USER MOD reduce.3.24.130724 H: found=0, std=0, add=1584, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1581 hydrogens (12 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 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 140 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 134 ASN : amide:sc= 0.361 K(o=0.61,f=-1.7!) USER MOD Set 2.2: A 145 ASN : amide:sc= 0.252 K(o=0.61,f=-3.2!) USER MOD Set 3.1: A 109 LYS NZ :NH3+ 165:sc= 1.17 (180deg=0) USER MOD Set 3.2: A 154 THR OG1 : rot 180:sc= 1.06 USER MOD Set 4.1: A 6 GLN : amide:sc= -0.596 K(o=0.17,f=-4.8!) USER MOD Set 4.2: A 9 LYS NZ :NH3+ 172:sc= 0.768 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 172:sc= 0.893 (180deg=0.853) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0226 USER MOD Single : A 8 LYS NZ :NH3+ -166:sc= -0.0184 (180deg=-0.222) USER MOD Single : A 12 ASN : amide:sc= 1.05 K(o=1.1,f=-8.7!) USER MOD Single : A 13 HIS : no HD1:sc= 0.544 K(o=0.54,f=-4.4!) USER MOD Single : A 16 SER OG : rot 85:sc= 1.17 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.127 K(o=-0.13,f=1.1) USER MOD Single : A 25 GLN : amide:sc= -0.886 K(o=-0.89,f=-0.13) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 157:sc= -2.7! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -1.22 K(o=-1.2,f=-0.0029) USER MOD Single : A 39 SER OG : rot 124:sc= 0.102 USER MOD Single : A 45 LYS NZ :NH3+ -153:sc= 2 (180deg=0.756) USER MOD Single : A 46 MET CE :methyl 159:sc= -0.0718 (180deg=-0.585) USER MOD Single : A 48 ASN : amide:sc= -0.0292 K(o=-0.029,f=-0.78) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.104) USER MOD Single : A 64 HIS : no HD1:sc= -1.27 X(o=-1.3,f=-1.3) USER MOD Single : A 68 ASN : amide:sc= -1.83! K(o=-1.8!,f=-0.038) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot -150:sc= 1.24 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -158:sc=-0.00235 (180deg=-0.172) USER MOD Single : A 81 CYS SG : rot 180:sc= -0.252 USER MOD Single : A 85 LYS NZ :NH3+ -145:sc= 1.25 (180deg=-0.57) USER MOD Single : A 86 CYS SG : rot 22:sc= 1.28 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ -170:sc= 0.826 (180deg=0.749) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0808 USER MOD Single : A 111 TYR OH : rot 150:sc= -1.91! USER MOD Single : A 115 HIS : no HE2:sc= -4.6! C(o=-4.6!,f=-4.7!) USER MOD Single : A 117 THR OG1 : rot 30:sc= 1.15 USER MOD Single : A 121 SER OG : rot 180:sc= 0.134 USER MOD Single : A 122 TYR OH : rot 125:sc= 0.489 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= 0.891 K(o=0.89,f=-0.35!) USER MOD Single : A 144 LYS NZ :NH3+ 157:sc= -0.0858 (180deg=-0.476) USER MOD Single : A 146 GLN : amide:sc= -1.15! K(o=-1.2!,f=-0.36) USER MOD Single : A 147 THR OG1 : rot 85:sc= 0.0779 USER MOD Single : A 152 LYS NZ :NH3+ -131:sc= 1.23 (180deg=-0.621) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0257) USER MOD Single : A 161 LYS NZ :NH3+ 179:sc= 1.26 (180deg=1.25) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0 USER MOD Single : A 167 TYR OH : rot 58:sc= 1.19 USER MOD Single : A 171 LYS NZ :NH3+ -124:sc= 1.3 (180deg=-0.261) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 DGT O3' : rot 38:sc= -1.15 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.218 -16.223 6.787 1.00 1.61 N ATOM 2 CA MET A 1 -10.659 -15.969 6.558 1.00 0.85 C ATOM 3 C MET A 1 -10.983 -16.136 5.095 1.00 0.76 C ATOM 4 O MET A 1 -11.379 -17.208 4.644 1.00 0.95 O ATOM 5 CB MET A 1 -11.040 -14.548 6.977 1.00 1.35 C ATOM 6 CG MET A 1 -11.295 -14.390 8.455 1.00 2.03 C ATOM 7 SD MET A 1 -12.360 -12.981 8.828 1.00 2.69 S ATOM 8 CE MET A 1 -12.932 -13.415 10.470 1.00 3.45 C ATOM 0 H1 MET A 1 -8.973 -15.976 7.767 1.00 1.61 H new ATOM 0 H2 MET A 1 -9.012 -17.229 6.622 1.00 1.61 H new ATOM 0 H3 MET A 1 -8.655 -15.643 6.133 1.00 1.61 H new ATOM 0 HA MET A 1 -11.222 -16.684 7.157 1.00 0.85 H new ATOM 0 HB2 MET A 1 -10.241 -13.867 6.682 1.00 1.35 H new ATOM 0 HB3 MET A 1 -11.934 -14.247 6.431 1.00 1.35 H new ATOM 0 HG2 MET A 1 -11.755 -15.300 8.840 1.00 2.03 H new ATOM 0 HG3 MET A 1 -10.344 -14.269 8.973 1.00 2.03 H new ATOM 0 HE1 MET A 1 -13.602 -12.639 10.839 1.00 3.45 H new ATOM 0 HE2 MET A 1 -13.464 -14.365 10.430 1.00 3.45 H new ATOM 0 HE3 MET A 1 -12.078 -13.505 11.141 1.00 3.45 H new ATOM 20 N LEU A 2 -10.781 -15.060 4.358 1.00 0.61 N ATOM 21 CA LEU A 2 -11.046 -15.041 2.937 1.00 0.57 C ATOM 22 C LEU A 2 -9.911 -15.724 2.170 1.00 0.52 C ATOM 23 O LEU A 2 -8.852 -16.014 2.726 1.00 0.60 O ATOM 24 CB LEU A 2 -11.234 -13.592 2.457 1.00 0.59 C ATOM 25 CG LEU A 2 -10.140 -12.607 2.876 1.00 0.64 C ATOM 26 CD1 LEU A 2 -9.508 -11.966 1.649 1.00 1.05 C ATOM 27 CD2 LEU A 2 -10.715 -11.540 3.797 1.00 0.96 C ATOM 0 H LEU A 2 -10.429 -14.178 4.729 1.00 0.61 H new ATOM 0 HA LEU A 2 -11.965 -15.594 2.743 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -11.298 -13.595 1.369 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -12.190 -13.226 2.831 1.00 0.59 H new ATOM 0 HG LEU A 2 -9.368 -13.153 3.418 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -8.732 -11.268 1.962 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -9.068 -12.740 1.020 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -10.271 -11.430 1.084 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -9.926 -10.846 4.087 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -11.503 -10.996 3.276 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -11.128 -12.013 4.688 1.00 0.96 H new ATOM 39 N THR A 3 -10.147 -15.988 0.904 1.00 0.46 N ATOM 40 CA THR A 3 -9.167 -16.637 0.053 1.00 0.42 C ATOM 41 C THR A 3 -8.611 -15.638 -0.956 1.00 0.39 C ATOM 42 O THR A 3 -9.110 -14.511 -1.050 1.00 0.40 O ATOM 43 CB THR A 3 -9.821 -17.807 -0.699 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.235 -17.575 -0.812 1.00 0.51 O ATOM 45 CG2 THR A 3 -9.576 -19.132 0.013 1.00 0.52 C ATOM 0 H THR A 3 -11.023 -15.760 0.433 1.00 0.46 H new ATOM 0 HA THR A 3 -8.355 -17.013 0.676 1.00 0.42 H new ATOM 0 HB THR A 3 -9.372 -17.867 -1.690 1.00 0.44 H new ATOM 0 HG1 THR A 3 -11.651 -18.320 -1.293 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.052 -19.938 -0.545 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.504 -19.318 0.077 1.00 0.52 H new ATOM 0 HG23 THR A 3 -9.997 -19.088 1.018 1.00 0.52 H new ATOM 53 N LEU A 4 -7.579 -16.038 -1.694 1.00 0.39 N ATOM 54 CA LEU A 4 -6.974 -15.181 -2.712 1.00 0.40 C ATOM 55 C LEU A 4 -8.028 -14.690 -3.699 1.00 0.39 C ATOM 56 O LEU A 4 -8.053 -13.514 -4.070 1.00 0.41 O ATOM 57 CB LEU A 4 -5.886 -15.948 -3.465 1.00 0.43 C ATOM 58 CG LEU A 4 -5.182 -15.173 -4.585 1.00 0.63 C ATOM 59 CD1 LEU A 4 -4.244 -14.123 -4.011 1.00 1.14 C ATOM 60 CD2 LEU A 4 -4.423 -16.130 -5.493 1.00 1.69 C ATOM 0 H LEU A 4 -7.142 -16.955 -1.606 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.531 -14.319 -2.213 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.134 -16.276 -2.747 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.330 -16.846 -3.893 1.00 0.43 H new ATOM 0 HG LEU A 4 -5.941 -14.660 -5.176 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -3.756 -13.587 -4.825 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -4.813 -13.420 -3.403 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -3.489 -14.609 -3.393 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -3.928 -15.566 -6.284 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -3.676 -16.669 -4.910 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -5.120 -16.841 -5.936 1.00 1.69 H new ATOM 72 N ILE A 5 -8.904 -15.604 -4.105 1.00 0.40 N ATOM 73 CA ILE A 5 -9.973 -15.287 -5.038 1.00 0.42 C ATOM 74 C ILE A 5 -10.880 -14.202 -4.470 1.00 0.40 C ATOM 75 O ILE A 5 -11.239 -13.254 -5.168 1.00 0.40 O ATOM 76 CB ILE A 5 -10.820 -16.532 -5.378 1.00 0.48 C ATOM 77 CG1 ILE A 5 -11.150 -17.329 -4.112 1.00 1.32 C ATOM 78 CG2 ILE A 5 -10.092 -17.410 -6.388 1.00 1.22 C ATOM 79 CD1 ILE A 5 -12.405 -18.170 -4.231 1.00 1.94 C ATOM 0 H ILE A 5 -8.891 -16.577 -3.798 1.00 0.40 H new ATOM 0 HA ILE A 5 -9.502 -14.927 -5.953 1.00 0.42 H new ATOM 0 HB ILE A 5 -11.758 -16.197 -5.821 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -10.309 -17.980 -3.873 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -11.265 -16.637 -3.277 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -10.702 -18.284 -6.617 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -9.913 -16.842 -7.301 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -9.139 -17.733 -5.969 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -12.574 -18.705 -3.297 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -13.258 -17.524 -4.438 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -12.287 -18.887 -5.044 1.00 1.94 H new ATOM 91 N GLN A 6 -11.227 -14.337 -3.192 1.00 0.38 N ATOM 92 CA GLN A 6 -12.085 -13.372 -2.524 1.00 0.38 C ATOM 93 C GLN A 6 -11.408 -12.014 -2.439 1.00 0.36 C ATOM 94 O GLN A 6 -12.025 -10.997 -2.741 1.00 0.37 O ATOM 95 CB GLN A 6 -12.468 -13.870 -1.131 1.00 0.40 C ATOM 96 CG GLN A 6 -13.815 -14.576 -1.087 1.00 0.77 C ATOM 97 CD GLN A 6 -14.975 -13.650 -1.424 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.974 -14.067 -2.012 1.00 1.38 O ATOM 99 NE2 GLN A 6 -14.861 -12.386 -1.046 1.00 0.99 N ATOM 0 H GLN A 6 -10.924 -15.110 -2.600 1.00 0.38 H new ATOM 0 HA GLN A 6 -12.995 -13.261 -3.113 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -11.697 -14.553 -0.773 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -12.488 -13.024 -0.444 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -13.806 -15.411 -1.788 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -13.968 -14.996 -0.093 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -14.020 -12.073 -0.561 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -15.614 -11.726 -1.240 1.00 0.99 H new ATOM 108 N GLY A 7 -10.150 -12.003 -2.007 1.00 0.35 N ATOM 109 CA GLY A 7 -9.408 -10.759 -1.924 1.00 0.34 C ATOM 110 C GLY A 7 -9.410 -10.006 -3.239 1.00 0.33 C ATOM 111 O GLY A 7 -9.700 -8.807 -3.279 1.00 0.33 O ATOM 0 H GLY A 7 -9.633 -12.832 -1.714 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -9.841 -10.130 -1.146 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.380 -10.969 -1.629 1.00 0.34 H new ATOM 115 N LYS A 8 -9.141 -10.719 -4.323 1.00 0.35 N ATOM 116 CA LYS A 8 -9.114 -10.105 -5.646 1.00 0.38 C ATOM 117 C LYS A 8 -10.515 -9.648 -6.037 1.00 0.38 C ATOM 118 O LYS A 8 -10.691 -8.582 -6.634 1.00 0.38 O ATOM 119 CB LYS A 8 -8.569 -11.091 -6.685 1.00 0.44 C ATOM 120 CG LYS A 8 -8.017 -10.424 -7.941 1.00 0.76 C ATOM 121 CD LYS A 8 -9.121 -10.021 -8.914 1.00 0.74 C ATOM 122 CE LYS A 8 -9.804 -11.233 -9.526 1.00 1.24 C ATOM 123 NZ LYS A 8 -8.876 -12.022 -10.377 1.00 1.81 N ATOM 0 H LYS A 8 -8.939 -11.719 -4.315 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.454 -9.238 -5.615 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -7.781 -11.688 -6.226 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.365 -11.779 -6.971 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -7.444 -9.541 -7.659 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -7.328 -11.106 -8.439 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.860 -9.412 -8.393 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -8.699 -9.403 -9.706 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -10.196 -11.868 -8.732 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -10.655 -10.907 -10.123 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -9.421 -12.691 -10.958 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -8.343 -11.380 -10.997 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -8.214 -12.549 -9.772 1.00 1.81 H new ATOM 137 N LYS A 9 -11.507 -10.450 -5.669 1.00 0.41 N ATOM 138 CA LYS A 9 -12.898 -10.156 -5.976 1.00 0.46 C ATOM 139 C LYS A 9 -13.354 -8.891 -5.255 1.00 0.43 C ATOM 140 O LYS A 9 -13.916 -7.973 -5.872 1.00 0.44 O ATOM 141 CB LYS A 9 -13.765 -11.358 -5.577 1.00 0.53 C ATOM 142 CG LYS A 9 -15.235 -11.043 -5.358 1.00 0.74 C ATOM 143 CD LYS A 9 -15.977 -12.260 -4.829 1.00 0.87 C ATOM 144 CE LYS A 9 -17.349 -11.892 -4.289 1.00 1.29 C ATOM 145 NZ LYS A 9 -18.077 -13.086 -3.780 1.00 1.69 N ATOM 0 H LYS A 9 -11.369 -11.318 -5.152 1.00 0.41 H new ATOM 0 HA LYS A 9 -13.003 -9.979 -7.046 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -13.683 -12.119 -6.353 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -13.361 -11.791 -4.662 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.333 -10.217 -4.653 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -15.685 -10.717 -6.296 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -16.085 -12.995 -5.627 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -15.390 -12.730 -4.040 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -17.241 -11.162 -3.487 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -17.935 -11.416 -5.076 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -18.947 -12.783 -3.298 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -18.321 -13.709 -4.576 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -17.472 -13.602 -3.110 1.00 1.69 H new ATOM 159 N ILE A 10 -13.089 -8.831 -3.954 1.00 0.41 N ATOM 160 CA ILE A 10 -13.479 -7.681 -3.161 1.00 0.42 C ATOM 161 C ILE A 10 -12.697 -6.450 -3.587 1.00 0.35 C ATOM 162 O ILE A 10 -13.261 -5.369 -3.666 1.00 0.38 O ATOM 163 CB ILE A 10 -13.340 -7.921 -1.635 1.00 0.46 C ATOM 164 CG1 ILE A 10 -11.882 -8.090 -1.200 1.00 0.45 C ATOM 165 CG2 ILE A 10 -14.151 -9.138 -1.227 1.00 0.57 C ATOM 166 CD1 ILE A 10 -11.743 -8.552 0.236 1.00 0.58 C ATOM 0 H ILE A 10 -12.608 -9.564 -3.433 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.539 -7.514 -3.351 1.00 0.42 H new ATOM 0 HB ILE A 10 -13.725 -7.035 -1.130 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -11.394 -8.810 -1.857 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -11.360 -7.141 -1.323 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -14.049 -9.300 -0.154 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -15.201 -8.974 -1.471 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -13.787 -10.014 -1.763 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -10.687 -8.653 0.485 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -12.204 -7.820 0.900 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -12.238 -9.515 0.358 1.00 0.58 H new ATOM 178 N VAL A 11 -11.408 -6.621 -3.887 1.00 0.31 N ATOM 179 CA VAL A 11 -10.582 -5.500 -4.334 1.00 0.30 C ATOM 180 C VAL A 11 -11.152 -4.911 -5.617 1.00 0.29 C ATOM 181 O VAL A 11 -11.307 -3.698 -5.733 1.00 0.30 O ATOM 182 CB VAL A 11 -9.113 -5.919 -4.568 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.401 -4.973 -5.527 1.00 0.39 C ATOM 184 CG2 VAL A 11 -8.371 -5.975 -3.251 1.00 0.41 C ATOM 0 H VAL A 11 -10.919 -7.514 -3.829 1.00 0.31 H new ATOM 0 HA VAL A 11 -10.595 -4.751 -3.542 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.121 -6.910 -5.023 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.371 -5.302 -5.665 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.915 -4.975 -6.488 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.407 -3.964 -5.115 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -7.337 -6.271 -3.428 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -8.391 -4.992 -2.780 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -8.849 -6.702 -2.595 1.00 0.41 H new ATOM 194 N ASN A 12 -11.458 -5.781 -6.576 1.00 0.32 N ATOM 195 CA ASN A 12 -12.019 -5.355 -7.852 1.00 0.37 C ATOM 196 C ASN A 12 -13.270 -4.503 -7.647 1.00 0.36 C ATOM 197 O ASN A 12 -13.404 -3.417 -8.226 1.00 0.38 O ATOM 198 CB ASN A 12 -12.347 -6.570 -8.723 1.00 0.44 C ATOM 199 CG ASN A 12 -12.701 -6.180 -10.147 1.00 0.59 C ATOM 200 OD1 ASN A 12 -12.264 -5.140 -10.645 1.00 1.02 O ATOM 201 ND2 ASN A 12 -13.474 -7.017 -10.818 1.00 1.32 N ATOM 0 H ASN A 12 -11.326 -6.789 -6.491 1.00 0.32 H new ATOM 0 HA ASN A 12 -11.271 -4.746 -8.360 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -11.492 -7.246 -8.736 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -13.180 -7.117 -8.281 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -13.729 -6.812 -11.784 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -13.815 -7.867 -10.370 1.00 1.32 H new ATOM 208 N HIS A 13 -14.172 -4.982 -6.807 1.00 0.35 N ATOM 209 CA HIS A 13 -15.401 -4.249 -6.527 1.00 0.38 C ATOM 210 C HIS A 13 -15.092 -2.975 -5.750 1.00 0.33 C ATOM 211 O HIS A 13 -15.562 -1.890 -6.095 1.00 0.35 O ATOM 212 CB HIS A 13 -16.386 -5.116 -5.740 1.00 0.44 C ATOM 213 CG HIS A 13 -17.340 -5.870 -6.613 1.00 0.64 C ATOM 214 ND1 HIS A 13 -18.464 -5.269 -7.131 1.00 1.05 N ATOM 215 CD2 HIS A 13 -17.292 -7.157 -7.031 1.00 1.07 C ATOM 216 CE1 HIS A 13 -19.067 -6.198 -7.855 1.00 1.21 C ATOM 217 NE2 HIS A 13 -18.394 -7.354 -7.821 1.00 1.22 N ATOM 0 H HIS A 13 -14.081 -5.868 -6.309 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.861 -3.982 -7.479 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.827 -5.824 -5.128 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -16.952 -4.482 -5.058 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -16.533 -7.886 -6.789 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -19.985 -6.043 -8.403 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -18.653 -8.220 -8.294 1.00 1.22 H new ATOM 225 N LEU A 14 -14.256 -3.120 -4.731 1.00 0.30 N ATOM 226 CA LEU A 14 -13.864 -2.012 -3.870 1.00 0.31 C ATOM 227 C LEU A 14 -13.284 -0.852 -4.674 1.00 0.31 C ATOM 228 O LEU A 14 -13.717 0.284 -4.533 1.00 0.34 O ATOM 229 CB LEU A 14 -12.827 -2.492 -2.848 1.00 0.35 C ATOM 230 CG LEU A 14 -13.376 -3.111 -1.554 1.00 0.49 C ATOM 231 CD1 LEU A 14 -12.679 -2.503 -0.354 1.00 0.89 C ATOM 232 CD2 LEU A 14 -14.885 -2.937 -1.437 1.00 0.54 C ATOM 0 H LEU A 14 -13.829 -4.011 -4.477 1.00 0.30 H new ATOM 0 HA LEU A 14 -14.758 -1.656 -3.358 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -12.185 -3.228 -3.333 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -12.195 -1.645 -2.580 1.00 0.35 H new ATOM 0 HG LEU A 14 -13.174 -4.182 -1.585 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -13.074 -2.947 0.560 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -11.608 -2.697 -0.418 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -12.853 -1.427 -0.339 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -15.232 -3.389 -0.508 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -15.130 -1.875 -1.438 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -15.374 -3.423 -2.282 1.00 0.54 H new ATOM 244 N ARG A 15 -12.337 -1.160 -5.546 1.00 0.32 N ATOM 245 CA ARG A 15 -11.678 -0.139 -6.352 1.00 0.37 C ATOM 246 C ARG A 15 -12.652 0.533 -7.324 1.00 0.38 C ATOM 247 O ARG A 15 -12.702 1.753 -7.421 1.00 0.45 O ATOM 248 CB ARG A 15 -10.484 -0.738 -7.114 1.00 0.43 C ATOM 249 CG ARG A 15 -10.859 -1.833 -8.108 1.00 1.21 C ATOM 250 CD ARG A 15 -9.637 -2.531 -8.673 1.00 1.96 C ATOM 251 NE ARG A 15 -9.991 -3.564 -9.649 1.00 2.47 N ATOM 252 CZ ARG A 15 -9.097 -4.295 -10.318 1.00 3.14 C ATOM 253 NH1 ARG A 15 -7.799 -4.096 -10.130 1.00 3.59 N ATOM 254 NH2 ARG A 15 -9.507 -5.218 -11.179 1.00 3.77 N ATOM 0 H ARG A 15 -12.006 -2.110 -5.715 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.311 0.629 -5.671 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -9.971 0.062 -7.649 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -9.775 -1.145 -6.393 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -11.499 -2.565 -7.616 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -11.438 -1.400 -8.923 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -8.986 -1.795 -9.145 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -9.070 -2.982 -7.859 1.00 1.96 H new ATOM 0 HE ARG A 15 -10.980 -3.735 -9.828 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -7.482 -3.383 -9.473 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -7.118 -4.656 -10.642 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -10.505 -5.368 -11.329 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -8.824 -5.777 -11.691 1.00 3.77 H new ATOM 268 N SER A 16 -13.425 -0.270 -8.034 1.00 0.36 N ATOM 269 CA SER A 16 -14.377 0.245 -9.013 1.00 0.41 C ATOM 270 C SER A 16 -15.583 0.955 -8.372 1.00 0.38 C ATOM 271 O SER A 16 -16.340 1.642 -9.061 1.00 0.41 O ATOM 272 CB SER A 16 -14.863 -0.908 -9.890 1.00 0.47 C ATOM 273 OG SER A 16 -13.775 -1.691 -10.352 1.00 1.10 O ATOM 0 H SER A 16 -13.415 -1.287 -7.953 1.00 0.36 H new ATOM 0 HA SER A 16 -13.856 0.995 -9.608 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.552 -1.535 -9.323 1.00 0.47 H new ATOM 0 HB3 SER A 16 -15.418 -0.513 -10.741 1.00 0.47 H new ATOM 0 HG SER A 16 -13.539 -2.356 -9.672 1.00 1.10 H new ATOM 279 N ARG A 17 -15.753 0.795 -7.070 1.00 0.34 N ATOM 280 CA ARG A 17 -16.888 1.396 -6.365 1.00 0.34 C ATOM 281 C ARG A 17 -16.472 2.453 -5.328 1.00 0.30 C ATOM 282 O ARG A 17 -17.334 2.931 -4.586 1.00 0.32 O ATOM 283 CB ARG A 17 -17.737 0.320 -5.684 1.00 0.40 C ATOM 284 CG ARG A 17 -18.814 -0.303 -6.571 1.00 0.60 C ATOM 285 CD ARG A 17 -18.245 -1.319 -7.553 1.00 1.17 C ATOM 286 NE ARG A 17 -19.188 -2.409 -7.826 1.00 1.61 N ATOM 287 CZ ARG A 17 -20.122 -2.383 -8.778 1.00 2.24 C ATOM 288 NH1 ARG A 17 -20.216 -1.345 -9.598 1.00 2.71 N ATOM 289 NH2 ARG A 17 -20.962 -3.402 -8.913 1.00 2.95 N ATOM 0 H ARG A 17 -15.124 0.256 -6.475 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.475 1.906 -7.129 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -17.078 -0.471 -5.327 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.216 0.756 -4.807 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.561 -0.788 -5.943 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -19.325 0.485 -7.124 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -17.991 -0.817 -8.487 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -17.320 -1.732 -7.151 1.00 1.17 H new ATOM 0 HE ARG A 17 -19.125 -3.246 -7.247 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -19.572 -0.560 -9.503 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -20.933 -1.332 -10.324 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -20.894 -4.206 -8.289 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -21.676 -3.381 -9.641 1.00 2.95 H new ATOM 303 N LEU A 18 -15.186 2.829 -5.259 1.00 0.27 N ATOM 304 CA LEU A 18 -14.769 3.785 -4.240 1.00 0.26 C ATOM 305 C LEU A 18 -15.083 5.209 -4.666 1.00 0.24 C ATOM 306 O LEU A 18 -15.048 5.537 -5.857 1.00 0.25 O ATOM 307 CB LEU A 18 -13.274 3.676 -3.960 1.00 0.30 C ATOM 308 CG LEU A 18 -12.841 2.613 -2.952 1.00 0.40 C ATOM 309 CD1 LEU A 18 -11.333 2.464 -2.992 1.00 0.63 C ATOM 310 CD2 LEU A 18 -13.299 2.962 -1.544 1.00 0.49 C ATOM 0 H LEU A 18 -14.445 2.496 -5.876 1.00 0.27 H new ATOM 0 HA LEU A 18 -15.325 3.545 -3.333 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -12.765 3.478 -4.903 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.923 4.645 -3.605 1.00 0.30 H new ATOM 0 HG LEU A 18 -13.310 1.668 -3.226 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -11.023 1.706 -2.273 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -11.024 2.163 -3.993 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -10.866 3.416 -2.739 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -12.974 2.185 -0.853 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -12.865 3.917 -1.246 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -14.386 3.035 -1.523 1.00 0.49 H new ATOM 322 N ALA A 19 -15.421 6.040 -3.691 1.00 0.25 N ATOM 323 CA ALA A 19 -15.696 7.450 -3.935 1.00 0.27 C ATOM 324 C ALA A 19 -15.568 8.237 -2.644 1.00 0.29 C ATOM 325 O ALA A 19 -16.058 7.811 -1.605 1.00 0.45 O ATOM 326 CB ALA A 19 -17.087 7.635 -4.523 1.00 0.32 C ATOM 0 H ALA A 19 -15.512 5.759 -2.715 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.966 7.823 -4.654 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -17.270 8.695 -4.697 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -17.158 7.095 -5.467 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.831 7.248 -3.827 1.00 0.32 H new ATOM 332 N PHE A 20 -14.908 9.376 -2.691 1.00 0.28 N ATOM 333 CA PHE A 20 -14.767 10.188 -1.505 1.00 0.29 C ATOM 334 C PHE A 20 -15.364 11.559 -1.725 1.00 0.33 C ATOM 335 O PHE A 20 -15.507 12.014 -2.858 1.00 0.35 O ATOM 336 CB PHE A 20 -13.293 10.274 -1.078 1.00 0.31 C ATOM 337 CG PHE A 20 -12.437 11.173 -1.928 1.00 0.32 C ATOM 338 CD1 PHE A 20 -12.360 12.528 -1.663 1.00 1.20 C ATOM 339 CD2 PHE A 20 -11.699 10.659 -2.980 1.00 1.22 C ATOM 340 CE1 PHE A 20 -11.570 13.356 -2.431 1.00 1.21 C ATOM 341 CE2 PHE A 20 -10.900 11.481 -3.754 1.00 1.25 C ATOM 342 CZ PHE A 20 -10.835 12.834 -3.478 1.00 0.41 C ATOM 0 H PHE A 20 -14.466 9.755 -3.528 1.00 0.28 H new ATOM 0 HA PHE A 20 -15.317 9.715 -0.692 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -13.249 10.624 -0.047 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.867 9.271 -1.093 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -12.927 12.943 -0.843 1.00 1.20 H new ATOM 0 HD2 PHE A 20 -11.748 9.603 -3.199 1.00 1.22 H new ATOM 0 HE1 PHE A 20 -11.525 14.413 -2.214 1.00 1.21 H new ATOM 0 HE2 PHE A 20 -10.329 11.067 -4.572 1.00 1.25 H new ATOM 0 HZ PHE A 20 -10.212 13.480 -4.078 1.00 0.41 H new ATOM 352 N GLU A 21 -15.736 12.209 -0.646 1.00 0.37 N ATOM 353 CA GLU A 21 -16.318 13.522 -0.731 1.00 0.43 C ATOM 354 C GLU A 21 -15.343 14.567 -0.204 1.00 0.46 C ATOM 355 O GLU A 21 -14.801 14.445 0.910 1.00 0.44 O ATOM 356 CB GLU A 21 -17.638 13.574 0.037 1.00 0.48 C ATOM 357 CG GLU A 21 -18.862 13.732 -0.846 1.00 1.11 C ATOM 358 CD GLU A 21 -20.016 12.843 -0.412 1.00 1.40 C ATOM 359 OE1 GLU A 21 -19.768 11.696 0.013 1.00 1.89 O ATOM 360 OE2 GLU A 21 -21.182 13.284 -0.501 1.00 1.92 O ATOM 0 H GLU A 21 -15.644 11.845 0.303 1.00 0.37 H new ATOM 0 HA GLU A 21 -16.526 13.744 -1.778 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.741 12.661 0.623 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -17.603 14.404 0.743 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -19.185 14.773 -0.830 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -18.595 13.497 -1.876 1.00 1.11 H new ATOM 367 N TYR A 22 -15.144 15.585 -1.022 1.00 0.52 N ATOM 368 CA TYR A 22 -14.259 16.692 -0.716 1.00 0.59 C ATOM 369 C TYR A 22 -15.053 17.986 -0.822 1.00 0.65 C ATOM 370 O TYR A 22 -15.580 18.306 -1.889 1.00 0.65 O ATOM 371 CB TYR A 22 -13.064 16.707 -1.683 1.00 0.60 C ATOM 372 CG TYR A 22 -12.519 18.092 -1.978 1.00 0.74 C ATOM 373 CD1 TYR A 22 -11.708 18.754 -1.065 1.00 1.53 C ATOM 374 CD2 TYR A 22 -12.826 18.739 -3.168 1.00 1.38 C ATOM 375 CE1 TYR A 22 -11.223 20.021 -1.331 1.00 1.69 C ATOM 376 CE2 TYR A 22 -12.343 20.003 -3.439 1.00 1.48 C ATOM 377 CZ TYR A 22 -11.543 20.639 -2.519 1.00 1.16 C ATOM 378 OH TYR A 22 -11.065 21.903 -2.786 1.00 1.40 O ATOM 0 H TYR A 22 -15.600 15.666 -1.931 1.00 0.52 H new ATOM 0 HA TYR A 22 -13.865 16.585 0.295 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -12.264 16.096 -1.264 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -13.364 16.240 -2.621 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -11.452 18.272 -0.133 1.00 1.53 H new ATOM 0 HD2 TYR A 22 -13.454 18.244 -3.894 1.00 1.38 H new ATOM 0 HE1 TYR A 22 -10.596 20.524 -0.610 1.00 1.69 H new ATOM 0 HE2 TYR A 22 -12.592 20.491 -4.370 1.00 1.48 H new ATOM 0 HH TYR A 22 -11.383 22.194 -3.666 1.00 1.40 H new ATOM 388 N ASN A 23 -15.171 18.706 0.290 1.00 0.72 N ATOM 389 CA ASN A 23 -15.911 19.967 0.326 1.00 0.80 C ATOM 390 C ASN A 23 -17.336 19.806 -0.209 1.00 0.78 C ATOM 391 O ASN A 23 -17.910 20.736 -0.777 1.00 0.83 O ATOM 392 CB ASN A 23 -15.163 21.042 -0.466 1.00 0.87 C ATOM 393 CG ASN A 23 -14.232 21.846 0.414 1.00 1.09 C ATOM 394 OD1 ASN A 23 -13.067 21.494 0.598 1.00 1.72 O ATOM 395 ND2 ASN A 23 -14.734 22.929 0.971 1.00 1.37 N ATOM 0 H ASN A 23 -14.761 18.437 1.184 1.00 0.72 H new ATOM 0 HA ASN A 23 -15.985 20.277 1.368 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -14.591 20.571 -1.265 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -15.882 21.710 -0.940 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -14.152 23.507 1.578 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -15.704 23.190 0.796 1.00 1.37 H new ATOM 402 N GLY A 24 -17.905 18.626 -0.011 1.00 0.73 N ATOM 403 CA GLY A 24 -19.254 18.356 -0.469 1.00 0.73 C ATOM 404 C GLY A 24 -19.307 17.759 -1.865 1.00 0.68 C ATOM 405 O GLY A 24 -20.346 17.246 -2.287 1.00 0.70 O ATOM 0 H GLY A 24 -17.453 17.844 0.463 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -19.737 17.673 0.229 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -19.827 19.283 -0.456 1.00 0.73 H new ATOM 409 N GLN A 25 -18.193 17.807 -2.582 1.00 0.64 N ATOM 410 CA GLN A 25 -18.137 17.267 -3.935 1.00 0.60 C ATOM 411 C GLN A 25 -17.685 15.815 -3.929 1.00 0.54 C ATOM 412 O GLN A 25 -16.727 15.456 -3.248 1.00 0.53 O ATOM 413 CB GLN A 25 -17.196 18.083 -4.814 1.00 0.63 C ATOM 414 CG GLN A 25 -17.667 19.514 -5.028 1.00 0.76 C ATOM 415 CD GLN A 25 -18.986 19.585 -5.778 1.00 1.16 C ATOM 416 OE1 GLN A 25 -19.837 20.425 -5.491 1.00 1.91 O ATOM 417 NE2 GLN A 25 -19.156 18.722 -6.767 1.00 1.56 N ATOM 0 H GLN A 25 -17.318 18.213 -2.251 1.00 0.64 H new ATOM 0 HA GLN A 25 -19.146 17.324 -4.344 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -16.205 18.097 -4.359 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -17.096 17.592 -5.782 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -17.775 20.006 -4.061 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -16.907 20.064 -5.583 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -18.429 18.038 -6.978 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -20.014 18.741 -7.318 1.00 1.56 H new ATOM 426 N LEU A 26 -18.378 14.995 -4.695 1.00 0.50 N ATOM 427 CA LEU A 26 -18.057 13.582 -4.786 1.00 0.46 C ATOM 428 C LEU A 26 -16.970 13.311 -5.819 1.00 0.43 C ATOM 429 O LEU A 26 -17.091 13.672 -6.990 1.00 0.47 O ATOM 430 CB LEU A 26 -19.301 12.774 -5.127 1.00 0.49 C ATOM 431 CG LEU A 26 -19.832 11.909 -3.989 1.00 0.54 C ATOM 432 CD1 LEU A 26 -20.987 11.058 -4.473 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.732 11.025 -3.413 1.00 0.61 C ATOM 0 H LEU A 26 -19.172 15.284 -5.267 1.00 0.50 H new ATOM 0 HA LEU A 26 -17.679 13.275 -3.811 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -20.088 13.460 -5.441 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -19.078 12.132 -5.979 1.00 0.49 H new ATOM 0 HG LEU A 26 -20.185 12.570 -3.198 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -21.357 10.445 -3.651 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.788 11.703 -4.834 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -20.649 10.412 -5.283 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -19.139 10.419 -2.603 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -18.343 10.372 -4.195 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.926 11.651 -3.029 1.00 0.61 H new ATOM 445 N ILE A 27 -15.918 12.662 -5.361 1.00 0.39 N ATOM 446 CA ILE A 27 -14.778 12.309 -6.197 1.00 0.39 C ATOM 447 C ILE A 27 -14.573 10.789 -6.175 1.00 0.36 C ATOM 448 O ILE A 27 -14.150 10.230 -5.164 1.00 0.42 O ATOM 449 CB ILE A 27 -13.483 13.001 -5.700 1.00 0.41 C ATOM 450 CG1 ILE A 27 -13.756 14.449 -5.252 1.00 0.46 C ATOM 451 CG2 ILE A 27 -12.411 12.970 -6.782 1.00 0.48 C ATOM 452 CD1 ILE A 27 -14.174 15.387 -6.364 1.00 0.78 C ATOM 0 H ILE A 27 -15.825 12.360 -4.391 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.987 12.647 -7.212 1.00 0.39 H new ATOM 0 HB ILE A 27 -13.121 12.447 -4.834 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -14.537 14.438 -4.491 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -12.857 14.845 -4.780 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -11.509 13.460 -6.415 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -12.183 11.935 -7.038 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.773 13.492 -7.668 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -14.344 16.383 -5.955 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -13.386 15.433 -7.116 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -15.093 15.021 -6.823 1.00 0.78 H new ATOM 464 N LYS A 28 -14.889 10.123 -7.281 1.00 0.31 N ATOM 465 CA LYS A 28 -14.752 8.673 -7.371 1.00 0.30 C ATOM 466 C LYS A 28 -13.275 8.267 -7.354 1.00 0.30 C ATOM 467 O LYS A 28 -12.417 8.992 -7.859 1.00 0.35 O ATOM 468 CB LYS A 28 -15.450 8.152 -8.640 1.00 0.32 C ATOM 469 CG LYS A 28 -14.740 8.508 -9.941 1.00 0.66 C ATOM 470 CD LYS A 28 -15.468 7.936 -11.155 1.00 1.05 C ATOM 471 CE LYS A 28 -15.696 6.438 -11.019 1.00 1.84 C ATOM 472 NZ LYS A 28 -16.225 5.841 -12.269 1.00 2.41 N ATOM 0 H LYS A 28 -15.243 10.565 -8.129 1.00 0.31 H new ATOM 0 HA LYS A 28 -15.233 8.222 -6.503 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.537 7.068 -8.573 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -16.464 8.552 -8.672 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -14.673 9.592 -10.034 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -13.719 8.126 -9.915 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -16.427 8.441 -11.276 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -14.887 8.136 -12.055 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -14.758 5.951 -10.753 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -16.394 6.250 -10.204 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -16.366 4.820 -12.133 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -17.133 6.287 -12.509 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -15.547 5.997 -13.042 1.00 2.41 H new ATOM 486 N ILE A 29 -12.981 7.118 -6.764 1.00 0.28 N ATOM 487 CA ILE A 29 -11.600 6.643 -6.676 1.00 0.31 C ATOM 488 C ILE A 29 -11.465 5.172 -7.073 1.00 0.29 C ATOM 489 O ILE A 29 -12.115 4.289 -6.494 1.00 0.31 O ATOM 490 CB ILE A 29 -11.002 6.829 -5.253 1.00 0.34 C ATOM 491 CG1 ILE A 29 -12.084 7.285 -4.267 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.860 7.831 -5.287 1.00 0.43 C ATOM 493 CD1 ILE A 29 -11.697 7.142 -2.809 1.00 0.36 C ATOM 0 H ILE A 29 -13.671 6.498 -6.341 1.00 0.28 H new ATOM 0 HA ILE A 29 -11.041 7.257 -7.383 1.00 0.31 H new ATOM 0 HB ILE A 29 -10.613 5.868 -4.915 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -12.325 8.329 -4.467 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.991 6.709 -4.449 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -9.451 7.951 -4.284 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -9.079 7.470 -5.956 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -10.229 8.792 -5.645 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -12.517 7.486 -2.179 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -11.486 6.095 -2.590 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.809 7.741 -2.608 1.00 0.36 H new ATOM 505 N LEU A 30 -10.705 4.940 -8.142 1.00 0.30 N ATOM 506 CA LEU A 30 -10.415 3.593 -8.613 1.00 0.31 C ATOM 507 C LEU A 30 -8.986 3.198 -8.277 1.00 0.29 C ATOM 508 O LEU A 30 -8.237 3.982 -7.694 1.00 0.28 O ATOM 509 CB LEU A 30 -10.676 3.412 -10.105 1.00 0.36 C ATOM 510 CG LEU A 30 -11.934 2.587 -10.410 1.00 1.41 C ATOM 511 CD1 LEU A 30 -13.159 3.479 -10.419 1.00 1.97 C ATOM 512 CD2 LEU A 30 -11.796 1.836 -11.726 1.00 2.00 C ATOM 0 H LEU A 30 -10.277 5.678 -8.701 1.00 0.30 H new ATOM 0 HA LEU A 30 -11.104 2.932 -8.088 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -10.772 4.393 -10.571 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -9.813 2.926 -10.561 1.00 0.36 H new ATOM 0 HG LEU A 30 -12.054 1.845 -9.621 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -14.043 2.880 -10.637 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -13.272 3.952 -9.443 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -13.044 4.247 -11.183 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -12.703 1.261 -11.914 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -11.643 2.548 -12.537 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -10.943 1.160 -11.671 1.00 2.00 H new ATOM 524 N SER A 31 -8.623 1.973 -8.655 1.00 0.31 N ATOM 525 CA SER A 31 -7.280 1.424 -8.456 1.00 0.33 C ATOM 526 C SER A 31 -6.203 2.320 -9.078 1.00 0.33 C ATOM 527 O SER A 31 -5.015 2.167 -8.799 1.00 0.36 O ATOM 528 CB SER A 31 -7.233 0.043 -9.103 1.00 0.41 C ATOM 529 OG SER A 31 -8.355 -0.134 -9.960 1.00 1.16 O ATOM 0 H SER A 31 -9.262 1.324 -9.115 1.00 0.31 H new ATOM 0 HA SER A 31 -7.077 1.364 -7.387 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.310 -0.069 -9.672 1.00 0.41 H new ATOM 0 HB3 SER A 31 -7.229 -0.728 -8.333 1.00 0.41 H new ATOM 0 HG SER A 31 -8.150 -0.819 -10.630 1.00 1.16 H new ATOM 535 N LYS A 32 -6.630 3.244 -9.931 1.00 0.34 N ATOM 536 CA LYS A 32 -5.732 4.176 -10.580 1.00 0.38 C ATOM 537 C LYS A 32 -4.984 4.996 -9.540 1.00 0.36 C ATOM 538 O LYS A 32 -3.882 5.488 -9.778 1.00 0.40 O ATOM 539 CB LYS A 32 -6.552 5.122 -11.450 1.00 0.45 C ATOM 540 CG LYS A 32 -5.777 5.713 -12.601 1.00 1.10 C ATOM 541 CD LYS A 32 -5.376 4.630 -13.571 1.00 1.55 C ATOM 542 CE LYS A 32 -5.596 5.064 -15.003 1.00 1.94 C ATOM 543 NZ LYS A 32 -5.012 4.095 -15.960 1.00 2.47 N ATOM 0 H LYS A 32 -7.610 3.364 -10.188 1.00 0.34 H new ATOM 0 HA LYS A 32 -5.015 3.621 -11.184 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -7.415 4.584 -11.843 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -6.936 5.931 -10.829 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -6.384 6.461 -13.111 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -4.889 6.223 -12.227 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -4.326 4.377 -13.423 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -5.953 3.727 -13.370 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -6.664 5.166 -15.193 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -5.149 6.046 -15.159 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -5.181 4.423 -16.932 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -3.988 4.017 -15.794 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -5.457 3.164 -15.826 1.00 2.47 H new ATOM 557 N ASN A 33 -5.614 5.148 -8.390 1.00 0.31 N ATOM 558 CA ASN A 33 -5.046 5.899 -7.289 1.00 0.33 C ATOM 559 C ASN A 33 -4.726 4.997 -6.101 1.00 0.30 C ATOM 560 O ASN A 33 -3.881 5.326 -5.272 1.00 0.38 O ATOM 561 CB ASN A 33 -6.026 7.003 -6.899 1.00 0.36 C ATOM 562 CG ASN A 33 -5.652 8.328 -7.528 1.00 0.75 C ATOM 563 OD1 ASN A 33 -5.818 9.390 -6.934 1.00 1.28 O ATOM 564 ND2 ASN A 33 -5.154 8.268 -8.753 1.00 1.12 N ATOM 0 H ASN A 33 -6.534 4.754 -8.194 1.00 0.31 H new ATOM 0 HA ASN A 33 -4.101 6.342 -7.603 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -7.033 6.723 -7.210 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -6.045 7.107 -5.814 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -4.892 9.125 -9.239 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -5.032 7.364 -9.210 1.00 1.12 H new ATOM 571 N ILE A 34 -5.399 3.858 -6.035 1.00 0.33 N ATOM 572 CA ILE A 34 -5.212 2.911 -4.944 1.00 0.33 C ATOM 573 C ILE A 34 -4.560 1.620 -5.435 1.00 0.29 C ATOM 574 O ILE A 34 -5.062 0.964 -6.348 1.00 0.30 O ATOM 575 CB ILE A 34 -6.572 2.589 -4.276 1.00 0.35 C ATOM 576 CG1 ILE A 34 -7.025 3.743 -3.379 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.498 1.305 -3.472 1.00 0.58 C ATOM 578 CD1 ILE A 34 -7.734 4.859 -4.111 1.00 0.59 C ATOM 0 H ILE A 34 -6.085 3.565 -6.730 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.549 3.372 -4.212 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.305 2.455 -5.072 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -7.689 3.350 -2.609 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -6.154 4.155 -2.869 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.467 1.105 -3.015 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -6.230 0.479 -4.130 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -5.743 1.407 -2.692 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -8.021 5.635 -3.401 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -7.067 5.283 -4.862 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -8.626 4.465 -4.598 1.00 0.59 H new ATOM 590 N VAL A 35 -3.459 1.245 -4.803 1.00 0.27 N ATOM 591 CA VAL A 35 -2.740 0.041 -5.178 1.00 0.26 C ATOM 592 C VAL A 35 -2.939 -1.058 -4.136 1.00 0.25 C ATOM 593 O VAL A 35 -2.597 -0.892 -2.964 1.00 0.26 O ATOM 594 CB VAL A 35 -1.230 0.287 -5.360 1.00 0.30 C ATOM 595 CG1 VAL A 35 -0.932 0.853 -6.738 1.00 0.45 C ATOM 596 CG2 VAL A 35 -0.682 1.198 -4.274 1.00 0.51 C ATOM 0 H VAL A 35 -3.044 1.760 -4.026 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.153 -0.273 -6.136 1.00 0.26 H new ATOM 0 HB VAL A 35 -0.728 -0.676 -5.272 1.00 0.30 H new ATOM 0 HG11 VAL A 35 0.141 1.017 -6.840 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -1.265 0.149 -7.500 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.457 1.800 -6.864 1.00 0.45 H new ATOM 0 HG21 VAL A 35 0.386 1.351 -4.432 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -1.196 2.159 -4.311 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -0.842 0.739 -3.299 1.00 0.51 H new ATOM 606 N ALA A 36 -3.499 -2.174 -4.570 1.00 0.25 N ATOM 607 CA ALA A 36 -3.736 -3.310 -3.691 1.00 0.25 C ATOM 608 C ALA A 36 -2.425 -3.996 -3.346 1.00 0.24 C ATOM 609 O ALA A 36 -1.620 -4.294 -4.233 1.00 0.27 O ATOM 610 CB ALA A 36 -4.692 -4.299 -4.340 1.00 0.30 C ATOM 0 H ALA A 36 -3.801 -2.320 -5.533 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.191 -2.942 -2.771 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -4.856 -5.141 -3.667 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -5.643 -3.806 -4.544 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.263 -4.660 -5.275 1.00 0.30 H new ATOM 616 N VAL A 37 -2.214 -4.236 -2.068 1.00 0.23 N ATOM 617 CA VAL A 37 -1.010 -4.885 -1.601 1.00 0.24 C ATOM 618 C VAL A 37 -1.327 -5.856 -0.476 1.00 0.25 C ATOM 619 O VAL A 37 -2.289 -5.678 0.285 1.00 0.25 O ATOM 620 CB VAL A 37 0.060 -3.873 -1.139 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.983 -3.511 -2.298 1.00 0.29 C ATOM 622 CG2 VAL A 37 -0.587 -2.627 -0.558 1.00 0.30 C ATOM 0 H VAL A 37 -2.870 -3.987 -1.328 1.00 0.23 H new ATOM 0 HA VAL A 37 -0.598 -5.435 -2.447 1.00 0.24 H new ATOM 0 HB VAL A 37 0.656 -4.339 -0.354 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.732 -2.797 -1.957 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.479 -4.411 -2.663 1.00 0.29 H new ATOM 0 HG13 VAL A 37 0.398 -3.067 -3.104 1.00 0.29 H new ATOM 0 HG21 VAL A 37 0.188 -1.929 -0.240 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.212 -2.154 -1.316 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -1.202 -2.902 0.299 1.00 0.30 H new ATOM 632 N GLY A 38 -0.592 -6.946 -0.470 1.00 0.27 N ATOM 633 CA GLY A 38 -0.775 -7.944 0.539 1.00 0.30 C ATOM 634 C GLY A 38 -0.422 -9.312 0.019 1.00 0.32 C ATOM 635 O GLY A 38 0.392 -9.447 -0.905 1.00 0.32 O ATOM 0 H GLY A 38 0.134 -7.156 -1.155 1.00 0.27 H new ATOM 0 HA2 GLY A 38 -0.155 -7.709 1.404 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -1.811 -7.937 0.878 1.00 0.30 H new ATOM 639 N SER A 39 -1.049 -10.329 0.592 1.00 0.38 N ATOM 640 CA SER A 39 -0.863 -11.694 0.144 1.00 0.43 C ATOM 641 C SER A 39 -1.275 -11.813 -1.324 1.00 0.43 C ATOM 642 O SER A 39 -0.860 -12.734 -2.016 1.00 0.44 O ATOM 643 CB SER A 39 -1.668 -12.627 1.025 1.00 0.57 C ATOM 644 OG SER A 39 -1.262 -12.500 2.375 1.00 1.40 O ATOM 0 H SER A 39 -1.696 -10.229 1.375 1.00 0.38 H new ATOM 0 HA SER A 39 0.187 -11.975 0.222 1.00 0.43 H new ATOM 0 HB2 SER A 39 -2.730 -12.398 0.934 1.00 0.57 H new ATOM 0 HB3 SER A 39 -1.535 -13.657 0.693 1.00 0.57 H new ATOM 0 HG SER A 39 -2.038 -12.275 2.930 1.00 1.40 H new ATOM 650 N LEU A 40 -2.133 -10.887 -1.776 1.00 0.45 N ATOM 651 CA LEU A 40 -2.550 -10.818 -3.170 1.00 0.51 C ATOM 652 C LEU A 40 -1.312 -10.636 -4.048 1.00 0.47 C ATOM 653 O LEU A 40 -1.190 -11.232 -5.115 1.00 0.52 O ATOM 654 CB LEU A 40 -3.490 -9.628 -3.373 1.00 0.63 C ATOM 655 CG LEU A 40 -4.970 -9.958 -3.582 1.00 0.97 C ATOM 656 CD1 LEU A 40 -5.202 -10.583 -4.945 1.00 1.24 C ATOM 657 CD2 LEU A 40 -5.484 -10.873 -2.482 1.00 2.02 C ATOM 0 H LEU A 40 -2.552 -10.171 -1.182 1.00 0.45 H new ATOM 0 HA LEU A 40 -3.071 -11.737 -3.440 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -3.405 -8.974 -2.505 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -3.141 -9.060 -4.236 1.00 0.63 H new ATOM 0 HG LEU A 40 -5.528 -9.023 -3.537 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -6.262 -10.807 -5.067 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -4.887 -9.887 -5.723 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -4.625 -11.504 -5.026 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -6.538 -11.092 -2.654 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -4.915 -11.802 -2.486 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -5.369 -10.381 -1.516 1.00 2.02 H new ATOM 669 N ARG A 41 -0.391 -9.800 -3.573 1.00 0.43 N ATOM 670 CA ARG A 41 0.852 -9.542 -4.287 1.00 0.47 C ATOM 671 C ARG A 41 1.790 -10.727 -4.103 1.00 0.47 C ATOM 672 O ARG A 41 2.538 -11.088 -5.012 1.00 0.54 O ATOM 673 CB ARG A 41 1.519 -8.255 -3.779 1.00 0.50 C ATOM 674 CG ARG A 41 2.439 -7.589 -4.790 1.00 0.92 C ATOM 675 CD ARG A 41 1.643 -6.817 -5.830 1.00 1.30 C ATOM 676 NE ARG A 41 2.485 -5.959 -6.664 1.00 1.82 N ATOM 677 CZ ARG A 41 1.997 -5.130 -7.593 1.00 2.29 C ATOM 678 NH1 ARG A 41 0.684 -5.061 -7.794 1.00 2.67 N ATOM 679 NH2 ARG A 41 2.814 -4.364 -8.307 1.00 2.98 N ATOM 0 H ARG A 41 -0.485 -9.290 -2.695 1.00 0.43 H new ATOM 0 HA ARG A 41 0.631 -9.410 -5.346 1.00 0.47 H new ATOM 0 HB2 ARG A 41 0.743 -7.547 -3.489 1.00 0.50 H new ATOM 0 HB3 ARG A 41 2.091 -8.486 -2.881 1.00 0.50 H new ATOM 0 HG2 ARG A 41 3.122 -6.913 -4.275 1.00 0.92 H new ATOM 0 HG3 ARG A 41 3.050 -8.345 -5.283 1.00 0.92 H new ATOM 0 HD2 ARG A 41 1.106 -7.521 -6.466 1.00 1.30 H new ATOM 0 HD3 ARG A 41 0.894 -6.205 -5.327 1.00 1.30 H new ATOM 0 HE ARG A 41 3.496 -5.995 -6.530 1.00 1.82 H new ATOM 0 HH11 ARG A 41 0.052 -5.639 -7.240 1.00 2.67 H new ATOM 0 HH12 ARG A 41 0.309 -4.430 -8.502 1.00 2.67 H new ATOM 0 HH21 ARG A 41 3.821 -4.406 -8.148 1.00 2.98 H new ATOM 0 HH22 ARG A 41 2.435 -3.734 -9.014 1.00 2.98 H new ATOM 693 N ARG A 42 1.748 -11.320 -2.911 1.00 0.43 N ATOM 694 CA ARG A 42 2.566 -12.480 -2.586 1.00 0.48 C ATOM 695 C ARG A 42 2.049 -13.761 -3.245 1.00 0.47 C ATOM 696 O ARG A 42 2.723 -14.794 -3.215 1.00 0.52 O ATOM 697 CB ARG A 42 2.535 -12.658 -1.071 1.00 0.52 C ATOM 698 CG ARG A 42 3.869 -12.976 -0.438 1.00 1.06 C ATOM 699 CD ARG A 42 3.687 -13.372 1.015 1.00 1.93 C ATOM 700 NE ARG A 42 3.154 -12.276 1.830 1.00 2.68 N ATOM 701 CZ ARG A 42 2.578 -12.446 3.022 1.00 3.60 C ATOM 702 NH1 ARG A 42 2.436 -13.669 3.532 1.00 3.96 N ATOM 703 NH2 ARG A 42 2.131 -11.395 3.704 1.00 4.52 N ATOM 0 H ARG A 42 1.147 -11.009 -2.148 1.00 0.43 H new ATOM 0 HA ARG A 42 3.576 -12.308 -2.958 1.00 0.48 H new ATOM 0 HB2 ARG A 42 2.145 -11.745 -0.621 1.00 0.52 H new ATOM 0 HB3 ARG A 42 1.835 -13.458 -0.828 1.00 0.52 H new ATOM 0 HG2 ARG A 42 4.353 -13.786 -0.984 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.526 -12.109 -0.505 1.00 1.06 H new ATOM 0 HD2 ARG A 42 3.013 -14.226 1.074 1.00 1.93 H new ATOM 0 HD3 ARG A 42 4.645 -13.693 1.424 1.00 1.93 H new ATOM 0 HE ARG A 42 3.228 -11.327 1.464 1.00 2.68 H new ATOM 0 HH11 ARG A 42 2.768 -14.481 3.011 1.00 3.96 H new ATOM 0 HH12 ARG A 42 1.995 -13.793 4.443 1.00 3.96 H new ATOM 0 HH21 ARG A 42 2.228 -10.457 3.316 1.00 4.52 H new ATOM 0 HH22 ARG A 42 1.691 -11.528 4.615 1.00 4.52 H new ATOM 717 N GLU A 43 0.856 -13.685 -3.823 1.00 0.46 N ATOM 718 CA GLU A 43 0.228 -14.822 -4.493 1.00 0.50 C ATOM 719 C GLU A 43 -0.051 -15.957 -3.496 1.00 0.47 C ATOM 720 O GLU A 43 0.260 -17.127 -3.745 1.00 0.52 O ATOM 721 CB GLU A 43 1.098 -15.305 -5.667 1.00 0.59 C ATOM 722 CG GLU A 43 1.383 -14.216 -6.692 1.00 0.67 C ATOM 723 CD GLU A 43 2.387 -14.639 -7.750 1.00 0.95 C ATOM 724 OE1 GLU A 43 2.580 -15.857 -7.951 1.00 1.60 O ATOM 725 OE2 GLU A 43 2.987 -13.752 -8.393 1.00 1.53 O ATOM 0 H GLU A 43 0.295 -12.833 -3.841 1.00 0.46 H new ATOM 0 HA GLU A 43 -0.730 -14.498 -4.899 1.00 0.50 H new ATOM 0 HB2 GLU A 43 2.043 -15.685 -5.278 1.00 0.59 H new ATOM 0 HB3 GLU A 43 0.599 -16.138 -6.161 1.00 0.59 H new ATOM 0 HG2 GLU A 43 0.450 -13.931 -7.179 1.00 0.67 H new ATOM 0 HG3 GLU A 43 1.758 -13.331 -6.178 1.00 0.67 H new ATOM 732 N GLU A 44 -0.651 -15.601 -2.363 1.00 0.43 N ATOM 733 CA GLU A 44 -0.973 -16.572 -1.328 1.00 0.43 C ATOM 734 C GLU A 44 -2.412 -17.076 -1.443 1.00 0.43 C ATOM 735 O GLU A 44 -3.300 -16.358 -1.889 1.00 0.52 O ATOM 736 CB GLU A 44 -0.714 -15.988 0.051 1.00 0.48 C ATOM 737 CG GLU A 44 0.464 -16.630 0.765 1.00 1.24 C ATOM 738 CD GLU A 44 0.286 -18.125 0.977 1.00 1.94 C ATOM 739 OE1 GLU A 44 0.022 -18.857 -0.009 1.00 2.47 O ATOM 740 OE2 GLU A 44 0.413 -18.575 2.132 1.00 2.57 O ATOM 0 H GLU A 44 -0.924 -14.644 -2.141 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.319 -17.432 -1.472 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -0.533 -14.917 -0.044 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -1.609 -16.107 0.662 1.00 0.48 H new ATOM 0 HG2 GLU A 44 1.371 -16.456 0.187 1.00 1.24 H new ATOM 0 HG3 GLU A 44 0.604 -16.146 1.731 1.00 1.24 H new ATOM 747 N LYS A 45 -2.617 -18.315 -1.002 1.00 0.46 N ATOM 748 CA LYS A 45 -3.913 -18.988 -1.084 1.00 0.50 C ATOM 749 C LYS A 45 -4.963 -18.414 -0.129 1.00 0.49 C ATOM 750 O LYS A 45 -6.129 -18.265 -0.497 1.00 0.56 O ATOM 751 CB LYS A 45 -3.751 -20.489 -0.797 1.00 0.59 C ATOM 752 CG LYS A 45 -3.090 -21.288 -1.919 1.00 1.14 C ATOM 753 CD LYS A 45 -1.571 -21.168 -1.892 1.00 1.28 C ATOM 754 CE LYS A 45 -1.067 -20.163 -2.920 1.00 1.42 C ATOM 755 NZ LYS A 45 0.267 -19.618 -2.559 1.00 2.10 N ATOM 0 H LYS A 45 -1.886 -18.884 -0.575 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.271 -18.822 -2.100 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -3.161 -20.609 0.112 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -4.734 -20.915 -0.597 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -3.372 -22.337 -1.830 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -3.464 -20.938 -2.881 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -1.248 -20.864 -0.897 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -1.125 -22.143 -2.088 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -1.010 -20.642 -3.897 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -1.781 -19.344 -3.007 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 0.377 -18.669 -2.970 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.349 -19.559 -1.524 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 1.010 -20.244 -2.930 1.00 2.10 H new ATOM 769 N MET A 46 -4.559 -18.091 1.088 1.00 0.46 N ATOM 770 CA MET A 46 -5.498 -17.588 2.079 1.00 0.48 C ATOM 771 C MET A 46 -5.156 -16.169 2.507 1.00 0.46 C ATOM 772 O MET A 46 -4.013 -15.732 2.388 1.00 0.67 O ATOM 773 CB MET A 46 -5.517 -18.519 3.297 1.00 0.60 C ATOM 774 CG MET A 46 -6.686 -18.271 4.241 1.00 0.67 C ATOM 775 SD MET A 46 -6.572 -19.225 5.767 1.00 1.15 S ATOM 776 CE MET A 46 -5.139 -18.477 6.541 1.00 2.00 C ATOM 0 H MET A 46 -3.595 -18.167 1.413 1.00 0.46 H new ATOM 0 HA MET A 46 -6.488 -17.565 1.624 1.00 0.48 H new ATOM 0 HB2 MET A 46 -5.553 -19.552 2.952 1.00 0.60 H new ATOM 0 HB3 MET A 46 -4.585 -18.399 3.849 1.00 0.60 H new ATOM 0 HG2 MET A 46 -6.730 -17.210 4.485 1.00 0.67 H new ATOM 0 HG3 MET A 46 -7.617 -18.520 3.732 1.00 0.67 H new ATOM 0 HE1 MET A 46 -5.157 -18.678 7.612 1.00 2.00 H new ATOM 0 HE2 MET A 46 -4.231 -18.897 6.108 1.00 2.00 H new ATOM 0 HE3 MET A 46 -5.156 -17.400 6.374 1.00 2.00 H new ATOM 786 N LEU A 47 -6.161 -15.457 3.013 1.00 0.49 N ATOM 787 CA LEU A 47 -5.977 -14.093 3.460 1.00 0.56 C ATOM 788 C LEU A 47 -6.948 -13.738 4.588 1.00 0.55 C ATOM 789 O LEU A 47 -7.899 -14.475 4.875 1.00 0.59 O ATOM 790 CB LEU A 47 -6.127 -13.113 2.289 1.00 0.82 C ATOM 791 CG LEU A 47 -4.896 -12.243 2.052 1.00 0.43 C ATOM 792 CD1 LEU A 47 -5.008 -11.438 0.772 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.680 -11.310 3.215 1.00 1.09 C ATOM 0 H LEU A 47 -7.112 -15.811 3.121 1.00 0.49 H new ATOM 0 HA LEU A 47 -4.964 -14.008 3.855 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -6.342 -13.677 1.381 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -6.986 -12.468 2.475 1.00 0.82 H new ATOM 0 HG LEU A 47 -4.043 -12.914 1.956 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -4.110 -10.833 0.643 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -5.114 -12.115 -0.076 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -5.880 -10.786 0.827 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -3.798 -10.696 3.030 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -5.552 -10.666 3.332 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -4.533 -11.891 4.125 1.00 1.09 H new ATOM 805 N ASN A 48 -6.678 -12.620 5.245 1.00 0.61 N ATOM 806 CA ASN A 48 -7.521 -12.134 6.333 1.00 0.64 C ATOM 807 C ASN A 48 -7.909 -10.682 6.097 1.00 0.52 C ATOM 808 O ASN A 48 -9.054 -10.291 6.296 1.00 0.54 O ATOM 809 CB ASN A 48 -6.799 -12.261 7.677 1.00 0.77 C ATOM 810 CG ASN A 48 -7.674 -11.844 8.848 1.00 1.47 C ATOM 811 OD1 ASN A 48 -8.480 -12.631 9.343 1.00 2.03 O ATOM 812 ND2 ASN A 48 -7.514 -10.610 9.305 1.00 2.14 N ATOM 0 H ASN A 48 -5.874 -12.026 5.043 1.00 0.61 H new ATOM 0 HA ASN A 48 -8.423 -12.746 6.359 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -6.477 -13.293 7.817 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -5.899 -11.646 7.662 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -8.070 -10.283 10.095 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -6.835 -9.988 8.867 1.00 2.14 H new ATOM 819 N ASP A 49 -6.951 -9.885 5.655 1.00 0.49 N ATOM 820 CA ASP A 49 -7.200 -8.477 5.402 1.00 0.39 C ATOM 821 C ASP A 49 -6.544 -8.059 4.102 1.00 0.34 C ATOM 822 O ASP A 49 -5.442 -8.510 3.794 1.00 0.42 O ATOM 823 CB ASP A 49 -6.675 -7.603 6.568 1.00 0.43 C ATOM 824 CG ASP A 49 -5.145 -7.407 6.555 1.00 0.52 C ATOM 825 OD1 ASP A 49 -4.401 -8.407 6.414 1.00 1.02 O ATOM 826 OD2 ASP A 49 -4.653 -6.257 6.697 1.00 1.05 O ATOM 0 H ASP A 49 -5.996 -10.188 5.464 1.00 0.49 H new ATOM 0 HA ASP A 49 -8.277 -8.329 5.323 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.158 -6.627 6.525 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -6.966 -8.061 7.513 1.00 0.43 H new ATOM 831 N VAL A 50 -7.226 -7.236 3.325 1.00 0.28 N ATOM 832 CA VAL A 50 -6.653 -6.761 2.081 1.00 0.27 C ATOM 833 C VAL A 50 -6.113 -5.392 2.329 1.00 0.24 C ATOM 834 O VAL A 50 -6.797 -4.537 2.901 1.00 0.26 O ATOM 835 CB VAL A 50 -7.631 -6.702 0.908 1.00 0.36 C ATOM 836 CG1 VAL A 50 -6.868 -6.375 -0.363 1.00 0.88 C ATOM 837 CG2 VAL A 50 -8.378 -8.010 0.768 1.00 0.90 C ATOM 0 H VAL A 50 -8.163 -6.888 3.530 1.00 0.28 H new ATOM 0 HA VAL A 50 -5.885 -7.477 1.788 1.00 0.27 H new ATOM 0 HB VAL A 50 -8.368 -5.920 1.092 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -7.562 -6.332 -1.203 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -6.372 -5.411 -0.252 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -6.122 -7.147 -0.548 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -9.069 -7.946 -0.073 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -7.667 -8.818 0.593 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -8.937 -8.210 1.682 1.00 0.90 H new ATOM 847 N ASP A 51 -4.879 -5.187 1.967 1.00 0.24 N ATOM 848 CA ASP A 51 -4.246 -3.941 2.217 1.00 0.24 C ATOM 849 C ASP A 51 -4.101 -3.146 0.926 1.00 0.24 C ATOM 850 O ASP A 51 -3.972 -3.713 -0.157 1.00 0.26 O ATOM 851 CB ASP A 51 -2.922 -4.271 2.875 1.00 0.27 C ATOM 852 CG ASP A 51 -3.103 -5.203 4.067 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.312 -6.439 3.910 1.00 0.40 O ATOM 854 OD2 ASP A 51 -3.066 -4.715 5.189 1.00 0.38 O ATOM 0 H ASP A 51 -4.295 -5.877 1.495 1.00 0.24 H new ATOM 0 HA ASP A 51 -4.831 -3.300 2.876 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.259 -4.737 2.146 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.439 -3.351 3.203 1.00 0.27 H new ATOM 859 N LEU A 52 -4.171 -1.825 1.019 1.00 0.26 N ATOM 860 CA LEU A 52 -4.095 -0.993 -0.171 1.00 0.31 C ATOM 861 C LEU A 52 -3.498 0.378 0.116 1.00 0.25 C ATOM 862 O LEU A 52 -3.958 1.103 1.005 1.00 0.32 O ATOM 863 CB LEU A 52 -5.496 -0.814 -0.767 1.00 0.41 C ATOM 864 CG LEU A 52 -6.203 -2.106 -1.179 1.00 0.64 C ATOM 865 CD1 LEU A 52 -7.152 -2.574 -0.088 1.00 1.28 C ATOM 866 CD2 LEU A 52 -6.949 -1.917 -2.485 1.00 1.07 C ATOM 0 H LEU A 52 -4.279 -1.313 1.895 1.00 0.26 H new ATOM 0 HA LEU A 52 -3.439 -1.502 -0.877 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.119 -0.295 -0.038 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -5.421 -0.166 -1.641 1.00 0.41 H new ATOM 0 HG LEU A 52 -5.443 -2.874 -1.325 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -7.643 -3.494 -0.403 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -6.591 -2.758 0.828 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -7.903 -1.806 0.095 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -7.444 -2.848 -2.759 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -7.694 -1.130 -2.368 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -6.245 -1.636 -3.269 1.00 1.07 H new ATOM 878 N LEU A 53 -2.454 0.727 -0.624 1.00 0.27 N ATOM 879 CA LEU A 53 -1.836 2.034 -0.474 1.00 0.31 C ATOM 880 C LEU A 53 -2.490 3.003 -1.443 1.00 0.26 C ATOM 881 O LEU A 53 -2.736 2.669 -2.601 1.00 0.26 O ATOM 882 CB LEU A 53 -0.332 1.997 -0.755 1.00 0.48 C ATOM 883 CG LEU A 53 0.481 0.960 0.020 1.00 0.79 C ATOM 884 CD1 LEU A 53 1.454 0.273 -0.914 1.00 1.59 C ATOM 885 CD2 LEU A 53 1.236 1.614 1.169 1.00 1.06 C ATOM 0 H LEU A 53 -2.022 0.128 -1.328 1.00 0.27 H new ATOM 0 HA LEU A 53 -1.978 2.352 0.559 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -0.188 1.817 -1.820 1.00 0.48 H new ATOM 0 HB3 LEU A 53 0.080 2.983 -0.540 1.00 0.48 H new ATOM 0 HG LEU A 53 -0.204 0.222 0.437 1.00 0.79 H new ATOM 0 HD11 LEU A 53 2.032 -0.466 -0.358 1.00 1.59 H new ATOM 0 HD12 LEU A 53 0.903 -0.224 -1.713 1.00 1.59 H new ATOM 0 HD13 LEU A 53 2.129 1.013 -1.345 1.00 1.59 H new ATOM 0 HD21 LEU A 53 1.807 0.857 1.706 1.00 1.06 H new ATOM 0 HD22 LEU A 53 1.915 2.370 0.775 1.00 1.06 H new ATOM 0 HD23 LEU A 53 0.526 2.084 1.850 1.00 1.06 H new ATOM 897 N ILE A 54 -2.791 4.184 -0.969 1.00 0.26 N ATOM 898 CA ILE A 54 -3.391 5.205 -1.804 1.00 0.25 C ATOM 899 C ILE A 54 -2.320 6.209 -2.177 1.00 0.25 C ATOM 900 O ILE A 54 -1.859 6.969 -1.328 1.00 0.27 O ATOM 901 CB ILE A 54 -4.543 5.931 -1.082 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.435 4.921 -0.346 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.349 6.766 -2.071 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.564 5.560 0.429 1.00 0.58 C ATOM 0 H ILE A 54 -2.631 4.469 -0.003 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.806 4.728 -2.692 1.00 0.25 H new ATOM 0 HB ILE A 54 -4.121 6.608 -0.339 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -5.853 4.223 -1.071 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -4.820 4.338 0.339 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -6.159 7.272 -1.545 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.699 7.507 -2.536 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.766 6.116 -2.840 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.151 4.785 0.922 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -6.154 6.237 1.178 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -7.203 6.120 -0.254 1.00 0.58 H new ATOM 916 N ILE A 55 -1.903 6.201 -3.431 1.00 0.25 N ATOM 917 CA ILE A 55 -0.862 7.098 -3.883 1.00 0.26 C ATOM 918 C ILE A 55 -1.442 8.319 -4.564 1.00 0.25 C ATOM 919 O ILE A 55 -2.157 8.212 -5.558 1.00 0.29 O ATOM 920 CB ILE A 55 0.092 6.400 -4.861 1.00 0.30 C ATOM 921 CG1 ILE A 55 -0.148 4.891 -4.888 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.527 6.696 -4.486 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.847 4.424 -6.143 1.00 0.44 C ATOM 0 H ILE A 55 -2.272 5.581 -4.153 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.311 7.406 -2.995 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.104 6.788 -5.861 1.00 0.30 H new ATOM 0 HG12 ILE A 55 0.808 4.376 -4.799 1.00 0.35 H new ATOM 0 HG13 ILE A 55 -0.745 4.609 -4.021 1.00 0.35 H new ATOM 0 HG21 ILE A 55 2.197 6.196 -5.186 1.00 0.48 H new ATOM 0 HG22 ILE A 55 1.699 7.772 -4.525 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.721 6.334 -3.477 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.988 3.344 -6.101 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.818 4.914 -6.223 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.241 4.677 -7.013 1.00 0.44 H new ATOM 935 N VAL A 56 -1.124 9.479 -4.032 1.00 0.24 N ATOM 936 CA VAL A 56 -1.613 10.727 -4.587 1.00 0.26 C ATOM 937 C VAL A 56 -0.451 11.651 -4.943 1.00 0.27 C ATOM 938 O VAL A 56 0.497 11.798 -4.170 1.00 0.25 O ATOM 939 CB VAL A 56 -2.558 11.438 -3.601 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.389 12.496 -4.309 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.465 10.433 -2.903 1.00 0.33 C ATOM 0 H VAL A 56 -0.527 9.586 -3.212 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.169 10.490 -5.494 1.00 0.26 H new ATOM 0 HB VAL A 56 -1.944 11.933 -2.848 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.048 12.983 -3.590 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -2.728 13.239 -4.756 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -3.988 12.026 -5.089 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -4.124 10.957 -2.211 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.064 9.906 -3.646 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -2.857 9.716 -2.352 1.00 0.33 H new ATOM 951 N PRO A 57 -0.495 12.261 -6.140 1.00 0.31 N ATOM 952 CA PRO A 57 0.554 13.182 -6.596 1.00 0.34 C ATOM 953 C PRO A 57 0.502 14.534 -5.886 1.00 0.34 C ATOM 954 O PRO A 57 1.361 15.391 -6.097 1.00 0.37 O ATOM 955 CB PRO A 57 0.258 13.348 -8.091 1.00 0.39 C ATOM 956 CG PRO A 57 -1.195 13.066 -8.237 1.00 0.41 C ATOM 957 CD PRO A 57 -1.546 12.069 -7.161 1.00 0.37 C ATOM 0 HA PRO A 57 1.551 12.795 -6.384 1.00 0.34 H new ATOM 0 HB2 PRO A 57 0.499 14.355 -8.430 1.00 0.39 H new ATOM 0 HB3 PRO A 57 0.854 12.659 -8.689 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -1.781 13.979 -8.127 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -1.415 12.664 -9.226 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -2.539 12.256 -6.752 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -1.547 11.049 -7.546 1.00 0.37 H new ATOM 965 N GLU A 58 -0.509 14.722 -5.048 1.00 0.33 N ATOM 966 CA GLU A 58 -0.668 15.959 -4.303 1.00 0.36 C ATOM 967 C GLU A 58 -1.032 15.669 -2.859 1.00 0.35 C ATOM 968 O GLU A 58 -1.912 14.849 -2.578 1.00 0.34 O ATOM 969 CB GLU A 58 -1.735 16.851 -4.933 1.00 0.40 C ATOM 970 CG GLU A 58 -1.295 17.495 -6.233 1.00 0.64 C ATOM 971 CD GLU A 58 -2.211 18.619 -6.658 1.00 1.32 C ATOM 972 OE1 GLU A 58 -2.191 19.683 -6.006 1.00 2.00 O ATOM 973 OE2 GLU A 58 -2.959 18.443 -7.639 1.00 1.99 O ATOM 0 H GLU A 58 -1.234 14.028 -4.868 1.00 0.33 H new ATOM 0 HA GLU A 58 0.286 16.486 -4.333 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.631 16.258 -5.116 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.009 17.632 -4.224 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.281 17.879 -6.120 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -1.264 16.739 -7.018 1.00 0.64 H new ATOM 980 N LYS A 59 -0.380 16.371 -1.946 1.00 0.36 N ATOM 981 CA LYS A 59 -0.619 16.184 -0.521 1.00 0.37 C ATOM 982 C LYS A 59 -2.029 16.619 -0.166 1.00 0.37 C ATOM 983 O LYS A 59 -2.665 16.061 0.733 1.00 0.37 O ATOM 984 CB LYS A 59 0.386 16.980 0.314 1.00 0.42 C ATOM 985 CG LYS A 59 1.831 16.619 0.035 1.00 1.10 C ATOM 986 CD LYS A 59 2.756 17.166 1.111 1.00 1.46 C ATOM 987 CE LYS A 59 4.191 16.716 0.894 1.00 2.16 C ATOM 988 NZ LYS A 59 5.080 17.124 2.019 1.00 2.64 N ATOM 0 H LYS A 59 0.321 17.078 -2.166 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.496 15.124 -0.296 1.00 0.37 H new ATOM 0 HB2 LYS A 59 0.243 18.043 0.122 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.177 16.816 1.371 1.00 0.42 H new ATOM 0 HG2 LYS A 59 1.933 15.535 -0.019 1.00 1.10 H new ATOM 0 HG3 LYS A 59 2.126 17.015 -0.937 1.00 1.10 H new ATOM 0 HD2 LYS A 59 2.711 18.255 1.111 1.00 1.46 H new ATOM 0 HD3 LYS A 59 2.413 16.833 2.091 1.00 1.46 H new ATOM 0 HE2 LYS A 59 4.218 15.632 0.785 1.00 2.16 H new ATOM 0 HE3 LYS A 59 4.567 17.140 -0.037 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 6.049 16.798 1.831 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 5.075 18.160 2.108 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 4.737 16.699 2.904 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.520 17.618 -0.890 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.854 18.131 -0.650 1.00 0.42 C ATOM 1004 C LYS A 60 -4.884 17.078 -1.009 1.00 0.40 C ATOM 1005 O LYS A 60 -5.594 16.594 -0.133 1.00 0.41 O ATOM 1006 CB LYS A 60 -4.096 19.411 -1.455 1.00 0.48 C ATOM 1007 CG LYS A 60 -3.579 20.667 -0.771 1.00 0.69 C ATOM 1008 CD LYS A 60 -2.064 20.746 -0.823 1.00 0.79 C ATOM 1009 CE LYS A 60 -1.475 21.113 0.531 1.00 0.94 C ATOM 1010 NZ LYS A 60 -0.406 22.134 0.408 1.00 1.50 N ATOM 0 H LYS A 60 -2.014 18.084 -1.643 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.949 18.374 0.408 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.616 19.314 -2.429 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -5.165 19.520 -1.636 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -4.007 21.547 -1.252 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -3.909 20.679 0.268 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.660 19.787 -1.148 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.763 21.487 -1.564 1.00 0.79 H new ATOM 0 HE2 LYS A 60 -2.265 21.490 1.181 1.00 0.94 H new ATOM 0 HE3 LYS A 60 -1.071 20.219 1.006 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 -0.030 22.358 1.351 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 0.359 21.765 -0.192 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 -0.797 22.996 -0.022 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.922 16.671 -2.277 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.876 15.666 -2.728 1.00 0.40 C ATOM 1026 C LEU A 61 -5.781 14.407 -1.879 1.00 0.37 C ATOM 1027 O LEU A 61 -6.766 13.692 -1.709 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.639 15.319 -4.197 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.653 16.498 -5.171 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.330 16.020 -6.581 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -7.002 17.202 -5.148 1.00 0.52 C ATOM 0 H LEU A 61 -4.303 17.023 -3.007 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.877 16.085 -2.620 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.676 14.815 -4.281 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.401 14.605 -4.509 1.00 0.42 H new ATOM 0 HG LEU A 61 -4.890 17.211 -4.857 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.343 16.869 -7.265 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.342 15.560 -6.592 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -6.074 15.288 -6.896 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -6.989 18.037 -5.848 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -7.784 16.499 -5.436 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -7.201 17.574 -4.143 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.593 14.142 -1.350 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.372 12.982 -0.509 1.00 0.31 C ATOM 1045 C LEU A 62 -5.167 13.095 0.775 1.00 0.34 C ATOM 1046 O LEU A 62 -5.867 12.168 1.170 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.885 12.861 -0.186 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.526 11.924 0.965 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -1.543 10.868 0.492 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.947 12.707 2.136 1.00 0.58 C ATOM 0 H LEU A 62 -3.766 14.721 -1.492 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.704 12.093 -1.045 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.365 12.521 -1.082 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.502 13.854 0.047 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.435 11.428 1.305 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -1.294 10.205 1.321 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -1.992 10.288 -0.314 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -0.636 11.352 0.129 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -1.698 12.020 2.945 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -1.047 13.230 1.814 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -2.681 13.431 2.488 1.00 0.58 H new ATOM 1062 N LYS A 63 -5.054 14.236 1.430 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.764 14.455 2.677 1.00 0.43 C ATOM 1064 C LYS A 63 -7.217 14.850 2.432 1.00 0.46 C ATOM 1065 O LYS A 63 -7.994 14.944 3.378 1.00 0.52 O ATOM 1066 CB LYS A 63 -5.061 15.515 3.533 1.00 0.47 C ATOM 1067 CG LYS A 63 -4.973 16.882 2.880 1.00 1.14 C ATOM 1068 CD LYS A 63 -4.384 17.927 3.819 1.00 1.36 C ATOM 1069 CE LYS A 63 -3.025 17.506 4.366 1.00 1.86 C ATOM 1070 NZ LYS A 63 -3.128 16.913 5.725 1.00 2.13 N ATOM 0 H LYS A 63 -4.481 15.021 1.122 1.00 0.37 H new ATOM 0 HA LYS A 63 -5.758 13.511 3.222 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -5.591 15.611 4.481 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -4.053 15.170 3.765 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -4.360 16.816 1.981 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -5.967 17.198 2.565 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -4.283 18.874 3.289 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -5.071 18.097 4.648 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -2.571 16.783 3.689 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -2.364 18.372 4.398 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -2.379 16.202 5.851 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -3.019 17.661 6.439 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -4.058 16.460 5.837 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.586 15.070 1.170 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.959 15.447 0.825 1.00 0.51 C ATOM 1086 C HIS A 64 -9.889 14.246 0.908 1.00 0.38 C ATOM 1087 O HIS A 64 -11.108 14.398 0.936 1.00 0.37 O ATOM 1088 CB HIS A 64 -9.025 16.042 -0.586 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.477 17.433 -0.692 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -8.552 18.148 -1.861 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.861 18.188 0.248 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -7.990 19.316 -1.606 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.558 19.389 -0.340 1.00 1.18 N ATOM 0 H HIS A 64 -6.956 14.994 0.371 1.00 0.45 H new ATOM 0 HA HIS A 64 -9.282 16.199 1.545 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.475 15.394 -1.268 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -10.063 16.046 -0.918 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -7.649 17.899 1.267 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -7.891 20.113 -2.328 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -7.094 20.183 0.101 1.00 1.18 H new ATOM 1101 N VAL A 65 -9.310 13.057 0.943 1.00 0.36 N ATOM 1102 CA VAL A 65 -10.094 11.829 1.027 1.00 0.35 C ATOM 1103 C VAL A 65 -10.609 11.606 2.453 1.00 0.37 C ATOM 1104 O VAL A 65 -11.651 10.980 2.661 1.00 0.43 O ATOM 1105 CB VAL A 65 -9.284 10.592 0.562 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.647 10.845 -0.798 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -8.224 10.205 1.583 1.00 1.09 C ATOM 0 H VAL A 65 -8.301 12.913 0.915 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.943 11.949 0.355 1.00 0.35 H new ATOM 0 HB VAL A 65 -9.980 9.758 0.470 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -8.083 9.964 -1.105 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.426 11.052 -1.532 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -7.975 11.701 -0.732 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -7.675 9.334 1.225 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -7.534 11.037 1.724 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -8.703 9.967 2.533 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.868 12.135 3.425 1.00 0.41 N ATOM 1118 CA LEU A 66 -10.210 11.996 4.842 1.00 0.52 C ATOM 1119 C LEU A 66 -11.560 12.646 5.218 1.00 0.51 C ATOM 1120 O LEU A 66 -12.344 12.018 5.928 1.00 0.56 O ATOM 1121 CB LEU A 66 -9.088 12.566 5.720 1.00 0.67 C ATOM 1122 CG LEU A 66 -8.161 11.532 6.379 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -8.919 10.697 7.402 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.519 10.630 5.334 1.00 0.83 C ATOM 0 H LEU A 66 -9.017 12.670 3.255 1.00 0.41 H new ATOM 0 HA LEU A 66 -10.319 10.927 5.025 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.480 13.234 5.110 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -9.540 13.173 6.505 1.00 0.67 H new ATOM 0 HG LEU A 66 -7.370 12.077 6.895 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -8.242 9.973 7.854 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -9.323 11.349 8.176 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -9.736 10.171 6.909 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.868 9.908 5.827 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -8.296 10.101 4.783 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -6.932 11.235 4.643 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.837 13.919 4.802 1.00 0.50 N ATOM 1137 CA PRO A 67 -13.103 14.606 5.110 1.00 0.53 C ATOM 1138 C PRO A 67 -14.330 13.704 4.979 1.00 0.46 C ATOM 1139 O PRO A 67 -15.131 13.611 5.911 1.00 0.54 O ATOM 1140 CB PRO A 67 -13.140 15.727 4.080 1.00 0.58 C ATOM 1141 CG PRO A 67 -11.709 16.083 3.881 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.932 14.802 4.038 1.00 0.55 C ATOM 0 HA PRO A 67 -13.138 14.947 6.145 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -13.602 15.398 3.149 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.717 16.579 4.439 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -11.549 16.517 2.894 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -11.387 16.826 4.611 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -10.677 14.370 3.070 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.995 14.967 4.570 1.00 0.55 H new ATOM 1150 N ASN A 68 -14.476 13.043 3.833 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.597 12.140 3.628 1.00 0.43 C ATOM 1152 C ASN A 68 -15.248 11.085 2.590 1.00 0.40 C ATOM 1153 O ASN A 68 -14.655 11.391 1.567 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.852 12.913 3.228 1.00 0.53 C ATOM 1155 CG ASN A 68 -18.133 12.170 3.581 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -18.596 12.213 4.721 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.732 11.498 2.611 1.00 1.40 N ATOM 0 H ASN A 68 -13.837 13.117 3.041 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.806 11.632 4.569 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.850 13.883 3.724 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.831 13.104 2.155 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -19.601 10.998 2.798 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -18.325 11.480 1.676 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.591 9.840 2.882 1.00 0.46 N ATOM 1165 CA ILE A 69 -15.316 8.723 1.989 1.00 0.48 C ATOM 1166 C ILE A 69 -16.490 7.750 2.028 1.00 0.58 C ATOM 1167 O ILE A 69 -17.030 7.478 3.101 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.989 8.001 2.355 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.783 6.769 1.469 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.962 7.619 3.834 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -12.400 6.162 1.586 1.00 0.71 C ATOM 0 H ILE A 69 -16.068 9.575 3.744 1.00 0.46 H new ATOM 0 HA ILE A 69 -15.195 9.111 0.978 1.00 0.48 H new ATOM 0 HB ILE A 69 -13.166 8.693 2.174 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -14.525 6.015 1.732 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.963 7.045 0.430 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -13.023 7.115 4.063 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -14.049 8.518 4.444 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.795 6.950 4.052 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -12.327 5.294 0.931 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.653 6.900 1.295 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -12.224 5.854 2.617 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.910 7.253 0.872 1.00 0.48 N ATOM 1184 CA ARG A 70 -18.030 6.322 0.808 1.00 0.61 C ATOM 1185 C ARG A 70 -17.807 5.254 -0.264 1.00 0.41 C ATOM 1186 O ARG A 70 -16.853 5.317 -1.047 1.00 0.34 O ATOM 1187 CB ARG A 70 -19.345 7.069 0.521 1.00 0.82 C ATOM 1188 CG ARG A 70 -19.812 7.976 1.651 1.00 1.23 C ATOM 1189 CD ARG A 70 -21.276 8.365 1.495 1.00 1.41 C ATOM 1190 NE ARG A 70 -21.454 9.560 0.667 1.00 1.74 N ATOM 1191 CZ ARG A 70 -22.577 9.851 0.005 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -23.607 9.009 0.015 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -22.666 10.988 -0.673 1.00 2.92 N ATOM 0 H ARG A 70 -16.494 7.478 -0.032 1.00 0.48 H new ATOM 0 HA ARG A 70 -18.099 5.832 1.779 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -19.219 7.668 -0.381 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -20.126 6.338 0.312 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -19.670 7.470 2.606 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -19.197 8.876 1.673 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -21.824 7.534 1.051 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -21.709 8.542 2.480 1.00 1.41 H new ATOM 0 HE ARG A 70 -20.672 10.210 0.591 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -23.544 8.132 0.532 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -24.460 9.241 -0.494 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -21.879 11.636 -0.687 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -23.522 11.214 -1.180 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.692 4.273 -0.276 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.650 3.183 -1.242 1.00 0.48 C ATOM 1209 C ILE A 71 -20.052 2.982 -1.802 1.00 0.45 C ATOM 1210 O ILE A 71 -21.034 3.109 -1.070 1.00 0.58 O ATOM 1211 CB ILE A 71 -18.163 1.857 -0.616 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.824 2.043 0.105 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -18.036 0.786 -1.689 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.284 0.767 0.717 1.00 1.09 C ATOM 0 H ILE A 71 -19.465 4.207 0.386 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.941 3.454 -2.025 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.902 1.540 0.120 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -16.092 2.436 -0.601 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.944 2.790 0.889 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.692 -0.144 -1.236 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -19.006 0.624 -2.158 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -17.318 1.110 -2.443 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.334 0.974 1.211 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -16.997 0.384 1.447 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -16.132 0.024 -0.066 1.00 1.09 H new ATOM 1226 N LYS A 72 -20.150 2.681 -3.087 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.446 2.486 -3.722 1.00 0.47 C ATOM 1228 C LYS A 72 -22.179 1.248 -3.188 1.00 0.43 C ATOM 1229 O LYS A 72 -21.781 0.113 -3.459 1.00 0.49 O ATOM 1230 CB LYS A 72 -21.287 2.383 -5.246 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.966 3.711 -5.927 1.00 0.87 C ATOM 1232 CD LYS A 72 -22.167 4.651 -5.965 1.00 1.57 C ATOM 1233 CE LYS A 72 -23.354 4.032 -6.693 1.00 1.96 C ATOM 1234 NZ LYS A 72 -24.485 4.984 -6.830 1.00 2.63 N ATOM 0 H LYS A 72 -19.351 2.566 -3.710 1.00 0.38 H new ATOM 0 HA LYS A 72 -22.053 3.357 -3.477 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -20.494 1.670 -5.471 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -22.207 1.981 -5.671 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -20.144 4.197 -5.400 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -20.624 3.521 -6.945 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -22.460 4.907 -4.947 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -21.884 5.581 -6.458 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -23.039 3.700 -7.682 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -23.689 3.147 -6.152 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -25.270 4.521 -7.331 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -24.804 5.282 -5.886 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -24.174 5.817 -7.369 1.00 2.63 H new ATOM 1248 N GLY A 73 -23.236 1.494 -2.409 1.00 0.46 N ATOM 1249 CA GLY A 73 -24.070 0.423 -1.873 1.00 0.53 C ATOM 1250 C GLY A 73 -23.372 -0.541 -0.921 1.00 0.47 C ATOM 1251 O GLY A 73 -23.726 -1.721 -0.882 1.00 0.52 O ATOM 0 H GLY A 73 -23.533 2.431 -2.136 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.916 0.872 -1.352 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -24.476 -0.149 -2.707 1.00 0.53 H new ATOM 1255 N LEU A 74 -22.396 -0.074 -0.155 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.688 -0.964 0.765 1.00 0.36 C ATOM 1257 C LEU A 74 -21.682 -0.442 2.201 1.00 0.34 C ATOM 1258 O LEU A 74 -21.874 0.754 2.440 1.00 0.35 O ATOM 1259 CB LEU A 74 -20.253 -1.152 0.295 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.723 -2.581 0.387 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -20.103 -3.370 -0.857 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -18.216 -2.569 0.581 1.00 0.56 C ATOM 0 H LEU A 74 -22.078 0.895 -0.148 1.00 0.40 H new ATOM 0 HA LEU A 74 -22.221 -1.915 0.763 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -20.180 -0.820 -0.741 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.606 -0.502 0.884 1.00 0.38 H new ATOM 0 HG LEU A 74 -20.177 -3.070 1.249 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.718 -4.386 -0.775 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -21.188 -3.400 -0.951 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -19.676 -2.890 -1.737 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -17.849 -3.593 0.645 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.744 -2.067 -0.264 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -17.972 -2.038 1.501 1.00 0.56 H new ATOM 1274 N SER A 75 -21.472 -1.357 3.153 1.00 0.33 N ATOM 1275 CA SER A 75 -21.397 -1.005 4.564 1.00 0.33 C ATOM 1276 C SER A 75 -19.926 -0.955 4.968 1.00 0.31 C ATOM 1277 O SER A 75 -19.168 -1.868 4.645 1.00 0.35 O ATOM 1278 CB SER A 75 -22.152 -2.038 5.411 1.00 0.37 C ATOM 1279 OG SER A 75 -22.211 -1.661 6.779 1.00 0.99 O ATOM 0 H SER A 75 -21.351 -2.352 2.964 1.00 0.33 H new ATOM 0 HA SER A 75 -21.860 -0.033 4.732 1.00 0.33 H new ATOM 0 HB2 SER A 75 -23.164 -2.156 5.023 1.00 0.37 H new ATOM 0 HB3 SER A 75 -21.662 -3.008 5.323 1.00 0.37 H new ATOM 0 HG SER A 75 -22.238 -2.465 7.339 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.505 0.110 5.644 1.00 0.32 N ATOM 1286 CA PHE A 76 -18.110 0.237 6.045 1.00 0.31 C ATOM 1287 C PHE A 76 -17.971 0.841 7.445 1.00 0.32 C ATOM 1288 O PHE A 76 -18.941 1.331 8.025 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.365 1.105 5.024 1.00 0.32 C ATOM 1290 CG PHE A 76 -18.197 2.233 4.477 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.409 3.379 5.219 1.00 1.26 C ATOM 1292 CD2 PHE A 76 -18.769 2.141 3.222 1.00 1.24 C ATOM 1293 CE1 PHE A 76 -19.177 4.413 4.722 1.00 1.29 C ATOM 1294 CE2 PHE A 76 -19.537 3.171 2.719 1.00 1.28 C ATOM 1295 CZ PHE A 76 -19.741 4.307 3.470 1.00 0.53 C ATOM 0 H PHE A 76 -20.103 0.888 5.922 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.675 -0.762 6.076 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.471 1.517 5.492 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -17.031 0.476 4.199 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -17.968 3.467 6.201 1.00 1.26 H new ATOM 0 HD2 PHE A 76 -18.613 1.252 2.628 1.00 1.24 H new ATOM 0 HE1 PHE A 76 -19.335 5.303 5.313 1.00 1.29 H new ATOM 0 HE2 PHE A 76 -19.978 3.086 1.737 1.00 1.28 H new ATOM 0 HZ PHE A 76 -20.342 5.114 3.078 1.00 0.53 H new ATOM 1305 N SER A 77 -16.759 0.779 7.982 1.00 0.30 N ATOM 1306 CA SER A 77 -16.446 1.335 9.297 1.00 0.32 C ATOM 1307 C SER A 77 -15.090 2.040 9.218 1.00 0.30 C ATOM 1308 O SER A 77 -14.171 1.516 8.589 1.00 0.29 O ATOM 1309 CB SER A 77 -16.430 0.227 10.354 1.00 0.36 C ATOM 1310 OG SER A 77 -17.577 -0.602 10.236 1.00 1.18 O ATOM 0 H SER A 77 -15.962 0.341 7.519 1.00 0.30 H new ATOM 0 HA SER A 77 -17.210 2.055 9.589 1.00 0.32 H new ATOM 0 HB2 SER A 77 -15.528 -0.375 10.242 1.00 0.36 H new ATOM 0 HB3 SER A 77 -16.397 0.669 11.350 1.00 0.36 H new ATOM 0 HG SER A 77 -17.545 -1.303 10.920 1.00 1.18 H new ATOM 1316 N VAL A 78 -14.948 3.197 9.863 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.705 3.977 9.781 1.00 0.33 C ATOM 1318 C VAL A 78 -12.870 3.910 11.069 1.00 0.34 C ATOM 1319 O VAL A 78 -13.313 4.351 12.129 1.00 0.38 O ATOM 1320 CB VAL A 78 -14.011 5.462 9.462 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.726 6.271 9.327 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -14.852 5.577 8.196 1.00 0.40 C ATOM 0 H VAL A 78 -15.672 3.617 10.446 1.00 0.32 H new ATOM 0 HA VAL A 78 -13.121 3.528 8.977 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.582 5.873 10.295 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -12.971 7.309 9.103 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -12.166 6.224 10.261 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -12.120 5.859 8.520 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -15.056 6.628 7.989 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -14.309 5.141 7.358 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -15.793 5.045 8.335 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.675 3.338 10.971 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.747 3.243 12.090 1.00 0.34 C ATOM 1334 C LYS A 79 -9.410 3.876 11.691 1.00 0.34 C ATOM 1335 O LYS A 79 -9.106 4.006 10.504 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.535 1.782 12.513 1.00 0.35 C ATOM 1337 CG LYS A 79 -11.246 1.406 13.810 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.754 1.382 13.648 1.00 0.69 C ATOM 1339 CE LYS A 79 -13.435 2.245 14.696 1.00 0.89 C ATOM 1340 NZ LYS A 79 -13.130 1.792 16.080 1.00 1.48 N ATOM 0 H LYS A 79 -11.322 2.925 10.108 1.00 0.32 H new ATOM 0 HA LYS A 79 -11.169 3.777 12.941 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -10.886 1.128 11.715 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -9.467 1.599 12.629 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -10.902 0.426 14.141 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -10.977 2.118 14.590 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -13.021 1.737 12.652 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -13.114 0.356 13.728 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -13.116 3.280 14.575 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -14.513 2.223 14.538 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -13.868 2.135 16.728 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -13.102 0.753 16.107 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -12.207 2.171 16.374 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.612 4.256 12.670 1.00 0.38 N ATOM 1355 CA VAL A 80 -7.321 4.866 12.402 1.00 0.40 C ATOM 1356 C VAL A 80 -6.189 3.925 12.827 1.00 0.41 C ATOM 1357 O VAL A 80 -6.390 3.048 13.669 1.00 0.43 O ATOM 1358 CB VAL A 80 -7.205 6.222 13.130 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -7.285 6.007 14.625 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -5.927 6.959 12.745 1.00 1.30 C ATOM 0 H VAL A 80 -8.834 4.153 13.660 1.00 0.38 H new ATOM 0 HA VAL A 80 -7.235 5.045 11.330 1.00 0.40 H new ATOM 0 HB VAL A 80 -8.038 6.853 12.820 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -7.203 6.967 15.135 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -8.239 5.543 14.875 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -6.471 5.356 14.943 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -5.880 7.909 13.277 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -5.062 6.351 13.011 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -5.923 7.144 11.671 1.00 1.30 H new ATOM 1370 N CYS A 81 -5.014 4.088 12.230 1.00 0.42 N ATOM 1371 CA CYS A 81 -3.875 3.249 12.556 1.00 0.46 C ATOM 1372 C CYS A 81 -2.581 4.067 12.568 1.00 0.49 C ATOM 1373 O CYS A 81 -2.278 4.797 11.624 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.772 2.092 11.559 1.00 0.47 C ATOM 1375 SG CYS A 81 -2.336 1.021 11.803 1.00 0.89 S ATOM 0 H CYS A 81 -4.829 4.795 11.518 1.00 0.42 H new ATOM 0 HA CYS A 81 -4.022 2.839 13.555 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.677 1.488 11.628 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.738 2.501 10.549 1.00 0.47 H new ATOM 0 HG CYS A 81 -2.344 0.075 10.911 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.819 3.955 13.645 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.573 4.686 13.742 1.00 0.76 C ATOM 1383 C GLY A 82 -0.747 6.182 13.585 1.00 0.76 C ATOM 1384 O GLY A 82 -1.652 6.786 14.169 1.00 0.88 O ATOM 0 H GLY A 82 -2.040 3.372 14.452 1.00 0.67 H new ATOM 0 HA2 GLY A 82 -0.112 4.479 14.708 1.00 0.76 H new ATOM 0 HA3 GLY A 82 0.114 4.324 12.977 1.00 0.76 H new ATOM 1388 N GLU A 83 0.130 6.777 12.800 1.00 0.76 N ATOM 1389 CA GLU A 83 0.088 8.207 12.554 1.00 0.82 C ATOM 1390 C GLU A 83 -0.593 8.533 11.221 1.00 0.69 C ATOM 1391 O GLU A 83 -1.485 9.375 11.166 1.00 0.89 O ATOM 1392 CB GLU A 83 1.503 8.784 12.575 1.00 1.01 C ATOM 1393 CG GLU A 83 2.301 8.408 13.817 1.00 1.35 C ATOM 1394 CD GLU A 83 3.431 9.377 14.090 1.00 1.90 C ATOM 1395 OE1 GLU A 83 4.533 9.187 13.535 1.00 2.50 O ATOM 1396 OE2 GLU A 83 3.219 10.337 14.862 1.00 2.46 O ATOM 0 H GLU A 83 0.885 6.289 12.318 1.00 0.76 H new ATOM 0 HA GLU A 83 -0.502 8.664 13.349 1.00 0.82 H new ATOM 0 HB2 GLU A 83 2.040 8.439 11.691 1.00 1.01 H new ATOM 0 HB3 GLU A 83 1.444 9.870 12.508 1.00 1.01 H new ATOM 0 HG2 GLU A 83 1.635 8.379 14.679 1.00 1.35 H new ATOM 0 HG3 GLU A 83 2.708 7.404 13.694 1.00 1.35 H new ATOM 1403 N ARG A 84 -0.170 7.866 10.144 1.00 0.58 N ATOM 1404 CA ARG A 84 -0.734 8.124 8.815 1.00 0.72 C ATOM 1405 C ARG A 84 -1.473 6.915 8.246 1.00 0.64 C ATOM 1406 O ARG A 84 -1.909 6.937 7.096 1.00 0.81 O ATOM 1407 CB ARG A 84 0.381 8.506 7.845 1.00 0.98 C ATOM 1408 CG ARG A 84 1.251 9.666 8.312 1.00 1.09 C ATOM 1409 CD ARG A 84 0.510 10.992 8.243 1.00 1.37 C ATOM 1410 NE ARG A 84 -0.181 11.300 9.492 1.00 1.46 N ATOM 1411 CZ ARG A 84 0.304 12.106 10.433 1.00 2.05 C ATOM 1412 NH1 ARG A 84 1.507 12.657 10.296 1.00 2.51 N ATOM 1413 NH2 ARG A 84 -0.413 12.353 11.521 1.00 2.36 N ATOM 0 H ARG A 84 0.555 7.149 10.164 1.00 0.58 H new ATOM 0 HA ARG A 84 -1.450 8.938 8.931 1.00 0.72 H new ATOM 0 HB2 ARG A 84 1.016 7.636 7.679 1.00 0.98 H new ATOM 0 HB3 ARG A 84 -0.063 8.765 6.884 1.00 0.98 H new ATOM 0 HG2 ARG A 84 1.578 9.485 9.336 1.00 1.09 H new ATOM 0 HG3 ARG A 84 2.148 9.719 7.695 1.00 1.09 H new ATOM 0 HD2 ARG A 84 1.216 11.790 8.013 1.00 1.37 H new ATOM 0 HD3 ARG A 84 -0.212 10.961 7.427 1.00 1.37 H new ATOM 0 HE ARG A 84 -1.092 10.871 9.653 1.00 1.46 H new ATOM 0 HH11 ARG A 84 2.065 12.463 9.465 1.00 2.51 H new ATOM 0 HH12 ARG A 84 1.871 13.274 11.022 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -1.332 11.926 11.634 1.00 2.36 H new ATOM 0 HH22 ARG A 84 -0.045 12.970 12.245 1.00 2.36 H new ATOM 1427 N LYS A 85 -1.598 5.860 9.031 1.00 0.46 N ATOM 1428 CA LYS A 85 -2.275 4.656 8.570 1.00 0.41 C ATOM 1429 C LYS A 85 -3.759 4.693 8.936 1.00 0.38 C ATOM 1430 O LYS A 85 -4.161 5.352 9.895 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.594 3.403 9.135 1.00 0.42 C ATOM 1432 CG LYS A 85 -0.104 3.329 8.820 1.00 0.55 C ATOM 1433 CD LYS A 85 0.606 2.275 9.668 1.00 0.88 C ATOM 1434 CE LYS A 85 0.159 0.866 9.304 1.00 1.17 C ATOM 1435 NZ LYS A 85 1.220 0.125 8.570 1.00 1.22 N ATOM 0 H LYS A 85 -1.243 5.810 9.986 1.00 0.46 H new ATOM 0 HA LYS A 85 -2.202 4.616 7.483 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.731 3.381 10.216 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -2.087 2.518 8.733 1.00 0.42 H new ATOM 0 HG2 LYS A 85 0.033 3.097 7.764 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.353 4.303 8.994 1.00 0.55 H new ATOM 0 HD2 LYS A 85 1.684 2.362 9.530 1.00 0.88 H new ATOM 0 HD3 LYS A 85 0.404 2.460 10.723 1.00 0.88 H new ATOM 0 HE2 LYS A 85 -0.104 0.322 10.211 1.00 1.17 H new ATOM 0 HE3 LYS A 85 -0.741 0.917 8.691 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 0.782 -0.498 7.862 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 1.850 0.802 8.094 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 1.771 -0.448 9.241 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.575 4.038 8.136 1.00 0.36 N ATOM 1450 CA CYS A 86 -6.001 4.001 8.384 1.00 0.34 C ATOM 1451 C CYS A 86 -6.505 2.574 8.233 1.00 0.32 C ATOM 1452 O CYS A 86 -5.957 1.793 7.457 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.736 4.950 7.436 1.00 0.38 C ATOM 1454 SG CYS A 86 -8.480 5.212 7.838 1.00 1.14 S ATOM 0 H CYS A 86 -4.275 3.524 7.308 1.00 0.36 H new ATOM 0 HA CYS A 86 -6.199 4.335 9.402 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -6.227 5.914 7.440 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -6.665 4.557 6.422 1.00 0.38 H new ATOM 0 HG CYS A 86 -8.682 4.936 9.092 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.542 2.232 8.976 1.00 0.32 N ATOM 1461 CA VAL A 87 -8.104 0.895 8.916 1.00 0.34 C ATOM 1462 C VAL A 87 -9.603 0.986 8.702 1.00 0.32 C ATOM 1463 O VAL A 87 -10.298 1.683 9.429 1.00 0.36 O ATOM 1464 CB VAL A 87 -7.816 0.084 10.201 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.648 -1.193 10.241 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -6.336 -0.250 10.304 1.00 0.95 C ATOM 0 H VAL A 87 -8.012 2.861 9.627 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.631 0.375 8.083 1.00 0.34 H new ATOM 0 HB VAL A 87 -8.096 0.701 11.055 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -8.426 -1.744 11.155 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.707 -0.938 10.220 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -8.407 -1.812 9.377 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -6.154 -0.821 11.215 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -6.035 -0.841 9.439 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -5.756 0.672 10.332 1.00 0.95 H new ATOM 1476 N LEU A 88 -10.100 0.304 7.702 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.521 0.325 7.430 1.00 0.31 C ATOM 1478 C LEU A 88 -12.068 -1.083 7.368 1.00 0.30 C ATOM 1479 O LEU A 88 -11.334 -2.041 7.148 1.00 0.33 O ATOM 1480 CB LEU A 88 -11.832 1.087 6.137 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.564 2.416 6.342 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -11.605 3.500 6.806 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -13.274 2.847 5.073 1.00 0.48 C ATOM 0 H LEU A 88 -9.549 -0.270 7.064 1.00 0.30 H new ATOM 0 HA LEU A 88 -12.011 0.852 8.248 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -10.897 1.279 5.610 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -12.437 0.450 5.491 1.00 0.33 H new ATOM 0 HG LEU A 88 -13.313 2.265 7.119 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -12.150 4.434 6.944 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -11.149 3.203 7.751 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -10.826 3.642 6.057 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -13.786 3.794 5.246 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -12.545 2.970 4.272 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -14.002 2.088 4.788 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.351 -1.215 7.612 1.00 0.30 N ATOM 1496 CA PHE A 89 -13.993 -2.504 7.565 1.00 0.31 C ATOM 1497 C PHE A 89 -15.093 -2.445 6.533 1.00 0.30 C ATOM 1498 O PHE A 89 -15.733 -1.411 6.373 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.552 -2.865 8.937 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.488 -3.070 9.977 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -12.810 -4.277 10.069 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -13.156 -2.052 10.857 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -11.826 -4.464 11.018 1.00 2.42 C ATOM 1504 CE2 PHE A 89 -12.172 -2.235 11.810 1.00 2.40 C ATOM 1505 CZ PHE A 89 -11.505 -3.442 11.891 1.00 2.50 C ATOM 0 H PHE A 89 -13.972 -0.440 7.846 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.274 -3.275 7.290 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -15.225 -2.074 9.267 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -15.147 -3.774 8.852 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -13.055 -5.080 9.390 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -13.672 -1.105 10.797 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -11.307 -5.409 11.079 1.00 2.42 H new ATOM 0 HE2 PHE A 89 -11.925 -1.434 12.491 1.00 2.40 H new ATOM 0 HZ PHE A 89 -10.735 -3.586 12.634 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.311 -3.533 5.831 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.338 -3.560 4.803 1.00 0.31 C ATOM 1517 C ILE A 90 -17.262 -4.741 5.019 1.00 0.31 C ATOM 1518 O ILE A 90 -16.812 -5.835 5.350 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.733 -3.631 3.390 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.504 -4.545 3.385 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.369 -2.232 2.903 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -14.002 -4.902 2.002 1.00 0.48 C ATOM 0 H ILE A 90 -14.798 -4.407 5.948 1.00 0.30 H new ATOM 0 HA ILE A 90 -16.902 -2.631 4.882 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.474 -4.050 2.709 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.700 -4.057 3.936 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.746 -5.463 3.920 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -14.942 -2.295 1.902 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.265 -1.611 2.877 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.640 -1.789 3.581 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -13.131 -5.551 2.088 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -14.788 -5.420 1.452 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.726 -3.992 1.469 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.550 -4.516 4.856 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.525 -5.561 5.057 1.00 0.34 C ATOM 1536 C GLU A 91 -20.625 -5.505 3.998 1.00 0.38 C ATOM 1537 O GLU A 91 -21.111 -4.421 3.634 1.00 0.41 O ATOM 1538 CB GLU A 91 -20.109 -5.426 6.468 1.00 0.39 C ATOM 1539 CG GLU A 91 -21.597 -5.689 6.554 1.00 1.34 C ATOM 1540 CD GLU A 91 -22.187 -5.252 7.876 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -22.226 -4.031 8.139 1.00 1.74 O ATOM 1542 OE2 GLU A 91 -22.613 -6.130 8.661 1.00 1.72 O ATOM 0 H GLU A 91 -18.944 -3.615 4.584 1.00 0.31 H new ATOM 0 HA GLU A 91 -19.039 -6.531 4.956 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -19.591 -6.119 7.131 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -19.908 -4.420 6.837 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -22.103 -5.165 5.743 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -21.783 -6.753 6.411 1.00 1.34 H new ATOM 1549 N TRP A 92 -20.970 -6.683 3.481 1.00 0.41 N ATOM 1550 CA TRP A 92 -22.029 -6.819 2.474 1.00 0.51 C ATOM 1551 C TRP A 92 -22.410 -8.284 2.316 1.00 0.52 C ATOM 1552 O TRP A 92 -21.573 -9.164 2.517 1.00 0.50 O ATOM 1553 CB TRP A 92 -21.650 -6.191 1.124 1.00 0.66 C ATOM 1554 CG TRP A 92 -20.684 -6.987 0.303 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -20.977 -7.996 -0.568 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -19.272 -6.813 0.254 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -19.830 -8.468 -1.144 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -18.768 -7.756 -0.659 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -18.382 -5.951 0.895 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -17.417 -7.858 -0.947 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -17.039 -6.053 0.609 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -16.567 -7.000 -0.305 1.00 1.76 C ATOM 0 H TRP A 92 -20.530 -7.565 3.743 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.895 -6.262 2.832 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -22.560 -6.041 0.543 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -21.222 -5.205 1.307 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -21.970 -8.368 -0.773 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -19.776 -9.227 -1.824 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -18.740 -5.217 1.602 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -17.048 -8.588 -1.652 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -16.339 -5.391 1.098 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -15.508 -7.055 -0.509 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.680 -8.543 2.001 1.00 0.61 N ATOM 1574 CA GLU A 93 -24.182 -9.906 1.851 1.00 0.67 C ATOM 1575 C GLU A 93 -24.048 -10.641 3.170 1.00 0.61 C ATOM 1576 O GLU A 93 -23.735 -11.834 3.217 1.00 0.64 O ATOM 1577 CB GLU A 93 -23.439 -10.660 0.750 1.00 0.74 C ATOM 1578 CG GLU A 93 -23.931 -10.343 -0.643 1.00 0.88 C ATOM 1579 CD GLU A 93 -23.498 -11.392 -1.650 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -24.016 -12.528 -1.587 1.00 1.63 O ATOM 1581 OE2 GLU A 93 -22.618 -11.102 -2.492 1.00 1.58 O ATOM 0 H GLU A 93 -24.382 -7.820 1.844 1.00 0.61 H new ATOM 0 HA GLU A 93 -25.232 -9.854 1.563 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -22.377 -10.423 0.813 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -23.538 -11.731 0.925 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -25.019 -10.274 -0.636 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -23.551 -9.368 -0.949 1.00 0.88 H new ATOM 1588 N LYS A 94 -24.280 -9.889 4.242 1.00 0.59 N ATOM 1589 CA LYS A 94 -24.180 -10.399 5.603 1.00 0.61 C ATOM 1590 C LYS A 94 -22.770 -10.913 5.884 1.00 0.55 C ATOM 1591 O LYS A 94 -22.549 -11.707 6.797 1.00 0.63 O ATOM 1592 CB LYS A 94 -25.222 -11.491 5.858 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.659 -11.050 5.609 1.00 0.85 C ATOM 1594 CD LYS A 94 -26.979 -9.709 6.268 1.00 0.93 C ATOM 1595 CE LYS A 94 -26.784 -9.751 7.775 1.00 1.23 C ATOM 1596 NZ LYS A 94 -27.025 -8.426 8.405 1.00 1.79 N ATOM 0 H LYS A 94 -24.544 -8.905 4.189 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.385 -9.577 6.289 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -25.000 -12.346 5.220 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -25.131 -11.831 6.890 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.832 -10.975 4.535 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -27.341 -11.811 5.989 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.341 -8.935 5.842 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -28.009 -9.432 6.044 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -27.462 -10.487 8.208 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -25.770 -10.080 8.000 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -26.881 -8.499 9.432 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -26.362 -7.729 8.011 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -28.001 -8.122 8.213 1.00 1.79 H new ATOM 1610 N LYS A 95 -21.819 -10.446 5.088 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.430 -10.829 5.242 1.00 0.46 C ATOM 1612 C LYS A 95 -19.610 -9.626 5.670 1.00 0.42 C ATOM 1613 O LYS A 95 -20.007 -8.488 5.442 1.00 0.42 O ATOM 1614 CB LYS A 95 -19.876 -11.410 3.943 1.00 0.52 C ATOM 1615 CG LYS A 95 -19.354 -12.822 4.103 1.00 0.63 C ATOM 1616 CD LYS A 95 -20.489 -13.832 4.096 1.00 0.77 C ATOM 1617 CE LYS A 95 -20.983 -14.099 2.679 1.00 0.94 C ATOM 1618 NZ LYS A 95 -22.439 -14.400 2.634 1.00 1.29 N ATOM 0 H LYS A 95 -21.991 -9.795 4.322 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.367 -11.599 6.010 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.659 -11.401 3.184 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -19.072 -10.770 3.579 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -18.657 -13.048 3.296 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -18.797 -12.903 5.037 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -20.152 -14.765 4.548 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -21.312 -13.462 4.707 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -20.775 -13.230 2.055 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -20.428 -14.936 2.255 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -22.694 -14.739 1.684 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -22.664 -15.134 3.335 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -22.979 -13.538 2.851 1.00 1.29 H new ATOM 1632 N THR A 96 -18.464 -9.887 6.263 1.00 0.43 N ATOM 1633 CA THR A 96 -17.592 -8.826 6.759 1.00 0.41 C ATOM 1634 C THR A 96 -16.129 -9.087 6.387 1.00 0.40 C ATOM 1635 O THR A 96 -15.668 -10.228 6.424 1.00 0.45 O ATOM 1636 CB THR A 96 -17.695 -8.690 8.296 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.340 -9.927 8.931 1.00 0.73 O ATOM 1638 CG2 THR A 96 -19.100 -8.295 8.732 1.00 0.55 C ATOM 0 H THR A 96 -18.107 -10.830 6.417 1.00 0.43 H new ATOM 0 HA THR A 96 -17.925 -7.901 6.289 1.00 0.41 H new ATOM 0 HB THR A 96 -17.003 -7.904 8.598 1.00 0.45 H new ATOM 0 HG1 THR A 96 -17.408 -9.827 9.904 1.00 0.73 H new ATOM 0 HG21 THR A 96 -19.133 -8.209 9.818 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.364 -7.337 8.284 1.00 0.55 H new ATOM 0 HG23 THR A 96 -19.809 -9.056 8.406 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.415 -8.027 6.010 1.00 0.38 N ATOM 1647 CA TYR A 97 -14.005 -8.126 5.639 1.00 0.40 C ATOM 1648 C TYR A 97 -13.222 -6.933 6.196 1.00 0.35 C ATOM 1649 O TYR A 97 -13.803 -5.879 6.495 1.00 0.33 O ATOM 1650 CB TYR A 97 -13.828 -8.172 4.113 1.00 0.47 C ATOM 1651 CG TYR A 97 -14.877 -8.968 3.355 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -16.149 -8.447 3.125 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.586 -10.233 2.851 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -17.096 -9.163 2.421 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -15.532 -10.951 2.141 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.784 -10.410 1.930 1.00 1.13 C ATOM 1657 OH TYR A 97 -17.726 -11.116 1.220 1.00 1.45 O ATOM 0 H TYR A 97 -15.795 -7.082 5.953 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.621 -9.053 6.065 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -13.829 -7.150 3.734 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -12.847 -8.593 3.891 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.398 -7.467 3.504 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.608 -10.660 3.017 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -18.078 -8.746 2.256 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -15.292 -11.930 1.754 1.00 1.54 H new ATOM 0 HH TYR A 97 -17.349 -11.977 0.942 1.00 1.45 H new ATOM 1667 N GLN A 98 -11.906 -7.096 6.307 1.00 0.37 N ATOM 1668 CA GLN A 98 -11.030 -6.049 6.836 1.00 0.34 C ATOM 1669 C GLN A 98 -10.253 -5.371 5.710 1.00 0.31 C ATOM 1670 O GLN A 98 -9.628 -6.040 4.879 1.00 0.31 O ATOM 1671 CB GLN A 98 -10.051 -6.629 7.863 1.00 0.40 C ATOM 1672 CG GLN A 98 -10.707 -7.541 8.885 1.00 0.80 C ATOM 1673 CD GLN A 98 -9.823 -7.807 10.088 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -8.596 -7.788 9.995 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -10.444 -8.065 11.228 1.00 1.84 N ATOM 0 H GLN A 98 -11.418 -7.950 6.036 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.658 -5.306 7.327 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.275 -7.186 7.338 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.558 -5.809 8.385 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -11.642 -7.091 9.219 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -10.961 -8.489 8.410 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -11.463 -8.071 11.263 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -9.903 -8.258 12.071 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.287 -4.047 5.703 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.613 -3.259 4.683 1.00 0.28 C ATOM 1686 C LEU A 99 -8.526 -2.367 5.285 1.00 0.26 C ATOM 1687 O LEU A 99 -8.800 -1.499 6.112 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.646 -2.390 3.963 1.00 0.31 C ATOM 1689 CG LEU A 99 -10.368 -2.106 2.486 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -9.355 -0.978 2.336 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -9.883 -3.367 1.789 1.00 0.48 C ATOM 0 H LEU A 99 -10.780 -3.491 6.401 1.00 0.29 H new ATOM 0 HA LEU A 99 -9.133 -3.943 3.983 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -11.619 -2.875 4.043 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -10.720 -1.438 4.488 1.00 0.31 H new ATOM 0 HG LEU A 99 -11.297 -1.788 2.013 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -9.172 -0.792 1.278 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.747 -0.073 2.801 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -8.421 -1.261 2.822 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -9.689 -3.150 0.739 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -8.965 -3.715 2.263 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -10.647 -4.141 1.865 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.297 -2.596 4.874 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.165 -1.801 5.335 1.00 0.26 C ATOM 1705 C ASP A 100 -5.850 -0.745 4.286 1.00 0.25 C ATOM 1706 O ASP A 100 -5.682 -1.075 3.114 1.00 0.26 O ATOM 1707 CB ASP A 100 -4.951 -2.707 5.497 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.302 -2.696 6.871 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -4.114 -1.613 7.445 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -3.929 -3.815 7.353 1.00 0.43 O ATOM 0 H ASP A 100 -7.049 -3.333 4.214 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.406 -1.329 6.287 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -5.249 -3.729 5.264 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -4.203 -2.417 4.759 1.00 0.32 H new ATOM 1715 N LEU A 101 -5.774 0.513 4.675 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.475 1.560 3.706 1.00 0.25 C ATOM 1717 C LEU A 101 -4.466 2.559 4.258 1.00 0.25 C ATOM 1718 O LEU A 101 -4.522 2.953 5.423 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.756 2.272 3.264 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.439 3.122 4.331 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -7.327 4.600 3.986 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.894 2.714 4.478 1.00 0.51 C ATOM 0 H LEU A 101 -5.911 0.835 5.633 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.027 1.084 2.834 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.520 2.910 2.412 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.465 1.522 2.914 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.937 2.955 5.284 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -7.819 5.192 4.757 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -6.276 4.882 3.928 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -7.806 4.787 3.025 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -9.369 3.329 5.243 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.409 2.855 3.528 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -8.950 1.665 4.769 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.531 2.955 3.415 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.501 3.896 3.807 1.00 0.25 C ATOM 1736 C PHE A 102 -2.400 5.021 2.789 1.00 0.24 C ATOM 1737 O PHE A 102 -2.534 4.786 1.593 1.00 0.24 O ATOM 1738 CB PHE A 102 -1.155 3.173 3.904 1.00 0.28 C ATOM 1739 CG PHE A 102 -1.267 1.732 4.321 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.300 1.382 5.660 1.00 1.29 C ATOM 1741 CD2 PHE A 102 -1.342 0.725 3.367 1.00 1.27 C ATOM 1742 CE1 PHE A 102 -1.408 0.059 6.040 1.00 1.40 C ATOM 1743 CE2 PHE A 102 -1.451 -0.597 3.744 1.00 1.36 C ATOM 1744 CZ PHE A 102 -1.484 -0.928 5.083 1.00 0.81 C ATOM 0 H PHE A 102 -3.464 2.637 2.448 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.761 4.319 4.778 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.656 3.223 2.936 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.521 3.700 4.618 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -1.241 2.152 6.415 1.00 1.29 H new ATOM 0 HD2 PHE A 102 -1.315 0.980 2.318 1.00 1.27 H new ATOM 0 HE1 PHE A 102 -1.433 -0.202 7.088 1.00 1.40 H new ATOM 0 HE2 PHE A 102 -1.510 -1.371 2.993 1.00 1.36 H new ATOM 0 HZ PHE A 102 -1.570 -1.963 5.381 1.00 0.81 H new ATOM 1754 N THR A 103 -2.172 6.235 3.259 1.00 0.25 N ATOM 1755 CA THR A 103 -2.040 7.377 2.367 1.00 0.25 C ATOM 1756 C THR A 103 -0.565 7.611 2.045 1.00 0.25 C ATOM 1757 O THR A 103 0.242 7.809 2.953 1.00 0.28 O ATOM 1758 CB THR A 103 -2.652 8.640 3.004 1.00 0.29 C ATOM 1759 OG1 THR A 103 -2.648 8.515 4.436 1.00 0.37 O ATOM 1760 CG2 THR A 103 -4.073 8.860 2.504 1.00 0.38 C ATOM 0 H THR A 103 -2.074 6.457 4.250 1.00 0.25 H new ATOM 0 HA THR A 103 -2.580 7.165 1.444 1.00 0.25 H new ATOM 0 HB THR A 103 -2.049 9.501 2.716 1.00 0.29 H new ATOM 0 HG1 THR A 103 -3.036 9.321 4.836 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.487 9.757 2.966 1.00 0.38 H new ATOM 0 HG22 THR A 103 -4.063 8.982 1.421 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.688 8.000 2.767 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.218 7.605 0.761 1.00 0.26 N ATOM 1769 CA ALA A 104 1.169 7.771 0.342 1.00 0.28 C ATOM 1770 C ALA A 104 1.293 8.779 -0.799 1.00 0.26 C ATOM 1771 O ALA A 104 0.297 9.128 -1.436 1.00 0.25 O ATOM 1772 CB ALA A 104 1.721 6.423 -0.087 1.00 0.34 C ATOM 0 H ALA A 104 -0.879 7.487 -0.007 1.00 0.26 H new ATOM 0 HA ALA A 104 1.743 8.158 1.184 1.00 0.28 H new ATOM 0 HB1 ALA A 104 2.758 6.538 -0.402 1.00 0.34 H new ATOM 0 HB2 ALA A 104 1.671 5.726 0.750 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.131 6.036 -0.917 1.00 0.34 H new ATOM 1778 N LEU A 105 2.516 9.238 -1.068 1.00 0.27 N ATOM 1779 CA LEU A 105 2.750 10.205 -2.122 1.00 0.27 C ATOM 1780 C LEU A 105 3.189 9.507 -3.391 1.00 0.26 C ATOM 1781 O LEU A 105 3.754 8.413 -3.341 1.00 0.27 O ATOM 1782 CB LEU A 105 3.815 11.211 -1.691 1.00 0.32 C ATOM 1783 CG LEU A 105 3.532 11.930 -0.376 1.00 0.39 C ATOM 1784 CD1 LEU A 105 4.640 12.923 -0.070 1.00 0.57 C ATOM 1785 CD2 LEU A 105 2.183 12.627 -0.441 1.00 0.49 C ATOM 0 H LEU A 105 3.356 8.950 -0.565 1.00 0.27 H new ATOM 0 HA LEU A 105 1.817 10.735 -2.315 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.769 10.692 -1.605 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.928 11.957 -2.478 1.00 0.32 H new ATOM 0 HG LEU A 105 3.501 11.196 0.429 1.00 0.39 H new ATOM 0 HD11 LEU A 105 4.425 13.429 0.871 1.00 0.57 H new ATOM 0 HD12 LEU A 105 5.590 12.395 0.011 1.00 0.57 H new ATOM 0 HD13 LEU A 105 4.701 13.659 -0.872 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.991 13.137 0.503 1.00 0.49 H new ATOM 0 HD22 LEU A 105 2.188 13.355 -1.252 1.00 0.49 H new ATOM 0 HD23 LEU A 105 1.401 11.890 -0.620 1.00 0.49 H new ATOM 1797 N ALA A 106 2.940 10.149 -4.520 1.00 0.27 N ATOM 1798 CA ALA A 106 3.300 9.593 -5.821 1.00 0.30 C ATOM 1799 C ALA A 106 4.788 9.268 -5.899 1.00 0.31 C ATOM 1800 O ALA A 106 5.199 8.360 -6.622 1.00 0.36 O ATOM 1801 CB ALA A 106 2.910 10.553 -6.937 1.00 0.34 C ATOM 0 H ALA A 106 2.487 11.062 -4.565 1.00 0.27 H new ATOM 0 HA ALA A 106 2.748 8.661 -5.946 1.00 0.30 H new ATOM 0 HB1 ALA A 106 3.186 10.123 -7.900 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.834 10.724 -6.911 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.431 11.501 -6.801 1.00 0.34 H new ATOM 1807 N GLU A 107 5.583 10.003 -5.141 1.00 0.31 N ATOM 1808 CA GLU A 107 7.024 9.795 -5.125 1.00 0.35 C ATOM 1809 C GLU A 107 7.422 8.630 -4.220 1.00 0.36 C ATOM 1810 O GLU A 107 8.437 7.978 -4.458 1.00 0.43 O ATOM 1811 CB GLU A 107 7.763 11.066 -4.692 1.00 0.40 C ATOM 1812 CG GLU A 107 7.027 11.893 -3.649 1.00 0.44 C ATOM 1813 CD GLU A 107 6.106 12.916 -4.278 1.00 0.67 C ATOM 1814 OE1 GLU A 107 6.606 13.972 -4.727 1.00 1.35 O ATOM 1815 OE2 GLU A 107 4.886 12.656 -4.348 1.00 1.38 O ATOM 0 H GLU A 107 5.257 10.750 -4.528 1.00 0.31 H new ATOM 0 HA GLU A 107 7.316 9.547 -6.146 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.739 10.787 -4.295 1.00 0.40 H new ATOM 0 HB3 GLU A 107 7.941 11.686 -5.571 1.00 0.40 H new ATOM 0 HG2 GLU A 107 6.447 11.231 -3.006 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.752 12.401 -3.013 1.00 0.44 H new ATOM 1822 N GLU A 108 6.618 8.341 -3.201 1.00 0.33 N ATOM 1823 CA GLU A 108 6.947 7.255 -2.286 1.00 0.36 C ATOM 1824 C GLU A 108 6.372 5.931 -2.792 1.00 0.39 C ATOM 1825 O GLU A 108 6.614 4.869 -2.219 1.00 0.59 O ATOM 1826 CB GLU A 108 6.485 7.584 -0.863 1.00 0.39 C ATOM 1827 CG GLU A 108 5.103 7.100 -0.495 1.00 0.75 C ATOM 1828 CD GLU A 108 4.662 7.650 0.845 1.00 1.62 C ATOM 1829 OE1 GLU A 108 4.267 8.834 0.893 1.00 2.31 O ATOM 1830 OE2 GLU A 108 4.703 6.909 1.847 1.00 2.35 O ATOM 0 H GLU A 108 5.750 8.834 -2.991 1.00 0.33 H new ATOM 0 HA GLU A 108 8.031 7.142 -2.251 1.00 0.36 H new ATOM 0 HB2 GLU A 108 7.199 7.155 -0.160 1.00 0.39 H new ATOM 0 HB3 GLU A 108 6.518 8.665 -0.731 1.00 0.39 H new ATOM 0 HG2 GLU A 108 4.393 7.402 -1.265 1.00 0.75 H new ATOM 0 HG3 GLU A 108 5.094 6.010 -0.463 1.00 0.75 H new ATOM 1837 N LYS A 109 5.613 6.026 -3.883 1.00 0.37 N ATOM 1838 CA LYS A 109 4.971 4.879 -4.528 1.00 0.38 C ATOM 1839 C LYS A 109 5.880 3.642 -4.648 1.00 0.34 C ATOM 1840 O LYS A 109 5.555 2.599 -4.085 1.00 0.35 O ATOM 1841 CB LYS A 109 4.458 5.283 -5.916 1.00 0.44 C ATOM 1842 CG LYS A 109 3.522 4.264 -6.538 1.00 0.74 C ATOM 1843 CD LYS A 109 3.205 4.603 -7.984 1.00 1.00 C ATOM 1844 CE LYS A 109 4.408 4.377 -8.891 1.00 1.73 C ATOM 1845 NZ LYS A 109 4.174 4.901 -10.262 1.00 2.18 N ATOM 0 H LYS A 109 5.424 6.913 -4.350 1.00 0.37 H new ATOM 0 HA LYS A 109 4.143 4.589 -3.881 1.00 0.38 H new ATOM 0 HB2 LYS A 109 3.941 6.239 -5.839 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.310 5.434 -6.579 1.00 0.44 H new ATOM 0 HG2 LYS A 109 3.976 3.274 -6.487 1.00 0.74 H new ATOM 0 HG3 LYS A 109 2.597 4.221 -5.963 1.00 0.74 H new ATOM 0 HD2 LYS A 109 2.370 3.991 -8.327 1.00 1.00 H new ATOM 0 HD3 LYS A 109 2.887 5.643 -8.053 1.00 1.00 H new ATOM 0 HE2 LYS A 109 5.284 4.863 -8.461 1.00 1.73 H new ATOM 0 HE3 LYS A 109 4.629 3.311 -8.942 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 5.080 4.963 -10.769 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 3.534 4.261 -10.774 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 3.745 5.846 -10.204 1.00 2.18 H new ATOM 1859 N PRO A 110 7.025 3.723 -5.369 1.00 0.34 N ATOM 1860 CA PRO A 110 7.917 2.568 -5.545 1.00 0.35 C ATOM 1861 C PRO A 110 8.375 1.977 -4.219 1.00 0.30 C ATOM 1862 O PRO A 110 8.400 0.760 -4.044 1.00 0.31 O ATOM 1863 CB PRO A 110 9.116 3.144 -6.309 1.00 0.42 C ATOM 1864 CG PRO A 110 9.020 4.621 -6.158 1.00 0.41 C ATOM 1865 CD PRO A 110 7.560 4.922 -6.049 1.00 0.37 C ATOM 0 HA PRO A 110 7.415 1.752 -6.065 1.00 0.35 H new ATOM 0 HB2 PRO A 110 10.055 2.769 -5.902 1.00 0.42 H new ATOM 0 HB3 PRO A 110 9.086 2.855 -7.360 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.557 4.960 -5.272 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.462 5.132 -7.013 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.376 5.829 -5.473 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.104 5.069 -7.028 1.00 0.37 H new ATOM 1873 N TYR A 111 8.709 2.855 -3.290 1.00 0.29 N ATOM 1874 CA TYR A 111 9.188 2.458 -1.971 1.00 0.27 C ATOM 1875 C TYR A 111 8.108 1.718 -1.199 1.00 0.26 C ATOM 1876 O TYR A 111 8.334 0.614 -0.696 1.00 0.26 O ATOM 1877 CB TYR A 111 9.631 3.694 -1.178 1.00 0.31 C ATOM 1878 CG TYR A 111 10.867 4.378 -1.722 1.00 0.27 C ATOM 1879 CD1 TYR A 111 11.086 4.486 -3.085 1.00 1.20 C ATOM 1880 CD2 TYR A 111 11.815 4.912 -0.867 1.00 1.24 C ATOM 1881 CE1 TYR A 111 12.214 5.102 -3.582 1.00 1.21 C ATOM 1882 CE2 TYR A 111 12.949 5.532 -1.356 1.00 1.27 C ATOM 1883 CZ TYR A 111 13.144 5.622 -2.713 1.00 0.41 C ATOM 1884 OH TYR A 111 14.273 6.235 -3.205 1.00 0.53 O ATOM 0 H TYR A 111 8.657 3.865 -3.425 1.00 0.29 H new ATOM 0 HA TYR A 111 10.037 1.789 -2.107 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.811 4.412 -1.161 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.819 3.400 -0.145 1.00 0.31 H new ATOM 0 HD1 TYR A 111 10.359 4.080 -3.772 1.00 1.20 H new ATOM 0 HD2 TYR A 111 11.666 4.843 0.200 1.00 1.24 H new ATOM 0 HE1 TYR A 111 12.367 5.176 -4.649 1.00 1.21 H new ATOM 0 HE2 TYR A 111 13.679 5.944 -0.675 1.00 1.27 H new ATOM 0 HH TYR A 111 14.566 6.931 -2.580 1.00 0.53 H new ATOM 1894 N ALA A 112 6.941 2.335 -1.114 1.00 0.26 N ATOM 1895 CA ALA A 112 5.813 1.753 -0.405 1.00 0.27 C ATOM 1896 C ALA A 112 5.448 0.398 -0.990 1.00 0.26 C ATOM 1897 O ALA A 112 5.211 -0.567 -0.258 1.00 0.26 O ATOM 1898 CB ALA A 112 4.617 2.695 -0.445 1.00 0.30 C ATOM 0 H ALA A 112 6.749 3.246 -1.531 1.00 0.26 H new ATOM 0 HA ALA A 112 6.102 1.605 0.636 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.781 2.245 0.090 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.883 3.641 0.027 1.00 0.30 H new ATOM 0 HB3 ALA A 112 4.330 2.875 -1.481 1.00 0.30 H new ATOM 1904 N ILE A 113 5.420 0.325 -2.314 1.00 0.27 N ATOM 1905 CA ILE A 113 5.099 -0.912 -2.997 1.00 0.29 C ATOM 1906 C ILE A 113 6.131 -1.981 -2.677 1.00 0.29 C ATOM 1907 O ILE A 113 5.767 -3.087 -2.299 1.00 0.31 O ATOM 1908 CB ILE A 113 5.013 -0.719 -4.528 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.804 0.147 -4.899 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.923 -2.065 -5.232 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.476 -0.465 -4.512 1.00 0.39 C ATOM 0 H ILE A 113 5.617 1.111 -2.933 1.00 0.27 H new ATOM 0 HA ILE A 113 4.120 -1.231 -2.639 1.00 0.29 H new ATOM 0 HB ILE A 113 5.920 -0.210 -4.855 1.00 0.33 H new ATOM 0 HG12 ILE A 113 3.901 1.118 -4.414 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.812 0.325 -5.974 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.863 -1.909 -6.309 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.808 -2.657 -5.000 1.00 0.37 H new ATOM 0 HG23 ILE A 113 4.033 -2.595 -4.892 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.667 0.204 -4.806 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.356 -1.423 -5.018 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.446 -0.618 -3.433 1.00 0.39 H new ATOM 1923 N PHE A 114 7.414 -1.630 -2.769 1.00 0.28 N ATOM 1924 CA PHE A 114 8.494 -2.580 -2.510 1.00 0.31 C ATOM 1925 C PHE A 114 8.326 -3.224 -1.148 1.00 0.31 C ATOM 1926 O PHE A 114 8.468 -4.441 -1.001 1.00 0.33 O ATOM 1927 CB PHE A 114 9.838 -1.863 -2.582 1.00 0.34 C ATOM 1928 CG PHE A 114 11.013 -2.660 -2.076 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.568 -3.671 -2.840 1.00 1.27 C ATOM 1930 CD2 PHE A 114 11.571 -2.382 -0.839 1.00 1.24 C ATOM 1931 CE1 PHE A 114 12.656 -4.393 -2.380 1.00 1.33 C ATOM 1932 CE2 PHE A 114 12.660 -3.096 -0.374 1.00 1.26 C ATOM 1933 CZ PHE A 114 13.202 -4.104 -1.147 1.00 0.55 C ATOM 0 H PHE A 114 7.730 -0.694 -3.021 1.00 0.28 H new ATOM 0 HA PHE A 114 8.459 -3.362 -3.268 1.00 0.31 H new ATOM 0 HB2 PHE A 114 10.028 -1.582 -3.618 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.771 -0.939 -2.008 1.00 0.34 H new ATOM 0 HD1 PHE A 114 11.147 -3.900 -3.808 1.00 1.27 H new ATOM 0 HD2 PHE A 114 11.150 -1.597 -0.229 1.00 1.24 H new ATOM 0 HE1 PHE A 114 13.077 -5.182 -2.986 1.00 1.33 H new ATOM 0 HE2 PHE A 114 13.086 -2.866 0.592 1.00 1.26 H new ATOM 0 HZ PHE A 114 14.052 -4.665 -0.787 1.00 0.55 H new ATOM 1943 N HIS A 115 8.000 -2.396 -0.167 1.00 0.30 N ATOM 1944 CA HIS A 115 7.810 -2.859 1.186 1.00 0.33 C ATOM 1945 C HIS A 115 6.676 -3.891 1.255 1.00 0.32 C ATOM 1946 O HIS A 115 6.875 -5.015 1.715 1.00 0.34 O ATOM 1947 CB HIS A 115 7.539 -1.660 2.107 1.00 0.38 C ATOM 1948 CG HIS A 115 7.590 -2.006 3.559 1.00 0.42 C ATOM 1949 ND1 HIS A 115 8.501 -1.437 4.414 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.857 -2.898 4.236 1.00 0.47 C ATOM 1951 CE1 HIS A 115 8.299 -1.992 5.588 1.00 0.49 C ATOM 1952 NE2 HIS A 115 7.308 -2.888 5.538 1.00 0.51 N ATOM 0 H HIS A 115 7.862 -1.393 -0.292 1.00 0.30 H new ATOM 0 HA HIS A 115 8.718 -3.356 1.526 1.00 0.33 H new ATOM 0 HB2 HIS A 115 8.272 -0.880 1.901 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.558 -1.246 1.874 1.00 0.38 H new ATOM 0 HD1 HIS A 115 9.195 -0.726 4.184 1.00 0.45 H new ATOM 0 HD2 HIS A 115 6.062 -3.510 3.837 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.861 -1.755 6.479 1.00 0.49 H new ATOM 1960 N PHE A 116 5.495 -3.500 0.794 1.00 0.32 N ATOM 1961 CA PHE A 116 4.323 -4.387 0.816 1.00 0.33 C ATOM 1962 C PHE A 116 4.317 -5.461 -0.282 1.00 0.33 C ATOM 1963 O PHE A 116 3.360 -6.227 -0.365 1.00 0.36 O ATOM 1964 CB PHE A 116 3.028 -3.594 0.713 1.00 0.35 C ATOM 1965 CG PHE A 116 2.727 -2.765 1.924 1.00 0.37 C ATOM 1966 CD1 PHE A 116 3.411 -1.585 2.163 1.00 1.29 C ATOM 1967 CD2 PHE A 116 1.762 -3.171 2.828 1.00 1.21 C ATOM 1968 CE1 PHE A 116 3.136 -0.826 3.282 1.00 1.31 C ATOM 1969 CE2 PHE A 116 1.484 -2.415 3.947 1.00 1.25 C ATOM 1970 CZ PHE A 116 2.171 -1.242 4.174 1.00 0.50 C ATOM 0 H PHE A 116 5.316 -2.577 0.399 1.00 0.32 H new ATOM 0 HA PHE A 116 4.392 -4.899 1.776 1.00 0.33 H new ATOM 0 HB2 PHE A 116 3.081 -2.941 -0.158 1.00 0.35 H new ATOM 0 HB3 PHE A 116 2.202 -4.285 0.543 1.00 0.35 H new ATOM 0 HD1 PHE A 116 4.168 -1.255 1.466 1.00 1.29 H new ATOM 0 HD2 PHE A 116 1.221 -4.090 2.656 1.00 1.21 H new ATOM 0 HE1 PHE A 116 3.676 0.092 3.459 1.00 1.31 H new ATOM 0 HE2 PHE A 116 0.728 -2.742 4.646 1.00 1.25 H new ATOM 0 HZ PHE A 116 1.953 -0.649 5.050 1.00 0.50 H new ATOM 1980 N THR A 117 5.320 -5.493 -1.154 1.00 0.33 N ATOM 1981 CA THR A 117 5.320 -6.478 -2.235 1.00 0.37 C ATOM 1982 C THR A 117 5.448 -7.929 -1.743 1.00 0.36 C ATOM 1983 O THR A 117 4.541 -8.738 -1.983 1.00 0.47 O ATOM 1984 CB THR A 117 6.397 -6.186 -3.306 1.00 0.63 C ATOM 1985 OG1 THR A 117 6.107 -4.950 -3.957 1.00 1.18 O ATOM 1986 CG2 THR A 117 6.443 -7.282 -4.357 1.00 0.92 C ATOM 0 H THR A 117 6.125 -4.867 -1.138 1.00 0.33 H new ATOM 0 HA THR A 117 4.338 -6.375 -2.697 1.00 0.37 H new ATOM 0 HB THR A 117 7.361 -6.137 -2.800 1.00 0.63 H new ATOM 0 HG1 THR A 117 5.645 -4.352 -3.333 1.00 1.18 H new ATOM 0 HG21 THR A 117 7.210 -7.047 -5.095 1.00 0.92 H new ATOM 0 HG22 THR A 117 6.678 -8.234 -3.880 1.00 0.92 H new ATOM 0 HG23 THR A 117 5.474 -7.353 -4.851 1.00 0.92 H new ATOM 1994 N GLY A 118 6.543 -8.291 -1.062 1.00 0.43 N ATOM 1995 CA GLY A 118 6.675 -9.682 -0.650 1.00 0.59 C ATOM 1996 C GLY A 118 6.816 -9.938 0.849 1.00 0.49 C ATOM 1997 O GLY A 118 5.845 -9.820 1.590 1.00 0.54 O ATOM 0 H GLY A 118 7.310 -7.673 -0.798 1.00 0.43 H new ATOM 0 HA2 GLY A 118 5.803 -10.228 -1.009 1.00 0.59 H new ATOM 0 HA3 GLY A 118 7.545 -10.105 -1.152 1.00 0.59 H new ATOM 2001 N PRO A 119 8.010 -10.328 1.332 1.00 0.51 N ATOM 2002 CA PRO A 119 8.227 -10.592 2.741 1.00 0.52 C ATOM 2003 C PRO A 119 8.938 -9.461 3.488 1.00 0.43 C ATOM 2004 O PRO A 119 9.986 -8.966 3.058 1.00 0.42 O ATOM 2005 CB PRO A 119 9.124 -11.825 2.689 1.00 0.65 C ATOM 2006 CG PRO A 119 9.958 -11.639 1.460 1.00 0.72 C ATOM 2007 CD PRO A 119 9.212 -10.671 0.550 1.00 0.70 C ATOM 0 HA PRO A 119 7.287 -10.709 3.280 1.00 0.52 H new ATOM 0 HB2 PRO A 119 9.746 -11.900 3.581 1.00 0.65 H new ATOM 0 HB3 PRO A 119 8.535 -12.741 2.633 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.941 -11.244 1.718 1.00 0.72 H new ATOM 0 HG3 PRO A 119 10.120 -12.592 0.957 1.00 0.72 H new ATOM 0 HD2 PRO A 119 9.811 -9.788 0.325 1.00 0.70 H new ATOM 0 HD3 PRO A 119 8.954 -11.133 -0.403 1.00 0.70 H new ATOM 2015 N VAL A 120 8.354 -9.060 4.608 1.00 0.43 N ATOM 2016 CA VAL A 120 8.918 -8.020 5.463 1.00 0.42 C ATOM 2017 C VAL A 120 10.351 -8.369 5.874 1.00 0.38 C ATOM 2018 O VAL A 120 11.211 -7.497 5.976 1.00 0.37 O ATOM 2019 CB VAL A 120 8.035 -7.790 6.718 1.00 0.49 C ATOM 2020 CG1 VAL A 120 7.936 -9.051 7.558 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.553 -6.627 7.554 1.00 0.53 C ATOM 0 H VAL A 120 7.475 -9.446 4.952 1.00 0.43 H new ATOM 0 HA VAL A 120 8.941 -7.094 4.888 1.00 0.42 H new ATOM 0 HB VAL A 120 7.034 -7.535 6.370 1.00 0.49 H new ATOM 0 HG11 VAL A 120 7.311 -8.859 8.430 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.494 -9.850 6.964 1.00 0.58 H new ATOM 0 HG13 VAL A 120 8.932 -9.350 7.884 1.00 0.58 H new ATOM 0 HG21 VAL A 120 7.913 -6.492 8.426 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.571 -6.839 7.881 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.547 -5.717 6.955 1.00 0.53 H new ATOM 2031 N SER A 121 10.593 -9.657 6.107 1.00 0.40 N ATOM 2032 CA SER A 121 11.905 -10.159 6.498 1.00 0.40 C ATOM 2033 C SER A 121 12.999 -9.702 5.531 1.00 0.36 C ATOM 2034 O SER A 121 14.075 -9.261 5.954 1.00 0.37 O ATOM 2035 CB SER A 121 11.847 -11.682 6.552 1.00 0.46 C ATOM 2036 OG SER A 121 10.547 -12.122 6.919 1.00 1.24 O ATOM 0 H SER A 121 9.881 -10.383 6.029 1.00 0.40 H new ATOM 0 HA SER A 121 12.158 -9.756 7.479 1.00 0.40 H new ATOM 0 HB2 SER A 121 12.116 -12.096 5.580 1.00 0.46 H new ATOM 0 HB3 SER A 121 12.578 -12.054 7.270 1.00 0.46 H new ATOM 0 HG SER A 121 10.529 -13.101 6.947 1.00 1.24 H new ATOM 2042 N TYR A 122 12.723 -9.817 4.229 1.00 0.36 N ATOM 2043 CA TYR A 122 13.662 -9.397 3.201 1.00 0.35 C ATOM 2044 C TYR A 122 14.031 -7.934 3.396 1.00 0.33 C ATOM 2045 O TYR A 122 15.193 -7.549 3.267 1.00 0.34 O ATOM 2046 CB TYR A 122 13.051 -9.608 1.818 1.00 0.38 C ATOM 2047 CG TYR A 122 14.009 -9.376 0.675 1.00 0.44 C ATOM 2048 CD1 TYR A 122 15.081 -10.226 0.468 1.00 1.29 C ATOM 2049 CD2 TYR A 122 13.837 -8.312 -0.199 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.962 -10.026 -0.580 1.00 1.35 C ATOM 2051 CE2 TYR A 122 14.710 -8.103 -1.251 1.00 1.36 C ATOM 2052 CZ TYR A 122 15.774 -8.962 -1.438 1.00 0.73 C ATOM 2053 OH TYR A 122 16.652 -8.751 -2.482 1.00 0.91 O ATOM 0 H TYR A 122 11.850 -10.201 3.867 1.00 0.36 H new ATOM 0 HA TYR A 122 14.567 -9.999 3.281 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.667 -10.626 1.754 1.00 0.38 H new ATOM 0 HB3 TYR A 122 12.198 -8.938 1.704 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.233 -11.061 1.136 1.00 1.29 H new ATOM 0 HD2 TYR A 122 13.007 -7.636 -0.055 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.793 -10.700 -0.726 1.00 1.35 H new ATOM 0 HE2 TYR A 122 14.560 -7.271 -1.923 1.00 1.36 H new ATOM 0 HH TYR A 122 16.155 -8.719 -3.326 1.00 0.91 H new ATOM 2063 N LEU A 123 13.032 -7.131 3.746 1.00 0.31 N ATOM 2064 CA LEU A 123 13.235 -5.708 3.975 1.00 0.31 C ATOM 2065 C LEU A 123 14.207 -5.498 5.128 1.00 0.31 C ATOM 2066 O LEU A 123 15.135 -4.699 5.028 1.00 0.31 O ATOM 2067 CB LEU A 123 11.906 -5.020 4.285 1.00 0.32 C ATOM 2068 CG LEU A 123 10.727 -5.476 3.425 1.00 0.34 C ATOM 2069 CD1 LEU A 123 9.431 -4.919 3.977 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.914 -5.047 1.981 1.00 0.34 C ATOM 0 H LEU A 123 12.070 -7.445 3.877 1.00 0.31 H new ATOM 0 HA LEU A 123 13.653 -5.269 3.069 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.660 -5.193 5.333 1.00 0.32 H new ATOM 0 HB3 LEU A 123 12.033 -3.945 4.160 1.00 0.32 H new ATOM 0 HG LEU A 123 10.683 -6.565 3.453 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.599 -5.251 3.356 1.00 0.43 H new ATOM 0 HD12 LEU A 123 9.287 -5.275 4.997 1.00 0.43 H new ATOM 0 HD13 LEU A 123 9.473 -3.830 3.976 1.00 0.43 H new ATOM 0 HD21 LEU A 123 10.063 -5.383 1.389 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.985 -3.961 1.931 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.828 -5.489 1.586 1.00 0.34 H new ATOM 2082 N ILE A 124 13.975 -6.221 6.224 1.00 0.36 N ATOM 2083 CA ILE A 124 14.838 -6.141 7.406 1.00 0.41 C ATOM 2084 C ILE A 124 16.297 -6.374 7.022 1.00 0.38 C ATOM 2085 O ILE A 124 17.195 -5.662 7.473 1.00 0.38 O ATOM 2086 CB ILE A 124 14.462 -7.180 8.490 1.00 0.52 C ATOM 2087 CG1 ILE A 124 12.944 -7.353 8.601 1.00 0.76 C ATOM 2088 CG2 ILE A 124 15.054 -6.775 9.836 1.00 1.01 C ATOM 2089 CD1 ILE A 124 12.197 -6.091 8.972 1.00 1.08 C ATOM 0 H ILE A 124 13.195 -6.871 6.319 1.00 0.36 H new ATOM 0 HA ILE A 124 14.697 -5.140 7.814 1.00 0.41 H new ATOM 0 HB ILE A 124 14.882 -8.141 8.193 1.00 0.52 H new ATOM 0 HG12 ILE A 124 12.562 -7.720 7.649 1.00 0.76 H new ATOM 0 HG13 ILE A 124 12.731 -8.119 9.347 1.00 0.76 H new ATOM 0 HG21 ILE A 124 14.782 -7.514 10.590 1.00 1.01 H new ATOM 0 HG22 ILE A 124 16.140 -6.722 9.755 1.00 1.01 H new ATOM 0 HG23 ILE A 124 14.664 -5.800 10.127 1.00 1.01 H new ATOM 0 HD11 ILE A 124 11.129 -6.303 9.029 1.00 1.08 H new ATOM 0 HD12 ILE A 124 12.547 -5.732 9.940 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.375 -5.327 8.215 1.00 1.08 H new ATOM 2101 N ARG A 125 16.515 -7.373 6.173 1.00 0.38 N ATOM 2102 CA ARG A 125 17.859 -7.712 5.710 1.00 0.41 C ATOM 2103 C ARG A 125 18.459 -6.535 4.955 1.00 0.36 C ATOM 2104 O ARG A 125 19.612 -6.156 5.165 1.00 0.38 O ATOM 2105 CB ARG A 125 17.827 -8.940 4.790 1.00 0.46 C ATOM 2106 CG ARG A 125 17.017 -10.109 5.328 1.00 1.30 C ATOM 2107 CD ARG A 125 17.684 -10.766 6.526 1.00 1.31 C ATOM 2108 NE ARG A 125 17.015 -10.440 7.781 1.00 2.16 N ATOM 2109 CZ ARG A 125 17.530 -10.696 8.983 1.00 2.81 C ATOM 2110 NH1 ARG A 125 18.719 -11.276 9.094 1.00 2.83 N ATOM 2111 NH2 ARG A 125 16.853 -10.378 10.081 1.00 3.80 N ATOM 0 H ARG A 125 15.777 -7.964 5.790 1.00 0.38 H new ATOM 0 HA ARG A 125 18.471 -7.942 6.582 1.00 0.41 H new ATOM 0 HB2 ARG A 125 17.417 -8.644 3.824 1.00 0.46 H new ATOM 0 HB3 ARG A 125 18.850 -9.273 4.614 1.00 0.46 H new ATOM 0 HG2 ARG A 125 16.024 -9.761 5.613 1.00 1.30 H new ATOM 0 HG3 ARG A 125 16.881 -10.849 4.539 1.00 1.30 H new ATOM 0 HD2 ARG A 125 17.687 -11.847 6.389 1.00 1.31 H new ATOM 0 HD3 ARG A 125 18.725 -10.448 6.579 1.00 1.31 H new ATOM 0 HE ARG A 125 16.101 -9.990 7.736 1.00 2.16 H new ATOM 0 HH11 ARG A 125 19.244 -11.528 8.256 1.00 2.83 H new ATOM 0 HH12 ARG A 125 19.108 -11.469 10.017 1.00 2.83 H new ATOM 0 HH21 ARG A 125 15.937 -9.937 10.005 1.00 3.80 H new ATOM 0 HH22 ARG A 125 17.250 -10.575 11.000 1.00 3.80 H new ATOM 2125 N ILE A 126 17.647 -5.954 4.089 1.00 0.34 N ATOM 2126 CA ILE A 126 18.051 -4.815 3.281 1.00 0.33 C ATOM 2127 C ILE A 126 18.357 -3.603 4.158 1.00 0.31 C ATOM 2128 O ILE A 126 19.344 -2.902 3.940 1.00 0.31 O ATOM 2129 CB ILE A 126 16.957 -4.488 2.229 1.00 0.34 C ATOM 2130 CG1 ILE A 126 17.270 -5.198 0.913 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.808 -2.988 1.997 1.00 0.38 C ATOM 2132 CD1 ILE A 126 17.178 -6.703 0.991 1.00 0.46 C ATOM 0 H ILE A 126 16.687 -6.259 3.926 1.00 0.34 H new ATOM 0 HA ILE A 126 18.967 -5.074 2.751 1.00 0.33 H new ATOM 0 HB ILE A 126 16.007 -4.849 2.622 1.00 0.34 H new ATOM 0 HG12 ILE A 126 16.582 -4.841 0.147 1.00 0.39 H new ATOM 0 HG13 ILE A 126 18.275 -4.922 0.593 1.00 0.39 H new ATOM 0 HG21 ILE A 126 16.031 -2.810 1.253 1.00 0.38 H new ATOM 0 HG22 ILE A 126 16.533 -2.501 2.932 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.753 -2.580 1.639 1.00 0.38 H new ATOM 0 HD11 ILE A 126 17.414 -7.133 0.018 1.00 0.46 H new ATOM 0 HD12 ILE A 126 17.886 -7.073 1.732 1.00 0.46 H new ATOM 0 HD13 ILE A 126 16.167 -6.991 1.279 1.00 0.46 H new ATOM 2144 N ARG A 127 17.521 -3.386 5.165 1.00 0.31 N ATOM 2145 CA ARG A 127 17.696 -2.265 6.082 1.00 0.33 C ATOM 2146 C ARG A 127 19.054 -2.351 6.767 1.00 0.33 C ATOM 2147 O ARG A 127 19.791 -1.365 6.838 1.00 0.34 O ATOM 2148 CB ARG A 127 16.590 -2.243 7.143 1.00 0.38 C ATOM 2149 CG ARG A 127 15.185 -2.087 6.585 1.00 1.09 C ATOM 2150 CD ARG A 127 14.934 -0.691 6.046 1.00 1.30 C ATOM 2151 NE ARG A 127 13.539 -0.519 5.619 1.00 1.79 N ATOM 2152 CZ ARG A 127 12.658 0.280 6.227 1.00 2.32 C ATOM 2153 NH1 ARG A 127 13.023 1.018 7.271 1.00 2.76 N ATOM 2154 NH2 ARG A 127 11.401 0.343 5.793 1.00 2.94 N ATOM 0 H ARG A 127 16.712 -3.973 5.369 1.00 0.31 H new ATOM 0 HA ARG A 127 17.639 -1.345 5.500 1.00 0.33 H new ATOM 0 HB2 ARG A 127 16.638 -3.167 7.719 1.00 0.38 H new ATOM 0 HB3 ARG A 127 16.785 -1.425 7.836 1.00 0.38 H new ATOM 0 HG2 ARG A 127 15.029 -2.815 5.789 1.00 1.09 H new ATOM 0 HG3 ARG A 127 14.459 -2.309 7.367 1.00 1.09 H new ATOM 0 HD2 ARG A 127 15.173 0.045 6.814 1.00 1.30 H new ATOM 0 HD3 ARG A 127 15.599 -0.501 5.204 1.00 1.30 H new ATOM 0 HE ARG A 127 13.222 -1.045 4.804 1.00 1.79 H new ATOM 0 HH11 ARG A 127 13.983 0.977 7.614 1.00 2.76 H new ATOM 0 HH12 ARG A 127 12.343 1.625 7.729 1.00 2.76 H new ATOM 0 HH21 ARG A 127 11.108 -0.220 4.994 1.00 2.94 H new ATOM 0 HH22 ARG A 127 10.730 0.954 6.259 1.00 2.94 H new ATOM 2168 N ALA A 128 19.378 -3.542 7.249 1.00 0.35 N ATOM 2169 CA ALA A 128 20.642 -3.775 7.932 1.00 0.38 C ATOM 2170 C ALA A 128 21.820 -3.640 6.976 1.00 0.37 C ATOM 2171 O ALA A 128 22.851 -3.068 7.327 1.00 0.39 O ATOM 2172 CB ALA A 128 20.641 -5.147 8.586 1.00 0.42 C ATOM 0 H ALA A 128 18.780 -4.365 7.179 1.00 0.35 H new ATOM 0 HA ALA A 128 20.753 -3.016 8.706 1.00 0.38 H new ATOM 0 HB1 ALA A 128 21.592 -5.309 9.093 1.00 0.42 H new ATOM 0 HB2 ALA A 128 19.829 -5.204 9.311 1.00 0.42 H new ATOM 0 HB3 ALA A 128 20.502 -5.913 7.824 1.00 0.42 H new ATOM 2178 N ALA A 129 21.656 -4.158 5.760 1.00 0.36 N ATOM 2179 CA ALA A 129 22.706 -4.091 4.752 1.00 0.38 C ATOM 2180 C ALA A 129 23.059 -2.641 4.456 1.00 0.36 C ATOM 2181 O ALA A 129 24.229 -2.245 4.511 1.00 0.40 O ATOM 2182 CB ALA A 129 22.267 -4.806 3.484 1.00 0.40 C ATOM 0 H ALA A 129 20.805 -4.628 5.451 1.00 0.36 H new ATOM 0 HA ALA A 129 23.595 -4.591 5.137 1.00 0.38 H new ATOM 0 HB1 ALA A 129 23.061 -4.748 2.740 1.00 0.40 H new ATOM 0 HB2 ALA A 129 22.057 -5.852 3.710 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.367 -4.332 3.092 1.00 0.40 H new ATOM 2188 N LEU A 130 22.040 -1.843 4.165 1.00 0.33 N ATOM 2189 CA LEU A 130 22.242 -0.436 3.878 1.00 0.32 C ATOM 2190 C LEU A 130 22.816 0.272 5.102 1.00 0.33 C ATOM 2191 O LEU A 130 23.675 1.144 4.979 1.00 0.35 O ATOM 2192 CB LEU A 130 20.920 0.197 3.452 1.00 0.32 C ATOM 2193 CG LEU A 130 20.294 -0.407 2.197 1.00 0.36 C ATOM 2194 CD1 LEU A 130 18.796 -0.176 2.210 1.00 0.38 C ATOM 2195 CD2 LEU A 130 20.924 0.174 0.933 1.00 0.41 C ATOM 0 H LEU A 130 21.068 -2.149 4.122 1.00 0.33 H new ATOM 0 HA LEU A 130 22.956 -0.332 3.061 1.00 0.32 H new ATOM 0 HB2 LEU A 130 20.210 0.108 4.274 1.00 0.32 H new ATOM 0 HB3 LEU A 130 21.081 1.262 3.284 1.00 0.32 H new ATOM 0 HG LEU A 130 20.486 -1.480 2.194 1.00 0.36 H new ATOM 0 HD11 LEU A 130 18.353 -0.609 1.313 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.363 -0.648 3.092 1.00 0.38 H new ATOM 0 HD13 LEU A 130 18.593 0.895 2.235 1.00 0.38 H new ATOM 0 HD21 LEU A 130 20.459 -0.274 0.055 1.00 0.41 H new ATOM 0 HD22 LEU A 130 20.771 1.253 0.913 1.00 0.41 H new ATOM 0 HD23 LEU A 130 21.993 -0.041 0.927 1.00 0.41 H new ATOM 2207 N LYS A 131 22.351 -0.126 6.286 1.00 0.33 N ATOM 2208 CA LYS A 131 22.835 0.451 7.535 1.00 0.37 C ATOM 2209 C LYS A 131 24.350 0.294 7.631 1.00 0.39 C ATOM 2210 O LYS A 131 25.055 1.179 8.121 1.00 0.43 O ATOM 2211 CB LYS A 131 22.149 -0.220 8.724 1.00 0.40 C ATOM 2212 CG LYS A 131 21.340 0.735 9.585 1.00 0.53 C ATOM 2213 CD LYS A 131 22.194 1.361 10.672 1.00 0.69 C ATOM 2214 CE LYS A 131 22.955 2.580 10.178 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.965 3.040 11.171 1.00 1.09 N ATOM 0 H LYS A 131 21.639 -0.847 6.404 1.00 0.33 H new ATOM 0 HA LYS A 131 22.595 1.514 7.552 1.00 0.37 H new ATOM 0 HB2 LYS A 131 21.492 -1.007 8.355 1.00 0.40 H new ATOM 0 HB3 LYS A 131 22.906 -0.701 9.344 1.00 0.40 H new ATOM 0 HG2 LYS A 131 20.913 1.519 8.959 1.00 0.53 H new ATOM 0 HG3 LYS A 131 20.506 0.200 10.039 1.00 0.53 H new ATOM 0 HD2 LYS A 131 21.559 1.647 11.510 1.00 0.69 H new ATOM 0 HD3 LYS A 131 22.901 0.621 11.046 1.00 0.69 H new ATOM 0 HE2 LYS A 131 23.452 2.342 9.237 1.00 0.82 H new ATOM 0 HE3 LYS A 131 22.253 3.388 9.972 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 24.464 3.873 10.798 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.488 3.291 12.060 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.650 2.277 11.349 1.00 1.09 H new ATOM 2229 N LYS A 132 24.841 -0.840 7.154 1.00 0.40 N ATOM 2230 CA LYS A 132 26.270 -1.116 7.147 1.00 0.45 C ATOM 2231 C LYS A 132 26.961 -0.309 6.044 1.00 0.44 C ATOM 2232 O LYS A 132 28.146 0.019 6.146 1.00 0.47 O ATOM 2233 CB LYS A 132 26.532 -2.614 6.945 1.00 0.49 C ATOM 2234 CG LYS A 132 25.809 -3.513 7.940 1.00 0.53 C ATOM 2235 CD LYS A 132 26.036 -3.075 9.381 1.00 0.59 C ATOM 2236 CE LYS A 132 27.481 -3.277 9.807 1.00 0.92 C ATOM 2237 NZ LYS A 132 27.722 -2.798 11.192 1.00 1.39 N ATOM 0 H LYS A 132 24.267 -1.588 6.765 1.00 0.40 H new ATOM 0 HA LYS A 132 26.680 -0.820 8.112 1.00 0.45 H new ATOM 0 HB2 LYS A 132 26.230 -2.892 5.935 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.604 -2.797 7.019 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.741 -3.506 7.724 1.00 0.53 H new ATOM 0 HG3 LYS A 132 26.153 -4.540 7.816 1.00 0.53 H new ATOM 0 HD2 LYS A 132 25.768 -2.024 9.489 1.00 0.59 H new ATOM 0 HD3 LYS A 132 25.379 -3.641 10.042 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.735 -4.335 9.739 1.00 0.92 H new ATOM 0 HE3 LYS A 132 28.140 -2.746 9.120 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 28.719 -2.953 11.445 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 27.504 -1.783 11.251 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 27.112 -3.322 11.852 1.00 1.39 H new ATOM 2251 N LYS A 133 26.211 0.013 4.993 1.00 0.42 N ATOM 2252 CA LYS A 133 26.748 0.786 3.871 1.00 0.44 C ATOM 2253 C LYS A 133 26.523 2.291 4.057 1.00 0.42 C ATOM 2254 O LYS A 133 26.845 3.082 3.172 1.00 0.45 O ATOM 2255 CB LYS A 133 26.123 0.326 2.552 1.00 0.49 C ATOM 2256 CG LYS A 133 26.368 -1.141 2.238 1.00 1.05 C ATOM 2257 CD LYS A 133 26.553 -1.371 0.746 1.00 1.48 C ATOM 2258 CE LYS A 133 25.331 -0.942 -0.049 1.00 2.08 C ATOM 2259 NZ LYS A 133 25.517 -1.153 -1.509 1.00 2.52 N ATOM 0 H LYS A 133 25.230 -0.248 4.893 1.00 0.42 H new ATOM 0 HA LYS A 133 27.823 0.607 3.841 1.00 0.44 H new ATOM 0 HB2 LYS A 133 25.049 0.506 2.587 1.00 0.49 H new ATOM 0 HB3 LYS A 133 26.522 0.934 1.740 1.00 0.49 H new ATOM 0 HG2 LYS A 133 27.254 -1.485 2.772 1.00 1.05 H new ATOM 0 HG3 LYS A 133 25.528 -1.736 2.597 1.00 1.05 H new ATOM 0 HD2 LYS A 133 27.425 -0.817 0.399 1.00 1.48 H new ATOM 0 HD3 LYS A 133 26.753 -2.427 0.563 1.00 1.48 H new ATOM 0 HE2 LYS A 133 24.461 -1.504 0.291 1.00 2.08 H new ATOM 0 HE3 LYS A 133 25.125 0.111 0.142 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 24.661 -0.848 -2.016 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 26.332 -0.597 -1.839 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 25.688 -2.162 -1.695 1.00 2.52 H new ATOM 2273 N ASN A 134 25.941 2.661 5.199 1.00 0.41 N ATOM 2274 CA ASN A 134 25.680 4.069 5.543 1.00 0.42 C ATOM 2275 C ASN A 134 24.541 4.634 4.694 1.00 0.40 C ATOM 2276 O ASN A 134 24.536 5.807 4.304 1.00 0.44 O ATOM 2277 CB ASN A 134 26.953 4.921 5.395 1.00 0.48 C ATOM 2278 CG ASN A 134 26.885 6.229 6.167 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.119 6.367 7.121 1.00 1.08 O ATOM 2280 ND2 ASN A 134 27.696 7.197 5.766 1.00 1.06 N ATOM 0 H ASN A 134 25.636 1.999 5.913 1.00 0.41 H new ATOM 0 HA ASN A 134 25.374 4.108 6.588 1.00 0.42 H new ATOM 0 HB2 ASN A 134 27.811 4.345 5.741 1.00 0.48 H new ATOM 0 HB3 ASN A 134 27.119 5.137 4.339 1.00 0.48 H new ATOM 0 HD21 ASN A 134 27.699 8.094 6.252 1.00 1.06 H new ATOM 0 HD22 ASN A 134 28.317 7.046 4.971 1.00 1.06 H new ATOM 2287 N TYR A 135 23.571 3.774 4.433 1.00 0.36 N ATOM 2288 CA TYR A 135 22.392 4.118 3.659 1.00 0.35 C ATOM 2289 C TYR A 135 21.159 3.767 4.473 1.00 0.34 C ATOM 2290 O TYR A 135 21.148 2.762 5.178 1.00 0.35 O ATOM 2291 CB TYR A 135 22.374 3.336 2.347 1.00 0.37 C ATOM 2292 CG TYR A 135 22.401 4.176 1.092 1.00 0.55 C ATOM 2293 CD1 TYR A 135 21.656 5.340 0.983 1.00 1.30 C ATOM 2294 CD2 TYR A 135 23.165 3.786 0.002 1.00 1.44 C ATOM 2295 CE1 TYR A 135 21.674 6.094 -0.173 1.00 1.46 C ATOM 2296 CE2 TYR A 135 23.186 4.533 -1.157 1.00 1.66 C ATOM 2297 CZ TYR A 135 22.440 5.686 -1.240 1.00 1.17 C ATOM 2298 OH TYR A 135 22.459 6.431 -2.400 1.00 1.51 O ATOM 0 H TYR A 135 23.581 2.807 4.757 1.00 0.36 H new ATOM 0 HA TYR A 135 22.405 5.184 3.430 1.00 0.35 H new ATOM 0 HB2 TYR A 135 23.232 2.664 2.333 1.00 0.37 H new ATOM 0 HB3 TYR A 135 21.480 2.713 2.327 1.00 0.37 H new ATOM 0 HD1 TYR A 135 21.051 5.663 1.817 1.00 1.30 H new ATOM 0 HD2 TYR A 135 23.753 2.882 0.062 1.00 1.44 H new ATOM 0 HE1 TYR A 135 21.090 7.000 -0.239 1.00 1.46 H new ATOM 0 HE2 TYR A 135 23.786 4.214 -1.997 1.00 1.66 H new ATOM 0 HH TYR A 135 23.051 6.004 -3.054 1.00 1.51 H new ATOM 2308 N LYS A 136 20.136 4.595 4.415 1.00 0.34 N ATOM 2309 CA LYS A 136 18.921 4.317 5.158 1.00 0.35 C ATOM 2310 C LYS A 136 17.696 4.553 4.285 1.00 0.34 C ATOM 2311 O LYS A 136 17.493 5.643 3.762 1.00 0.36 O ATOM 2312 CB LYS A 136 18.840 5.169 6.429 1.00 0.39 C ATOM 2313 CG LYS A 136 20.191 5.603 6.988 1.00 1.36 C ATOM 2314 CD LYS A 136 20.132 5.845 8.491 1.00 1.43 C ATOM 2315 CE LYS A 136 19.074 6.874 8.858 1.00 1.18 C ATOM 2316 NZ LYS A 136 19.025 7.126 10.326 1.00 1.36 N ATOM 0 H LYS A 136 20.119 5.456 3.869 1.00 0.34 H new ATOM 0 HA LYS A 136 18.944 3.269 5.455 1.00 0.35 H new ATOM 0 HB2 LYS A 136 18.246 6.058 6.218 1.00 0.39 H new ATOM 0 HB3 LYS A 136 18.308 4.605 7.196 1.00 0.39 H new ATOM 0 HG2 LYS A 136 20.936 4.837 6.772 1.00 1.36 H new ATOM 0 HG3 LYS A 136 20.516 6.514 6.486 1.00 1.36 H new ATOM 0 HD2 LYS A 136 19.918 4.906 9.002 1.00 1.43 H new ATOM 0 HD3 LYS A 136 21.106 6.185 8.843 1.00 1.43 H new ATOM 0 HE2 LYS A 136 19.281 7.809 8.337 1.00 1.18 H new ATOM 0 HE3 LYS A 136 18.098 6.528 8.517 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 18.291 7.833 10.533 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 18.802 6.240 10.823 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 19.948 7.481 10.648 1.00 1.36 H new ATOM 2330 N LEU A 137 16.897 3.516 4.124 1.00 0.34 N ATOM 2331 CA LEU A 137 15.687 3.592 3.319 1.00 0.36 C ATOM 2332 C LEU A 137 14.525 4.058 4.186 1.00 0.35 C ATOM 2333 O LEU A 137 14.390 3.627 5.330 1.00 0.36 O ATOM 2334 CB LEU A 137 15.386 2.218 2.702 1.00 0.43 C ATOM 2335 CG LEU A 137 13.930 1.970 2.288 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.617 2.650 0.967 1.00 0.66 C ATOM 2337 CD2 LEU A 137 13.652 0.479 2.196 1.00 0.64 C ATOM 0 H LEU A 137 17.064 2.601 4.543 1.00 0.34 H new ATOM 0 HA LEU A 137 15.830 4.310 2.511 1.00 0.36 H new ATOM 0 HB2 LEU A 137 16.019 2.090 1.824 1.00 0.43 H new ATOM 0 HB3 LEU A 137 15.675 1.449 3.419 1.00 0.43 H new ATOM 0 HG LEU A 137 13.282 2.400 3.052 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.579 2.459 0.696 1.00 0.66 H new ATOM 0 HD12 LEU A 137 13.774 3.724 1.064 1.00 0.66 H new ATOM 0 HD13 LEU A 137 14.273 2.256 0.191 1.00 0.66 H new ATOM 0 HD21 LEU A 137 12.615 0.320 1.901 1.00 0.64 H new ATOM 0 HD22 LEU A 137 14.313 0.031 1.454 1.00 0.64 H new ATOM 0 HD23 LEU A 137 13.829 0.015 3.167 1.00 0.64 H new ATOM 2349 N ASN A 138 13.687 4.921 3.634 1.00 0.35 N ATOM 2350 CA ASN A 138 12.538 5.462 4.351 1.00 0.37 C ATOM 2351 C ASN A 138 11.433 5.790 3.354 1.00 0.40 C ATOM 2352 O ASN A 138 11.700 5.926 2.162 1.00 0.40 O ATOM 2353 CB ASN A 138 12.926 6.714 5.148 1.00 0.40 C ATOM 2354 CG ASN A 138 12.915 6.494 6.650 1.00 0.52 C ATOM 2355 OD1 ASN A 138 12.423 7.331 7.404 1.00 0.68 O ATOM 2356 ND2 ASN A 138 13.476 5.386 7.101 1.00 0.81 N ATOM 0 H ASN A 138 13.782 5.267 2.679 1.00 0.35 H new ATOM 0 HA ASN A 138 12.181 4.715 5.060 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.921 7.038 4.842 1.00 0.40 H new ATOM 0 HB3 ASN A 138 12.238 7.522 4.901 1.00 0.40 H new ATOM 0 HD21 ASN A 138 13.510 5.204 8.104 1.00 0.81 H new ATOM 0 HD22 ASN A 138 13.875 4.713 6.446 1.00 0.81 H new ATOM 2363 N GLN A 139 10.207 5.931 3.845 1.00 0.45 N ATOM 2364 CA GLN A 139 9.047 6.227 2.988 1.00 0.53 C ATOM 2365 C GLN A 139 9.205 7.551 2.235 1.00 0.60 C ATOM 2366 O GLN A 139 8.498 7.812 1.274 1.00 0.92 O ATOM 2367 CB GLN A 139 7.768 6.302 3.832 1.00 0.63 C ATOM 2368 CG GLN A 139 7.704 5.290 4.962 1.00 1.09 C ATOM 2369 CD GLN A 139 6.460 5.446 5.815 1.00 1.95 C ATOM 2370 OE1 GLN A 139 5.457 4.766 5.605 1.00 2.36 O ATOM 2371 NE2 GLN A 139 6.511 6.353 6.783 1.00 2.87 N ATOM 0 H GLN A 139 9.982 5.846 4.836 1.00 0.45 H new ATOM 0 HA GLN A 139 8.982 5.418 2.261 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.682 7.304 4.252 1.00 0.63 H new ATOM 0 HB3 GLN A 139 6.907 6.155 3.180 1.00 0.63 H new ATOM 0 HG2 GLN A 139 7.730 4.283 4.545 1.00 1.09 H new ATOM 0 HG3 GLN A 139 8.587 5.397 5.591 1.00 1.09 H new ATOM 0 HE21 GLN A 139 7.361 6.898 6.927 1.00 2.87 H new ATOM 0 HE22 GLN A 139 5.700 6.505 7.383 1.00 2.87 H new ATOM 2380 N TYR A 140 10.138 8.376 2.674 1.00 0.47 N ATOM 2381 CA TYR A 140 10.343 9.684 2.064 1.00 0.53 C ATOM 2382 C TYR A 140 11.509 9.684 1.082 1.00 0.49 C ATOM 2383 O TYR A 140 11.613 10.575 0.237 1.00 0.54 O ATOM 2384 CB TYR A 140 10.572 10.723 3.162 1.00 0.60 C ATOM 2385 CG TYR A 140 9.947 10.320 4.476 1.00 0.63 C ATOM 2386 CD1 TYR A 140 8.577 10.432 4.683 1.00 1.37 C ATOM 2387 CD2 TYR A 140 10.726 9.797 5.499 1.00 1.33 C ATOM 2388 CE1 TYR A 140 8.001 10.031 5.873 1.00 1.42 C ATOM 2389 CE2 TYR A 140 10.158 9.398 6.692 1.00 1.38 C ATOM 2390 CZ TYR A 140 8.796 9.514 6.874 1.00 0.80 C ATOM 2391 OH TYR A 140 8.230 9.106 8.059 1.00 0.92 O ATOM 0 H TYR A 140 10.767 8.167 3.449 1.00 0.47 H new ATOM 0 HA TYR A 140 9.448 9.936 1.495 1.00 0.53 H new ATOM 0 HB2 TYR A 140 11.643 10.869 3.302 1.00 0.60 H new ATOM 0 HB3 TYR A 140 10.158 11.680 2.845 1.00 0.60 H new ATOM 0 HD1 TYR A 140 7.953 10.839 3.901 1.00 1.37 H new ATOM 0 HD2 TYR A 140 11.793 9.701 5.359 1.00 1.33 H new ATOM 0 HE1 TYR A 140 6.935 10.122 6.018 1.00 1.42 H new ATOM 0 HE2 TYR A 140 10.778 8.996 7.480 1.00 1.38 H new ATOM 0 HH TYR A 140 8.929 8.766 8.656 1.00 0.92 H new ATOM 2401 N GLY A 141 12.390 8.699 1.194 1.00 0.43 N ATOM 2402 CA GLY A 141 13.520 8.637 0.292 1.00 0.42 C ATOM 2403 C GLY A 141 14.655 7.801 0.837 1.00 0.38 C ATOM 2404 O GLY A 141 14.446 6.939 1.695 1.00 0.37 O ATOM 0 H GLY A 141 12.343 7.950 1.885 1.00 0.43 H new ATOM 0 HA2 GLY A 141 13.195 8.224 -0.663 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.879 9.647 0.096 1.00 0.42 H new ATOM 2408 N LEU A 142 15.861 8.060 0.351 1.00 0.38 N ATOM 2409 CA LEU A 142 17.037 7.326 0.794 1.00 0.37 C ATOM 2410 C LEU A 142 17.980 8.260 1.533 1.00 0.38 C ATOM 2411 O LEU A 142 18.216 9.375 1.097 1.00 0.54 O ATOM 2412 CB LEU A 142 17.752 6.697 -0.401 1.00 0.40 C ATOM 2413 CG LEU A 142 17.600 5.179 -0.540 1.00 0.47 C ATOM 2414 CD1 LEU A 142 18.324 4.457 0.581 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.138 4.779 -0.557 1.00 0.50 C ATOM 0 H LEU A 142 16.050 8.775 -0.352 1.00 0.38 H new ATOM 0 HA LEU A 142 16.721 6.530 1.469 1.00 0.37 H new ATOM 0 HB2 LEU A 142 17.380 7.166 -1.312 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.814 6.933 -0.331 1.00 0.40 H new ATOM 0 HG LEU A 142 18.050 4.888 -1.489 1.00 0.47 H new ATOM 0 HD11 LEU A 142 18.201 3.381 0.460 1.00 0.85 H new ATOM 0 HD12 LEU A 142 19.385 4.707 0.549 1.00 0.85 H new ATOM 0 HD13 LEU A 142 17.907 4.764 1.540 1.00 0.85 H new ATOM 0 HD21 LEU A 142 16.058 3.697 -0.657 1.00 0.50 H new ATOM 0 HD22 LEU A 142 15.664 5.094 0.373 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.639 5.259 -1.399 1.00 0.50 H new ATOM 2427 N PHE A 143 18.501 7.817 2.656 1.00 0.37 N ATOM 2428 CA PHE A 143 19.407 8.641 3.444 1.00 0.39 C ATOM 2429 C PHE A 143 20.853 8.192 3.291 1.00 0.40 C ATOM 2430 O PHE A 143 21.250 7.149 3.809 1.00 0.40 O ATOM 2431 CB PHE A 143 19.016 8.601 4.920 1.00 0.41 C ATOM 2432 CG PHE A 143 17.832 9.456 5.261 1.00 0.44 C ATOM 2433 CD1 PHE A 143 17.998 10.805 5.526 1.00 1.26 C ATOM 2434 CD2 PHE A 143 16.558 8.912 5.325 1.00 1.30 C ATOM 2435 CE1 PHE A 143 16.914 11.599 5.850 1.00 1.28 C ATOM 2436 CE2 PHE A 143 15.471 9.701 5.649 1.00 1.34 C ATOM 2437 CZ PHE A 143 15.649 11.045 5.913 1.00 0.58 C ATOM 0 H PHE A 143 18.317 6.894 3.048 1.00 0.37 H new ATOM 0 HA PHE A 143 19.324 9.662 3.070 1.00 0.39 H new ATOM 0 HB2 PHE A 143 18.799 7.570 5.200 1.00 0.41 H new ATOM 0 HB3 PHE A 143 19.868 8.922 5.520 1.00 0.41 H new ATOM 0 HD1 PHE A 143 18.985 11.241 5.479 1.00 1.26 H new ATOM 0 HD2 PHE A 143 16.414 7.862 5.120 1.00 1.30 H new ATOM 0 HE1 PHE A 143 17.055 12.650 6.054 1.00 1.28 H new ATOM 0 HE2 PHE A 143 14.483 9.267 5.696 1.00 1.34 H new ATOM 0 HZ PHE A 143 14.801 11.663 6.168 1.00 0.58 H new ATOM 2447 N LYS A 144 21.632 8.978 2.569 1.00 0.42 N ATOM 2448 CA LYS A 144 23.044 8.693 2.369 1.00 0.45 C ATOM 2449 C LYS A 144 23.860 9.554 3.320 1.00 0.56 C ATOM 2450 O LYS A 144 23.908 10.776 3.168 1.00 0.64 O ATOM 2451 CB LYS A 144 23.450 8.972 0.914 1.00 0.55 C ATOM 2452 CG LYS A 144 24.944 9.210 0.714 1.00 0.80 C ATOM 2453 CD LYS A 144 25.767 7.962 0.998 1.00 0.97 C ATOM 2454 CE LYS A 144 25.719 6.979 -0.160 1.00 1.96 C ATOM 2455 NZ LYS A 144 26.321 7.541 -1.397 1.00 2.30 N ATOM 0 H LYS A 144 21.307 9.827 2.107 1.00 0.42 H new ATOM 0 HA LYS A 144 23.234 7.639 2.575 1.00 0.45 H new ATOM 0 HB2 LYS A 144 23.142 8.129 0.295 1.00 0.55 H new ATOM 0 HB3 LYS A 144 22.904 9.845 0.558 1.00 0.55 H new ATOM 0 HG2 LYS A 144 25.124 9.537 -0.310 1.00 0.80 H new ATOM 0 HG3 LYS A 144 25.273 10.017 1.369 1.00 0.80 H new ATOM 0 HD2 LYS A 144 26.802 8.245 1.192 1.00 0.97 H new ATOM 0 HD3 LYS A 144 25.394 7.478 1.901 1.00 0.97 H new ATOM 0 HE2 LYS A 144 26.247 6.067 0.117 1.00 1.96 H new ATOM 0 HE3 LYS A 144 24.683 6.701 -0.356 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 26.624 6.765 -2.019 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 25.617 8.126 -1.891 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 27.144 8.126 -1.148 1.00 2.30 H new ATOM 2469 N ASN A 145 24.480 8.918 4.307 1.00 0.62 N ATOM 2470 CA ASN A 145 25.288 9.629 5.302 1.00 0.81 C ATOM 2471 C ASN A 145 24.443 10.698 5.991 1.00 0.99 C ATOM 2472 O ASN A 145 24.896 11.823 6.215 1.00 1.97 O ATOM 2473 CB ASN A 145 26.527 10.260 4.649 1.00 0.92 C ATOM 2474 CG ASN A 145 27.581 10.646 5.668 1.00 1.20 C ATOM 2475 OD1 ASN A 145 27.644 10.068 6.752 1.00 1.57 O ATOM 2476 ND2 ASN A 145 28.418 11.615 5.327 1.00 1.70 N ATOM 0 H ASN A 145 24.441 7.908 4.443 1.00 0.62 H new ATOM 0 HA ASN A 145 25.629 8.913 6.049 1.00 0.81 H new ATOM 0 HB2 ASN A 145 26.956 9.557 3.934 1.00 0.92 H new ATOM 0 HB3 ASN A 145 26.228 11.144 4.086 1.00 0.92 H new ATOM 0 HD21 ASN A 145 29.150 11.908 5.974 1.00 1.70 H new ATOM 0 HD22 ASN A 145 28.330 12.068 4.417 1.00 1.70 H new ATOM 2483 N GLN A 146 23.194 10.325 6.291 1.00 0.56 N ATOM 2484 CA GLN A 146 22.219 11.201 6.956 1.00 0.58 C ATOM 2485 C GLN A 146 21.634 12.244 5.994 1.00 0.55 C ATOM 2486 O GLN A 146 20.798 13.061 6.382 1.00 0.60 O ATOM 2487 CB GLN A 146 22.827 11.883 8.184 1.00 0.66 C ATOM 2488 CG GLN A 146 23.138 10.918 9.317 1.00 1.54 C ATOM 2489 CD GLN A 146 24.498 11.169 9.940 1.00 2.42 C ATOM 2490 OE1 GLN A 146 24.685 10.986 11.146 1.00 2.97 O ATOM 2491 NE2 GLN A 146 25.460 11.568 9.123 1.00 3.02 N ATOM 0 H GLN A 146 22.827 9.398 6.077 1.00 0.56 H new ATOM 0 HA GLN A 146 21.400 10.563 7.290 1.00 0.58 H new ATOM 0 HB2 GLN A 146 23.744 12.394 7.890 1.00 0.66 H new ATOM 0 HB3 GLN A 146 22.138 12.646 8.545 1.00 0.66 H new ATOM 0 HG2 GLN A 146 22.369 11.005 10.085 1.00 1.54 H new ATOM 0 HG3 GLN A 146 23.098 9.896 8.940 1.00 1.54 H new ATOM 0 HE21 GLN A 146 25.262 11.707 8.132 1.00 3.02 H new ATOM 0 HE22 GLN A 146 26.399 11.736 9.484 1.00 3.02 H new ATOM 2500 N THR A 147 22.063 12.205 4.741 1.00 0.51 N ATOM 2501 CA THR A 147 21.571 13.135 3.734 1.00 0.52 C ATOM 2502 C THR A 147 20.409 12.520 2.971 1.00 0.47 C ATOM 2503 O THR A 147 20.545 11.441 2.399 1.00 0.46 O ATOM 2504 CB THR A 147 22.682 13.504 2.734 1.00 0.56 C ATOM 2505 OG1 THR A 147 23.905 13.773 3.438 1.00 0.64 O ATOM 2506 CG2 THR A 147 22.285 14.712 1.900 1.00 0.62 C ATOM 0 H THR A 147 22.753 11.537 4.396 1.00 0.51 H new ATOM 0 HA THR A 147 21.240 14.036 4.250 1.00 0.52 H new ATOM 0 HB THR A 147 22.831 12.660 2.061 1.00 0.56 H new ATOM 0 HG1 THR A 147 24.377 12.931 3.607 1.00 0.64 H new ATOM 0 HG21 THR A 147 23.087 14.952 1.202 1.00 0.62 H new ATOM 0 HG22 THR A 147 21.375 14.487 1.344 1.00 0.62 H new ATOM 0 HG23 THR A 147 22.108 15.565 2.556 1.00 0.62 H new ATOM 2514 N LEU A 148 19.267 13.191 2.969 1.00 0.47 N ATOM 2515 CA LEU A 148 18.108 12.675 2.262 1.00 0.44 C ATOM 2516 C LEU A 148 18.267 12.843 0.760 1.00 0.44 C ATOM 2517 O LEU A 148 18.467 13.945 0.251 1.00 0.50 O ATOM 2518 CB LEU A 148 16.821 13.353 2.717 1.00 0.47 C ATOM 2519 CG LEU A 148 15.545 12.815 2.067 1.00 0.49 C ATOM 2520 CD1 LEU A 148 15.426 11.323 2.293 1.00 0.58 C ATOM 2521 CD2 LEU A 148 14.320 13.531 2.606 1.00 0.78 C ATOM 0 H LEU A 148 19.120 14.082 3.443 1.00 0.47 H new ATOM 0 HA LEU A 148 18.040 11.613 2.499 1.00 0.44 H new ATOM 0 HB2 LEU A 148 16.734 13.246 3.798 1.00 0.47 H new ATOM 0 HB3 LEU A 148 16.896 14.420 2.508 1.00 0.47 H new ATOM 0 HG LEU A 148 15.604 13.002 0.995 1.00 0.49 H new ATOM 0 HD11 LEU A 148 14.513 10.956 1.824 1.00 0.58 H new ATOM 0 HD12 LEU A 148 16.287 10.819 1.854 1.00 0.58 H new ATOM 0 HD13 LEU A 148 15.392 11.119 3.363 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.425 13.131 2.129 1.00 0.78 H new ATOM 0 HD22 LEU A 148 14.255 13.380 3.683 1.00 0.78 H new ATOM 0 HD23 LEU A 148 14.399 14.597 2.393 1.00 0.78 H new ATOM 2533 N VAL A 149 18.163 11.734 0.074 1.00 0.40 N ATOM 2534 CA VAL A 149 18.280 11.680 -1.368 1.00 0.41 C ATOM 2535 C VAL A 149 16.960 11.187 -1.958 1.00 0.39 C ATOM 2536 O VAL A 149 16.422 10.162 -1.521 1.00 0.43 O ATOM 2537 CB VAL A 149 19.433 10.743 -1.792 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.688 10.829 -3.288 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.700 11.062 -1.009 1.00 0.48 C ATOM 0 H VAL A 149 17.992 10.826 0.505 1.00 0.40 H new ATOM 0 HA VAL A 149 18.502 12.679 -1.744 1.00 0.41 H new ATOM 0 HB VAL A 149 19.136 9.720 -1.562 1.00 0.44 H new ATOM 0 HG11 VAL A 149 20.505 10.159 -3.557 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.787 10.538 -3.828 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.956 11.852 -3.553 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.500 10.391 -1.322 1.00 0.48 H new ATOM 0 HG22 VAL A 149 20.996 12.094 -1.200 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.512 10.930 0.057 1.00 0.48 H new ATOM 2549 N PRO A 150 16.406 11.934 -2.927 1.00 0.40 N ATOM 2550 CA PRO A 150 15.137 11.586 -3.570 1.00 0.42 C ATOM 2551 C PRO A 150 15.253 10.387 -4.504 1.00 0.35 C ATOM 2552 O PRO A 150 16.353 9.943 -4.847 1.00 0.42 O ATOM 2553 CB PRO A 150 14.786 12.841 -4.363 1.00 0.53 C ATOM 2554 CG PRO A 150 16.086 13.508 -4.632 1.00 0.68 C ATOM 2555 CD PRO A 150 16.974 13.188 -3.464 1.00 0.48 C ATOM 0 HA PRO A 150 14.384 11.297 -2.837 1.00 0.42 H new ATOM 0 HB2 PRO A 150 14.273 12.590 -5.291 1.00 0.53 H new ATOM 0 HB3 PRO A 150 14.120 13.491 -3.796 1.00 0.53 H new ATOM 0 HG2 PRO A 150 16.523 13.147 -5.563 1.00 0.68 H new ATOM 0 HG3 PRO A 150 15.956 14.585 -4.738 1.00 0.68 H new ATOM 0 HD2 PRO A 150 18.011 13.058 -3.773 1.00 0.48 H new ATOM 0 HD3 PRO A 150 16.960 13.985 -2.720 1.00 0.48 H new ATOM 2563 N LEU A 151 14.106 9.884 -4.923 1.00 0.43 N ATOM 2564 CA LEU A 151 14.044 8.739 -5.809 1.00 0.40 C ATOM 2565 C LEU A 151 13.949 9.171 -7.260 1.00 0.39 C ATOM 2566 O LEU A 151 13.347 10.192 -7.582 1.00 0.56 O ATOM 2567 CB LEU A 151 12.863 7.808 -5.460 1.00 0.62 C ATOM 2568 CG LEU A 151 11.602 8.420 -4.803 1.00 0.87 C ATOM 2569 CD1 LEU A 151 11.844 8.756 -3.333 1.00 1.11 C ATOM 2570 CD2 LEU A 151 11.103 9.641 -5.563 1.00 1.31 C ATOM 0 H LEU A 151 13.194 10.257 -4.659 1.00 0.43 H new ATOM 0 HA LEU A 151 14.970 8.182 -5.668 1.00 0.40 H new ATOM 0 HB2 LEU A 151 12.549 7.313 -6.379 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.240 7.032 -4.793 1.00 0.62 H new ATOM 0 HG LEU A 151 10.821 7.661 -4.850 1.00 0.87 H new ATOM 0 HD11 LEU A 151 10.938 9.184 -2.904 1.00 1.11 H new ATOM 0 HD12 LEU A 151 12.109 7.848 -2.791 1.00 1.11 H new ATOM 0 HD13 LEU A 151 12.658 9.476 -3.254 1.00 1.11 H new ATOM 0 HD21 LEU A 151 10.217 10.040 -5.069 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.883 10.402 -5.580 1.00 1.31 H new ATOM 0 HD23 LEU A 151 10.851 9.356 -6.585 1.00 1.31 H new ATOM 2582 N LYS A 152 14.572 8.393 -8.124 1.00 0.40 N ATOM 2583 CA LYS A 152 14.562 8.660 -9.549 1.00 0.53 C ATOM 2584 C LYS A 152 14.009 7.458 -10.299 1.00 0.50 C ATOM 2585 O LYS A 152 14.477 7.114 -11.384 1.00 0.58 O ATOM 2586 CB LYS A 152 15.974 8.984 -10.026 1.00 0.72 C ATOM 2587 CG LYS A 152 16.640 10.077 -9.230 1.00 0.84 C ATOM 2588 CD LYS A 152 17.543 9.514 -8.161 1.00 1.45 C ATOM 2589 CE LYS A 152 18.353 8.336 -8.667 1.00 1.66 C ATOM 2590 NZ LYS A 152 19.578 8.109 -7.858 1.00 2.55 N ATOM 0 H LYS A 152 15.098 7.560 -7.859 1.00 0.40 H new ATOM 0 HA LYS A 152 13.921 9.519 -9.748 1.00 0.53 H new ATOM 0 HB2 LYS A 152 16.584 8.082 -9.971 1.00 0.72 H new ATOM 0 HB3 LYS A 152 15.936 9.280 -11.074 1.00 0.72 H new ATOM 0 HG2 LYS A 152 17.220 10.713 -9.899 1.00 0.84 H new ATOM 0 HG3 LYS A 152 15.879 10.708 -8.770 1.00 0.84 H new ATOM 0 HD2 LYS A 152 18.218 10.294 -7.808 1.00 1.45 H new ATOM 0 HD3 LYS A 152 16.943 9.202 -7.306 1.00 1.45 H new ATOM 0 HE2 LYS A 152 17.736 7.438 -8.648 1.00 1.66 H new ATOM 0 HE3 LYS A 152 18.633 8.509 -9.706 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 20.398 8.009 -8.490 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 19.728 8.918 -7.221 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 19.467 7.241 -7.295 1.00 2.55 H new ATOM 2604 N ILE A 153 13.006 6.824 -9.707 1.00 0.43 N ATOM 2605 CA ILE A 153 12.386 5.646 -10.301 1.00 0.43 C ATOM 2606 C ILE A 153 10.876 5.664 -10.108 1.00 0.45 C ATOM 2607 O ILE A 153 10.321 6.593 -9.522 1.00 0.48 O ATOM 2608 CB ILE A 153 12.923 4.322 -9.710 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.654 4.239 -8.199 1.00 0.38 C ATOM 2610 CG2 ILE A 153 14.405 4.140 -10.020 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.788 4.754 -7.341 1.00 0.40 C ATOM 0 H ILE A 153 12.603 7.106 -8.813 1.00 0.43 H new ATOM 0 HA ILE A 153 12.639 5.688 -11.360 1.00 0.43 H new ATOM 0 HB ILE A 153 12.384 3.503 -10.187 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.752 4.807 -7.970 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.454 3.201 -7.933 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.754 3.200 -9.592 1.00 0.42 H new ATOM 0 HG22 ILE A 153 14.551 4.123 -11.100 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.971 4.967 -9.590 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.519 4.661 -6.289 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.688 4.171 -7.539 1.00 0.40 H new ATOM 0 HD13 ILE A 153 13.975 5.802 -7.576 1.00 0.40 H new ATOM 2623 N THR A 154 10.223 4.623 -10.605 1.00 0.47 N ATOM 2624 CA THR A 154 8.778 4.490 -10.493 1.00 0.52 C ATOM 2625 C THR A 154 8.368 3.013 -10.522 1.00 0.53 C ATOM 2626 O THR A 154 7.246 2.662 -10.160 1.00 0.74 O ATOM 2627 CB THR A 154 8.059 5.266 -11.628 1.00 0.61 C ATOM 2628 OG1 THR A 154 6.646 5.010 -11.606 1.00 0.70 O ATOM 2629 CG2 THR A 154 8.621 4.889 -12.991 1.00 0.71 C ATOM 0 H THR A 154 10.677 3.852 -11.094 1.00 0.47 H new ATOM 0 HA THR A 154 8.476 4.919 -9.538 1.00 0.52 H new ATOM 0 HB THR A 154 8.232 6.328 -11.457 1.00 0.61 H new ATOM 0 HG1 THR A 154 6.212 5.510 -12.328 1.00 0.70 H new ATOM 0 HG21 THR A 154 8.098 5.448 -13.767 1.00 0.71 H new ATOM 0 HG22 THR A 154 9.684 5.128 -13.025 1.00 0.71 H new ATOM 0 HG23 THR A 154 8.484 3.821 -13.158 1.00 0.71 H new ATOM 2637 N THR A 155 9.288 2.145 -10.935 1.00 0.45 N ATOM 2638 CA THR A 155 9.003 0.719 -11.016 1.00 0.46 C ATOM 2639 C THR A 155 9.772 -0.054 -9.950 1.00 0.42 C ATOM 2640 O THR A 155 10.854 0.365 -9.535 1.00 0.40 O ATOM 2641 CB THR A 155 9.360 0.173 -12.416 1.00 0.51 C ATOM 2642 OG1 THR A 155 8.968 1.120 -13.420 1.00 0.62 O ATOM 2643 CG2 THR A 155 8.674 -1.159 -12.679 1.00 0.56 C ATOM 0 H THR A 155 10.233 2.405 -11.217 1.00 0.45 H new ATOM 0 HA THR A 155 7.936 0.583 -10.842 1.00 0.46 H new ATOM 0 HB THR A 155 10.438 0.017 -12.454 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.198 0.771 -14.306 1.00 0.62 H new ATOM 0 HG21 THR A 155 8.945 -1.518 -13.672 1.00 0.56 H new ATOM 0 HG22 THR A 155 8.992 -1.886 -11.931 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.593 -1.029 -12.622 1.00 0.56 H new ATOM 2651 N GLU A 156 9.201 -1.179 -9.516 1.00 0.44 N ATOM 2652 CA GLU A 156 9.822 -2.035 -8.503 1.00 0.43 C ATOM 2653 C GLU A 156 11.227 -2.431 -8.929 1.00 0.41 C ATOM 2654 O GLU A 156 12.182 -2.307 -8.162 1.00 0.39 O ATOM 2655 CB GLU A 156 8.995 -3.302 -8.296 1.00 0.50 C ATOM 2656 CG GLU A 156 7.508 -3.053 -8.134 1.00 0.53 C ATOM 2657 CD GLU A 156 6.685 -4.303 -8.378 1.00 1.06 C ATOM 2658 OE1 GLU A 156 7.280 -5.364 -8.667 1.00 1.75 O ATOM 2659 OE2 GLU A 156 5.439 -4.223 -8.310 1.00 1.72 O ATOM 0 H GLU A 156 8.301 -1.521 -9.854 1.00 0.44 H new ATOM 0 HA GLU A 156 9.868 -1.472 -7.571 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.150 -3.967 -9.146 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.363 -3.823 -7.412 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.312 -2.682 -7.128 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.195 -2.273 -8.828 1.00 0.53 H new ATOM 2666 N LYS A 157 11.337 -2.907 -10.169 1.00 0.44 N ATOM 2667 CA LYS A 157 12.616 -3.323 -10.726 1.00 0.44 C ATOM 2668 C LYS A 157 13.601 -2.162 -10.694 1.00 0.40 C ATOM 2669 O LYS A 157 14.737 -2.290 -10.226 1.00 0.39 O ATOM 2670 CB LYS A 157 12.428 -3.808 -12.164 1.00 0.49 C ATOM 2671 CG LYS A 157 11.281 -4.800 -12.336 1.00 0.69 C ATOM 2672 CD LYS A 157 11.694 -6.210 -11.958 1.00 1.05 C ATOM 2673 CE LYS A 157 12.378 -6.914 -13.118 1.00 1.58 C ATOM 2674 NZ LYS A 157 11.405 -7.370 -14.144 1.00 2.00 N ATOM 0 H LYS A 157 10.548 -3.013 -10.807 1.00 0.44 H new ATOM 0 HA LYS A 157 13.013 -4.141 -10.125 1.00 0.44 H new ATOM 0 HB2 LYS A 157 12.250 -2.946 -12.808 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.353 -4.274 -12.504 1.00 0.49 H new ATOM 0 HG2 LYS A 157 10.437 -4.491 -11.719 1.00 0.69 H new ATOM 0 HG3 LYS A 157 10.941 -4.786 -13.371 1.00 0.69 H new ATOM 0 HD2 LYS A 157 12.368 -6.177 -11.102 1.00 1.05 H new ATOM 0 HD3 LYS A 157 10.816 -6.779 -11.651 1.00 1.05 H new ATOM 0 HE2 LYS A 157 13.099 -6.238 -13.578 1.00 1.58 H new ATOM 0 HE3 LYS A 157 12.938 -7.771 -12.743 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 11.890 -7.974 -14.838 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 10.644 -7.911 -13.685 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 10.999 -6.544 -14.628 1.00 2.00 H new ATOM 2688 N GLU A 158 13.143 -1.020 -11.177 1.00 0.41 N ATOM 2689 CA GLU A 158 13.952 0.174 -11.207 1.00 0.39 C ATOM 2690 C GLU A 158 14.432 0.519 -9.803 1.00 0.35 C ATOM 2691 O GLU A 158 15.594 0.858 -9.594 1.00 0.34 O ATOM 2692 CB GLU A 158 13.130 1.307 -11.795 1.00 0.43 C ATOM 2693 CG GLU A 158 13.700 1.878 -13.077 1.00 0.53 C ATOM 2694 CD GLU A 158 13.731 0.852 -14.195 1.00 1.06 C ATOM 2695 OE1 GLU A 158 12.652 0.333 -14.553 1.00 1.71 O ATOM 2696 OE2 GLU A 158 14.826 0.568 -14.719 1.00 1.71 O ATOM 0 H GLU A 158 12.204 -0.900 -11.556 1.00 0.41 H new ATOM 0 HA GLU A 158 14.833 0.012 -11.828 1.00 0.39 H new ATOM 0 HB2 GLU A 158 12.119 0.948 -11.987 1.00 0.43 H new ATOM 0 HB3 GLU A 158 13.050 2.105 -11.057 1.00 0.43 H new ATOM 0 HG2 GLU A 158 13.103 2.735 -13.389 1.00 0.53 H new ATOM 0 HG3 GLU A 158 14.710 2.243 -12.893 1.00 0.53 H new ATOM 2703 N LEU A 159 13.532 0.382 -8.841 1.00 0.35 N ATOM 2704 CA LEU A 159 13.851 0.672 -7.457 1.00 0.32 C ATOM 2705 C LEU A 159 14.902 -0.292 -6.911 1.00 0.31 C ATOM 2706 O LEU A 159 15.886 0.141 -6.324 1.00 0.30 O ATOM 2707 CB LEU A 159 12.595 0.610 -6.592 1.00 0.34 C ATOM 2708 CG LEU A 159 12.844 0.711 -5.090 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.252 2.118 -4.702 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.612 0.280 -4.326 1.00 0.41 C ATOM 0 H LEU A 159 12.573 0.071 -8.997 1.00 0.35 H new ATOM 0 HA LEU A 159 14.262 1.681 -7.422 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.926 1.417 -6.890 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.076 -0.326 -6.797 1.00 0.34 H new ATOM 0 HG LEU A 159 13.665 0.042 -4.831 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.424 2.164 -3.627 1.00 0.55 H new ATOM 0 HD12 LEU A 159 14.168 2.389 -5.227 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.459 2.815 -4.973 1.00 0.55 H new ATOM 0 HD21 LEU A 159 11.802 0.357 -3.255 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.774 0.925 -4.593 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.370 -0.752 -4.579 1.00 0.41 H new ATOM 2722 N ILE A 160 14.705 -1.596 -7.103 1.00 0.33 N ATOM 2723 CA ILE A 160 15.667 -2.573 -6.593 1.00 0.34 C ATOM 2724 C ILE A 160 17.046 -2.378 -7.221 1.00 0.33 C ATOM 2725 O ILE A 160 18.063 -2.453 -6.519 1.00 0.33 O ATOM 2726 CB ILE A 160 15.204 -4.041 -6.767 1.00 0.38 C ATOM 2727 CG1 ILE A 160 14.683 -4.312 -8.175 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.135 -4.381 -5.739 1.00 0.43 C ATOM 2729 CD1 ILE A 160 15.665 -5.044 -9.066 1.00 0.42 C ATOM 0 H ILE A 160 13.906 -1.995 -7.597 1.00 0.33 H new ATOM 0 HA ILE A 160 15.733 -2.386 -5.521 1.00 0.34 H new ATOM 0 HB ILE A 160 16.074 -4.679 -6.609 1.00 0.38 H new ATOM 0 HG12 ILE A 160 13.766 -4.897 -8.105 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.421 -3.363 -8.643 1.00 0.40 H new ATOM 0 HG21 ILE A 160 13.818 -5.415 -5.872 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.541 -4.252 -4.736 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.279 -3.719 -5.872 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.220 -5.198 -10.049 1.00 0.42 H new ATOM 0 HD12 ILE A 160 16.574 -4.452 -9.169 1.00 0.42 H new ATOM 0 HD13 ILE A 160 15.909 -6.009 -8.623 1.00 0.42 H new ATOM 2741 N LYS A 161 17.101 -2.107 -8.530 1.00 0.34 N ATOM 2742 CA LYS A 161 18.393 -1.894 -9.172 1.00 0.35 C ATOM 2743 C LYS A 161 18.984 -0.553 -8.732 1.00 0.34 C ATOM 2744 O LYS A 161 20.203 -0.401 -8.663 1.00 0.37 O ATOM 2745 CB LYS A 161 18.307 -1.995 -10.700 1.00 0.41 C ATOM 2746 CG LYS A 161 17.275 -1.086 -11.335 1.00 0.78 C ATOM 2747 CD LYS A 161 16.734 -1.690 -12.621 1.00 1.43 C ATOM 2748 CE LYS A 161 17.609 -1.343 -13.811 1.00 1.61 C ATOM 2749 NZ LYS A 161 16.815 -1.183 -15.059 1.00 2.63 N ATOM 0 H LYS A 161 16.291 -2.033 -9.145 1.00 0.34 H new ATOM 0 HA LYS A 161 19.061 -2.693 -8.849 1.00 0.35 H new ATOM 0 HB2 LYS A 161 19.285 -1.763 -11.122 1.00 0.41 H new ATOM 0 HB3 LYS A 161 18.079 -3.026 -10.971 1.00 0.41 H new ATOM 0 HG2 LYS A 161 16.456 -0.916 -10.636 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.721 -0.114 -11.545 1.00 0.78 H new ATOM 0 HD2 LYS A 161 16.672 -2.773 -12.517 1.00 1.43 H new ATOM 0 HD3 LYS A 161 15.721 -1.328 -12.796 1.00 1.43 H new ATOM 0 HE2 LYS A 161 18.151 -0.420 -13.605 1.00 1.61 H new ATOM 0 HE3 LYS A 161 18.354 -2.125 -13.953 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 17.449 -0.930 -15.844 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 16.331 -2.077 -15.279 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 16.109 -0.430 -14.927 1.00 2.63 H new ATOM 2763 N GLU A 162 18.113 0.413 -8.445 1.00 0.33 N ATOM 2764 CA GLU A 162 18.544 1.720 -7.962 1.00 0.35 C ATOM 2765 C GLU A 162 19.096 1.592 -6.542 1.00 0.34 C ATOM 2766 O GLU A 162 20.085 2.233 -6.185 1.00 0.37 O ATOM 2767 CB GLU A 162 17.368 2.704 -8.002 1.00 0.36 C ATOM 2768 CG GLU A 162 17.638 4.042 -7.328 1.00 0.66 C ATOM 2769 CD GLU A 162 18.760 4.823 -7.980 1.00 0.92 C ATOM 2770 OE1 GLU A 162 18.924 4.731 -9.210 1.00 1.62 O ATOM 2771 OE2 GLU A 162 19.479 5.547 -7.260 1.00 1.73 O ATOM 0 H GLU A 162 17.102 0.313 -8.540 1.00 0.33 H new ATOM 0 HA GLU A 162 19.335 2.102 -8.607 1.00 0.35 H new ATOM 0 HB2 GLU A 162 17.097 2.884 -9.042 1.00 0.36 H new ATOM 0 HB3 GLU A 162 16.506 2.239 -7.524 1.00 0.36 H new ATOM 0 HG2 GLU A 162 16.728 4.641 -7.347 1.00 0.66 H new ATOM 0 HG3 GLU A 162 17.885 3.870 -6.280 1.00 0.66 H new ATOM 2778 N LEU A 163 18.463 0.736 -5.741 1.00 0.32 N ATOM 2779 CA LEU A 163 18.888 0.508 -4.363 1.00 0.33 C ATOM 2780 C LEU A 163 20.165 -0.320 -4.317 1.00 0.34 C ATOM 2781 O LEU A 163 20.939 -0.228 -3.365 1.00 0.36 O ATOM 2782 CB LEU A 163 17.790 -0.212 -3.575 1.00 0.33 C ATOM 2783 CG LEU A 163 16.552 0.623 -3.258 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.431 -0.271 -2.750 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.881 1.696 -2.232 1.00 0.46 C ATOM 0 H LEU A 163 17.651 0.188 -6.025 1.00 0.32 H new ATOM 0 HA LEU A 163 19.080 1.481 -3.910 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.479 -1.091 -4.140 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.215 -0.570 -2.637 1.00 0.33 H new ATOM 0 HG LEU A 163 16.220 1.113 -4.173 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.554 0.336 -2.527 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.179 -1.007 -3.513 1.00 0.35 H new ATOM 0 HD13 LEU A 163 15.756 -0.784 -1.845 1.00 0.35 H new ATOM 0 HD21 LEU A 163 15.987 2.281 -2.018 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.235 1.226 -1.314 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.658 2.351 -2.627 1.00 0.46 H new ATOM 2797 N GLY A 164 20.389 -1.120 -5.346 1.00 0.33 N ATOM 2798 CA GLY A 164 21.577 -1.940 -5.389 1.00 0.35 C ATOM 2799 C GLY A 164 21.332 -3.348 -4.880 1.00 0.37 C ATOM 2800 O GLY A 164 22.176 -3.918 -4.189 1.00 0.43 O ATOM 0 H GLY A 164 19.770 -1.216 -6.151 1.00 0.33 H new ATOM 0 HA2 GLY A 164 21.945 -1.987 -6.414 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.359 -1.472 -4.791 1.00 0.35 H new ATOM 2804 N PHE A 165 20.174 -3.904 -5.203 1.00 0.35 N ATOM 2805 CA PHE A 165 19.828 -5.250 -4.770 1.00 0.38 C ATOM 2806 C PHE A 165 19.276 -6.068 -5.928 1.00 0.41 C ATOM 2807 O PHE A 165 19.134 -5.568 -7.046 1.00 0.45 O ATOM 2808 CB PHE A 165 18.807 -5.202 -3.630 1.00 0.38 C ATOM 2809 CG PHE A 165 19.371 -4.655 -2.351 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.277 -5.393 -1.605 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.004 -3.399 -1.904 1.00 1.23 C ATOM 2812 CE1 PHE A 165 20.804 -4.891 -0.433 1.00 1.25 C ATOM 2813 CE2 PHE A 165 19.531 -2.890 -0.731 1.00 1.25 C ATOM 2814 CZ PHE A 165 20.431 -3.637 0.005 1.00 0.48 C ATOM 0 H PHE A 165 19.457 -3.444 -5.764 1.00 0.35 H new ATOM 0 HA PHE A 165 20.737 -5.730 -4.409 1.00 0.38 H new ATOM 0 HB2 PHE A 165 17.959 -4.589 -3.936 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.426 -6.207 -3.450 1.00 0.38 H new ATOM 0 HD1 PHE A 165 20.574 -6.374 -1.946 1.00 1.23 H new ATOM 0 HD2 PHE A 165 18.301 -2.811 -2.475 1.00 1.23 H new ATOM 0 HE1 PHE A 165 21.507 -5.478 0.140 1.00 1.25 H new ATOM 0 HE2 PHE A 165 19.239 -1.908 -0.390 1.00 1.25 H new ATOM 0 HZ PHE A 165 20.842 -3.240 0.922 1.00 0.48 H new ATOM 2824 N THR A 166 18.970 -7.324 -5.650 1.00 0.47 N ATOM 2825 CA THR A 166 18.433 -8.221 -6.656 1.00 0.52 C ATOM 2826 C THR A 166 16.936 -8.421 -6.445 1.00 0.51 C ATOM 2827 O THR A 166 16.463 -8.507 -5.307 1.00 0.51 O ATOM 2828 CB THR A 166 19.157 -9.588 -6.633 1.00 0.61 C ATOM 2829 OG1 THR A 166 18.572 -10.484 -7.588 1.00 1.46 O ATOM 2830 CG2 THR A 166 19.105 -10.216 -5.248 1.00 1.43 C ATOM 0 H THR A 166 19.086 -7.747 -4.729 1.00 0.47 H new ATOM 0 HA THR A 166 18.598 -7.764 -7.632 1.00 0.52 H new ATOM 0 HB THR A 166 20.200 -9.412 -6.896 1.00 0.61 H new ATOM 0 HG1 THR A 166 19.043 -11.343 -7.562 1.00 1.46 H new ATOM 0 HG21 THR A 166 19.622 -11.175 -5.264 1.00 1.43 H new ATOM 0 HG22 THR A 166 19.590 -9.554 -4.530 1.00 1.43 H new ATOM 0 HG23 THR A 166 18.066 -10.369 -4.957 1.00 1.43 H new ATOM 2838 N TYR A 167 16.187 -8.471 -7.539 1.00 0.55 N ATOM 2839 CA TYR A 167 14.751 -8.665 -7.456 1.00 0.57 C ATOM 2840 C TYR A 167 14.436 -10.131 -7.192 1.00 0.57 C ATOM 2841 O TYR A 167 14.673 -10.997 -8.036 1.00 0.67 O ATOM 2842 CB TYR A 167 14.065 -8.197 -8.740 1.00 0.68 C ATOM 2843 CG TYR A 167 12.557 -8.103 -8.635 1.00 0.74 C ATOM 2844 CD1 TYR A 167 11.951 -7.285 -7.688 1.00 1.43 C ATOM 2845 CD2 TYR A 167 11.740 -8.831 -9.491 1.00 1.41 C ATOM 2846 CE1 TYR A 167 10.573 -7.195 -7.599 1.00 1.49 C ATOM 2847 CE2 TYR A 167 10.365 -8.748 -9.410 1.00 1.49 C ATOM 2848 CZ TYR A 167 9.784 -7.929 -8.463 1.00 0.95 C ATOM 2849 OH TYR A 167 8.410 -7.847 -8.384 1.00 1.08 O ATOM 0 H TYR A 167 16.550 -8.380 -8.488 1.00 0.55 H new ATOM 0 HA TYR A 167 14.369 -8.067 -6.629 1.00 0.57 H new ATOM 0 HB2 TYR A 167 14.461 -7.220 -9.016 1.00 0.68 H new ATOM 0 HB3 TYR A 167 14.320 -8.884 -9.547 1.00 0.68 H new ATOM 0 HD1 TYR A 167 12.566 -6.711 -7.011 1.00 1.43 H new ATOM 0 HD2 TYR A 167 12.189 -9.474 -10.234 1.00 1.41 H new ATOM 0 HE1 TYR A 167 10.117 -6.555 -6.858 1.00 1.49 H new ATOM 0 HE2 TYR A 167 9.746 -9.321 -10.085 1.00 1.49 H new ATOM 0 HH TYR A 167 8.131 -6.915 -8.499 1.00 1.08 H new ATOM 2859 N ARG A 168 13.919 -10.393 -6.006 1.00 0.58 N ATOM 2860 CA ARG A 168 13.555 -11.731 -5.593 1.00 0.64 C ATOM 2861 C ARG A 168 12.048 -11.903 -5.655 1.00 0.61 C ATOM 2862 O ARG A 168 11.315 -10.935 -5.856 1.00 0.65 O ATOM 2863 CB ARG A 168 14.055 -11.985 -4.173 1.00 0.78 C ATOM 2864 CG ARG A 168 15.565 -12.075 -4.074 1.00 1.05 C ATOM 2865 CD ARG A 168 16.032 -13.457 -4.466 1.00 1.59 C ATOM 2866 NE ARG A 168 15.676 -14.445 -3.448 1.00 2.25 N ATOM 2867 CZ ARG A 168 15.933 -15.749 -3.530 1.00 3.01 C ATOM 2868 NH1 ARG A 168 16.580 -16.243 -4.577 1.00 3.43 N ATOM 2869 NH2 ARG A 168 15.544 -16.554 -2.552 1.00 3.74 N ATOM 0 H ARG A 168 13.740 -9.679 -5.300 1.00 0.58 H new ATOM 0 HA ARG A 168 14.017 -12.452 -6.268 1.00 0.64 H new ATOM 0 HB2 ARG A 168 13.703 -11.184 -3.523 1.00 0.78 H new ATOM 0 HB3 ARG A 168 13.618 -12.912 -3.802 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.024 -11.330 -4.724 1.00 1.05 H new ATOM 0 HG3 ARG A 168 15.884 -11.850 -3.056 1.00 1.05 H new ATOM 0 HD2 ARG A 168 15.586 -13.737 -5.420 1.00 1.59 H new ATOM 0 HD3 ARG A 168 17.113 -13.452 -4.609 1.00 1.59 H new ATOM 0 HE ARG A 168 15.195 -14.110 -2.613 1.00 2.25 H new ATOM 0 HH11 ARG A 168 16.885 -15.623 -5.327 1.00 3.43 H new ATOM 0 HH12 ARG A 168 16.773 -17.243 -4.632 1.00 3.43 H new ATOM 0 HH21 ARG A 168 15.051 -16.174 -1.744 1.00 3.74 H new ATOM 0 HH22 ARG A 168 15.737 -17.554 -2.607 1.00 3.74 H new ATOM 2883 N ILE A 169 11.582 -13.131 -5.481 1.00 0.63 N ATOM 2884 CA ILE A 169 10.158 -13.408 -5.512 1.00 0.61 C ATOM 2885 C ILE A 169 9.662 -13.713 -4.102 1.00 0.59 C ATOM 2886 O ILE A 169 10.299 -14.465 -3.363 1.00 0.56 O ATOM 2887 CB ILE A 169 9.815 -14.590 -6.449 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.480 -15.880 -5.956 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.232 -14.277 -7.876 1.00 0.71 C ATOM 2890 CD1 ILE A 169 10.232 -17.070 -6.841 1.00 0.67 C ATOM 0 H ILE A 169 12.170 -13.948 -5.317 1.00 0.63 H new ATOM 0 HA ILE A 169 9.659 -12.521 -5.902 1.00 0.61 H new ATOM 0 HB ILE A 169 8.735 -14.739 -6.435 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.555 -15.716 -5.877 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.117 -16.104 -4.953 1.00 0.61 H new ATOM 0 HG21 ILE A 169 9.983 -15.120 -8.521 1.00 0.71 H new ATOM 0 HG22 ILE A 169 9.706 -13.387 -8.222 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.307 -14.099 -7.910 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.735 -17.943 -6.426 1.00 0.67 H new ATOM 0 HD12 ILE A 169 9.161 -17.262 -6.901 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.621 -16.868 -7.839 1.00 0.67 H new ATOM 2902 N PRO A 170 8.521 -13.137 -3.707 1.00 0.65 N ATOM 2903 CA PRO A 170 7.951 -13.354 -2.374 1.00 0.69 C ATOM 2904 C PRO A 170 7.507 -14.788 -2.155 1.00 0.63 C ATOM 2905 O PRO A 170 7.429 -15.265 -1.025 1.00 0.66 O ATOM 2906 CB PRO A 170 6.731 -12.441 -2.350 1.00 0.83 C ATOM 2907 CG PRO A 170 6.411 -12.140 -3.773 1.00 0.83 C ATOM 2908 CD PRO A 170 7.708 -12.211 -4.518 1.00 0.76 C ATOM 0 HA PRO A 170 8.684 -13.148 -1.594 1.00 0.69 H new ATOM 0 HB2 PRO A 170 5.890 -12.928 -1.856 1.00 0.83 H new ATOM 0 HB3 PRO A 170 6.940 -11.526 -1.796 1.00 0.83 H new ATOM 0 HG2 PRO A 170 5.694 -12.858 -4.171 1.00 0.83 H new ATOM 0 HG3 PRO A 170 5.960 -11.152 -3.870 1.00 0.83 H new ATOM 0 HD2 PRO A 170 7.568 -12.583 -5.533 1.00 0.76 H new ATOM 0 HD3 PRO A 170 8.178 -11.231 -4.600 1.00 0.76 H new ATOM 2916 N LYS A 171 7.228 -15.458 -3.259 1.00 0.62 N ATOM 2917 CA LYS A 171 6.762 -16.834 -3.255 1.00 0.63 C ATOM 2918 C LYS A 171 7.728 -17.773 -2.549 1.00 0.63 C ATOM 2919 O LYS A 171 7.314 -18.729 -1.898 1.00 0.73 O ATOM 2920 CB LYS A 171 6.546 -17.283 -4.696 1.00 0.65 C ATOM 2921 CG LYS A 171 5.302 -16.672 -5.315 1.00 0.76 C ATOM 2922 CD LYS A 171 5.656 -15.537 -6.259 1.00 0.79 C ATOM 2923 CE LYS A 171 6.219 -16.068 -7.558 1.00 0.81 C ATOM 2924 NZ LYS A 171 5.147 -16.522 -8.487 1.00 1.03 N ATOM 0 H LYS A 171 7.319 -15.058 -4.193 1.00 0.62 H new ATOM 0 HA LYS A 171 5.826 -16.875 -2.699 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.416 -17.010 -5.293 1.00 0.65 H new ATOM 0 HB3 LYS A 171 6.467 -18.370 -4.727 1.00 0.65 H new ATOM 0 HG2 LYS A 171 4.748 -17.439 -5.857 1.00 0.76 H new ATOM 0 HG3 LYS A 171 4.646 -16.302 -4.527 1.00 0.76 H new ATOM 0 HD2 LYS A 171 4.769 -14.937 -6.461 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.384 -14.879 -5.785 1.00 0.79 H new ATOM 0 HE2 LYS A 171 6.812 -15.291 -8.041 1.00 0.81 H new ATOM 0 HE3 LYS A 171 6.893 -16.899 -7.348 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 5.314 -17.514 -8.752 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.223 -16.441 -8.017 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 5.154 -15.929 -9.342 1.00 1.03 H new ATOM 2938 N LYS A 172 9.012 -17.500 -2.668 1.00 0.59 N ATOM 2939 CA LYS A 172 10.021 -18.346 -2.046 1.00 0.66 C ATOM 2940 C LYS A 172 10.588 -17.704 -0.786 1.00 0.70 C ATOM 2941 O LYS A 172 11.380 -18.328 -0.079 1.00 0.80 O ATOM 2942 CB LYS A 172 11.147 -18.637 -3.045 1.00 0.70 C ATOM 2943 CG LYS A 172 10.918 -19.883 -3.879 1.00 0.77 C ATOM 2944 CD LYS A 172 9.580 -19.844 -4.598 1.00 0.71 C ATOM 2945 CE LYS A 172 9.451 -20.982 -5.598 1.00 0.82 C ATOM 2946 NZ LYS A 172 9.131 -22.274 -4.932 1.00 1.16 N ATOM 0 H LYS A 172 9.384 -16.704 -3.186 1.00 0.59 H new ATOM 0 HA LYS A 172 9.544 -19.282 -1.756 1.00 0.66 H new ATOM 0 HB2 LYS A 172 11.260 -17.781 -3.711 1.00 0.70 H new ATOM 0 HB3 LYS A 172 12.085 -18.743 -2.500 1.00 0.70 H new ATOM 0 HG2 LYS A 172 11.720 -19.983 -4.610 1.00 0.77 H new ATOM 0 HG3 LYS A 172 10.960 -20.763 -3.237 1.00 0.77 H new ATOM 0 HD2 LYS A 172 8.772 -19.906 -3.869 1.00 0.71 H new ATOM 0 HD3 LYS A 172 9.471 -18.890 -5.115 1.00 0.71 H new ATOM 0 HE2 LYS A 172 8.671 -20.743 -6.321 1.00 0.82 H new ATOM 0 HE3 LYS A 172 10.382 -21.082 -6.156 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 9.052 -23.024 -5.649 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 9.888 -22.515 -4.261 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 8.230 -22.187 -4.421 1.00 1.16 H new ATOM 2960 N ARG A 173 10.105 -16.496 -0.475 1.00 0.68 N ATOM 2961 CA ARG A 173 10.569 -15.716 0.684 1.00 0.76 C ATOM 2962 C ARG A 173 12.075 -15.418 0.630 1.00 0.61 C ATOM 2963 O ARG A 173 12.881 -16.290 0.319 1.00 0.97 O ATOM 2964 CB ARG A 173 10.223 -16.427 1.999 1.00 1.36 C ATOM 2965 CG ARG A 173 8.749 -16.348 2.380 1.00 1.98 C ATOM 2966 CD ARG A 173 7.937 -17.461 1.730 1.00 2.47 C ATOM 2967 NE ARG A 173 8.502 -18.780 2.000 1.00 2.99 N ATOM 2968 CZ ARG A 173 7.877 -19.741 2.680 1.00 3.79 C ATOM 2969 NH1 ARG A 173 6.667 -19.535 3.191 1.00 4.07 N ATOM 2970 NH2 ARG A 173 8.478 -20.908 2.860 1.00 4.60 N ATOM 0 H ARG A 173 9.380 -16.028 -1.019 1.00 0.68 H new ATOM 0 HA ARG A 173 10.044 -14.762 0.643 1.00 0.76 H new ATOM 0 HB2 ARG A 173 10.511 -17.475 1.920 1.00 1.36 H new ATOM 0 HB3 ARG A 173 10.819 -15.993 2.802 1.00 1.36 H new ATOM 0 HG2 ARG A 173 8.650 -16.411 3.464 1.00 1.98 H new ATOM 0 HG3 ARG A 173 8.347 -15.381 2.079 1.00 1.98 H new ATOM 0 HD2 ARG A 173 6.912 -17.424 2.098 1.00 2.47 H new ATOM 0 HD3 ARG A 173 7.896 -17.298 0.653 1.00 2.47 H new ATOM 0 HE ARG A 173 9.437 -18.979 1.645 1.00 2.99 H new ATOM 0 HH11 ARG A 173 6.207 -18.634 3.065 1.00 4.07 H new ATOM 0 HH12 ARG A 173 6.199 -20.278 3.709 1.00 4.07 H new ATOM 0 HH21 ARG A 173 9.411 -21.065 2.480 1.00 4.60 H new ATOM 0 HH22 ARG A 173 8.007 -21.649 3.379 1.00 4.60 H new ATOM 2984 N LEU A 174 12.435 -14.176 0.968 1.00 0.60 N ATOM 2985 CA LEU A 174 13.825 -13.731 0.969 1.00 1.13 C ATOM 2986 C LEU A 174 14.553 -14.147 -0.311 1.00 1.70 C ATOM 2987 O LEU A 174 15.481 -14.984 -0.230 1.00 2.14 O ATOM 2988 CB LEU A 174 14.549 -14.288 2.193 1.00 1.32 C ATOM 2989 CG LEU A 174 14.184 -13.637 3.528 1.00 1.64 C ATOM 2990 CD1 LEU A 174 13.034 -14.378 4.193 1.00 1.79 C ATOM 2991 CD2 LEU A 174 15.396 -13.596 4.446 1.00 2.09 C ATOM 2992 OXT LEU A 174 14.189 -13.644 -1.390 1.00 2.37 O ATOM 0 H LEU A 174 11.770 -13.455 1.247 1.00 0.60 H new ATOM 0 HA LEU A 174 13.828 -12.642 1.010 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.342 -15.356 2.261 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.623 -14.181 2.038 1.00 1.32 H new ATOM 0 HG LEU A 174 13.861 -12.614 3.334 1.00 1.64 H new ATOM 0 HD11 LEU A 174 12.791 -13.898 5.141 1.00 1.79 H new ATOM 0 HD12 LEU A 174 12.161 -14.355 3.541 1.00 1.79 H new ATOM 0 HD13 LEU A 174 13.324 -15.413 4.375 1.00 1.79 H new ATOM 0 HD21 LEU A 174 15.120 -13.130 5.392 1.00 2.09 H new ATOM 0 HD22 LEU A 174 15.747 -14.611 4.630 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.190 -13.017 3.974 1.00 2.09 H new TER 3004 LEU A 174 HETATM 3005 PG DGT A 201 -1.058 -10.956 5.972 1.00 0.85 P HETATM 3006 O1G DGT A 201 -0.415 -11.335 7.248 1.00 1.15 O HETATM 3007 O2G DGT A 201 -1.631 -12.006 5.106 1.00 0.98 O HETATM 3008 O3G DGT A 201 -2.266 -9.956 6.329 1.00 0.86 O HETATM 3009 O3B DGT A 201 -0.075 -9.977 5.159 1.00 0.69 O HETATM 3010 PB DGT A 201 -0.843 -8.989 4.153 1.00 0.61 P HETATM 3011 O1B DGT A 201 0.063 -8.722 3.014 1.00 0.78 O HETATM 3012 O2B DGT A 201 -2.192 -9.535 3.884 1.00 0.74 O HETATM 3013 O3A DGT A 201 -0.950 -7.669 5.059 1.00 0.74 O HETATM 3014 PA DGT A 201 -0.358 -6.227 4.659 1.00 0.89 P HETATM 3015 O1A DGT A 201 -0.770 -5.312 5.749 1.00 1.28 O HETATM 3016 O2A DGT A 201 -0.865 -5.938 3.302 1.00 1.02 O HETATM 3017 O5' DGT A 201 1.246 -6.159 4.554 1.00 0.79 O HETATM 3018 C5' DGT A 201 2.091 -7.020 3.780 1.00 0.62 C HETATM 3019 C4' DGT A 201 3.502 -6.460 3.998 1.00 0.68 C HETATM 3020 O4' DGT A 201 3.267 -5.115 4.461 1.00 0.83 O HETATM 3021 C3' DGT A 201 4.300 -7.168 5.084 1.00 0.97 C HETATM 3022 O3' DGT A 201 5.654 -7.387 4.656 1.00 1.76 O HETATM 3023 C2' DGT A 201 4.244 -6.183 6.238 1.00 0.89 C HETATM 3024 C1' DGT A 201 4.210 -4.856 5.510 1.00 0.56 C HETATM 3025 N9 DGT A 201 3.773 -3.770 6.416 1.00 0.59 N HETATM 3026 C8 DGT A 201 4.514 -2.722 6.766 1.00 0.56 C HETATM 3027 N7 DGT A 201 3.971 -2.195 7.861 1.00 0.55 N HETATM 3028 C5 DGT A 201 2.924 -2.935 8.209 1.00 0.57 C HETATM 3029 C6 DGT A 201 2.143 -2.894 9.282 1.00 0.67 C HETATM 3030 O6 DGT A 201 2.149 -1.913 10.024 1.00 0.79 O HETATM 3031 N1 DGT A 201 1.190 -3.898 9.470 1.00 0.80 N HETATM 3032 C2 DGT A 201 1.068 -4.897 8.505 1.00 0.79 C HETATM 3033 N2 DGT A 201 0.229 -5.906 8.694 1.00 0.98 N HETATM 3034 N3 DGT A 201 1.873 -4.861 7.437 1.00 0.76 N HETATM 3035 C4 DGT A 201 2.793 -3.904 7.305 1.00 0.64 C HETATM 0 HO3' DGT A 201 5.964 -6.613 4.141 1.00 1.76 H new HETATM 0 HN2A DGT A 201 0.141 -6.636 7.987 1.00 0.98 H new HETATM 0 H5'A DGT A 201 2.018 -8.055 4.114 1.00 0.62 H new HETATM 0 H2'A DGT A 201 3.361 -6.331 6.860 1.00 0.89 H new HETATM 0 HN2 DGT A 201 -0.329 -5.953 9.547 1.00 0.98 H new HETATM 0 H8 DGT A 201 5.404 -2.361 6.250 1.00 0.56 H new HETATM 0 H5' DGT A 201 1.815 -7.005 2.726 1.00 0.62 H new HETATM 0 H4' DGT A 201 4.078 -6.566 3.079 1.00 0.68 H new HETATM 0 H3' DGT A 201 3.910 -8.153 5.341 1.00 0.97 H new HETATM 0 H2' DGT A 201 5.112 -6.269 6.892 1.00 0.89 H new HETATM 0 H16 DGT A 201 0.594 -3.900 10.298 1.00 0.80 H new HETATM 0 H1' DGT A 201 5.177 -4.520 5.134 1.00 0.56 H new HETATM 3048 MG MG A 202 -3.534 -5.143 6.564 1.00 0.47 MG HETATM 3049 MG MG A 203 -3.035 -8.973 5.980 1.00 0.82 MG