 1.00 0.25 O ATOM 1985 CB LEU A 131 4.316 -4.237 -5.283 1.00 0.32 C ATOM 1986 CG LEU A 131 3.442 -3.813 -4.112 1.00 0.48 C ATOM 1987 CD1 LEU A 131 2.297 -4.782 -3.949 1.00 0.34 C ATOM 1988 CD2 LEU A 131 4.254 -3.759 -2.844 1.00 1.06 C ATOM 0 H LEU A 131 6.445 -4.956 -4.188 1.00 0.29 H new ATOM 0 HA LEU A 131 4.002 -6.276 -4.752 1.00 0.29 H new ATOM 0 HB2 LEU A 131 5.192 -3.589 -5.319 1.00 0.32 H new ATOM 0 HB3 LEU A 131 3.763 -4.078 -6.209 1.00 0.32 H new ATOM 0 HG LEU A 131 3.044 -2.819 -4.314 1.00 0.48 H new ATOM 0 HD11 LEU A 131 1.675 -4.473 -3.109 1.00 0.34 H new ATOM 0 HD12 LEU A 131 1.698 -4.793 -4.859 1.00 0.34 H new ATOM 0 HD13 LEU A 131 2.690 -5.781 -3.761 1.00 0.34 H new ATOM 0 HD21 LEU A 131 3.615 -3.454 -2.015 1.00 1.06 H new ATOM 0 HD22 LEU A 131 4.671 -4.744 -2.637 1.00 1.06 H new ATOM 0 HD23 LEU A 131 5.064 -3.039 -2.961 1.00 1.06 H new ATOM 2000 N MET A 132 6.148 -5.845 -7.176 1.00 0.21 N ATOM 2001 CA MET A 132 6.489 -6.281 -8.503 1.00 0.22 C ATOM 2002 C MET A 132 6.912 -7.746 -8.481 1.00 0.26 C ATOM 2003 O MET A 132 7.116 -8.359 -9.526 1.00 0.32 O ATOM 2004 CB MET A 132 7.571 -5.381 -9.077 1.00 0.23 C ATOM 2005 CG MET A 132 8.972 -5.640 -8.550 1.00 0.26 C ATOM 2006 SD MET A 132 9.881 -6.764 -9.614 1.00 0.35 S ATOM 2007 CE MET A 132 9.353 -6.116 -11.194 1.00 0.32 C ATOM 0 H MET A 132 6.851 -5.263 -6.721 1.00 0.21 H new ATOM 0 HA MET A 132 5.617 -6.205 -9.152 1.00 0.22 H new ATOM 0 HB2 MET A 132 7.580 -5.496 -10.161 1.00 0.23 H new ATOM 0 HB3 MET A 132 7.307 -4.344 -8.869 1.00 0.23 H new ATOM 0 HG2 MET A 132 9.512 -4.696 -8.471 1.00 0.26 H new ATOM 0 HG3 MET A 132 8.912 -6.058 -7.545 1.00 0.26 H new ATOM 0 HE1 MET A 132 10.083 -6.381 -11.958 1.00 0.32 H new ATOM 0 HE2 MET A 132 8.384 -6.540 -11.456 1.00 0.32 H new ATOM 0 HE3 MET A 132 9.270 -5.031 -11.133 1.00 0.32 H new ATOM 2017 N GLU A 133 7.012 -8.313 -7.278 1.00 0.27 N ATOM 2018 CA GLU A 133 7.236 -9.738 -7.137 1.00 0.35 C ATOM 2019 C GLU A 133 5.906 -10.460 -7.267 1.00 0.34 C ATOM 2020 O GLU A 133 5.853 -11.626 -7.664 1.00 0.40 O ATOM 2021 CB GLU A 133 7.902 -10.078 -5.800 1.00 0.44 C ATOM 2022 CG GLU A 133 8.177 -11.563 -5.632 1.00 0.67 C ATOM 2023 CD GLU A 133 8.844 -11.897 -4.321 1.00 1.30 C ATOM 2024 OE1 GLU A 133 8.142 -11.959 -3.290 1.00 2.18 O ATOM 2025 OE2 GLU A 133 10.077 -12.082 -4.305 1.00 1.55 O ATOM 0 H GLU A 133 6.941 -7.804 -6.397 1.00 0.27 H new ATOM 0 HA GLU A 133 7.916 -10.064 -7.924 1.00 0.35 H new ATOM 0 HB2 GLU A 133 8.840 -9.529 -5.718 1.00 0.44 H new ATOM 0 HB3 GLU A 133 7.262 -9.739 -4.985 1.00 0.44 H new ATOM 0 HG2 GLU A 133 7.237 -12.111 -5.705 1.00 0.67 H new ATOM 0 HG3 GLU A 133 8.809 -11.904 -6.452 1.00 0.67 H new ATOM 2032 N TYR A 134 4.814 -9.764 -6.937 1.00 0.30 N ATOM 2033 CA TYR A 134 3.496 -10.282 -7.259 1.00 0.34 C ATOM 2034 C TYR A 134 3.164 -9.887 -8.697 1.00 0.36 C ATOM 2035 O TYR A 134 2.089 -10.180 -9.218 1.00 0.44 O ATOM 2036 CB TYR A 134 2.452 -9.771 -6.278 1.00 0.32 C ATOM 2037 CG TYR A 134 2.924 -9.778 -4.840 1.00 0.37 C ATOM 2038 CD1 TYR A 134 3.277 -10.962 -4.202 1.00 0.51 C ATOM 2039 CD2 TYR A 134 3.063 -8.592 -4.133 1.00 0.37 C ATOM 2040 CE1 TYR A 134 3.747 -10.961 -2.904 1.00 0.61 C ATOM 2041 CE2 TYR A 134 3.540 -8.583 -2.839 1.00 0.49 C ATOM 2042 CZ TYR A 134 3.880 -9.769 -2.227 1.00 0.57 C ATOM 2043 OH TYR A 134 4.366 -9.762 -0.939 1.00 0.74 O ATOM 0 H TYR A 134 4.821 -8.863 -6.459 1.00 0.30 H new ATOM 0 HA TYR A 134 3.492 -11.369 -7.174 1.00 0.34 H new ATOM 0 HB2 TYR A 134 2.170 -8.755 -6.555 1.00 0.32 H new ATOM 0 HB3 TYR A 134 1.555 -10.385 -6.361 1.00 0.32 H new ATOM 0 HD1 TYR A 134 3.182 -11.899 -4.731 1.00 0.51 H new ATOM 0 HD2 TYR A 134 2.793 -7.659 -4.605 1.00 0.37 H new ATOM 0 HE1 TYR A 134 4.009 -11.891 -2.421 1.00 0.61 H new ATOM 0 HE2 TYR A 134 3.647 -7.649 -2.307 1.00 0.49 H new ATOM 0 HH TYR A 134 5.087 -9.102 -0.865 1.00 0.74 H new ATOM 2053 N ASN A 135 4.124 -9.175 -9.300 1.00 0.35 N ATOM 2054 CA ASN A 135 4.148 -8.857 -10.724 1.00 0.38 C ATOM 2055 C ASN A 135 3.101 -7.829 -11.050 1.00 0.42 C ATOM 2056 O ASN A 135 2.377 -7.922 -12.043 1.00 0.59 O ATOM 2057 CB ASN A 135 4.003 -10.107 -11.597 1.00 0.47 C ATOM 2058 CG ASN A 135 5.273 -10.930 -11.627 1.00 1.19 C ATOM 2059 OD1 ASN A 135 6.144 -10.719 -12.473 1.00 1.94 O ATOM 2060 ND2 ASN A 135 5.390 -11.879 -10.713 1.00 1.89 N ATOM 0 H ASN A 135 4.924 -8.796 -8.793 1.00 0.35 H new ATOM 0 HA ASN A 135 5.126 -8.433 -10.953 1.00 0.38 H new ATOM 0 HB2 ASN A 135 3.184 -10.719 -11.220 1.00 0.47 H new ATOM 0 HB3 ASN A 135 3.739 -9.811 -12.612 1.00 0.47 H new ATOM 0 HD21 ASN A 135 6.223 -12.467 -10.692 1.00 1.89 H new ATOM 0 HD22 ASN A 135 4.647 -12.023 -10.029 1.00 1.89 H new ATOM 2067 N LEU A 136 3.028 -6.856 -10.175 1.00 0.38 N ATOM 2068 CA LEU A 136 2.282 -5.661 -10.409 1.00 0.46 C ATOM 2069 C LEU A 136 3.263 -4.512 -10.292 1.00 0.39 C ATOM 2070 O LEU A 136 3.461 -3.924 -9.228 1.00 0.43 O ATOM 2071 CB LEU A 136 1.109 -5.544 -9.434 1.00 0.62 C ATOM 2072 CG LEU A 136 1.455 -5.635 -7.952 1.00 0.89 C ATOM 2073 CD1 LEU A 136 0.703 -4.582 -7.162 1.00 1.68 C ATOM 2074 CD2 LEU A 136 1.112 -7.018 -7.437 1.00 1.44 C ATOM 0 H LEU A 136 3.495 -6.880 -9.269 1.00 0.38 H new ATOM 0 HA LEU A 136 1.827 -5.659 -11.400 1.00 0.46 H new ATOM 0 HB2 LEU A 136 0.609 -4.592 -9.611 1.00 0.62 H new ATOM 0 HB3 LEU A 136 0.390 -6.329 -9.667 1.00 0.62 H new ATOM 0 HG LEU A 136 2.523 -5.457 -7.827 1.00 0.89 H new ATOM 0 HD11 LEU A 136 0.964 -4.664 -6.107 1.00 1.68 H new ATOM 0 HD12 LEU A 136 0.973 -3.591 -7.527 1.00 1.68 H new ATOM 0 HD13 LEU A 136 -0.370 -4.733 -7.283 1.00 1.68 H new ATOM 0 HD21 LEU A 136 1.359 -7.083 -6.377 1.00 1.44 H new ATOM 0 HD22 LEU A 136 0.046 -7.203 -7.573 1.00 1.44 H new ATOM 0 HD23 LEU A 136 1.683 -7.764 -7.990 1.00 1.44 H new ATOM 2086 N VAL A 137 3.958 -4.286 -11.390 1.00 0.33 N ATOM 2087 CA VAL A 137 5.056 -3.342 -11.426 1.00 0.27 C ATOM 2088 C VAL A 137 4.567 -1.940 -11.144 1.00 0.26 C ATOM 2089 O VAL A 137 3.566 -1.493 -11.696 1.00 0.27 O ATOM 2090 CB VAL A 137 5.789 -3.338 -12.783 1.00 0.27 C ATOM 2091 CG1 VAL A 137 7.285 -3.518 -12.579 1.00 0.61 C ATOM 2092 CG2 VAL A 137 5.225 -4.397 -13.718 1.00 0.49 C ATOM 0 H VAL A 137 3.777 -4.751 -12.280 1.00 0.33 H new ATOM 0 HA VAL A 137 5.756 -3.663 -10.655 1.00 0.27 H new ATOM 0 HB VAL A 137 5.626 -2.370 -13.256 1.00 0.27 H new ATOM 0 HG11 VAL A 137 7.787 -3.513 -13.546 1.00 0.61 H new ATOM 0 HG12 VAL A 137 7.669 -2.703 -11.966 1.00 0.61 H new ATOM 0 HG13 VAL A 137 7.472 -4.468 -12.078 1.00 0.61 H new ATOM 0 HG21 VAL A 137 5.762 -4.369 -14.666 1.00 0.49 H new ATOM 0 HG22 VAL A 137 5.340 -5.381 -13.264 1.00 0.49 H new ATOM 0 HG23 VAL A 137 4.167 -4.201 -13.895 1.00 0.49 H new ATOM 2102 N PRO A 138 5.252 -1.247 -10.240 1.00 0.25 N ATOM 2103 CA PRO A 138 5.001 0.160 -9.967 1.00 0.27 C ATOM 2104 C PRO A 138 4.878 0.992 -11.227 1.00 0.30 C ATOM 2105 O PRO A 138 5.491 0.707 -12.256 1.00 0.29 O ATOM 2106 CB PRO A 138 6.239 0.585 -9.214 1.00 0.30 C ATOM 2107 CG PRO A 138 6.663 -0.628 -8.487 1.00 0.29 C ATOM 2108 CD PRO A 138 6.301 -1.798 -9.367 1.00 0.27 C ATOM 0 HA PRO A 138 4.063 0.300 -9.431 1.00 0.27 H new ATOM 0 HB2 PRO A 138 7.017 0.933 -9.893 1.00 0.30 H new ATOM 0 HB3 PRO A 138 6.025 1.405 -8.528 1.00 0.30 H new ATOM 0 HG2 PRO A 138 7.735 -0.608 -8.289 1.00 0.29 H new ATOM 0 HG3 PRO A 138 6.162 -0.698 -7.522 1.00 0.29 H new ATOM 0 HD2 PRO A 138 7.158 -2.152 -9.940 1.00 0.27 H new ATOM 0 HD3 PRO A 138 5.937 -2.644 -8.784 1.00 0.27 H new ATOM 2116 N GLU A 139 4.118 2.048 -11.101 1.00 0.35 N ATOM 2117 CA GLU A 139 3.853 2.951 -12.205 1.00 0.40 C ATOM 2118 C GLU A 139 5.075 3.827 -12.409 1.00 0.42 C ATOM 2119 O GLU A 139 5.328 4.341 -13.495 1.00 0.50 O ATOM 2120 CB GLU A 139 2.617 3.796 -11.907 1.00 0.47 C ATOM 2121 CG GLU A 139 1.603 3.807 -13.035 1.00 0.80 C ATOM 2122 CD GLU A 139 2.143 4.421 -14.309 1.00 1.49 C ATOM 2123 OE1 GLU A 139 2.752 3.688 -15.118 1.00 2.01 O ATOM 2124 OE2 GLU A 139 1.960 5.637 -14.514 1.00 1.98 O ATOM 0 H GLU A 139 3.661 2.313 -10.229 1.00 0.35 H new ATOM 0 HA GLU A 139 3.655 2.387 -13.117 1.00 0.40 H new ATOM 0 HB2 GLU A 139 2.139 3.419 -11.003 1.00 0.47 H new ATOM 0 HB3 GLU A 139 2.928 4.820 -11.699 1.00 0.47 H new ATOM 0 HG2 GLU A 139 1.282 2.785 -13.238 1.00 0.80 H new ATOM 0 HG3 GLU A 139 0.720 4.361 -12.717 1.00 0.80 H new ATOM 2131 N GLU A 140 5.816 3.988 -11.324 1.00 0.42 N ATOM 2132 CA GLU A 140 7.156 4.561 -11.360 1.00 0.44 C ATOM 2133 C GLU A 140 7.997 3.818 -12.388 1.00 0.43 C ATOM 2134 O GLU A 140 8.739 4.417 -13.166 1.00 0.51 O ATOM 2135 CB GLU A 140 7.854 4.409 -9.998 1.00 0.45 C ATOM 2136 CG GLU A 140 6.997 3.799 -8.908 1.00 0.75 C ATOM 2137 CD GLU A 140 5.872 4.695 -8.440 1.00 0.87 C ATOM 2138 OE1 GLU A 140 6.161 5.687 -7.738 1.00 1.14 O ATOM 2139 OE2 GLU A 140 4.707 4.419 -8.788 1.00 1.01 O ATOM 0 H GLU A 140 5.505 3.724 -10.389 1.00 0.42 H new ATOM 0 HA GLU A 140 7.062 5.617 -11.613 1.00 0.44 H new ATOM 0 HB2 GLU A 140 8.744 3.793 -10.129 1.00 0.45 H new ATOM 0 HB3 GLU A 140 8.192 5.391 -9.668 1.00 0.45 H new ATOM 0 HG2 GLU A 140 6.575 2.862 -9.273 1.00 0.75 H new ATOM 0 HG3 GLU A 140 7.631 3.553 -8.056 1.00 0.75 H new ATOM 2146 N TRP A 141 7.860 2.492 -12.372 1.00 0.35 N ATOM 2147 CA TRP A 141 8.730 1.622 -13.147 1.00 0.35 C ATOM 2148 C TRP A 141 8.109 1.281 -14.496 1.00 0.38 C ATOM 2149 O TRP A 141 8.822 0.998 -15.455 1.00 0.45 O ATOM 2150 CB TRP A 141 9.080 0.367 -12.356 1.00 0.32 C ATOM 2151 CG TRP A 141 9.484 0.647 -10.927 1.00 0.29 C ATOM 2152 CD1 TRP A 141 9.732 1.867 -10.358 1.00 0.34 C ATOM 2153 CD2 TRP A 141 9.679 -0.314 -9.889 1.00 0.25 C ATOM 2154 NE1 TRP A 141 10.009 1.732 -9.030 1.00 0.31 N ATOM 2155 CE2 TRP A 141 10.004 0.394 -8.711 1.00 0.26 C ATOM 2156 CE3 TRP A 141 9.598 -1.700 -9.843 1.00 0.23 C ATOM 2157 CZ2 TRP A 141 10.236 -0.255 -7.496 1.00 0.24 C ATOM 2158 CZ3 TRP A 141 9.828 -2.347 -8.638 1.00 0.23 C ATOM 2159 CH2 TRP A 141 10.144 -1.626 -7.476 1.00 0.23 C ATOM 0 H TRP A 141 7.151 2.000 -11.828 1.00 0.35 H new ATOM 0 HA TRP A 141 9.658 2.158 -13.346 1.00 0.35 H new ATOM 0 HB2 TRP A 141 8.222 -0.305 -12.357 1.00 0.32 H new ATOM 0 HB3 TRP A 141 9.894 -0.155 -12.859 1.00 0.32 H new ATOM 0 HD1 TRP A 141 9.711 2.808 -10.888 1.00 0.34 H new ATOM 0 HE1 TRP A 141 10.190 2.497 -8.380 1.00 0.31 H new ATOM 0 HE3 TRP A 141 9.360 -2.265 -10.732 1.00 0.23 H new ATOM 0 HZ2 TRP A 141 10.479 0.302 -6.603 1.00 0.24 H new ATOM 0 HZ3 TRP A 141 9.763 -3.424 -8.593 1.00 0.23 H new ATOM 0 HH2 TRP A 141 10.318 -2.157 -6.552 1.00 0.23 H new ATOM 2170 N GLY A 142 6.782 1.320 -14.580 1.00 0.35 N ATOM 2171 CA GLY A 142 6.134 1.177 -15.869 1.00 0.39 C ATOM 2172 C GLY A 142 5.235 -0.035 -15.935 1.00 0.38 C ATOM 2173 O GLY A 142 4.997 -0.586 -17.012 1.00 0.45 O ATOM 0 H GLY A 142 6.152 1.447 -13.788 1.00 0.35 H new ATOM 0 HA2 GLY A 142 5.548 2.072 -16.078 1.00 0.39 H new ATOM 0 HA3 GLY A 142 6.893 1.104 -16.647 1.00 0.39 H new ATOM 2177 N GLY A 143 4.756 -0.461 -14.781 1.00 0.33 N ATOM 2178 CA GLY A 143 3.833 -1.575 -14.735 1.00 0.34 C ATOM 2179 C GLY A 143 2.388 -1.131 -14.717 1.00 0.37 C ATOM 2180 O GLY A 143 1.885 -0.591 -15.701 1.00 0.50 O ATOM 0 H GLY A 143 4.988 -0.057 -13.874 1.00 0.33 H new ATOM 0 HA2 GLY A 143 4.001 -2.218 -15.599 1.00 0.34 H new ATOM 0 HA3 GLY A 143 4.036 -2.174 -13.848 1.00 0.34 H new ATOM 2184 N ASP A 144 1.722 -1.353 -13.596 1.00 0.33 N ATOM 2185 CA ASP A 144 0.314 -1.012 -13.472 1.00 0.40 C ATOM 2186 C ASP A 144 -0.059 -0.674 -12.026 1.00 0.30 C ATOM 2187 O ASP A 144 -1.232 -0.737 -11.647 1.00 0.32 O ATOM 2188 CB ASP A 144 -0.567 -2.167 -13.971 1.00 0.57 C ATOM 2189 CG ASP A 144 -0.510 -3.389 -13.066 1.00 0.93 C ATOM 2190 OD1 ASP A 144 0.551 -4.047 -13.020 1.00 1.19 O ATOM 2191 OD2 ASP A 144 -1.524 -3.694 -12.401 1.00 1.30 O ATOM 0 H ASP A 144 2.133 -1.767 -12.759 1.00 0.33 H new ATOM 0 HA ASP A 144 0.140 -0.130 -14.088 1.00 0.40 H new ATOM 0 HB2 ASP A 144 -1.599 -1.824 -14.045 1.00 0.57 H new ATOM 0 HB3 ASP A 144 -0.252 -2.450 -14.975 1.00 0.57 H new ATOM 2196 N THR A 145 0.923 -0.295 -11.216 1.00 0.25 N ATOM 2197 CA THR A 145 0.664 -0.118 -9.791 1.00 0.24 C ATOM 2198 C THR A 145 1.076 1.262 -9.283 1.00 0.24 C ATOM 2199 O THR A 145 2.246 1.630 -9.327 1.00 0.31 O ATOM 2200 CB THR A 145 1.379 -1.209 -8.985 1.00 0.25 C ATOM 2201 OG1 THR A 145 1.001 -2.486 -9.498 1.00 0.32 O ATOM 2202 CG2 THR A 145 1.026 -1.126 -7.508 1.00 0.28 C ATOM 0 H THR A 145 1.882 -0.108 -11.510 1.00 0.25 H new ATOM 0 HA THR A 145 -0.414 -0.202 -9.651 1.00 0.24 H new ATOM 0 HB THR A 145 2.455 -1.065 -9.081 1.00 0.25 H new ATOM 0 HG1 THR A 145 0.025 -2.536 -9.564 1.00 0.32 H new ATOM 0 HG21 THR A 145 1.549 -1.913 -6.964 1.00 0.28 H new ATOM 0 HG22 THR A 145 1.325 -0.154 -7.116 1.00 0.28 H new ATOM 0 HG23 THR A 145 -0.049 -1.252 -7.383 1.00 0.28 H new ATOM 2210 N ILE A 146 0.103 2.014 -8.779 1.00 0.26 N ATOM 2211 CA ILE A 146 0.353 3.373 -8.315 1.00 0.27 C ATOM 2212 C ILE A 146 0.845 3.364 -6.868 1.00 0.24 C ATOM 2213 O ILE A 146 0.081 3.078 -5.949 1.00 0.26 O ATOM 2214 CB ILE A 146 -0.913 4.257 -8.414 1.00 0.35 C ATOM 2215 CG1 ILE A 146 -1.394 4.395 -9.867 1.00 0.48 C ATOM 2216 CG2 ILE A 146 -0.642 5.630 -7.823 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.153 3.191 -10.390 1.00 1.23 C ATOM 0 H ILE A 146 -0.864 1.706 -8.682 1.00 0.26 H new ATOM 0 HA ILE A 146 1.121 3.795 -8.964 1.00 0.27 H new ATOM 0 HB ILE A 146 -1.704 3.769 -7.844 1.00 0.35 H new ATOM 0 HG12 ILE A 146 -2.033 5.274 -9.944 1.00 0.48 H new ATOM 0 HG13 ILE A 146 -0.530 4.572 -10.508 1.00 0.48 H new ATOM 0 HG21 ILE A 146 -1.540 6.242 -7.899 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -0.361 5.526 -6.775 1.00 0.34 H new ATOM 0 HG23 ILE A 146 0.170 6.108 -8.371 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.456 3.372 -11.421 1.00 1.23 H new ATOM 0 HD12 ILE A 146 -1.512 2.311 -10.349 1.00 1.23 H new ATOM 0 HD13 ILE A 146 -3.038 3.024 -9.776 1.00 1.23 H new ATOM 2229 N PHE A 147 2.119 3.672 -6.673 1.00 0.23 N ATOM 2230 CA PHE A 147 2.705 3.692 -5.338 1.00 0.22 C ATOM 2231 C PHE A 147 2.553 5.057 -4.683 1.00 0.24 C ATOM 2232 O PHE A 147 3.044 6.066 -5.190 1.00 0.38 O ATOM 2233 CB PHE A 147 4.183 3.313 -5.394 1.00 0.23 C ATOM 2234 CG PHE A 147 4.390 1.837 -5.315 1.00 0.21 C ATOM 2235 CD1 PHE A 147 4.217 1.040 -6.431 1.00 0.20 C ATOM 2236 CD2 PHE A 147 4.727 1.242 -4.113 1.00 0.21 C ATOM 2237 CE1 PHE A 147 4.382 -0.327 -6.350 1.00 0.20 C ATOM 2238 CE2 PHE A 147 4.888 -0.125 -4.026 1.00 0.22 C ATOM 2239 CZ PHE A 147 4.717 -0.908 -5.146 1.00 0.19 C ATOM 0 H PHE A 147 2.768 3.912 -7.422 1.00 0.23 H new ATOM 0 HA PHE A 147 2.167 2.959 -4.736 1.00 0.22 H new ATOM 0 HB2 PHE A 147 4.618 3.690 -6.319 1.00 0.23 H new ATOM 0 HB3 PHE A 147 4.712 3.797 -4.573 1.00 0.23 H new ATOM 0 HD1 PHE A 147 3.950 1.492 -7.375 1.00 0.20 H new ATOM 0 HD2 PHE A 147 4.865 1.854 -3.234 1.00 0.21 H new ATOM 0 HE1 PHE A 147 4.249 -0.941 -7.228 1.00 0.20 H new ATOM 0 HE2 PHE A 147 5.148 -0.580 -3.082 1.00 0.22 H new ATOM 0 HZ PHE A 147 4.846 -1.978 -5.081 1.00 0.19 H new ATOM 2249 N CYS A 148 1.863 5.078 -3.559 1.00 0.25 N ATOM 2250 CA CYS A 148 1.734 6.283 -2.767 1.00 0.28 C ATOM 2251 C CYS A 148 2.420 6.086 -1.426 1.00 0.26 C ATOM 2252 O CYS A 148 2.088 5.159 -0.690 1.00 0.32 O ATOM 2253 CB CYS A 148 0.262 6.611 -2.542 1.00 0.30 C ATOM 2254 SG CYS A 148 -0.706 6.719 -4.067 1.00 1.10 S ATOM 0 H CYS A 148 1.380 4.267 -3.173 1.00 0.25 H new ATOM 0 HA CYS A 148 2.204 7.109 -3.301 1.00 0.28 H new ATOM 0 HB2 CYS A 148 -0.176 5.848 -1.898 1.00 0.30 H new ATOM 0 HB3 CYS A 148 0.188 7.559 -2.009 1.00 0.30 H new ATOM 0 HG CYS A 148 -1.659 5.835 -4.039 1.00 1.10 H new ATOM 2260 N LYS A 149 3.388 6.929 -1.118 1.00 0.37 N ATOM 2261 CA LYS A 149 4.019 6.896 0.189 1.00 0.38 C ATOM 2262 C LYS A 149 3.379 7.950 1.084 1.00 0.39 C ATOM 2263 O LYS A 149 3.616 9.147 0.930 1.00 0.47 O ATOM 2264 CB LYS A 149 5.537 7.097 0.074 1.00 0.47 C ATOM 2265 CG LYS A 149 5.964 8.373 -0.642 1.00 0.64 C ATOM 2266 CD LYS A 149 7.470 8.584 -0.552 1.00 0.94 C ATOM 2267 CE LYS A 149 7.890 9.918 -1.157 1.00 1.57 C ATOM 2268 NZ LYS A 149 9.340 10.181 -0.966 1.00 2.44 N ATOM 0 H LYS A 149 3.753 7.641 -1.750 1.00 0.37 H new ATOM 0 HA LYS A 149 3.864 5.915 0.639 1.00 0.38 H new ATOM 0 HB2 LYS A 149 5.965 7.100 1.076 1.00 0.47 H new ATOM 0 HB3 LYS A 149 5.963 6.243 -0.452 1.00 0.47 H new ATOM 0 HG2 LYS A 149 5.664 8.322 -1.689 1.00 0.64 H new ATOM 0 HG3 LYS A 149 5.449 9.228 -0.204 1.00 0.64 H new ATOM 0 HD2 LYS A 149 7.781 8.544 0.492 1.00 0.94 H new ATOM 0 HD3 LYS A 149 7.983 7.773 -1.069 1.00 0.94 H new ATOM 0 HE2 LYS A 149 7.657 9.923 -2.222 1.00 1.57 H new ATOM 0 HE3 LYS A 149 7.312 10.722 -0.701 1.00 1.57 H new ATOM 0 HZ1 LYS A 149 9.586 11.098 -1.391 1.00 2.44 H new ATOM 0 HZ2 LYS A 149 9.558 10.202 0.051 1.00 2.44 H new ATOM 0 HZ3 LYS A 149 9.893 9.428 -1.423 1.00 2.44 H new ATOM 2282 N LEU A 150 2.538 7.505 2.002 1.00 0.40 N ATOM 2283 CA LEU A 150 1.726 8.427 2.781 1.00 0.45 C ATOM 2284 C LEU A 150 1.886 8.241 4.278 1.00 0.45 C ATOM 2285 O LEU A 150 2.744 7.504 4.762 1.00 0.49 O ATOM 2286 CB LEU A 150 0.247 8.252 2.451 1.00 0.60 C ATOM 2287 CG LEU A 150 -0.318 6.871 2.749 1.00 0.49 C ATOM 2288 CD1 LEU A 150 -1.765 6.974 3.204 1.00 1.25 C ATOM 2289 CD2 LEU A 150 -0.200 5.999 1.519 1.00 1.27 C ATOM 0 H LEU A 150 2.399 6.520 2.226 1.00 0.40 H new ATOM 0 HA LEU A 150 2.076 9.424 2.512 1.00 0.45 H new ATOM 0 HB2 LEU A 150 -0.325 8.991 3.012 1.00 0.60 H new ATOM 0 HB3 LEU A 150 0.098 8.469 1.393 1.00 0.60 H new ATOM 0 HG LEU A 150 0.254 6.417 3.558 1.00 0.49 H new ATOM 0 HD11 LEU A 150 -2.153 5.977 3.413 1.00 1.25 H new ATOM 0 HD12 LEU A 150 -1.820 7.581 4.108 1.00 1.25 H new ATOM 0 HD13 LEU A 150 -2.361 7.438 2.418 1.00 1.25 H new ATOM 0 HD21 LEU A 150 -0.605 5.010 1.734 1.00 1.27 H new ATOM 0 HD22 LEU A 150 -0.759 6.450 0.699 1.00 1.27 H new ATOM 0 HD23 LEU A 150 0.849 5.908 1.237 1.00 1.27 H new ATOM 2301 N SER A 151 1.017 8.937 4.989 1.00 0.49 N ATOM 2302 CA SER A 151 0.900 8.850 6.421 1.00 0.55 C ATOM 2303 C SER A 151 -0.354 9.592 6.841 1.00 0.57 C ATOM 2304 O SER A 151 -0.553 10.741 6.452 1.00 0.60 O ATOM 2305 CB SER A 151 2.105 9.459 7.104 1.00 0.66 C ATOM 2306 OG SER A 151 2.042 9.274 8.509 1.00 1.79 O ATOM 0 H SER A 151 0.359 9.594 4.569 1.00 0.49 H new ATOM 0 HA SER A 151 0.844 7.802 6.714 1.00 0.55 H new ATOM 0 HB2 SER A 151 3.016 9.005 6.715 1.00 0.66 H new ATOM 0 HB3 SER A 151 2.157 10.524 6.876 1.00 0.66 H new ATOM 0 HG SER A 151 2.819 8.757 8.806 1.00 1.79 H new ATOM 2312 N ALA A 152 -1.213 8.929 7.594 1.00 0.62 N ATOM 2313 CA ALA A 152 -2.416 9.567 8.127 1.00 0.70 C ATOM 2314 C ALA A 152 -2.060 10.639 9.154 1.00 0.74 C ATOM 2315 O ALA A 152 -2.904 11.445 9.551 1.00 0.87 O ATOM 2316 CB ALA A 152 -3.318 8.525 8.756 1.00 0.86 C ATOM 0 H ALA A 152 -1.105 7.949 7.854 1.00 0.62 H new ATOM 0 HA ALA A 152 -2.941 10.048 7.302 1.00 0.70 H new ATOM 0 HB1 ALA A 152 -4.212 9.008 9.151 1.00 0.86 H new ATOM 0 HB2 ALA A 152 -3.605 7.790 8.004 1.00 0.86 H new ATOM 0 HB3 ALA A 152 -2.787 8.026 9.567 1.00 0.86 H new ATOM 2322 N LYS A 153 -0.802 10.640 9.576 1.00 0.77 N ATOM 2323 CA LYS A 153 -0.315 11.566 10.576 1.00 0.93 C ATOM 2324 C LYS A 153 0.088 12.874 9.925 1.00 0.86 C ATOM 2325 O LYS A 153 -0.420 13.944 10.265 1.00 0.96 O ATOM 2326 CB LYS A 153 0.884 10.963 11.269 1.00 1.13 C ATOM 2327 CG LYS A 153 0.704 9.504 11.640 1.00 1.19 C ATOM 2328 CD LYS A 153 2.038 8.846 11.968 1.00 1.68 C ATOM 2329 CE LYS A 153 2.783 9.594 13.063 1.00 2.31 C ATOM 2330 NZ LYS A 153 4.178 9.104 13.212 1.00 3.03 N ATOM 0 H LYS A 153 -0.093 9.994 9.230 1.00 0.77 H new ATOM 0 HA LYS A 153 -1.107 11.759 11.300 1.00 0.93 H new ATOM 0 HB2 LYS A 153 1.754 11.059 10.619 1.00 1.13 H new ATOM 0 HB3 LYS A 153 1.096 11.535 12.172 1.00 1.13 H new ATOM 0 HG2 LYS A 153 0.037 9.425 12.498 1.00 1.19 H new ATOM 0 HG3 LYS A 153 0.228 8.973 10.816 1.00 1.19 H new ATOM 0 HD2 LYS A 153 1.868 7.816 12.282 1.00 1.68 H new ATOM 0 HD3 LYS A 153 2.655 8.807 11.070 1.00 1.68 H new ATOM 0 HE2 LYS A 153 2.794 10.659 12.833 1.00 2.31 H new ATOM 0 HE3 LYS A 153 2.253 9.477 14.009 1.00 2.31 H new ATOM 0 HZ1 LYS A 153 4.638 9.602 14.001 1.00 3.03 H new ATOM 0 HZ2 LYS A 153 4.168 8.082 13.406 1.00 3.03 H new ATOM 0 HZ3 LYS A 153 4.705 9.285 12.334 1.00 3.03 H new ATOM 2344 N THR A 154 1.002 12.770 8.973 1.00 0.78 N ATOM 2345 CA THR A 154 1.508 13.938 8.281 1.00 0.81 C ATOM 2346 C THR A 154 0.551 14.360 7.179 1.00 0.73 C ATOM 2347 O THR A 154 0.630 15.480 6.678 1.00 0.82 O ATOM 2348 CB THR A 154 2.906 13.688 7.690 1.00 0.89 C ATOM 2349 OG1 THR A 154 2.909 12.480 6.918 1.00 1.19 O ATOM 2350 CG2 THR A 154 3.951 13.596 8.788 1.00 1.20 C ATOM 0 H THR A 154 1.407 11.886 8.664 1.00 0.78 H new ATOM 0 HA THR A 154 1.590 14.740 9.015 1.00 0.81 H new ATOM 0 HB THR A 154 3.154 14.530 7.044 1.00 0.89 H new ATOM 0 HG1 THR A 154 3.803 12.332 6.545 1.00 1.19 H new ATOM 0 HG21 THR A 154 4.931 13.419 8.344 1.00 1.20 H new ATOM 0 HG22 THR A 154 3.971 14.529 9.351 1.00 1.20 H new ATOM 0 HG23 THR A 154 3.703 12.773 9.459 1.00 1.20 H new ATOM 2358 N LYS A 155 -0.335 13.435 6.800 1.00 0.65 N ATOM 2359 CA LYS A 155 -1.410 13.702 5.838 1.00 0.67 C ATOM 2360 C LYS A 155 -0.890 13.803 4.395 1.00 0.66 C ATOM 2361 O LYS A 155 -1.675 13.765 3.448 1.00 0.86 O ATOM 2362 CB LYS A 155 -2.159 14.985 6.224 1.00 0.86 C ATOM 2363 CG LYS A 155 -3.429 15.206 5.433 1.00 1.27 C ATOM 2364 CD LYS A 155 -4.523 14.246 5.851 1.00 1.12 C ATOM 2365 CE LYS A 155 -5.621 14.201 4.812 1.00 1.39 C ATOM 2366 NZ LYS A 155 -5.720 15.479 4.065 1.00 2.27 N ATOM 0 H LYS A 155 -0.328 12.478 7.152 1.00 0.65 H new ATOM 0 HA LYS A 155 -2.096 12.856 5.875 1.00 0.67 H new ATOM 0 HB2 LYS A 155 -2.404 14.947 7.285 1.00 0.86 H new ATOM 0 HB3 LYS A 155 -1.498 15.839 6.080 1.00 0.86 H new ATOM 0 HG2 LYS A 155 -3.771 16.231 5.573 1.00 1.27 H new ATOM 0 HG3 LYS A 155 -3.222 15.082 4.370 1.00 1.27 H new ATOM 0 HD2 LYS A 155 -4.105 13.249 5.989 1.00 1.12 H new ATOM 0 HD3 LYS A 155 -4.937 14.554 6.811 1.00 1.12 H new ATOM 0 HE2 LYS A 155 -5.429 13.385 4.115 1.00 1.39 H new ATOM 0 HE3 LYS A 155 -6.573 13.988 5.298 1.00 1.39 H new ATOM 0 HZ1 LYS A 155 -6.583 15.476 3.484 1.00 2.27 H new ATOM 0 HZ2 LYS A 155 -5.758 16.272 4.737 1.00 2.27 H new ATOM 0 HZ3 LYS A 155 -4.889 15.586 3.449 1.00 2.27 H new ATOM 2380 N GLU A 156 0.430 13.887 4.250 1.00 0.62 N ATOM 2381 CA GLU A 156 1.091 14.102 2.957 1.00 0.66 C ATOM 2382 C GLU A 156 0.505 13.241 1.841 1.00 0.59 C ATOM 2383 O GLU A 156 -0.163 13.736 0.929 1.00 0.58 O ATOM 2384 CB GLU A 156 2.579 13.789 3.095 1.00 0.75 C ATOM 2385 CG GLU A 156 3.254 14.523 4.237 1.00 1.13 C ATOM 2386 CD GLU A 156 3.339 16.015 4.002 1.00 1.78 C ATOM 2387 OE1 GLU A 156 4.317 16.461 3.371 1.00 2.03 O ATOM 2388 OE2 GLU A 156 2.435 16.751 4.444 1.00 2.64 O ATOM 0 H GLU A 156 1.081 13.808 5.032 1.00 0.62 H new ATOM 0 HA GLU A 156 0.931 15.145 2.683 1.00 0.66 H new ATOM 0 HB2 GLU A 156 2.703 12.716 3.241 1.00 0.75 H new ATOM 0 HB3 GLU A 156 3.083 14.044 2.163 1.00 0.75 H new ATOM 0 HG2 GLU A 156 2.705 14.335 5.159 1.00 1.13 H new ATOM 0 HG3 GLU A 156 4.258 14.123 4.377 1.00 1.13 H new ATOM 2395 N GLY A 157 0.758 11.947 1.929 1.00 0.62 N ATOM 2396 CA GLY A 157 0.357 11.035 0.888 1.00 0.61 C ATOM 2397 C GLY A 157 -1.136 10.758 0.855 1.00 0.48 C ATOM 2398 O GLY A 157 -1.612 10.074 -0.042 1.00 0.46 O ATOM 0 H GLY A 157 1.240 11.510 2.714 1.00 0.62 H new ATOM 0 HA2 GLY A 157 0.663 11.442 -0.076 1.00 0.61 H new ATOM 0 HA3 GLY A 157 0.889 10.093 1.019 1.00 0.61 H new ATOM 2402 N LEU A 158 -1.872 11.276 1.830 1.00 0.48 N ATOM 2403 CA LEU A 158 -3.314 11.052 1.897 1.00 0.50 C ATOM 2404 C LEU A 158 -3.995 11.880 0.816 1.00 0.46 C ATOM 2405 O LEU A 158 -4.851 11.387 0.080 1.00 0.51 O ATOM 2406 CB LEU A 158 -3.837 11.419 3.294 1.00 0.62 C ATOM 2407 CG LEU A 158 -5.122 10.706 3.743 1.00 0.83 C ATOM 2408 CD1 LEU A 158 -6.334 11.207 2.972 1.00 1.55 C ATOM 2409 CD2 LEU A 158 -4.977 9.201 3.579 1.00 1.27 C ATOM 0 H LEU A 158 -1.498 11.852 2.584 1.00 0.48 H new ATOM 0 HA LEU A 158 -3.538 9.999 1.724 1.00 0.50 H new ATOM 0 HB2 LEU A 158 -3.054 11.205 4.021 1.00 0.62 H new ATOM 0 HB3 LEU A 158 -4.013 12.494 3.323 1.00 0.62 H new ATOM 0 HG LEU A 158 -5.279 10.934 4.797 1.00 0.83 H new ATOM 0 HD11 LEU A 158 -7.226 10.682 3.314 1.00 1.55 H new ATOM 0 HD12 LEU A 158 -6.456 12.277 3.141 1.00 1.55 H new ATOM 0 HD13 LEU A 158 -6.190 11.022 1.908 1.00 1.55 H new ATOM 0 HD21 LEU A 158 -5.895 8.710 3.901 1.00 1.27 H new ATOM 0 HD22 LEU A 158 -4.788 8.966 2.532 1.00 1.27 H new ATOM 0 HD23 LEU A 158 -4.144 8.847 4.187 1.00 1.27 H new ATOM 2421 N ASP A 159 -3.586 13.136 0.703 1.00 0.48 N ATOM 2422 CA ASP A 159 -4.085 14.007 -0.353 1.00 0.57 C ATOM 2423 C ASP A 159 -3.545 13.548 -1.702 1.00 0.50 C ATOM 2424 O ASP A 159 -4.245 13.590 -2.715 1.00 0.52 O ATOM 2425 CB ASP A 159 -3.679 15.463 -0.094 1.00 0.73 C ATOM 2426 CG ASP A 159 -4.339 16.048 1.140 1.00 1.54 C ATOM 2427 OD1 ASP A 159 -3.832 15.820 2.258 1.00 2.50 O ATOM 2428 OD2 ASP A 159 -5.368 16.740 1.003 1.00 1.58 O ATOM 0 H ASP A 159 -2.911 13.575 1.329 1.00 0.48 H new ATOM 0 HA ASP A 159 -5.173 13.950 -0.363 1.00 0.57 H new ATOM 0 HB2 ASP A 159 -2.596 15.519 0.018 1.00 0.73 H new ATOM 0 HB3 ASP A 159 -3.941 16.068 -0.962 1.00 0.73 H new ATOM 2433 N HIS A 160 -2.296 13.080 -1.700 1.00 0.47 N ATOM 2434 CA HIS A 160 -1.651 12.581 -2.913 1.00 0.46 C ATOM 2435 C HIS A 160 -2.267 11.251 -3.348 1.00 0.41 C ATOM 2436 O HIS A 160 -2.142 10.847 -4.500 1.00 0.43 O ATOM 2437 CB HIS A 160 -0.137 12.424 -2.688 1.00 0.50 C ATOM 2438 CG HIS A 160 0.628 11.931 -3.886 1.00 0.56 C ATOM 2439 ND1 HIS A 160 0.972 12.736 -4.948 1.00 0.67 N ATOM 2440 CD2 HIS A 160 1.126 10.702 -4.176 1.00 0.59 C ATOM 2441 CE1 HIS A 160 1.647 12.028 -5.837 1.00 0.73 C ATOM 2442 NE2 HIS A 160 1.756 10.790 -5.391 1.00 0.67 N ATOM 0 H HIS A 160 -1.709 13.037 -0.867 1.00 0.47 H new ATOM 0 HA HIS A 160 -1.812 13.307 -3.710 1.00 0.46 H new ATOM 0 HB2 HIS A 160 0.273 13.387 -2.383 1.00 0.50 H new ATOM 0 HB3 HIS A 160 0.024 11.732 -1.861 1.00 0.50 H new ATOM 0 HD2 HIS A 160 1.042 9.817 -3.562 1.00 0.59 H new ATOM 0 HE1 HIS A 160 2.043 12.399 -6.771 1.00 0.73 H new ATOM 0 HE2 HIS A 160 2.231 10.025 -5.871 1.00 0.67 H new ATOM 2451 N LEU A 161 -2.926 10.572 -2.427 1.00 0.39 N ATOM 2452 CA LEU A 161 -3.602 9.325 -2.746 1.00 0.39 C ATOM 2453 C LEU A 161 -4.829 9.599 -3.600 1.00 0.39 C ATOM 2454 O LEU A 161 -5.013 8.991 -4.652 1.00 0.42 O ATOM 2455 CB LEU A 161 -4.003 8.588 -1.465 1.00 0.41 C ATOM 2456 CG LEU A 161 -4.773 7.283 -1.676 1.00 0.51 C ATOM 2457 CD1 LEU A 161 -3.941 6.293 -2.473 1.00 0.91 C ATOM 2458 CD2 LEU A 161 -5.186 6.688 -0.337 1.00 0.88 C ATOM 0 H LEU A 161 -3.008 10.862 -1.452 1.00 0.39 H new ATOM 0 HA LEU A 161 -2.915 8.692 -3.308 1.00 0.39 H new ATOM 0 HB2 LEU A 161 -3.101 8.370 -0.893 1.00 0.41 H new ATOM 0 HB3 LEU A 161 -4.613 9.256 -0.857 1.00 0.41 H new ATOM 0 HG LEU A 161 -5.676 7.502 -2.246 1.00 0.51 H new ATOM 0 HD11 LEU A 161 -4.506 5.372 -2.612 1.00 0.91 H new ATOM 0 HD12 LEU A 161 -3.699 6.721 -3.446 1.00 0.91 H new ATOM 0 HD13 LEU A 161 -3.019 6.075 -1.934 1.00 0.91 H new ATOM 0 HD21 LEU A 161 -5.733 5.760 -0.504 1.00 0.88 H new ATOM 0 HD22 LEU A 161 -4.297 6.483 0.260 1.00 0.88 H new ATOM 0 HD23 LEU A 161 -5.824 7.394 0.194 1.00 0.88 H new ATOM 2470 N LEU A 162 -5.645 10.543 -3.149 1.00 0.40 N ATOM 2471 CA LEU A 162 -6.878 10.892 -3.833 1.00 0.44 C ATOM 2472 C LEU A 162 -6.612 11.334 -5.267 1.00 0.45 C ATOM 2473 O LEU A 162 -7.378 11.009 -6.173 1.00 0.48 O ATOM 2474 CB LEU A 162 -7.596 12.004 -3.067 1.00 0.50 C ATOM 2475 CG LEU A 162 -8.032 11.636 -1.646 1.00 0.69 C ATOM 2476 CD1 LEU A 162 -8.683 12.827 -0.962 1.00 1.05 C ATOM 2477 CD2 LEU A 162 -8.986 10.451 -1.676 1.00 1.06 C ATOM 0 H LEU A 162 -5.470 11.085 -2.303 1.00 0.40 H new ATOM 0 HA LEU A 162 -7.510 10.005 -3.868 1.00 0.44 H new ATOM 0 HB2 LEU A 162 -6.938 12.872 -3.015 1.00 0.50 H new ATOM 0 HB3 LEU A 162 -8.477 12.305 -3.634 1.00 0.50 H new ATOM 0 HG LEU A 162 -7.147 11.355 -1.075 1.00 0.69 H new ATOM 0 HD11 LEU A 162 -8.986 12.546 0.047 1.00 1.05 H new ATOM 0 HD12 LEU A 162 -7.971 13.651 -0.911 1.00 1.05 H new ATOM 0 HD13 LEU A 162 -9.559 13.139 -1.531 1.00 1.05 H new ATOM 0 HD21 LEU A 162 -9.287 10.201 -0.659 1.00 1.06 H new ATOM 0 HD22 LEU A 162 -9.868 10.709 -2.263 1.00 1.06 H new ATOM 0 HD23 LEU A 162 -8.487 9.594 -2.128 1.00 1.06 H new ATOM 2489 N GLU A 163 -5.516 12.054 -5.476 1.00 0.46 N ATOM 2490 CA GLU A 163 -5.189 12.547 -6.810 1.00 0.52 C ATOM 2491 C GLU A 163 -4.780 11.394 -7.726 1.00 0.51 C ATOM 2492 O GLU A 163 -5.117 11.384 -8.909 1.00 0.56 O ATOM 2493 CB GLU A 163 -4.088 13.612 -6.761 1.00 0.62 C ATOM 2494 CG GLU A 163 -2.731 13.087 -6.336 1.00 1.06 C ATOM 2495 CD GLU A 163 -1.652 14.144 -6.381 1.00 1.75 C ATOM 2496 OE1 GLU A 163 -1.451 14.839 -5.369 1.00 2.49 O ATOM 2497 OE2 GLU A 163 -1.002 14.288 -7.432 1.00 1.97 O ATOM 0 H GLU A 163 -4.846 12.307 -4.750 1.00 0.46 H new ATOM 0 HA GLU A 163 -6.085 13.014 -7.218 1.00 0.52 H new ATOM 0 HB2 GLU A 163 -3.996 14.068 -7.747 1.00 0.62 H new ATOM 0 HB3 GLU A 163 -4.392 14.400 -6.072 1.00 0.62 H new ATOM 0 HG2 GLU A 163 -2.801 12.690 -5.323 1.00 1.06 H new ATOM 0 HG3 GLU A 163 -2.448 12.258 -6.985 1.00 1.06 H new ATOM 2504 N MET A 164 -4.080 10.409 -7.166 1.00 0.49 N ATOM 2505 CA MET A 164 -3.676 9.233 -7.929 1.00 0.52 C ATOM 2506 C MET A 164 -4.899 8.398 -8.270 1.00 0.51 C ATOM 2507 O MET A 164 -5.011 7.847 -9.366 1.00 0.57 O ATOM 2508 CB MET A 164 -2.673 8.389 -7.138 1.00 0.53 C ATOM 2509 CG MET A 164 -1.338 9.072 -6.858 1.00 0.68 C ATOM 2510 SD MET A 164 -0.342 9.353 -8.340 1.00 0.87 S ATOM 2511 CE MET A 164 -1.092 10.838 -9.004 1.00 0.67 C ATOM 0 H MET A 164 -3.783 10.403 -6.190 1.00 0.49 H new ATOM 0 HA MET A 164 -3.195 9.565 -8.849 1.00 0.52 H new ATOM 0 HB2 MET A 164 -3.127 8.108 -6.188 1.00 0.53 H new ATOM 0 HB3 MET A 164 -2.484 7.466 -7.687 1.00 0.53 H new ATOM 0 HG2 MET A 164 -1.524 10.028 -6.369 1.00 0.68 H new ATOM 0 HG3 MET A 164 -0.767 8.462 -6.158 1.00 0.68 H new ATOM 0 HE1 MET A 164 -1.316 10.691 -10.061 1.00 0.67 H new ATOM 0 HE2 MET A 164 -2.014 11.052 -8.464 1.00 0.67 H new ATOM 0 HE3 MET A 164 -0.403 11.675 -8.892 1.00 0.67 H new ATOM 2521 N ILE A 165 -5.816 8.322 -7.315 1.00 0.48 N ATOM 2522 CA ILE A 165 -7.076 7.642 -7.497 1.00 0.51 C ATOM 2523 C ILE A 165 -7.863 8.270 -8.651 1.00 0.58 C ATOM 2524 O ILE A 165 -8.279 7.578 -9.581 1.00 0.64 O ATOM 2525 CB ILE A 165 -7.891 7.722 -6.190 1.00 0.50 C ATOM 2526 CG1 ILE A 165 -7.261 6.828 -5.119 1.00 0.48 C ATOM 2527 CG2 ILE A 165 -9.336 7.346 -6.418 1.00 0.59 C ATOM 2528 CD1 ILE A 165 -7.904 6.967 -3.755 1.00 0.50 C ATOM 0 H ILE A 165 -5.699 8.735 -6.390 1.00 0.48 H new ATOM 0 HA ILE A 165 -6.886 6.597 -7.743 1.00 0.51 H new ATOM 0 HB ILE A 165 -7.872 8.755 -5.841 1.00 0.50 H new ATOM 0 HG12 ILE A 165 -7.330 5.788 -5.439 1.00 0.48 H new ATOM 0 HG13 ILE A 165 -6.201 7.066 -5.037 1.00 0.48 H new ATOM 0 HG21 ILE A 165 -9.882 7.413 -5.477 1.00 0.59 H new ATOM 0 HG22 ILE A 165 -9.779 8.028 -7.144 1.00 0.59 H new ATOM 0 HG23 ILE A 165 -9.391 6.326 -6.798 1.00 0.59 H new ATOM 0 HD11 ILE A 165 -7.405 6.304 -3.048 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -7.812 7.998 -3.413 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -8.959 6.700 -3.821 1.00 0.50 H new ATOM 2540 N LEU A 166 -8.032 9.590 -8.592 1.00 0.61 N ATOM 2541 CA LEU A 166 -8.752 10.332 -9.620 1.00 0.72 C ATOM 2542 C LEU A 166 -8.077 10.202 -10.977 1.00 0.72 C ATOM 2543 O LEU A 166 -8.745 10.020 -11.996 1.00 0.81 O ATOM 2544 CB LEU A 166 -8.828 11.803 -9.236 1.00 0.82 C ATOM 2545 CG LEU A 166 -9.720 12.121 -8.037 1.00 0.98 C ATOM 2546 CD1 LEU A 166 -9.570 13.578 -7.633 1.00 1.81 C ATOM 2547 CD2 LEU A 166 -11.173 11.805 -8.363 1.00 1.48 C ATOM 0 H LEU A 166 -7.675 10.171 -7.833 1.00 0.61 H new ATOM 0 HA LEU A 166 -9.755 9.912 -9.694 1.00 0.72 H new ATOM 0 HB2 LEU A 166 -7.820 12.158 -9.022 1.00 0.82 H new ATOM 0 HB3 LEU A 166 -9.189 12.368 -10.096 1.00 0.82 H new ATOM 0 HG LEU A 166 -9.409 11.499 -7.198 1.00 0.98 H new ATOM 0 HD11 LEU A 166 -10.213 13.786 -6.778 1.00 1.81 H new ATOM 0 HD12 LEU A 166 -8.532 13.776 -7.364 1.00 1.81 H new ATOM 0 HD13 LEU A 166 -9.857 14.218 -8.467 1.00 1.81 H new ATOM 0 HD21 LEU A 166 -11.798 12.036 -7.500 1.00 1.48 H new ATOM 0 HD22 LEU A 166 -11.494 12.405 -9.215 1.00 1.48 H new ATOM 0 HD23 LEU A 166 -11.269 10.747 -8.608 1.00 1.48 H new ATOM 2559 N LEU A 167 -6.749 10.295 -10.975 1.00 0.69 N ATOM 2560 CA LEU A 167 -5.961 10.202 -12.199 1.00 0.79 C ATOM 2561 C LEU A 167 -6.338 8.938 -12.968 1.00 0.87 C ATOM 2562 O LEU A 167 -6.583 8.980 -14.171 1.00 1.02 O ATOM 2563 CB LEU A 167 -4.461 10.210 -11.847 1.00 0.84 C ATOM 2564 CG LEU A 167 -3.480 10.488 -13.002 1.00 1.06 C ATOM 2565 CD1 LEU A 167 -3.333 9.279 -13.917 1.00 1.42 C ATOM 2566 CD2 LEU A 167 -3.923 11.710 -13.797 1.00 1.41 C ATOM 0 H LEU A 167 -6.194 10.436 -10.131 1.00 0.69 H new ATOM 0 HA LEU A 167 -6.172 11.060 -12.837 1.00 0.79 H new ATOM 0 HB2 LEU A 167 -4.297 10.960 -11.074 1.00 0.84 H new ATOM 0 HB3 LEU A 167 -4.209 9.243 -11.412 1.00 0.84 H new ATOM 0 HG LEU A 167 -2.503 10.690 -12.564 1.00 1.06 H new ATOM 0 HD11 LEU A 167 -2.633 9.513 -14.719 1.00 1.42 H new ATOM 0 HD12 LEU A 167 -2.957 8.432 -13.343 1.00 1.42 H new ATOM 0 HD13 LEU A 167 -4.303 9.026 -14.344 1.00 1.42 H new ATOM 0 HD21 LEU A 167 -3.218 11.891 -14.609 1.00 1.41 H new ATOM 0 HD22 LEU A 167 -4.916 11.534 -14.211 1.00 1.41 H new ATOM 0 HD23 LEU A 167 -3.952 12.580 -13.141 1.00 1.41 H new ATOM 2578 N VAL A 168 -6.428 7.827 -12.254 1.00 0.83 N ATOM 2579 CA VAL A 168 -6.735 6.553 -12.869 1.00 0.96 C ATOM 2580 C VAL A 168 -8.237 6.395 -13.099 1.00 1.01 C ATOM 2581 O VAL A 168 -8.661 5.699 -14.018 1.00 1.14 O ATOM 2582 CB VAL A 168 -6.180 5.399 -12.015 1.00 1.03 C ATOM 2583 CG1 VAL A 168 -6.750 4.068 -12.449 1.00 1.17 C ATOM 2584 CG2 VAL A 168 -4.668 5.380 -12.119 1.00 1.14 C ATOM 0 H VAL A 168 -6.292 7.786 -11.244 1.00 0.83 H new ATOM 0 HA VAL A 168 -6.252 6.521 -13.845 1.00 0.96 H new ATOM 0 HB VAL A 168 -6.476 5.562 -10.979 1.00 1.03 H new ATOM 0 HG11 VAL A 168 -6.337 3.275 -11.826 1.00 1.17 H new ATOM 0 HG12 VAL A 168 -7.835 4.085 -12.344 1.00 1.17 H new ATOM 0 HG13 VAL A 168 -6.489 3.883 -13.491 1.00 1.17 H new ATOM 0 HG21 VAL A 168 -4.272 4.564 -11.515 1.00 1.14 H new ATOM 0 HG22 VAL A 168 -4.377 5.236 -13.159 1.00 1.14 H new ATOM 0 HG23 VAL A 168 -4.266 6.327 -11.757 1.00 1.14 H new ATOM 2594 N SER A 169 -9.042 7.074 -12.290 1.00 0.98 N ATOM 2595 CA SER A 169 -10.490 7.055 -12.471 1.00 1.14 C ATOM 2596 C SER A 169 -10.865 7.629 -13.838 1.00 1.22 C ATOM 2597 O SER A 169 -11.896 7.283 -14.407 1.00 1.41 O ATOM 2598 CB SER A 169 -11.180 7.844 -11.357 1.00 1.20 C ATOM 2599 OG SER A 169 -10.885 7.292 -10.083 1.00 1.54 O ATOM 0 H SER A 169 -8.720 7.642 -11.506 1.00 0.98 H new ATOM 0 HA SER A 169 -10.829 6.020 -12.423 1.00 1.14 H new ATOM 0 HB2 SER A 169 -10.857 8.884 -11.390 1.00 1.20 H new ATOM 0 HB3 SER A 169 -12.258 7.840 -11.518 1.00 1.20 H new ATOM 0 HG SER A 169 -9.982 7.559 -9.812 1.00 1.54 H new ATOM 2605 N GLU A 170 -10.019 8.514 -14.357 1.00 1.15 N ATOM 2606 CA GLU A 170 -10.220 9.079 -15.683 1.00 1.33 C ATOM 2607 C GLU A 170 -9.367 8.348 -16.728 1.00 1.37 C ATOM 2608 O GLU A 170 -9.794 8.146 -17.864 1.00 1.53 O ATOM 2609 CB GLU A 170 -9.883 10.570 -15.669 1.00 1.46 C ATOM 2610 CG GLU A 170 -10.174 11.280 -16.978 1.00 2.02 C ATOM 2611 CD GLU A 170 -9.998 12.778 -16.869 1.00 2.31 C ATOM 2612 OE1 GLU A 170 -10.949 13.468 -16.446 1.00 2.65 O ATOM 2613 OE2 GLU A 170 -8.909 13.277 -17.217 1.00 2.79 O ATOM 0 H GLU A 170 -9.186 8.855 -13.876 1.00 1.15 H new ATOM 0 HA GLU A 170 -11.267 8.952 -15.957 1.00 1.33 H new ATOM 0 HB2 GLU A 170 -10.449 11.053 -14.872 1.00 1.46 H new ATOM 0 HB3 GLU A 170 -8.827 10.691 -15.429 1.00 1.46 H new ATOM 0 HG2 GLU A 170 -9.512 10.894 -17.753 1.00 2.02 H new ATOM 0 HG3 GLU A 170 -11.194 11.058 -17.290 1.00 2.02 H new ATOM 2620 N MET A 171 -8.167 7.938 -16.329 1.00 1.30 N ATOM 2621 CA MET A 171 -7.212 7.312 -17.248 1.00 1.44 C ATOM 2622 C MET A 171 -7.453 5.805 -17.374 1.00 1.51 C ATOM 2623 O MET A 171 -6.653 5.095 -17.972 1.00 1.76 O ATOM 2624 CB MET A 171 -5.778 7.573 -16.787 1.00 1.40 C ATOM 2625 CG MET A 171 -4.749 7.445 -17.899 1.00 1.67 C ATOM 2626 SD MET A 171 -3.063 7.346 -17.275 1.00 1.82 S ATOM 2627 CE MET A 171 -3.108 5.728 -16.509 1.00 1.77 C ATOM 0 H MET A 171 -7.828 8.027 -15.371 1.00 1.30 H new ATOM 0 HA MET A 171 -7.362 7.760 -18.230 1.00 1.44 H new ATOM 0 HB2 MET A 171 -5.718 8.575 -16.362 1.00 1.40 H new ATOM 0 HB3 MET A 171 -5.528 6.873 -15.990 1.00 1.40 H new ATOM 0 HG2 MET A 171 -4.967 6.555 -18.490 1.00 1.67 H new ATOM 0 HG3 MET A 171 -4.835 8.301 -18.569 1.00 1.67 H new ATOM 0 HE1 MET A 171 -2.124 5.264 -16.581 1.00 1.77 H new ATOM 0 HE2 MET A 171 -3.385 5.830 -15.460 1.00 1.77 H new ATOM 0 HE3 MET A 171 -3.842 5.104 -17.019 1.00 1.77 H new ATOM 2637 N GLU A 172 -8.527 5.337 -16.744 1.00 1.43 N ATOM 2638 CA GLU A 172 -8.978 3.937 -16.786 1.00 1.58 C ATOM 2639 C GLU A 172 -8.691 3.218 -18.117 1.00 1.73 C ATOM 2640 O GLU A 172 -8.301 2.049 -18.128 1.00 2.00 O ATOM 2641 CB GLU A 172 -10.483 3.900 -16.514 1.00 1.62 C ATOM 2642 CG GLU A 172 -11.284 4.870 -17.377 1.00 2.05 C ATOM 2643 CD GLU A 172 -12.785 4.698 -17.238 1.00 2.83 C ATOM 2644 OE1 GLU A 172 -13.344 3.764 -17.848 1.00 3.31 O ATOM 2645 OE2 GLU A 172 -13.408 5.485 -16.499 1.00 3.45 O ATOM 0 H GLU A 172 -9.128 5.932 -16.173 1.00 1.43 H new ATOM 0 HA GLU A 172 -8.410 3.404 -16.024 1.00 1.58 H new ATOM 0 HB2 GLU A 172 -10.850 2.888 -16.684 1.00 1.62 H new ATOM 0 HB3 GLU A 172 -10.660 4.131 -15.463 1.00 1.62 H new ATOM 0 HG2 GLU A 172 -11.016 5.892 -17.108 1.00 2.05 H new ATOM 0 HG3 GLU A 172 -11.005 4.732 -18.422 1.00 2.05 H new ATOM 2652 N GLU A 173 -8.886 3.920 -19.225 1.00 1.74 N ATOM 2653 CA GLU A 173 -8.753 3.340 -20.564 1.00 2.08 C ATOM 2654 C GLU A 173 -7.281 3.149 -20.977 1.00 2.36 C ATOM 2655 O GLU A 173 -7.005 2.785 -22.120 1.00 2.69 O ATOM 2656 CB GLU A 173 -9.485 4.221 -21.584 1.00 2.29 C ATOM 2657 CG GLU A 173 -9.734 3.546 -22.926 1.00 2.72 C ATOM 2658 CD GLU A 173 -10.711 2.390 -22.832 1.00 2.95 C ATOM 2659 OE1 GLU A 173 -10.387 1.373 -22.185 1.00 3.36 O ATOM 2660 OE2 GLU A 173 -11.814 2.492 -23.412 1.00 3.18 O ATOM 0 H GLU A 173 -9.141 4.908 -19.226 1.00 1.74 H new ATOM 0 HA GLU A 173 -9.207 2.349 -20.541 1.00 2.08 H new ATOM 0 HB2 GLU A 173 -10.442 4.529 -21.162 1.00 2.29 H new ATOM 0 HB3 GLU A 173 -8.903 5.128 -21.748 1.00 2.29 H new ATOM 0 HG2 GLU A 173 -10.117 4.283 -23.632 1.00 2.72 H new ATOM 0 HG3 GLU A 173 -8.787 3.183 -23.326 1.00 2.72 H new ATOM 2667 N LEU A 174 -6.356 3.433 -20.051 1.00 2.34 N ATOM 2668 CA LEU A 174 -4.903 3.349 -20.294 1.00 2.77 C ATOM 2669 C LEU A 174 -4.533 2.178 -21.217 1.00 2.83 C ATOM 2670 O LEU A 174 -4.329 2.373 -22.420 1.00 3.15 O ATOM 2671 CB LEU A 174 -4.158 3.236 -18.951 1.00 3.04 C ATOM 2672 CG LEU A 174 -2.641 3.511 -18.986 1.00 3.65 C ATOM 2673 CD1 LEU A 174 -1.853 2.256 -19.328 1.00 4.14 C ATOM 2674 CD2 LEU A 174 -2.316 4.625 -19.974 1.00 4.09 C ATOM 0 H LEU A 174 -6.593 3.730 -19.104 1.00 2.34 H new ATOM 0 HA LEU A 174 -4.598 4.262 -20.805 1.00 2.77 H new ATOM 0 HB2 LEU A 174 -4.615 3.931 -18.246 1.00 3.04 H new ATOM 0 HB3 LEU A 174 -4.315 2.232 -18.556 1.00 3.04 H new ATOM 0 HG LEU A 174 -2.345 3.831 -17.987 1.00 3.65 H new ATOM 0 HD11 LEU A 174 -0.788 2.488 -19.344 1.00 4.14 H new ATOM 0 HD12 LEU A 174 -2.046 1.489 -18.578 1.00 4.14 H new ATOM 0 HD13 LEU A 174 -2.159 1.890 -20.308 1.00 4.14 H new ATOM 0 HD21 LEU A 174 -1.240 4.802 -19.982 1.00 4.09 H new ATOM 0 HD22 LEU A 174 -2.643 4.333 -20.972 1.00 4.09 H new ATOM 0 HD23 LEU A 174 -2.832 5.538 -19.676 1.00 4.09 H new ATOM 2686 N LYS A 175 -4.455 0.972 -20.645 1.00 2.71 N ATOM 2687 CA LYS A 175 -4.138 -0.251 -21.398 1.00 2.98 C ATOM 2688 C LYS A 175 -2.846 -0.124 -22.219 1.00 2.92 C ATOM 2689 O LYS A 175 -2.104 0.850 -22.097 1.00 3.27 O ATOM 2690 CB LYS A 175 -5.299 -0.620 -22.329 1.00 3.56 C ATOM 2691 CG LYS A 175 -6.141 -1.787 -21.836 1.00 3.99 C ATOM 2692 CD LYS A 175 -6.915 -1.450 -20.573 1.00 4.91 C ATOM 2693 CE LYS A 175 -7.670 -2.665 -20.049 1.00 5.73 C ATOM 2694 NZ LYS A 175 -8.587 -3.240 -21.072 1.00 6.31 N ATOM 0 H LYS A 175 -4.609 0.814 -19.649 1.00 2.71 H new ATOM 0 HA LYS A 175 -3.984 -1.039 -20.661 1.00 2.98 H new ATOM 0 HB2 LYS A 175 -5.942 0.251 -22.454 1.00 3.56 H new ATOM 0 HB3 LYS A 175 -4.899 -0.864 -23.313 1.00 3.56 H new ATOM 0 HG2 LYS A 175 -6.839 -2.084 -22.619 1.00 3.99 H new ATOM 0 HG3 LYS A 175 -5.494 -2.643 -21.645 1.00 3.99 H new ATOM 0 HD2 LYS A 175 -6.228 -1.088 -19.808 1.00 4.91 H new ATOM 0 HD3 LYS A 175 -7.618 -0.643 -20.779 1.00 4.91 H new ATOM 0 HE2 LYS A 175 -6.956 -3.426 -19.734 1.00 5.73 H new ATOM 0 HE3 LYS A 175 -8.244 -2.382 -19.167 1.00 5.73 H new ATOM 0 HZ1 LYS A 175 -9.212 -3.940 -20.624 1.00 6.31 H new ATOM 0 HZ2 LYS A 175 -9.161 -2.480 -21.490 1.00 6.31 H new ATOM 0 HZ3 LYS A 175 -8.029 -3.702 -21.818 1.00 6.31 H new ATOM 2708 N ALA A 176 -2.573 -1.151 -23.019 1.00 3.23 N ATOM 2709 CA ALA A 176 -1.491 -1.124 -24.004 1.00 3.81 C ATOM 2710 C ALA A 176 -0.116 -0.901 -23.371 1.00 4.06 C ATOM 2711 O ALA A 176 0.466 0.182 -23.480 1.00 4.47 O ATOM 2712 CB ALA A 176 -1.766 -0.063 -25.065 1.00 4.57 C ATOM 0 H ALA A 176 -3.095 -2.027 -23.004 1.00 3.23 H new ATOM 0 HA ALA A 176 -1.466 -2.108 -24.472 1.00 3.81 H new ATOM 0 HB1 ALA A 176 -0.953 -0.055 -25.791 1.00 4.57 H new ATOM 0 HB2 ALA A 176 -2.703 -0.291 -25.573 1.00 4.57 H new ATOM 0 HB3 ALA A 176 -1.839 0.916 -24.591 1.00 4.57 H new ATOM 2718 N ASN A 177 0.411 -1.929 -22.722 1.00 4.28 N ATOM 2719 CA ASN A 177 1.764 -1.873 -22.182 1.00 4.87 C ATOM 2720 C ASN A 177 2.632 -2.935 -22.848 1.00 5.36 C ATOM 2721 O ASN A 177 2.394 -4.132 -22.676 1.00 5.81 O ATOM 2722 CB ASN A 177 1.762 -2.066 -20.659 1.00 5.37 C ATOM 2723 CG ASN A 177 3.161 -2.011 -20.064 1.00 5.96 C ATOM 2724 OD1 ASN A 177 4.052 -1.349 -20.596 1.00 6.37 O ATOM 2725 ND2 ASN A 177 3.362 -2.694 -18.947 1.00 6.38 N ATOM 0 H ASN A 177 -0.075 -2.810 -22.556 1.00 4.28 H new ATOM 0 HA ASN A 177 2.177 -0.887 -22.394 1.00 4.87 H new ATOM 0 HB2 ASN A 177 1.144 -1.295 -20.199 1.00 5.37 H new ATOM 0 HB3 ASN A 177 1.305 -3.026 -20.418 1.00 5.37 H new ATOM 0 HD21 ASN A 177 4.279 -2.682 -18.500 1.00 6.38 H new ATOM 0 HD22 ASN A 177 2.600 -3.232 -18.534 1.00 6.38 H new ATOM 2732 N PRO A 178 3.620 -2.502 -23.650 1.00 5.69 N ATOM 2733 CA PRO A 178 4.544 -3.403 -24.351 1.00 6.51 C ATOM 2734 C PRO A 178 5.267 -4.354 -23.400 1.00 7.07 C ATOM 2735 O PRO A 178 5.916 -3.873 -22.448 1.00 7.39 O ATOM 2736 CB PRO A 178 5.543 -2.461 -25.038 1.00 6.95 C ATOM 2737 CG PRO A 178 5.349 -1.132 -24.391 1.00 6.50 C ATOM 2738 CD PRO A 178 3.918 -1.093 -23.941 1.00 5.73 C ATOM 2739 OXT PRO A 178 5.185 -5.580 -23.616 1.00 7.47 O ATOM 0 HA PRO A 178 4.014 -4.050 -25.050 1.00 6.51 H new ATOM 0 HB2 PRO A 178 6.566 -2.814 -24.910 1.00 6.95 H new ATOM 0 HB3 PRO A 178 5.356 -2.406 -26.111 1.00 6.95 H new ATOM 0 HG2 PRO A 178 6.027 -1.007 -23.546 1.00 6.50 H new ATOM 0 HG3 PRO A 178 5.560 -0.323 -25.091 1.00 6.50 H new ATOM 0 HD2 PRO A 178 3.790 -0.464 -23.060 1.00 5.73 H new ATOM 0 HD3 PRO A 178 3.263 -0.694 -24.716 1.00 5.73 H new TER 2747 PRO A 178