USER MOD reduce.3.24.130724 H: found=0, std=0, add=1696, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1692 hydrogens (26 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 74 ASN :FLIP amide:sc= 0.503 F(o=0.49,f=1) USER MOD Set 1.2: B 85 LYS NZ :NH3+ -173:sc= 0.515 (180deg=0.488) USER MOD Set 2.1: B 1 MET CE :methyl 170:sc= 0 (180deg=-0.202) USER MOD Set 2.2: B 99 ANW OAV : rot 179:sc= 0.451! USER MOD Set 3.1: A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -118:sc= -0.129 (180deg=-0.263) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.00853 (180deg=-0.0281) USER MOD Single : A 7 THR OG1 : rot 94:sc= 0.623 USER MOD Single : A 12 SER OG : rot 58:sc= 0.146 USER MOD Single : A 15 THR OG1 : rot 75:sc= 1.19 USER MOD Single : A 18 THR OG1 : rot -145:sc= 0.36 USER MOD Single : A 19 THR OG1 : rot 86:sc= 1.04 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -1:sc= -0.873 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 176:sc= 0.428 (180deg=0.421) USER MOD Single : A 55 SER OG : rot 30:sc= 0.354 USER MOD Single : A 59 LYS NZ :NH3+ -132:sc= 0.0922 (180deg=-0.013) USER MOD Single : A 60 MET CE :methyl 176:sc= 0 (180deg=-0.0116) USER MOD Single : A 61 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00248) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 67 GLN : amide:sc= -0.062 K(o=-0.062,f=-1.1) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 149:sc= -0.0471 (180deg=-1.13!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0335) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ANW OAV : rot 179:sc= 0.521! USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 173:sc= 0.698 USER MOD Single : B 12 SER OG : rot 59:sc= 0.202 USER MOD Single : B 15 THR OG1 : rot 86:sc= 1.28 USER MOD Single : B 18 THR OG1 : rot -9:sc= 0.126 USER MOD Single : B 19 THR OG1 : rot 69:sc= 1.2 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0135) USER MOD Single : B 32 SER OG : rot -54:sc= -0.178 USER MOD Single : B 34 SER OG : rot -150:sc= 0 USER MOD Single : B 36 ASN : amide:sc=-0.000462 X(o=-0.00046,f=0) USER MOD Single : B 39 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00865) USER MOD Single : B 43 THR OG1 : rot 79:sc= 0.605 USER MOD Single : B 44 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : B 45 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : B 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot 36:sc= 0.00622 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -163:sc= 0.187 (180deg=0.0767) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 67 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00607) USER MOD Single : B 74 ASN : amide:sc= -0.0677 X(o=-0.068,f=0) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0094) USER MOD Single : B 97 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0745) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.756 16.937 6.707 1.00 1.04 N ATOM 2 CA MET A 1 7.426 15.625 6.452 1.00 0.91 C ATOM 3 C MET A 1 7.581 14.815 7.758 1.00 0.73 C ATOM 4 O MET A 1 8.694 14.444 8.157 1.00 0.96 O ATOM 5 CB MET A 1 8.786 15.834 5.737 1.00 1.31 C ATOM 6 CG MET A 1 9.740 16.810 6.435 1.00 1.57 C ATOM 7 SD MET A 1 11.315 17.007 5.576 1.00 2.18 S ATOM 8 CE MET A 1 12.079 15.405 5.846 1.00 2.71 C ATOM 0 H1 MET A 1 6.932 17.578 5.907 1.00 1.04 H new ATOM 0 H2 MET A 1 5.732 16.789 6.813 1.00 1.04 H new ATOM 0 H3 MET A 1 7.137 17.358 7.578 1.00 1.04 H new ATOM 0 HA MET A 1 6.791 15.040 5.786 1.00 0.91 H new ATOM 0 HB2 MET A 1 9.283 14.868 5.643 1.00 1.31 H new ATOM 0 HB3 MET A 1 8.597 16.195 4.726 1.00 1.31 H new ATOM 0 HG2 MET A 1 9.256 17.783 6.519 1.00 1.57 H new ATOM 0 HG3 MET A 1 9.929 16.459 7.450 1.00 1.57 H new ATOM 0 HE1 MET A 1 12.999 15.532 6.416 1.00 2.71 H new ATOM 0 HE2 MET A 1 11.394 14.764 6.401 1.00 2.71 H new ATOM 0 HE3 MET A 1 12.308 14.944 4.885 1.00 2.71 H new ATOM 20 N ALA A 2 6.436 14.548 8.418 1.00 0.77 N ATOM 21 CA ALA A 2 6.395 13.790 9.678 1.00 0.71 C ATOM 22 C ALA A 2 5.103 12.973 9.780 1.00 0.59 C ATOM 23 O ALA A 2 4.012 13.510 9.560 1.00 0.68 O ATOM 24 CB ALA A 2 6.512 14.735 10.868 1.00 1.02 C ATOM 0 H ALA A 2 5.519 14.852 8.091 1.00 0.77 H new ATOM 0 HA ALA A 2 7.240 13.101 9.689 1.00 0.71 H new ATOM 0 HB1 ALA A 2 6.480 14.160 11.794 1.00 1.02 H new ATOM 0 HB2 ALA A 2 7.455 15.278 10.810 1.00 1.02 H new ATOM 0 HB3 ALA A 2 5.684 15.444 10.852 1.00 1.02 H new ATOM 30 N ALA A 3 5.230 11.678 10.122 1.00 0.56 N ATOM 31 CA ALA A 3 4.072 10.784 10.251 1.00 0.54 C ATOM 32 C ALA A 3 3.625 10.677 11.715 1.00 0.55 C ATOM 33 O ALA A 3 4.360 10.139 12.553 1.00 0.70 O ATOM 34 CB ALA A 3 4.392 9.403 9.680 1.00 0.66 C ATOM 0 H ALA A 3 6.126 11.230 10.314 1.00 0.56 H new ATOM 0 HA ALA A 3 3.249 11.209 9.677 1.00 0.54 H new ATOM 0 HB1 ALA A 3 3.522 8.755 9.785 1.00 0.66 H new ATOM 0 HB2 ALA A 3 4.650 9.496 8.625 1.00 0.66 H new ATOM 0 HB3 ALA A 3 5.233 8.971 10.222 1.00 0.66 H new ATOM 40 N GLU A 4 2.420 11.201 12.016 1.00 0.52 N ATOM 41 CA GLU A 4 1.859 11.172 13.379 1.00 0.55 C ATOM 42 C GLU A 4 0.553 10.339 13.402 1.00 0.52 C ATOM 43 O GLU A 4 -0.290 10.502 12.512 1.00 0.50 O ATOM 44 CB GLU A 4 1.601 12.614 13.874 1.00 0.61 C ATOM 45 CG GLU A 4 1.374 12.735 15.382 1.00 0.74 C ATOM 46 CD GLU A 4 1.184 14.171 15.841 1.00 0.86 C ATOM 47 OE1 GLU A 4 0.055 14.689 15.716 1.00 0.94 O ATOM 48 OE2 GLU A 4 2.166 14.775 16.323 1.00 1.02 O ATOM 0 H GLU A 4 1.815 11.651 11.329 1.00 0.52 H new ATOM 0 HA GLU A 4 2.576 10.700 14.051 1.00 0.55 H new ATOM 0 HB2 GLU A 4 2.451 13.238 13.596 1.00 0.61 H new ATOM 0 HB3 GLU A 4 0.729 13.013 13.355 1.00 0.61 H new ATOM 0 HG2 GLU A 4 0.496 12.152 15.660 1.00 0.74 H new ATOM 0 HG3 GLU A 4 2.224 12.301 15.908 1.00 0.74 H new ATOM 55 N PRO A 5 0.356 9.442 14.423 1.00 0.57 N ATOM 56 CA PRO A 5 -0.849 8.585 14.515 1.00 0.59 C ATOM 57 C PRO A 5 -2.121 9.346 14.959 1.00 0.53 C ATOM 58 O PRO A 5 -2.096 10.087 15.949 1.00 0.59 O ATOM 59 CB PRO A 5 -0.443 7.526 15.550 1.00 0.74 C ATOM 60 CG PRO A 5 0.557 8.198 16.426 1.00 0.73 C ATOM 61 CD PRO A 5 1.286 9.190 15.560 1.00 0.67 C ATOM 0 HA PRO A 5 -1.125 8.174 13.544 1.00 0.59 H new ATOM 0 HB2 PRO A 5 -1.305 7.187 16.125 1.00 0.74 H new ATOM 0 HB3 PRO A 5 -0.016 6.647 15.067 1.00 0.74 H new ATOM 0 HG2 PRO A 5 0.067 8.699 17.261 1.00 0.73 H new ATOM 0 HG3 PRO A 5 1.250 7.472 16.852 1.00 0.73 H new ATOM 0 HD2 PRO A 5 1.505 10.108 16.105 1.00 0.67 H new ATOM 0 HD3 PRO A 5 2.239 8.790 15.213 1.00 0.67 H new ATOM 69 N LEU A 6 -3.230 9.137 14.217 1.00 0.58 N ATOM 70 CA LEU A 6 -4.530 9.779 14.506 1.00 0.67 C ATOM 71 C LEU A 6 -5.624 8.707 14.683 1.00 0.71 C ATOM 72 O LEU A 6 -6.219 8.595 15.760 1.00 1.19 O ATOM 73 CB LEU A 6 -4.911 10.765 13.373 1.00 0.84 C ATOM 74 CG LEU A 6 -3.967 11.973 13.168 1.00 0.91 C ATOM 75 CD1 LEU A 6 -4.359 12.758 11.911 1.00 1.14 C ATOM 76 CD2 LEU A 6 -3.961 12.891 14.400 1.00 1.03 C ATOM 0 H LEU A 6 -3.249 8.521 13.404 1.00 0.58 H new ATOM 0 HA LEU A 6 -4.443 10.343 15.435 1.00 0.67 H new ATOM 0 HB2 LEU A 6 -4.961 10.208 12.438 1.00 0.84 H new ATOM 0 HB3 LEU A 6 -5.913 11.144 13.572 1.00 0.84 H new ATOM 0 HG LEU A 6 -2.956 11.588 13.034 1.00 0.91 H new ATOM 0 HD11 LEU A 6 -3.683 13.604 11.785 1.00 1.14 H new ATOM 0 HD12 LEU A 6 -4.292 12.107 11.040 1.00 1.14 H new ATOM 0 HD13 LEU A 6 -5.381 13.123 12.014 1.00 1.14 H new ATOM 0 HD21 LEU A 6 -3.288 13.731 14.225 1.00 1.03 H new ATOM 0 HD22 LEU A 6 -4.969 13.265 14.580 1.00 1.03 H new ATOM 0 HD23 LEU A 6 -3.622 12.330 15.270 1.00 1.03 H new ATOM 88 N THR A 7 -5.873 7.925 13.614 1.00 0.52 N ATOM 89 CA THR A 7 -6.870 6.837 13.612 1.00 0.52 C ATOM 90 C THR A 7 -6.143 5.493 13.406 1.00 0.49 C ATOM 91 O THR A 7 -5.014 5.483 12.912 1.00 0.56 O ATOM 92 CB THR A 7 -7.928 7.065 12.484 1.00 0.58 C ATOM 93 OG1 THR A 7 -8.393 8.424 12.517 1.00 0.98 O ATOM 94 CG2 THR A 7 -9.133 6.133 12.617 1.00 0.94 C ATOM 0 H THR A 7 -5.386 8.031 12.724 1.00 0.52 H new ATOM 0 HA THR A 7 -7.396 6.824 14.567 1.00 0.52 H new ATOM 0 HB THR A 7 -7.433 6.848 11.537 1.00 0.58 H new ATOM 0 HG1 THR A 7 -7.868 8.965 11.890 1.00 0.98 H new ATOM 0 HG21 THR A 7 -9.838 6.332 11.810 1.00 0.94 H new ATOM 0 HG22 THR A 7 -8.800 5.097 12.560 1.00 0.94 H new ATOM 0 HG23 THR A 7 -9.622 6.305 13.576 1.00 0.94 H new ATOM 102 N GLU A 8 -6.783 4.364 13.788 1.00 0.51 N ATOM 103 CA GLU A 8 -6.173 3.019 13.639 1.00 0.50 C ATOM 104 C GLU A 8 -5.772 2.716 12.175 1.00 0.46 C ATOM 105 O GLU A 8 -4.729 2.096 11.945 1.00 0.48 O ATOM 106 CB GLU A 8 -7.118 1.921 14.179 1.00 0.55 C ATOM 107 CG GLU A 8 -6.455 0.551 14.356 1.00 0.91 C ATOM 108 CD GLU A 8 -7.390 -0.489 14.950 1.00 0.95 C ATOM 109 OE1 GLU A 8 -8.240 -1.019 14.203 1.00 1.14 O ATOM 110 OE2 GLU A 8 -7.274 -0.776 16.162 1.00 1.42 O ATOM 0 H GLU A 8 -7.716 4.355 14.200 1.00 0.51 H new ATOM 0 HA GLU A 8 -5.259 3.019 14.233 1.00 0.50 H new ATOM 0 HB2 GLU A 8 -7.520 2.244 15.139 1.00 0.55 H new ATOM 0 HB3 GLU A 8 -7.963 1.818 13.498 1.00 0.55 H new ATOM 0 HG2 GLU A 8 -6.097 0.199 13.388 1.00 0.91 H new ATOM 0 HG3 GLU A 8 -5.582 0.657 15.000 1.00 0.91 H new ATOM 117 N LEU A 9 -6.600 3.149 11.194 1.00 0.45 N ATOM 118 CA LEU A 9 -6.299 2.935 9.758 1.00 0.44 C ATOM 119 C LEU A 9 -5.133 3.832 9.295 1.00 0.42 C ATOM 120 O LEU A 9 -4.313 3.402 8.478 1.00 0.43 O ATOM 121 CB LEU A 9 -7.550 3.166 8.882 1.00 0.48 C ATOM 122 CG LEU A 9 -8.589 2.019 8.889 1.00 0.56 C ATOM 123 CD1 LEU A 9 -9.943 2.499 8.360 1.00 0.65 C ATOM 124 CD2 LEU A 9 -8.087 0.813 8.076 1.00 0.65 C ATOM 0 H LEU A 9 -7.474 3.644 11.369 1.00 0.45 H new ATOM 0 HA LEU A 9 -5.994 1.895 9.638 1.00 0.44 H new ATOM 0 HB2 LEU A 9 -8.042 4.080 9.215 1.00 0.48 H new ATOM 0 HB3 LEU A 9 -7.227 3.334 7.855 1.00 0.48 H new ATOM 0 HG LEU A 9 -8.722 1.700 9.923 1.00 0.56 H new ATOM 0 HD11 LEU A 9 -10.654 1.673 8.376 1.00 0.65 H new ATOM 0 HD12 LEU A 9 -10.313 3.308 8.989 1.00 0.65 H new ATOM 0 HD13 LEU A 9 -9.828 2.858 7.337 1.00 0.65 H new ATOM 0 HD21 LEU A 9 -8.837 0.022 8.098 1.00 0.65 H new ATOM 0 HD22 LEU A 9 -7.911 1.118 7.044 1.00 0.65 H new ATOM 0 HD23 LEU A 9 -7.157 0.444 8.509 1.00 0.65 H new ATOM 136 N GLU A 10 -5.068 5.080 9.816 1.00 0.42 N ATOM 137 CA GLU A 10 -3.964 6.012 9.499 1.00 0.44 C ATOM 138 C GLU A 10 -2.672 5.555 10.211 1.00 0.44 C ATOM 139 O GLU A 10 -1.567 5.794 9.718 1.00 0.48 O ATOM 140 CB GLU A 10 -4.295 7.455 9.935 1.00 0.49 C ATOM 141 CG GLU A 10 -5.519 8.061 9.258 1.00 0.54 C ATOM 142 CD GLU A 10 -5.774 9.499 9.679 1.00 0.63 C ATOM 143 OE1 GLU A 10 -5.106 10.405 9.137 1.00 1.03 O ATOM 144 OE2 GLU A 10 -6.636 9.718 10.557 1.00 0.96 O ATOM 0 H GLU A 10 -5.765 5.462 10.455 1.00 0.42 H new ATOM 0 HA GLU A 10 -3.824 6.002 8.418 1.00 0.44 H new ATOM 0 HB2 GLU A 10 -4.450 7.467 11.014 1.00 0.49 H new ATOM 0 HB3 GLU A 10 -3.432 8.089 9.730 1.00 0.49 H new ATOM 0 HG2 GLU A 10 -5.387 8.022 8.177 1.00 0.54 H new ATOM 0 HG3 GLU A 10 -6.395 7.457 9.494 1.00 0.54 H new ATOM 151 N GLU A 11 -2.844 4.897 11.384 1.00 0.44 N ATOM 152 CA GLU A 11 -1.735 4.367 12.197 1.00 0.46 C ATOM 153 C GLU A 11 -1.029 3.191 11.491 1.00 0.45 C ATOM 154 O GLU A 11 0.178 3.014 11.657 1.00 0.47 O ATOM 155 CB GLU A 11 -2.272 3.918 13.578 1.00 0.52 C ATOM 156 CG GLU A 11 -1.196 3.606 14.625 1.00 0.61 C ATOM 157 CD GLU A 11 -1.784 3.076 15.923 1.00 0.69 C ATOM 158 OE1 GLU A 11 -2.413 3.868 16.655 1.00 0.79 O ATOM 159 OE2 GLU A 11 -1.617 1.870 16.203 1.00 0.81 O ATOM 0 H GLU A 11 -3.763 4.721 11.790 1.00 0.44 H new ATOM 0 HA GLU A 11 -1.000 5.160 12.331 1.00 0.46 H new ATOM 0 HB2 GLU A 11 -2.922 4.701 13.970 1.00 0.52 H new ATOM 0 HB3 GLU A 11 -2.890 3.031 13.439 1.00 0.52 H new ATOM 0 HG2 GLU A 11 -0.500 2.872 14.219 1.00 0.61 H new ATOM 0 HG3 GLU A 11 -0.622 4.509 14.832 1.00 0.61 H new ATOM 166 N SER A 12 -1.794 2.391 10.709 1.00 0.45 N ATOM 167 CA SER A 12 -1.244 1.230 9.976 1.00 0.47 C ATOM 168 C SER A 12 -0.094 1.632 9.026 1.00 0.44 C ATOM 169 O SER A 12 1.003 1.083 9.121 1.00 0.49 O ATOM 170 CB SER A 12 -2.357 0.511 9.194 1.00 0.52 C ATOM 171 OG SER A 12 -3.329 -0.038 10.069 1.00 0.63 O ATOM 0 H SER A 12 -2.795 2.531 10.571 1.00 0.45 H new ATOM 0 HA SER A 12 -0.829 0.547 10.718 1.00 0.47 H new ATOM 0 HB2 SER A 12 -2.835 1.212 8.510 1.00 0.52 H new ATOM 0 HB3 SER A 12 -1.923 -0.282 8.586 1.00 0.52 H new ATOM 0 HG SER A 12 -3.705 0.674 10.628 1.00 0.63 H new ATOM 177 N ILE A 13 -0.356 2.592 8.113 1.00 0.42 N ATOM 178 CA ILE A 13 0.671 3.082 7.160 1.00 0.43 C ATOM 179 C ILE A 13 1.693 4.020 7.848 1.00 0.41 C ATOM 180 O ILE A 13 2.829 4.141 7.379 1.00 0.46 O ATOM 181 CB ILE A 13 0.041 3.781 5.899 1.00 0.47 C ATOM 182 CG1 ILE A 13 -0.858 5.004 6.264 1.00 0.46 C ATOM 183 CG2 ILE A 13 -0.747 2.761 5.066 1.00 0.56 C ATOM 184 CD1 ILE A 13 -0.102 6.299 6.509 1.00 0.44 C ATOM 0 H ILE A 13 -1.265 3.043 8.014 1.00 0.42 H new ATOM 0 HA ILE A 13 1.202 2.197 6.810 1.00 0.43 H new ATOM 0 HB ILE A 13 0.869 4.172 5.307 1.00 0.47 H new ATOM 0 HG12 ILE A 13 -1.574 5.164 5.458 1.00 0.46 H new ATOM 0 HG13 ILE A 13 -1.433 4.761 7.157 1.00 0.46 H new ATOM 0 HG21 ILE A 13 -1.178 3.257 4.196 1.00 0.56 H new ATOM 0 HG22 ILE A 13 -0.078 1.966 4.736 1.00 0.56 H new ATOM 0 HG23 ILE A 13 -1.545 2.334 5.673 1.00 0.56 H new ATOM 0 HD11 ILE A 13 -0.808 7.092 6.756 1.00 0.44 H new ATOM 0 HD12 ILE A 13 0.594 6.163 7.337 1.00 0.44 H new ATOM 0 HD13 ILE A 13 0.451 6.573 5.611 1.00 0.44 H new ATOM 196 N GLU A 14 1.275 4.687 8.948 1.00 0.39 N ATOM 197 CA GLU A 14 2.151 5.602 9.719 1.00 0.40 C ATOM 198 C GLU A 14 3.302 4.831 10.404 1.00 0.41 C ATOM 199 O GLU A 14 4.444 5.299 10.407 1.00 0.44 O ATOM 200 CB GLU A 14 1.298 6.387 10.759 1.00 0.43 C ATOM 201 CG GLU A 14 2.057 7.029 11.934 1.00 0.52 C ATOM 202 CD GLU A 14 2.301 6.063 13.094 1.00 0.61 C ATOM 203 OE1 GLU A 14 1.334 5.415 13.546 1.00 0.93 O ATOM 204 OE2 GLU A 14 3.461 5.945 13.537 1.00 1.00 O ATOM 0 H GLU A 14 0.330 4.608 9.324 1.00 0.39 H new ATOM 0 HA GLU A 14 2.609 6.313 9.032 1.00 0.40 H new ATOM 0 HB2 GLU A 14 0.759 7.174 10.232 1.00 0.43 H new ATOM 0 HB3 GLU A 14 0.550 5.707 11.168 1.00 0.43 H new ATOM 0 HG2 GLU A 14 3.015 7.406 11.576 1.00 0.52 H new ATOM 0 HG3 GLU A 14 1.492 7.887 12.297 1.00 0.52 H new ATOM 211 N THR A 15 2.981 3.654 10.981 1.00 0.42 N ATOM 212 CA THR A 15 3.969 2.804 11.682 1.00 0.45 C ATOM 213 C THR A 15 5.086 2.288 10.740 1.00 0.43 C ATOM 214 O THR A 15 6.205 2.040 11.195 1.00 0.45 O ATOM 215 CB THR A 15 3.259 1.609 12.394 1.00 0.50 C ATOM 216 OG1 THR A 15 2.209 2.118 13.236 1.00 0.65 O ATOM 217 CG2 THR A 15 4.219 0.781 13.255 1.00 0.77 C ATOM 0 H THR A 15 2.037 3.267 10.975 1.00 0.42 H new ATOM 0 HA THR A 15 4.450 3.432 12.432 1.00 0.45 H new ATOM 0 HB THR A 15 2.863 0.957 11.615 1.00 0.50 H new ATOM 0 HG1 THR A 15 1.453 2.401 12.681 1.00 0.65 H new ATOM 0 HG21 THR A 15 3.673 -0.036 13.726 1.00 0.77 H new ATOM 0 HG22 THR A 15 5.011 0.373 12.627 1.00 0.77 H new ATOM 0 HG23 THR A 15 4.657 1.416 14.025 1.00 0.77 H new ATOM 225 N VAL A 16 4.785 2.154 9.430 1.00 0.41 N ATOM 226 CA VAL A 16 5.772 1.677 8.435 1.00 0.42 C ATOM 227 C VAL A 16 6.893 2.728 8.211 1.00 0.42 C ATOM 228 O VAL A 16 8.043 2.358 7.950 1.00 0.46 O ATOM 229 CB VAL A 16 5.109 1.322 7.055 1.00 0.44 C ATOM 230 CG1 VAL A 16 6.093 0.590 6.132 1.00 0.50 C ATOM 231 CG2 VAL A 16 3.837 0.482 7.233 1.00 0.49 C ATOM 0 H VAL A 16 3.869 2.369 9.037 1.00 0.41 H new ATOM 0 HA VAL A 16 6.204 0.766 8.848 1.00 0.42 H new ATOM 0 HB VAL A 16 4.832 2.268 6.590 1.00 0.44 H new ATOM 0 HG11 VAL A 16 5.602 0.359 5.186 1.00 0.50 H new ATOM 0 HG12 VAL A 16 6.959 1.226 5.946 1.00 0.50 H new ATOM 0 HG13 VAL A 16 6.418 -0.336 6.607 1.00 0.50 H new ATOM 0 HG21 VAL A 16 3.409 0.258 6.256 1.00 0.49 H new ATOM 0 HG22 VAL A 16 4.084 -0.449 7.743 1.00 0.49 H new ATOM 0 HG23 VAL A 16 3.113 1.040 7.827 1.00 0.49 H new ATOM 241 N VAL A 17 6.545 4.032 8.319 1.00 0.42 N ATOM 242 CA VAL A 17 7.513 5.133 8.133 1.00 0.47 C ATOM 243 C VAL A 17 8.275 5.428 9.439 1.00 0.55 C ATOM 244 O VAL A 17 9.504 5.529 9.425 1.00 0.95 O ATOM 245 CB VAL A 17 6.818 6.451 7.634 1.00 0.51 C ATOM 246 CG1 VAL A 17 7.840 7.576 7.385 1.00 0.60 C ATOM 247 CG2 VAL A 17 5.989 6.196 6.371 1.00 0.52 C ATOM 0 H VAL A 17 5.598 4.345 8.535 1.00 0.42 H new ATOM 0 HA VAL A 17 8.215 4.801 7.369 1.00 0.47 H new ATOM 0 HB VAL A 17 6.147 6.778 8.428 1.00 0.51 H new ATOM 0 HG11 VAL A 17 7.320 8.470 7.041 1.00 0.60 H new ATOM 0 HG12 VAL A 17 8.370 7.798 8.311 1.00 0.60 H new ATOM 0 HG13 VAL A 17 8.554 7.257 6.626 1.00 0.60 H new ATOM 0 HG21 VAL A 17 5.520 7.126 6.050 1.00 0.52 H new ATOM 0 HG22 VAL A 17 6.638 5.824 5.578 1.00 0.52 H new ATOM 0 HG23 VAL A 17 5.218 5.456 6.585 1.00 0.52 H new ATOM 257 N THR A 18 7.534 5.551 10.563 1.00 0.47 N ATOM 258 CA THR A 18 8.119 5.877 11.885 1.00 0.51 C ATOM 259 C THR A 18 9.114 4.813 12.405 1.00 0.51 C ATOM 260 O THR A 18 10.162 5.174 12.949 1.00 0.60 O ATOM 261 CB THR A 18 7.018 6.114 12.965 1.00 0.56 C ATOM 262 OG1 THR A 18 6.203 4.944 13.109 1.00 0.57 O ATOM 263 CG2 THR A 18 6.125 7.307 12.613 1.00 0.62 C ATOM 0 H THR A 18 6.522 5.428 10.581 1.00 0.47 H new ATOM 0 HA THR A 18 8.676 6.799 11.719 1.00 0.51 H new ATOM 0 HB THR A 18 7.528 6.330 13.904 1.00 0.56 H new ATOM 0 HG1 THR A 18 5.280 5.210 13.304 1.00 0.57 H new ATOM 0 HG21 THR A 18 5.371 7.439 13.389 1.00 0.62 H new ATOM 0 HG22 THR A 18 6.734 8.208 12.541 1.00 0.62 H new ATOM 0 HG23 THR A 18 5.633 7.124 11.658 1.00 0.62 H new ATOM 271 N THR A 19 8.793 3.513 12.238 1.00 0.49 N ATOM 272 CA THR A 19 9.671 2.417 12.716 1.00 0.53 C ATOM 273 C THR A 19 10.995 2.336 11.924 1.00 0.53 C ATOM 274 O THR A 19 12.057 2.152 12.529 1.00 0.62 O ATOM 275 CB THR A 19 8.952 1.036 12.677 1.00 0.55 C ATOM 276 OG1 THR A 19 7.696 1.130 13.355 1.00 0.56 O ATOM 277 CG2 THR A 19 9.788 -0.065 13.340 1.00 0.66 C ATOM 0 H THR A 19 7.939 3.195 11.779 1.00 0.49 H new ATOM 0 HA THR A 19 9.908 2.658 13.752 1.00 0.53 H new ATOM 0 HB THR A 19 8.807 0.772 11.629 1.00 0.55 H new ATOM 0 HG1 THR A 19 7.011 1.451 12.732 1.00 0.56 H new ATOM 0 HG21 THR A 19 9.249 -1.011 13.290 1.00 0.66 H new ATOM 0 HG22 THR A 19 10.740 -0.162 12.819 1.00 0.66 H new ATOM 0 HG23 THR A 19 9.970 0.195 14.383 1.00 0.66 H new ATOM 285 N PHE A 20 10.932 2.471 10.580 1.00 0.53 N ATOM 286 CA PHE A 20 12.135 2.396 9.728 1.00 0.57 C ATOM 287 C PHE A 20 12.523 3.788 9.168 1.00 0.57 C ATOM 288 O PHE A 20 12.816 3.931 7.974 1.00 0.89 O ATOM 289 CB PHE A 20 11.909 1.363 8.593 1.00 0.64 C ATOM 290 CG PHE A 20 13.188 0.722 8.087 1.00 0.71 C ATOM 291 CD1 PHE A 20 13.788 -0.320 8.791 1.00 0.83 C ATOM 292 CD2 PHE A 20 13.798 1.161 6.917 1.00 0.76 C ATOM 293 CE1 PHE A 20 14.959 -0.901 8.339 1.00 0.95 C ATOM 294 CE2 PHE A 20 14.969 0.579 6.464 1.00 0.86 C ATOM 295 CZ PHE A 20 15.549 -0.453 7.176 1.00 0.93 C ATOM 0 H PHE A 20 10.065 2.631 10.067 1.00 0.53 H new ATOM 0 HA PHE A 20 12.974 2.061 10.338 1.00 0.57 H new ATOM 0 HB2 PHE A 20 11.239 0.582 8.953 1.00 0.64 H new ATOM 0 HB3 PHE A 20 11.406 1.855 7.761 1.00 0.64 H new ATOM 0 HD1 PHE A 20 13.332 -0.679 9.702 1.00 0.83 H new ATOM 0 HD2 PHE A 20 13.352 1.967 6.354 1.00 0.76 H new ATOM 0 HE1 PHE A 20 15.412 -1.707 8.898 1.00 0.95 H new ATOM 0 HE2 PHE A 20 15.430 0.932 5.553 1.00 0.86 H new ATOM 0 HZ PHE A 20 16.463 -0.908 6.823 1.00 0.93 H new ATOM 305 N PHE A 21 12.533 4.813 10.049 1.00 0.71 N ATOM 306 CA PHE A 21 12.897 6.189 9.657 1.00 0.73 C ATOM 307 C PHE A 21 14.402 6.446 9.879 1.00 0.66 C ATOM 308 O PHE A 21 15.077 6.956 8.981 1.00 0.67 O ATOM 309 CB PHE A 21 12.060 7.219 10.448 1.00 1.04 C ATOM 310 CG PHE A 21 12.121 8.634 9.901 1.00 1.67 C ATOM 311 CD1 PHE A 21 13.123 9.511 10.301 1.00 2.34 C ATOM 312 CD2 PHE A 21 11.171 9.090 8.995 1.00 1.97 C ATOM 313 CE1 PHE A 21 13.175 10.801 9.811 1.00 3.02 C ATOM 314 CE2 PHE A 21 11.219 10.377 8.504 1.00 2.74 C ATOM 315 CZ PHE A 21 12.221 11.234 8.913 1.00 3.17 C ATOM 0 H PHE A 21 12.293 4.711 11.035 1.00 0.71 H new ATOM 0 HA PHE A 21 12.681 6.303 8.595 1.00 0.73 H new ATOM 0 HB2 PHE A 21 11.020 6.892 10.459 1.00 1.04 H new ATOM 0 HB3 PHE A 21 12.402 7.228 11.483 1.00 1.04 H new ATOM 0 HD1 PHE A 21 13.871 9.179 11.005 1.00 2.34 H new ATOM 0 HD2 PHE A 21 10.383 8.426 8.671 1.00 1.97 H new ATOM 0 HE1 PHE A 21 13.961 11.470 10.130 1.00 3.02 H new ATOM 0 HE2 PHE A 21 10.473 10.715 7.800 1.00 2.74 H new ATOM 0 HZ PHE A 21 12.258 12.243 8.530 1.00 3.17 H new ATOM 325 N THR A 22 14.920 6.083 11.082 1.00 0.75 N ATOM 326 CA THR A 22 16.351 6.276 11.426 1.00 0.89 C ATOM 327 C THR A 22 17.291 5.591 10.403 1.00 0.82 C ATOM 328 O THR A 22 18.383 6.099 10.130 1.00 0.97 O ATOM 329 CB THR A 22 16.670 5.757 12.863 1.00 1.11 C ATOM 330 OG1 THR A 22 15.689 6.245 13.798 1.00 1.25 O ATOM 331 CG2 THR A 22 18.068 6.181 13.328 1.00 1.37 C ATOM 0 H THR A 22 14.368 5.657 11.827 1.00 0.75 H new ATOM 0 HA THR A 22 16.532 7.350 11.392 1.00 0.89 H new ATOM 0 HB THR A 22 16.640 4.668 12.827 1.00 1.11 H new ATOM 0 HG1 THR A 22 15.898 5.912 14.695 1.00 1.25 H new ATOM 0 HG21 THR A 22 18.249 5.799 14.333 1.00 1.37 H new ATOM 0 HG22 THR A 22 18.816 5.777 12.646 1.00 1.37 H new ATOM 0 HG23 THR A 22 18.134 7.269 13.336 1.00 1.37 H new ATOM 339 N PHE A 23 16.847 4.449 9.840 1.00 0.69 N ATOM 340 CA PHE A 23 17.626 3.706 8.833 1.00 0.76 C ATOM 341 C PHE A 23 17.495 4.360 7.439 1.00 0.69 C ATOM 342 O PHE A 23 18.470 4.402 6.687 1.00 0.82 O ATOM 343 CB PHE A 23 17.171 2.228 8.777 1.00 0.87 C ATOM 344 CG PHE A 23 17.569 1.401 9.993 1.00 1.04 C ATOM 345 CD1 PHE A 23 16.865 1.499 11.191 1.00 1.01 C ATOM 346 CD2 PHE A 23 18.643 0.518 9.935 1.00 1.34 C ATOM 347 CE1 PHE A 23 17.225 0.742 12.293 1.00 1.24 C ATOM 348 CE2 PHE A 23 19.002 -0.239 11.036 1.00 1.55 C ATOM 349 CZ PHE A 23 18.292 -0.128 12.215 1.00 1.49 C ATOM 0 H PHE A 23 15.949 4.021 10.068 1.00 0.69 H new ATOM 0 HA PHE A 23 18.675 3.738 9.128 1.00 0.76 H new ATOM 0 HB2 PHE A 23 16.087 2.198 8.671 1.00 0.87 H new ATOM 0 HB3 PHE A 23 17.591 1.765 7.884 1.00 0.87 H new ATOM 0 HD1 PHE A 23 16.026 2.175 11.261 1.00 1.01 H new ATOM 0 HD2 PHE A 23 19.204 0.422 9.017 1.00 1.34 H new ATOM 0 HE1 PHE A 23 16.670 0.833 13.215 1.00 1.24 H new ATOM 0 HE2 PHE A 23 19.839 -0.918 10.973 1.00 1.55 H new ATOM 0 HZ PHE A 23 18.571 -0.721 13.073 1.00 1.49 H new ATOM 359 N ALA A 24 16.291 4.884 7.111 1.00 0.59 N ATOM 360 CA ALA A 24 16.032 5.539 5.806 1.00 0.67 C ATOM 361 C ALA A 24 16.791 6.873 5.632 1.00 0.62 C ATOM 362 O ALA A 24 17.132 7.238 4.505 1.00 0.83 O ATOM 363 CB ALA A 24 14.533 5.762 5.604 1.00 0.82 C ATOM 0 H ALA A 24 15.482 4.866 7.733 1.00 0.59 H new ATOM 0 HA ALA A 24 16.409 4.858 5.044 1.00 0.67 H new ATOM 0 HB1 ALA A 24 14.363 6.244 4.641 1.00 0.82 H new ATOM 0 HB2 ALA A 24 14.016 4.803 5.626 1.00 0.82 H new ATOM 0 HB3 ALA A 24 14.149 6.399 6.401 1.00 0.82 H new ATOM 369 N ARG A 25 17.044 7.600 6.746 1.00 0.61 N ATOM 370 CA ARG A 25 17.767 8.895 6.701 1.00 0.65 C ATOM 371 C ARG A 25 19.313 8.724 6.694 1.00 0.69 C ATOM 372 O ARG A 25 20.039 9.724 6.674 1.00 0.88 O ATOM 373 CB ARG A 25 17.326 9.814 7.875 1.00 0.75 C ATOM 374 CG ARG A 25 17.680 9.299 9.279 1.00 0.78 C ATOM 375 CD ARG A 25 17.279 10.279 10.388 1.00 0.97 C ATOM 376 NE ARG A 25 17.895 9.928 11.684 1.00 1.09 N ATOM 377 CZ ARG A 25 17.422 10.264 12.907 1.00 1.32 C ATOM 378 NH1 ARG A 25 16.276 10.946 13.062 1.00 1.55 N ATOM 379 NH2 ARG A 25 18.109 9.902 13.993 1.00 1.47 N ATOM 0 H ARG A 25 16.760 7.314 7.683 1.00 0.61 H new ATOM 0 HA ARG A 25 17.497 9.368 5.757 1.00 0.65 H new ATOM 0 HB2 ARG A 25 17.783 10.794 7.739 1.00 0.75 H new ATOM 0 HB3 ARG A 25 16.247 9.955 7.819 1.00 0.75 H new ATOM 0 HG2 ARG A 25 17.183 8.344 9.447 1.00 0.78 H new ATOM 0 HG3 ARG A 25 18.753 9.114 9.334 1.00 0.78 H new ATOM 0 HD2 ARG A 25 17.578 11.288 10.106 1.00 0.97 H new ATOM 0 HD3 ARG A 25 16.194 10.285 10.492 1.00 0.97 H new ATOM 0 HE ARG A 25 18.756 9.382 11.655 1.00 1.09 H new ATOM 0 HH11 ARG A 25 15.735 11.226 12.244 1.00 1.55 H new ATOM 0 HH12 ARG A 25 15.947 11.184 13.998 1.00 1.55 H new ATOM 0 HH21 ARG A 25 18.979 9.379 13.895 1.00 1.47 H new ATOM 0 HH22 ARG A 25 17.764 10.149 14.921 1.00 1.47 H new ATOM 393 N GLN A 26 19.816 7.469 6.698 1.00 0.73 N ATOM 394 CA GLN A 26 21.269 7.202 6.701 1.00 0.84 C ATOM 395 C GLN A 26 21.910 7.483 5.324 1.00 0.78 C ATOM 396 O GLN A 26 22.983 8.094 5.258 1.00 0.89 O ATOM 397 CB GLN A 26 21.547 5.742 7.130 1.00 1.01 C ATOM 398 CG GLN A 26 22.940 5.515 7.721 1.00 1.22 C ATOM 399 CD GLN A 26 23.239 4.042 7.984 1.00 1.49 C ATOM 400 OE1 GLN A 26 23.775 3.345 7.119 1.00 1.63 O ATOM 401 NE2 GLN A 26 22.887 3.556 9.178 1.00 1.80 N ATOM 0 H GLN A 26 19.238 6.629 6.699 1.00 0.73 H new ATOM 0 HA GLN A 26 21.724 7.882 7.422 1.00 0.84 H new ATOM 0 HB2 GLN A 26 20.800 5.443 7.865 1.00 1.01 H new ATOM 0 HB3 GLN A 26 21.421 5.091 6.265 1.00 1.01 H new ATOM 0 HG2 GLN A 26 23.689 5.917 7.038 1.00 1.22 H new ATOM 0 HG3 GLN A 26 23.029 6.071 8.654 1.00 1.22 H new ATOM 0 HE21 GLN A 26 22.446 4.165 9.867 1.00 1.80 H new ATOM 0 HE22 GLN A 26 23.060 2.576 9.401 1.00 1.80 H new ATOM 410 N GLU A 27 21.242 7.045 4.232 1.00 0.70 N ATOM 411 CA GLU A 27 21.763 7.235 2.862 1.00 0.76 C ATOM 412 C GLU A 27 20.654 7.656 1.881 1.00 0.93 C ATOM 413 O GLU A 27 19.646 6.957 1.742 1.00 1.59 O ATOM 414 CB GLU A 27 22.427 5.929 2.364 1.00 0.92 C ATOM 415 CG GLU A 27 23.850 5.693 2.874 1.00 1.09 C ATOM 416 CD GLU A 27 24.881 6.612 2.232 1.00 1.27 C ATOM 417 OE1 GLU A 27 25.390 6.265 1.143 1.00 1.52 O ATOM 418 OE2 GLU A 27 25.178 7.675 2.817 1.00 1.46 O ATOM 0 H GLU A 27 20.346 6.560 4.274 1.00 0.70 H new ATOM 0 HA GLU A 27 22.501 8.036 2.899 1.00 0.76 H new ATOM 0 HB2 GLU A 27 21.805 5.086 2.664 1.00 0.92 H new ATOM 0 HB3 GLU A 27 22.445 5.941 1.274 1.00 0.92 H new ATOM 0 HG2 GLU A 27 23.869 5.836 3.954 1.00 1.09 H new ATOM 0 HG3 GLU A 27 24.129 4.657 2.684 1.00 1.09 H new ATOM 425 N GLY A 28 20.855 8.810 1.207 1.00 0.79 N ATOM 426 CA GLY A 28 19.895 9.312 0.225 1.00 0.92 C ATOM 427 C GLY A 28 18.590 9.816 0.833 1.00 0.73 C ATOM 428 O GLY A 28 17.772 9.011 1.275 1.00 0.72 O ATOM 0 H GLY A 28 21.675 9.403 1.332 1.00 0.79 H new ATOM 0 HA2 GLY A 28 20.358 10.122 -0.339 1.00 0.92 H new ATOM 0 HA3 GLY A 28 19.669 8.517 -0.486 1.00 0.92 H new ATOM 432 N ARG A 29 18.409 11.159 0.866 1.00 0.72 N ATOM 433 CA ARG A 29 17.181 11.815 1.390 1.00 0.71 C ATOM 434 C ARG A 29 16.755 11.308 2.804 1.00 0.68 C ATOM 435 O ARG A 29 17.471 10.518 3.431 1.00 0.76 O ATOM 436 CB ARG A 29 16.037 11.655 0.355 1.00 0.73 C ATOM 437 CG ARG A 29 16.266 12.426 -0.953 1.00 0.92 C ATOM 438 CD ARG A 29 15.037 12.416 -1.865 1.00 1.31 C ATOM 439 NE ARG A 29 15.243 13.201 -3.096 1.00 1.46 N ATOM 440 CZ ARG A 29 15.095 14.544 -3.204 1.00 1.91 C ATOM 441 NH1 ARG A 29 14.776 15.300 -2.143 1.00 2.60 N ATOM 442 NH2 ARG A 29 15.281 15.138 -4.383 1.00 2.05 N ATOM 0 H ARG A 29 19.110 11.820 0.530 1.00 0.72 H new ATOM 0 HA ARG A 29 17.406 12.872 1.529 1.00 0.71 H new ATOM 0 HB2 ARG A 29 15.915 10.597 0.124 1.00 0.73 H new ATOM 0 HB3 ARG A 29 15.104 11.993 0.805 1.00 0.73 H new ATOM 0 HG2 ARG A 29 16.533 13.457 -0.721 1.00 0.92 H new ATOM 0 HG3 ARG A 29 17.112 11.990 -1.484 1.00 0.92 H new ATOM 0 HD2 ARG A 29 14.793 11.387 -2.130 1.00 1.31 H new ATOM 0 HD3 ARG A 29 14.181 12.816 -1.321 1.00 1.31 H new ATOM 0 HE ARG A 29 15.520 12.692 -3.935 1.00 1.46 H new ATOM 0 HH11 ARG A 29 14.639 14.866 -1.230 1.00 2.60 H new ATOM 0 HH12 ARG A 29 14.670 16.309 -2.249 1.00 2.60 H new ATOM 0 HH21 ARG A 29 15.534 14.582 -5.200 1.00 2.05 H new ATOM 0 HH22 ARG A 29 15.170 16.148 -4.468 1.00 2.05 H new ATOM 456 N LYS A 30 15.594 11.797 3.309 1.00 0.67 N ATOM 457 CA LYS A 30 15.067 11.411 4.637 1.00 0.67 C ATOM 458 C LYS A 30 13.965 10.344 4.532 1.00 0.66 C ATOM 459 O LYS A 30 13.944 9.403 5.330 1.00 0.72 O ATOM 460 CB LYS A 30 14.516 12.647 5.384 1.00 0.76 C ATOM 461 CG LYS A 30 15.540 13.755 5.632 1.00 0.82 C ATOM 462 CD LYS A 30 16.678 13.312 6.556 1.00 0.89 C ATOM 463 CE LYS A 30 17.631 14.461 6.885 1.00 1.00 C ATOM 464 NZ LYS A 30 18.410 14.927 5.697 1.00 1.22 N ATOM 0 H LYS A 30 15.004 12.463 2.811 1.00 0.67 H new ATOM 0 HA LYS A 30 15.900 10.985 5.197 1.00 0.67 H new ATOM 0 HB2 LYS A 30 13.686 13.060 4.811 1.00 0.76 H new ATOM 0 HB3 LYS A 30 14.112 12.324 6.343 1.00 0.76 H new ATOM 0 HG2 LYS A 30 15.957 14.079 4.678 1.00 0.82 H new ATOM 0 HG3 LYS A 30 15.037 14.618 6.069 1.00 0.82 H new ATOM 0 HD2 LYS A 30 16.260 12.913 7.480 1.00 0.89 H new ATOM 0 HD3 LYS A 30 17.235 12.504 6.083 1.00 0.89 H new ATOM 0 HE2 LYS A 30 17.059 15.296 7.289 1.00 1.00 H new ATOM 0 HE3 LYS A 30 18.323 14.141 7.664 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 19.039 15.706 5.978 1.00 1.22 H new ATOM 0 HZ2 LYS A 30 18.979 14.140 5.324 1.00 1.22 H new ATOM 0 HZ3 LYS A 30 17.755 15.259 4.961 1.00 1.22 H new ATOM 478 N ASP A 31 13.045 10.500 3.555 1.00 0.66 N ATOM 479 CA ASP A 31 11.936 9.550 3.358 1.00 0.71 C ATOM 480 C ASP A 31 12.192 8.622 2.152 1.00 0.64 C ATOM 481 O ASP A 31 11.310 8.416 1.306 1.00 0.89 O ATOM 482 CB ASP A 31 10.602 10.317 3.222 1.00 0.87 C ATOM 483 CG ASP A 31 10.095 10.815 4.565 1.00 1.03 C ATOM 484 OD1 ASP A 31 9.511 10.004 5.314 1.00 1.38 O ATOM 485 OD2 ASP A 31 10.288 12.011 4.870 1.00 1.43 O ATOM 0 H ASP A 31 13.051 11.276 2.892 1.00 0.66 H new ATOM 0 HA ASP A 31 11.870 8.906 4.235 1.00 0.71 H new ATOM 0 HB2 ASP A 31 10.737 11.163 2.548 1.00 0.87 H new ATOM 0 HB3 ASP A 31 9.853 9.666 2.770 1.00 0.87 H new ATOM 490 N SER A 32 13.417 8.057 2.088 1.00 0.65 N ATOM 491 CA SER A 32 13.811 7.125 1.022 1.00 0.58 C ATOM 492 C SER A 32 14.811 6.096 1.565 1.00 0.56 C ATOM 493 O SER A 32 15.862 6.466 2.102 1.00 0.63 O ATOM 494 CB SER A 32 14.404 7.876 -0.189 1.00 0.58 C ATOM 495 OG SER A 32 15.711 8.346 0.067 1.00 1.09 O ATOM 0 H SER A 32 14.153 8.236 2.772 1.00 0.65 H new ATOM 0 HA SER A 32 12.918 6.602 0.679 1.00 0.58 H new ATOM 0 HB2 SER A 32 14.420 7.213 -1.054 1.00 0.58 H new ATOM 0 HB3 SER A 32 13.760 8.717 -0.444 1.00 0.58 H new ATOM 0 HG SER A 32 15.973 8.103 0.980 1.00 1.09 H new ATOM 501 N LEU A 33 14.473 4.802 1.430 1.00 0.54 N ATOM 502 CA LEU A 33 15.336 3.709 1.909 1.00 0.54 C ATOM 503 C LEU A 33 16.520 3.484 0.945 1.00 0.52 C ATOM 504 O LEU A 33 16.564 4.070 -0.142 1.00 0.66 O ATOM 505 CB LEU A 33 14.519 2.398 2.069 1.00 0.55 C ATOM 506 CG LEU A 33 13.587 2.295 3.304 1.00 0.67 C ATOM 507 CD1 LEU A 33 12.384 3.241 3.207 1.00 0.76 C ATOM 508 CD2 LEU A 33 13.110 0.851 3.483 1.00 0.75 C ATOM 0 H LEU A 33 13.607 4.487 0.992 1.00 0.54 H new ATOM 0 HA LEU A 33 15.733 3.994 2.883 1.00 0.54 H new ATOM 0 HB2 LEU A 33 13.911 2.267 1.174 1.00 0.55 H new ATOM 0 HB3 LEU A 33 15.220 1.564 2.103 1.00 0.55 H new ATOM 0 HG LEU A 33 14.167 2.600 4.175 1.00 0.67 H new ATOM 0 HD11 LEU A 33 11.762 3.131 4.095 1.00 0.76 H new ATOM 0 HD12 LEU A 33 12.735 4.270 3.135 1.00 0.76 H new ATOM 0 HD13 LEU A 33 11.798 2.995 2.321 1.00 0.76 H new ATOM 0 HD21 LEU A 33 12.456 0.789 4.353 1.00 0.75 H new ATOM 0 HD22 LEU A 33 12.563 0.536 2.595 1.00 0.75 H new ATOM 0 HD23 LEU A 33 13.971 0.199 3.629 1.00 0.75 H new ATOM 520 N SER A 34 17.491 2.657 1.370 1.00 0.50 N ATOM 521 CA SER A 34 18.664 2.324 0.548 1.00 0.52 C ATOM 522 C SER A 34 18.523 0.899 -0.009 1.00 0.47 C ATOM 523 O SER A 34 17.786 0.084 0.554 1.00 0.47 O ATOM 524 CB SER A 34 19.952 2.463 1.377 1.00 0.62 C ATOM 525 OG SER A 34 21.112 2.232 0.585 1.00 0.68 O ATOM 0 H SER A 34 17.484 2.205 2.284 1.00 0.50 H new ATOM 0 HA SER A 34 18.723 3.019 -0.289 1.00 0.52 H new ATOM 0 HB2 SER A 34 20.000 3.462 1.811 1.00 0.62 H new ATOM 0 HB3 SER A 34 19.930 1.756 2.206 1.00 0.62 H new ATOM 0 HG SER A 34 21.913 2.330 1.141 1.00 0.68 H new ATOM 531 N VAL A 35 19.246 0.598 -1.106 1.00 0.50 N ATOM 532 CA VAL A 35 19.187 -0.733 -1.753 1.00 0.49 C ATOM 533 C VAL A 35 19.681 -1.873 -0.819 1.00 0.45 C ATOM 534 O VAL A 35 19.217 -3.012 -0.937 1.00 0.46 O ATOM 535 CB VAL A 35 19.971 -0.738 -3.109 1.00 0.59 C ATOM 536 CG1 VAL A 35 21.492 -0.678 -2.909 1.00 0.63 C ATOM 537 CG2 VAL A 35 19.571 -1.938 -3.975 1.00 0.64 C ATOM 0 H VAL A 35 19.877 1.256 -1.564 1.00 0.50 H new ATOM 0 HA VAL A 35 18.136 -0.931 -1.964 1.00 0.49 H new ATOM 0 HB VAL A 35 19.689 0.172 -3.639 1.00 0.59 H new ATOM 0 HG11 VAL A 35 21.987 -0.684 -3.880 1.00 0.63 H new ATOM 0 HG12 VAL A 35 21.753 0.235 -2.374 1.00 0.63 H new ATOM 0 HG13 VAL A 35 21.817 -1.543 -2.331 1.00 0.63 H new ATOM 0 HG21 VAL A 35 20.131 -1.915 -4.910 1.00 0.64 H new ATOM 0 HG22 VAL A 35 19.793 -2.862 -3.441 1.00 0.64 H new ATOM 0 HG23 VAL A 35 18.504 -1.891 -4.191 1.00 0.64 H new ATOM 547 N ASN A 36 20.618 -1.555 0.097 1.00 0.45 N ATOM 548 CA ASN A 36 21.163 -2.541 1.050 1.00 0.46 C ATOM 549 C ASN A 36 20.369 -2.558 2.375 1.00 0.44 C ATOM 550 O ASN A 36 20.226 -3.619 2.987 1.00 0.55 O ATOM 551 CB ASN A 36 22.652 -2.236 1.331 1.00 0.55 C ATOM 552 CG ASN A 36 23.347 -3.327 2.145 1.00 0.64 C ATOM 553 OD1 ASN A 36 23.840 -4.307 1.587 1.00 0.82 O ATOM 554 ND2 ASN A 36 23.394 -3.164 3.472 1.00 0.77 N ATOM 0 H ASN A 36 21.013 -0.620 0.196 1.00 0.45 H new ATOM 0 HA ASN A 36 21.071 -3.527 0.596 1.00 0.46 H new ATOM 0 HB2 ASN A 36 23.175 -2.110 0.383 1.00 0.55 H new ATOM 0 HB3 ASN A 36 22.728 -1.289 1.866 1.00 0.55 H new ATOM 0 HD21 ASN A 36 23.850 -3.865 4.056 1.00 0.77 H new ATOM 0 HD22 ASN A 36 22.974 -2.339 3.900 1.00 0.77 H new ATOM 561 N GLU A 37 19.851 -1.387 2.810 1.00 0.44 N ATOM 562 CA GLU A 37 19.102 -1.282 4.080 1.00 0.46 C ATOM 563 C GLU A 37 17.710 -1.940 4.005 1.00 0.41 C ATOM 564 O GLU A 37 17.256 -2.508 5.003 1.00 0.43 O ATOM 565 CB GLU A 37 18.994 0.190 4.532 1.00 0.55 C ATOM 566 CG GLU A 37 20.343 0.814 4.898 1.00 0.70 C ATOM 567 CD GLU A 37 20.220 2.220 5.456 1.00 0.83 C ATOM 568 OE1 GLU A 37 19.983 3.158 4.663 1.00 1.25 O ATOM 569 OE2 GLU A 37 20.365 2.385 6.687 1.00 1.54 O ATOM 0 H GLU A 37 19.938 -0.507 2.302 1.00 0.44 H new ATOM 0 HA GLU A 37 19.669 -1.836 4.828 1.00 0.46 H new ATOM 0 HB2 GLU A 37 18.536 0.775 3.734 1.00 0.55 H new ATOM 0 HB3 GLU A 37 18.329 0.250 5.393 1.00 0.55 H new ATOM 0 HG2 GLU A 37 20.841 0.181 5.632 1.00 0.70 H new ATOM 0 HG3 GLU A 37 20.978 0.836 4.012 1.00 0.70 H new ATOM 576 N PHE A 38 17.030 -1.867 2.838 1.00 0.40 N ATOM 577 CA PHE A 38 15.704 -2.507 2.674 1.00 0.39 C ATOM 578 C PHE A 38 15.858 -4.048 2.612 1.00 0.37 C ATOM 579 O PHE A 38 15.032 -4.777 3.164 1.00 0.40 O ATOM 580 CB PHE A 38 14.949 -1.945 1.430 1.00 0.43 C ATOM 581 CG PHE A 38 15.034 -2.786 0.162 1.00 0.41 C ATOM 582 CD1 PHE A 38 16.112 -2.666 -0.704 1.00 0.49 C ATOM 583 CD2 PHE A 38 14.034 -3.701 -0.153 1.00 0.50 C ATOM 584 CE1 PHE A 38 16.194 -3.433 -1.847 1.00 0.61 C ATOM 585 CE2 PHE A 38 14.111 -4.468 -1.299 1.00 0.61 C ATOM 586 CZ PHE A 38 15.192 -4.335 -2.147 1.00 0.65 C ATOM 0 H PHE A 38 17.370 -1.380 2.009 1.00 0.40 H new ATOM 0 HA PHE A 38 15.093 -2.265 3.544 1.00 0.39 H new ATOM 0 HB2 PHE A 38 13.898 -1.823 1.692 1.00 0.43 H new ATOM 0 HB3 PHE A 38 15.340 -0.952 1.210 1.00 0.43 H new ATOM 0 HD1 PHE A 38 16.899 -1.961 -0.479 1.00 0.49 H new ATOM 0 HD2 PHE A 38 13.187 -3.813 0.507 1.00 0.50 H new ATOM 0 HE1 PHE A 38 17.042 -3.328 -2.508 1.00 0.61 H new ATOM 0 HE2 PHE A 38 13.326 -5.172 -1.532 1.00 0.61 H new ATOM 0 HZ PHE A 38 15.254 -4.935 -3.043 1.00 0.65 H new ATOM 596 N LYS A 39 16.945 -4.520 1.943 1.00 0.37 N ATOM 597 CA LYS A 39 17.252 -5.965 1.795 1.00 0.40 C ATOM 598 C LYS A 39 17.418 -6.661 3.167 1.00 0.38 C ATOM 599 O LYS A 39 17.064 -7.836 3.311 1.00 0.42 O ATOM 600 CB LYS A 39 18.533 -6.149 0.940 1.00 0.46 C ATOM 601 CG LYS A 39 18.752 -7.573 0.414 1.00 0.55 C ATOM 602 CD LYS A 39 19.939 -7.652 -0.554 1.00 0.64 C ATOM 603 CE LYS A 39 20.204 -9.080 -1.038 1.00 0.76 C ATOM 604 NZ LYS A 39 19.153 -9.582 -1.978 1.00 0.87 N ATOM 0 H LYS A 39 17.629 -3.910 1.494 1.00 0.37 H new ATOM 0 HA LYS A 39 16.408 -6.435 1.290 1.00 0.40 H new ATOM 0 HB2 LYS A 39 18.489 -5.466 0.092 1.00 0.46 H new ATOM 0 HB3 LYS A 39 19.397 -5.860 1.538 1.00 0.46 H new ATOM 0 HG2 LYS A 39 18.923 -8.247 1.253 1.00 0.55 H new ATOM 0 HG3 LYS A 39 17.849 -7.916 -0.091 1.00 0.55 H new ATOM 0 HD2 LYS A 39 19.747 -7.010 -1.414 1.00 0.64 H new ATOM 0 HD3 LYS A 39 20.832 -7.267 -0.062 1.00 0.64 H new ATOM 0 HE2 LYS A 39 21.174 -9.116 -1.533 1.00 0.76 H new ATOM 0 HE3 LYS A 39 20.261 -9.745 -0.176 1.00 0.76 H new ATOM 0 HZ1 LYS A 39 19.385 -10.552 -2.272 1.00 0.87 H new ATOM 0 HZ2 LYS A 39 18.229 -9.576 -1.501 1.00 0.87 H new ATOM 0 HZ3 LYS A 39 19.114 -8.967 -2.815 1.00 0.87 H new ATOM 618 N GLU A 40 17.961 -5.927 4.166 1.00 0.38 N ATOM 619 CA GLU A 40 18.157 -6.462 5.533 1.00 0.40 C ATOM 620 C GLU A 40 16.819 -6.614 6.276 1.00 0.40 C ATOM 621 O GLU A 40 16.637 -7.571 7.028 1.00 0.44 O ATOM 622 CB GLU A 40 19.092 -5.551 6.356 1.00 0.45 C ATOM 623 CG GLU A 40 20.533 -5.504 5.854 1.00 0.49 C ATOM 624 CD GLU A 40 21.394 -4.520 6.627 1.00 0.59 C ATOM 625 OE1 GLU A 40 21.434 -3.333 6.238 1.00 0.64 O ATOM 626 OE2 GLU A 40 22.021 -4.937 7.624 1.00 0.73 O ATOM 0 H GLU A 40 18.271 -4.962 4.050 1.00 0.38 H new ATOM 0 HA GLU A 40 18.614 -7.446 5.425 1.00 0.40 H new ATOM 0 HB2 GLU A 40 18.687 -4.539 6.354 1.00 0.45 H new ATOM 0 HB3 GLU A 40 19.092 -5.892 7.391 1.00 0.45 H new ATOM 0 HG2 GLU A 40 20.971 -6.499 5.928 1.00 0.49 H new ATOM 0 HG3 GLU A 40 20.537 -5.232 4.799 1.00 0.49 H new ATOM 633 N LEU A 41 15.888 -5.659 6.056 1.00 0.39 N ATOM 634 CA LEU A 41 14.557 -5.668 6.702 1.00 0.41 C ATOM 635 C LEU A 41 13.702 -6.873 6.253 1.00 0.40 C ATOM 636 O LEU A 41 12.889 -7.375 7.033 1.00 0.44 O ATOM 637 CB LEU A 41 13.826 -4.341 6.402 1.00 0.44 C ATOM 638 CG LEU A 41 12.638 -3.974 7.322 1.00 0.55 C ATOM 639 CD1 LEU A 41 13.087 -3.813 8.783 1.00 0.65 C ATOM 640 CD2 LEU A 41 11.951 -2.701 6.811 1.00 0.58 C ATOM 0 H LEU A 41 16.036 -4.867 5.431 1.00 0.39 H new ATOM 0 HA LEU A 41 14.706 -5.767 7.777 1.00 0.41 H new ATOM 0 HB2 LEU A 41 14.556 -3.533 6.451 1.00 0.44 H new ATOM 0 HB3 LEU A 41 13.461 -4.379 5.376 1.00 0.44 H new ATOM 0 HG LEU A 41 11.919 -4.793 7.295 1.00 0.55 H new ATOM 0 HD11 LEU A 41 12.227 -3.555 9.402 1.00 0.65 H new ATOM 0 HD12 LEU A 41 13.520 -4.749 9.136 1.00 0.65 H new ATOM 0 HD13 LEU A 41 13.832 -3.020 8.849 1.00 0.65 H new ATOM 0 HD21 LEU A 41 11.116 -2.451 7.465 1.00 0.58 H new ATOM 0 HD22 LEU A 41 12.667 -1.879 6.805 1.00 0.58 H new ATOM 0 HD23 LEU A 41 11.582 -2.868 5.799 1.00 0.58 H new ATOM 652 N VAL A 42 13.883 -7.320 4.989 1.00 0.36 N ATOM 653 CA VAL A 42 13.149 -8.482 4.443 1.00 0.37 C ATOM 654 C VAL A 42 13.637 -9.796 5.097 1.00 0.38 C ATOM 655 O VAL A 42 12.841 -10.715 5.301 1.00 0.41 O ATOM 656 CB VAL A 42 13.286 -8.574 2.879 1.00 0.40 C ATOM 657 CG1 VAL A 42 12.579 -9.810 2.300 1.00 0.45 C ATOM 658 CG2 VAL A 42 12.750 -7.304 2.208 1.00 0.41 C ATOM 0 H VAL A 42 14.532 -6.892 4.329 1.00 0.36 H new ATOM 0 HA VAL A 42 12.095 -8.339 4.680 1.00 0.37 H new ATOM 0 HB VAL A 42 14.350 -8.672 2.665 1.00 0.40 H new ATOM 0 HG11 VAL A 42 12.704 -9.827 1.217 1.00 0.45 H new ATOM 0 HG12 VAL A 42 13.014 -10.712 2.729 1.00 0.45 H new ATOM 0 HG13 VAL A 42 11.517 -9.769 2.542 1.00 0.45 H new ATOM 0 HG21 VAL A 42 12.856 -7.392 1.127 1.00 0.41 H new ATOM 0 HG22 VAL A 42 11.697 -7.176 2.461 1.00 0.41 H new ATOM 0 HG23 VAL A 42 13.315 -6.441 2.559 1.00 0.41 H new ATOM 668 N THR A 43 14.946 -9.870 5.429 1.00 0.39 N ATOM 669 CA THR A 43 15.541 -11.063 6.061 1.00 0.42 C ATOM 670 C THR A 43 15.811 -10.835 7.576 1.00 0.49 C ATOM 671 O THR A 43 16.780 -11.376 8.123 1.00 0.80 O ATOM 672 CB THR A 43 16.869 -11.463 5.331 1.00 0.45 C ATOM 673 OG1 THR A 43 16.787 -11.146 3.927 1.00 0.46 O ATOM 674 CG2 THR A 43 17.189 -12.954 5.487 1.00 0.50 C ATOM 0 H THR A 43 15.610 -9.113 5.268 1.00 0.39 H new ATOM 0 HA THR A 43 14.822 -11.877 5.968 1.00 0.42 H new ATOM 0 HB THR A 43 17.670 -10.890 5.799 1.00 0.45 H new ATOM 0 HG1 THR A 43 17.624 -11.400 3.485 1.00 0.46 H new ATOM 0 HG21 THR A 43 18.118 -13.183 4.964 1.00 0.50 H new ATOM 0 HG22 THR A 43 17.299 -13.194 6.545 1.00 0.50 H new ATOM 0 HG23 THR A 43 16.378 -13.546 5.063 1.00 0.50 H new ATOM 682 N GLN A 44 14.940 -10.050 8.260 1.00 0.41 N ATOM 683 CA GLN A 44 15.108 -9.766 9.702 1.00 0.44 C ATOM 684 C GLN A 44 13.753 -9.595 10.424 1.00 0.44 C ATOM 685 O GLN A 44 13.486 -10.301 11.399 1.00 0.50 O ATOM 686 CB GLN A 44 15.988 -8.509 9.911 1.00 0.48 C ATOM 687 CG GLN A 44 16.504 -8.335 11.345 1.00 0.65 C ATOM 688 CD GLN A 44 17.379 -7.100 11.519 1.00 0.77 C ATOM 689 OE1 GLN A 44 18.596 -7.168 11.349 1.00 1.02 O ATOM 690 NE2 GLN A 44 16.769 -5.962 11.864 1.00 1.10 N ATOM 0 H GLN A 44 14.123 -9.608 7.838 1.00 0.41 H new ATOM 0 HA GLN A 44 15.607 -10.629 10.142 1.00 0.44 H new ATOM 0 HB2 GLN A 44 16.840 -8.559 9.234 1.00 0.48 H new ATOM 0 HB3 GLN A 44 15.412 -7.626 9.634 1.00 0.48 H new ATOM 0 HG2 GLN A 44 15.655 -8.270 12.025 1.00 0.65 H new ATOM 0 HG3 GLN A 44 17.074 -9.220 11.630 1.00 0.65 H new ATOM 0 HE21 GLN A 44 15.758 -5.945 11.996 1.00 1.10 H new ATOM 0 HE22 GLN A 44 17.315 -5.110 11.995 1.00 1.10 H new ATOM 699 N GLN A 45 12.909 -8.653 9.947 1.00 0.41 N ATOM 700 CA GLN A 45 11.596 -8.374 10.569 1.00 0.43 C ATOM 701 C GLN A 45 10.404 -8.585 9.604 1.00 0.41 C ATOM 702 O GLN A 45 9.252 -8.432 10.024 1.00 0.45 O ATOM 703 CB GLN A 45 11.592 -6.932 11.122 1.00 0.47 C ATOM 704 CG GLN A 45 10.524 -6.662 12.190 1.00 0.59 C ATOM 705 CD GLN A 45 10.789 -5.408 13.024 1.00 0.64 C ATOM 706 OE1 GLN A 45 11.378 -4.436 12.541 1.00 0.65 O ATOM 707 NE2 GLN A 45 10.354 -5.416 14.286 1.00 0.84 N ATOM 0 H GLN A 45 13.114 -8.073 9.133 1.00 0.41 H new ATOM 0 HA GLN A 45 11.460 -9.092 11.378 1.00 0.43 H new ATOM 0 HB2 GLN A 45 12.573 -6.716 11.545 1.00 0.47 H new ATOM 0 HB3 GLN A 45 11.442 -6.239 10.294 1.00 0.47 H new ATOM 0 HG2 GLN A 45 9.553 -6.565 11.704 1.00 0.59 H new ATOM 0 HG3 GLN A 45 10.463 -7.523 12.855 1.00 0.59 H new ATOM 0 HE21 GLN A 45 9.871 -6.236 14.654 1.00 0.84 H new ATOM 0 HE22 GLN A 45 10.505 -4.602 14.883 1.00 0.84 H new ATOM 716 N LEU A 46 10.668 -8.936 8.323 1.00 0.40 N ATOM 717 CA LEU A 46 9.598 -9.161 7.334 1.00 0.40 C ATOM 718 C LEU A 46 9.875 -10.411 6.438 1.00 0.40 C ATOM 719 O LEU A 46 9.639 -10.355 5.223 1.00 0.42 O ATOM 720 CB LEU A 46 9.436 -7.877 6.479 1.00 0.41 C ATOM 721 CG LEU A 46 8.061 -7.683 5.779 1.00 0.40 C ATOM 722 CD1 LEU A 46 7.331 -6.448 6.325 1.00 0.59 C ATOM 723 CD2 LEU A 46 8.226 -7.577 4.259 1.00 0.67 C ATOM 0 H LEU A 46 11.610 -9.068 7.956 1.00 0.40 H new ATOM 0 HA LEU A 46 8.668 -9.371 7.862 1.00 0.40 H new ATOM 0 HB2 LEU A 46 9.618 -7.014 7.120 1.00 0.41 H new ATOM 0 HB3 LEU A 46 10.212 -7.875 5.714 1.00 0.41 H new ATOM 0 HG LEU A 46 7.455 -8.562 5.997 1.00 0.40 H new ATOM 0 HD11 LEU A 46 6.373 -6.338 5.817 1.00 0.59 H new ATOM 0 HD12 LEU A 46 7.163 -6.568 7.395 1.00 0.59 H new ATOM 0 HD13 LEU A 46 7.938 -5.560 6.151 1.00 0.59 H new ATOM 0 HD21 LEU A 46 7.249 -7.442 3.795 1.00 0.67 H new ATOM 0 HD22 LEU A 46 8.862 -6.724 4.021 1.00 0.67 H new ATOM 0 HD23 LEU A 46 8.685 -8.489 3.878 1.00 0.67 H new ATOM 735 N PRO A 47 10.366 -11.572 7.005 1.00 0.42 N ATOM 736 CA PRO A 47 10.637 -12.787 6.201 1.00 0.45 C ATOM 737 C PRO A 47 9.376 -13.630 5.884 1.00 0.47 C ATOM 738 O PRO A 47 9.256 -14.160 4.774 1.00 0.52 O ATOM 739 CB PRO A 47 11.623 -13.568 7.080 1.00 0.49 C ATOM 740 CG PRO A 47 11.271 -13.198 8.482 1.00 0.49 C ATOM 741 CD PRO A 47 10.718 -11.795 8.437 1.00 0.46 C ATOM 0 HA PRO A 47 11.021 -12.534 5.213 1.00 0.45 H new ATOM 0 HB2 PRO A 47 11.528 -14.642 6.920 1.00 0.49 H new ATOM 0 HB3 PRO A 47 12.654 -13.301 6.849 1.00 0.49 H new ATOM 0 HG2 PRO A 47 10.535 -13.890 8.891 1.00 0.49 H new ATOM 0 HG3 PRO A 47 12.149 -13.247 9.127 1.00 0.49 H new ATOM 0 HD2 PRO A 47 9.844 -11.693 9.080 1.00 0.46 H new ATOM 0 HD3 PRO A 47 11.454 -11.068 8.782 1.00 0.46 H new ATOM 749 N HIS A 48 8.443 -13.755 6.860 1.00 0.47 N ATOM 750 CA HIS A 48 7.196 -14.538 6.674 1.00 0.52 C ATOM 751 C HIS A 48 6.258 -13.892 5.638 1.00 0.50 C ATOM 752 O HIS A 48 5.545 -14.605 4.922 1.00 0.57 O ATOM 753 CB HIS A 48 6.442 -14.718 8.009 1.00 0.57 C ATOM 754 CG HIS A 48 7.186 -15.527 9.028 1.00 0.65 C ATOM 755 ND1 HIS A 48 8.088 -14.975 9.911 1.00 0.69 N ATOM 756 CD2 HIS A 48 7.149 -16.850 9.307 1.00 0.79 C ATOM 757 CE1 HIS A 48 8.578 -15.923 10.688 1.00 0.80 C ATOM 758 NE2 HIS A 48 8.024 -17.072 10.341 1.00 0.85 N ATOM 0 H HIS A 48 8.530 -13.325 7.781 1.00 0.47 H new ATOM 0 HA HIS A 48 7.499 -15.516 6.300 1.00 0.52 H new ATOM 0 HB2 HIS A 48 6.227 -13.735 8.428 1.00 0.57 H new ATOM 0 HB3 HIS A 48 5.483 -15.197 7.811 1.00 0.57 H new ATOM 0 HD2 HIS A 48 6.544 -17.593 8.809 1.00 0.79 H new ATOM 0 HE1 HIS A 48 9.307 -15.784 11.473 1.00 0.80 H new ATOM 0 HE2 HIS A 48 8.216 -17.977 10.772 1.00 0.85 H new ATOM 767 N LEU A 49 6.252 -12.541 5.565 1.00 0.46 N ATOM 768 CA LEU A 49 5.403 -11.804 4.605 1.00 0.46 C ATOM 769 C LEU A 49 5.873 -12.059 3.161 1.00 0.45 C ATOM 770 O LEU A 49 5.077 -12.459 2.306 1.00 0.53 O ATOM 771 CB LEU A 49 5.407 -10.285 4.920 1.00 0.47 C ATOM 772 CG LEU A 49 4.033 -9.575 4.863 1.00 0.50 C ATOM 773 CD1 LEU A 49 3.136 -10.019 6.025 1.00 0.87 C ATOM 774 CD2 LEU A 49 4.216 -8.057 4.855 1.00 0.53 C ATOM 0 H LEU A 49 6.825 -11.942 6.159 1.00 0.46 H new ATOM 0 HA LEU A 49 4.381 -12.169 4.704 1.00 0.46 H new ATOM 0 HB2 LEU A 49 5.826 -10.142 5.916 1.00 0.47 H new ATOM 0 HB3 LEU A 49 6.078 -9.791 4.218 1.00 0.47 H new ATOM 0 HG LEU A 49 3.537 -9.862 3.936 1.00 0.50 H new ATOM 0 HD11 LEU A 49 2.177 -9.505 5.961 1.00 0.87 H new ATOM 0 HD12 LEU A 49 2.975 -11.096 5.970 1.00 0.87 H new ATOM 0 HD13 LEU A 49 3.618 -9.772 6.971 1.00 0.87 H new ATOM 0 HD21 LEU A 49 3.240 -7.573 4.815 1.00 0.53 H new ATOM 0 HD22 LEU A 49 4.737 -7.749 5.761 1.00 0.53 H new ATOM 0 HD23 LEU A 49 4.802 -7.766 3.983 1.00 0.53 H new ATOM 786 N LEU A 50 7.178 -11.822 2.904 1.00 0.43 N ATOM 787 CA LEU A 50 7.784 -12.049 1.583 1.00 0.45 C ATOM 788 C LEU A 50 8.560 -13.379 1.611 1.00 0.48 C ATOM 789 O LEU A 50 9.723 -13.417 2.025 1.00 0.54 O ATOM 790 CB LEU A 50 8.718 -10.878 1.194 1.00 0.48 C ATOM 791 CG LEU A 50 8.057 -9.479 1.084 1.00 0.57 C ATOM 792 CD1 LEU A 50 9.121 -8.388 0.944 1.00 0.66 C ATOM 793 CD2 LEU A 50 7.069 -9.418 -0.092 1.00 0.73 C ATOM 0 H LEU A 50 7.832 -11.471 3.603 1.00 0.43 H new ATOM 0 HA LEU A 50 6.997 -12.103 0.831 1.00 0.45 H new ATOM 0 HB2 LEU A 50 9.520 -10.821 1.930 1.00 0.48 H new ATOM 0 HB3 LEU A 50 9.181 -11.114 0.236 1.00 0.48 H new ATOM 0 HG LEU A 50 7.497 -9.304 2.003 1.00 0.57 H new ATOM 0 HD11 LEU A 50 8.636 -7.415 0.868 1.00 0.66 H new ATOM 0 HD12 LEU A 50 9.773 -8.402 1.817 1.00 0.66 H new ATOM 0 HD13 LEU A 50 9.712 -8.570 0.047 1.00 0.66 H new ATOM 0 HD21 LEU A 50 6.623 -8.425 -0.141 1.00 0.73 H new ATOM 0 HD22 LEU A 50 7.598 -9.625 -1.022 1.00 0.73 H new ATOM 0 HD23 LEU A 50 6.285 -10.161 0.053 1.00 0.73 H new ATOM 805 N LYS A 51 7.892 -14.473 1.187 1.00 0.55 N ATOM 806 CA LYS A 51 8.494 -15.830 1.184 1.00 0.66 C ATOM 807 C LYS A 51 9.812 -15.920 0.381 1.00 0.63 C ATOM 808 O LYS A 51 10.732 -16.639 0.786 1.00 0.76 O ATOM 809 CB LYS A 51 7.469 -16.891 0.692 1.00 0.78 C ATOM 810 CG LYS A 51 7.271 -17.022 -0.831 1.00 0.78 C ATOM 811 CD LYS A 51 6.592 -15.803 -1.461 1.00 1.18 C ATOM 812 CE LYS A 51 6.588 -15.872 -2.986 1.00 1.16 C ATOM 813 NZ LYS A 51 5.764 -17.003 -3.512 1.00 1.32 N ATOM 0 H LYS A 51 6.933 -14.446 0.841 1.00 0.55 H new ATOM 0 HA LYS A 51 8.757 -16.046 2.219 1.00 0.66 H new ATOM 0 HB2 LYS A 51 7.776 -17.863 1.078 1.00 0.78 H new ATOM 0 HB3 LYS A 51 6.502 -16.661 1.140 1.00 0.78 H new ATOM 0 HG2 LYS A 51 8.241 -17.174 -1.305 1.00 0.78 H new ATOM 0 HG3 LYS A 51 6.673 -17.909 -1.038 1.00 0.78 H new ATOM 0 HD2 LYS A 51 5.566 -15.733 -1.099 1.00 1.18 H new ATOM 0 HD3 LYS A 51 7.106 -14.897 -1.141 1.00 1.18 H new ATOM 0 HE2 LYS A 51 6.206 -14.933 -3.387 1.00 1.16 H new ATOM 0 HE3 LYS A 51 7.612 -15.978 -3.343 1.00 1.16 H new ATOM 0 HZ1 LYS A 51 5.741 -16.962 -4.551 1.00 1.32 H new ATOM 0 HZ2 LYS A 51 6.181 -17.906 -3.210 1.00 1.32 H new ATOM 0 HZ3 LYS A 51 4.795 -16.928 -3.141 1.00 1.32 H new ATOM 827 N ASP A 52 9.897 -15.189 -0.747 1.00 0.64 N ATOM 828 CA ASP A 52 11.096 -15.197 -1.598 1.00 0.71 C ATOM 829 C ASP A 52 12.105 -14.131 -1.121 1.00 0.59 C ATOM 830 O ASP A 52 12.269 -13.081 -1.754 1.00 0.73 O ATOM 831 CB ASP A 52 10.692 -14.992 -3.082 1.00 0.99 C ATOM 832 CG ASP A 52 11.766 -15.422 -4.076 1.00 1.46 C ATOM 833 OD1 ASP A 52 12.388 -16.488 -3.870 1.00 2.08 O ATOM 834 OD2 ASP A 52 11.973 -14.694 -5.068 1.00 2.02 O ATOM 0 H ASP A 52 9.148 -14.586 -1.088 1.00 0.64 H new ATOM 0 HA ASP A 52 11.590 -16.166 -1.518 1.00 0.71 H new ATOM 0 HB2 ASP A 52 9.779 -15.554 -3.282 1.00 0.99 H new ATOM 0 HB3 ASP A 52 10.460 -13.939 -3.244 1.00 0.99 H new ATOM 839 N VAL A 53 12.771 -14.418 0.022 1.00 0.51 N ATOM 840 CA VAL A 53 13.771 -13.504 0.615 1.00 0.52 C ATOM 841 C VAL A 53 15.127 -13.567 -0.125 1.00 0.56 C ATOM 842 O VAL A 53 15.834 -12.557 -0.202 1.00 0.71 O ATOM 843 CB VAL A 53 13.986 -13.757 2.150 1.00 0.59 C ATOM 844 CG1 VAL A 53 12.674 -13.574 2.922 1.00 0.65 C ATOM 845 CG2 VAL A 53 14.599 -15.140 2.448 1.00 0.64 C ATOM 0 H VAL A 53 12.632 -15.278 0.552 1.00 0.51 H new ATOM 0 HA VAL A 53 13.358 -12.502 0.496 1.00 0.52 H new ATOM 0 HB VAL A 53 14.705 -13.012 2.489 1.00 0.59 H new ATOM 0 HG11 VAL A 53 12.848 -13.754 3.983 1.00 0.65 H new ATOM 0 HG12 VAL A 53 12.308 -12.557 2.782 1.00 0.65 H new ATOM 0 HG13 VAL A 53 11.932 -14.281 2.551 1.00 0.65 H new ATOM 0 HG21 VAL A 53 14.724 -15.258 3.524 1.00 0.64 H new ATOM 0 HG22 VAL A 53 13.937 -15.920 2.072 1.00 0.64 H new ATOM 0 HG23 VAL A 53 15.570 -15.221 1.959 1.00 0.64 H new ATOM 855 N GLY A 54 15.480 -14.754 -0.668 1.00 0.53 N ATOM 856 CA GLY A 54 16.741 -14.931 -1.390 1.00 0.64 C ATOM 857 C GLY A 54 16.784 -14.220 -2.743 1.00 0.61 C ATOM 858 O GLY A 54 17.730 -13.469 -3.018 1.00 0.83 O ATOM 0 H GLY A 54 14.906 -15.595 -0.615 1.00 0.53 H new ATOM 0 HA2 GLY A 54 17.558 -14.562 -0.770 1.00 0.64 H new ATOM 0 HA3 GLY A 54 16.914 -15.996 -1.544 1.00 0.64 H new ATOM 862 N SER A 55 15.761 -14.460 -3.588 1.00 0.57 N ATOM 863 CA SER A 55 15.678 -13.846 -4.923 1.00 0.58 C ATOM 864 C SER A 55 14.774 -12.597 -4.900 1.00 0.51 C ATOM 865 O SER A 55 13.631 -12.625 -5.373 1.00 0.62 O ATOM 866 CB SER A 55 15.189 -14.871 -5.968 1.00 0.74 C ATOM 867 OG SER A 55 15.087 -14.289 -7.260 1.00 0.85 O ATOM 0 H SER A 55 14.980 -15.077 -3.366 1.00 0.57 H new ATOM 0 HA SER A 55 16.679 -13.525 -5.212 1.00 0.58 H new ATOM 0 HB2 SER A 55 15.878 -15.715 -6.001 1.00 0.74 H new ATOM 0 HB3 SER A 55 14.218 -15.264 -5.667 1.00 0.74 H new ATOM 0 HG SER A 55 15.748 -13.571 -7.348 1.00 0.85 H new ATOM 873 N LEU A 56 15.306 -11.500 -4.329 1.00 0.49 N ATOM 874 CA LEU A 56 14.581 -10.216 -4.243 1.00 0.53 C ATOM 875 C LEU A 56 14.855 -9.337 -5.494 1.00 0.58 C ATOM 876 O LEU A 56 14.201 -8.310 -5.676 1.00 1.03 O ATOM 877 CB LEU A 56 14.987 -9.458 -2.943 1.00 0.67 C ATOM 878 CG LEU A 56 13.846 -8.806 -2.116 1.00 0.83 C ATOM 879 CD1 LEU A 56 13.092 -7.744 -2.916 1.00 1.22 C ATOM 880 CD2 LEU A 56 12.882 -9.862 -1.566 1.00 1.21 C ATOM 0 H LEU A 56 16.239 -11.477 -3.918 1.00 0.49 H new ATOM 0 HA LEU A 56 13.512 -10.427 -4.209 1.00 0.53 H new ATOM 0 HB2 LEU A 56 15.516 -10.157 -2.296 1.00 0.67 H new ATOM 0 HB3 LEU A 56 15.696 -8.676 -3.215 1.00 0.67 H new ATOM 0 HG LEU A 56 14.316 -8.303 -1.271 1.00 0.83 H new ATOM 0 HD11 LEU A 56 12.303 -7.315 -2.298 1.00 1.22 H new ATOM 0 HD12 LEU A 56 13.783 -6.958 -3.219 1.00 1.22 H new ATOM 0 HD13 LEU A 56 12.651 -8.201 -3.802 1.00 1.22 H new ATOM 0 HD21 LEU A 56 12.095 -9.373 -0.992 1.00 1.21 H new ATOM 0 HD22 LEU A 56 12.437 -10.415 -2.393 1.00 1.21 H new ATOM 0 HD23 LEU A 56 13.427 -10.551 -0.921 1.00 1.21 H new ATOM 892 N ASP A 57 15.808 -9.764 -6.363 1.00 0.49 N ATOM 893 CA ASP A 57 16.183 -9.016 -7.589 1.00 0.53 C ATOM 894 C ASP A 57 14.998 -8.810 -8.560 1.00 0.47 C ATOM 895 O ASP A 57 14.935 -7.777 -9.227 1.00 0.50 O ATOM 896 CB ASP A 57 17.373 -9.695 -8.308 1.00 0.67 C ATOM 897 CG ASP A 57 17.097 -11.134 -8.737 1.00 0.70 C ATOM 898 OD1 ASP A 57 17.025 -12.015 -7.851 1.00 0.77 O ATOM 899 OD2 ASP A 57 16.962 -11.379 -9.956 1.00 0.77 O ATOM 0 H ASP A 57 16.333 -10.629 -6.234 1.00 0.49 H new ATOM 0 HA ASP A 57 16.490 -8.023 -7.262 1.00 0.53 H new ATOM 0 HB2 ASP A 57 17.636 -9.108 -9.188 1.00 0.67 H new ATOM 0 HB3 ASP A 57 18.239 -9.683 -7.646 1.00 0.67 H new ATOM 904 N GLU A 58 14.064 -9.789 -8.635 1.00 0.46 N ATOM 905 CA GLU A 58 12.877 -9.679 -9.518 1.00 0.51 C ATOM 906 C GLU A 58 12.024 -8.443 -9.149 1.00 0.47 C ATOM 907 O GLU A 58 11.624 -7.675 -10.030 1.00 0.56 O ATOM 908 CB GLU A 58 12.016 -10.962 -9.438 1.00 0.60 C ATOM 909 CG GLU A 58 10.875 -11.041 -10.464 1.00 0.79 C ATOM 910 CD GLU A 58 9.916 -12.189 -10.198 1.00 0.92 C ATOM 911 OE1 GLU A 58 10.180 -13.308 -10.686 1.00 1.09 O ATOM 912 OE2 GLU A 58 8.903 -11.968 -9.500 1.00 1.02 O ATOM 0 H GLU A 58 14.108 -10.656 -8.100 1.00 0.46 H new ATOM 0 HA GLU A 58 13.233 -9.559 -10.541 1.00 0.51 H new ATOM 0 HB2 GLU A 58 12.666 -11.827 -9.572 1.00 0.60 H new ATOM 0 HB3 GLU A 58 11.591 -11.035 -8.437 1.00 0.60 H new ATOM 0 HG2 GLU A 58 10.321 -10.102 -10.456 1.00 0.79 H new ATOM 0 HG3 GLU A 58 11.298 -11.152 -11.462 1.00 0.79 H new ATOM 919 N LYS A 59 11.765 -8.264 -7.839 1.00 0.42 N ATOM 920 CA LYS A 59 10.969 -7.126 -7.337 1.00 0.47 C ATOM 921 C LYS A 59 11.843 -5.879 -7.066 1.00 0.53 C ATOM 922 O LYS A 59 11.313 -4.769 -6.988 1.00 0.91 O ATOM 923 CB LYS A 59 10.185 -7.544 -6.073 1.00 0.52 C ATOM 924 CG LYS A 59 9.108 -8.601 -6.351 1.00 0.60 C ATOM 925 CD LYS A 59 8.419 -9.098 -5.077 1.00 0.81 C ATOM 926 CE LYS A 59 7.405 -10.199 -5.382 1.00 1.17 C ATOM 927 NZ LYS A 59 6.646 -10.633 -4.173 1.00 1.55 N ATOM 0 H LYS A 59 12.096 -8.894 -7.108 1.00 0.42 H new ATOM 0 HA LYS A 59 10.259 -6.846 -8.115 1.00 0.47 H new ATOM 0 HB2 LYS A 59 10.884 -7.933 -5.332 1.00 0.52 H new ATOM 0 HB3 LYS A 59 9.715 -6.662 -5.637 1.00 0.52 H new ATOM 0 HG2 LYS A 59 8.359 -8.182 -7.023 1.00 0.60 H new ATOM 0 HG3 LYS A 59 9.561 -9.447 -6.867 1.00 0.60 H new ATOM 0 HD2 LYS A 59 9.168 -9.475 -4.380 1.00 0.81 H new ATOM 0 HD3 LYS A 59 7.916 -8.265 -4.585 1.00 0.81 H new ATOM 0 HE2 LYS A 59 6.704 -9.843 -6.137 1.00 1.17 H new ATOM 0 HE3 LYS A 59 7.924 -11.058 -5.808 1.00 1.17 H new ATOM 0 HZ1 LYS A 59 6.644 -11.672 -4.119 1.00 1.55 H new ATOM 0 HZ2 LYS A 59 7.097 -10.243 -3.321 1.00 1.55 H new ATOM 0 HZ3 LYS A 59 5.667 -10.288 -4.235 1.00 1.55 H new ATOM 941 N MET A 60 13.184 -6.062 -6.934 1.00 0.39 N ATOM 942 CA MET A 60 14.121 -4.941 -6.689 1.00 0.41 C ATOM 943 C MET A 60 14.236 -4.028 -7.925 1.00 0.42 C ATOM 944 O MET A 60 14.284 -2.805 -7.778 1.00 0.46 O ATOM 945 CB MET A 60 15.519 -5.461 -6.287 1.00 0.45 C ATOM 946 CG MET A 60 16.465 -4.379 -5.752 1.00 0.53 C ATOM 947 SD MET A 60 18.112 -5.008 -5.344 1.00 0.66 S ATOM 948 CE MET A 60 18.838 -5.182 -6.977 1.00 0.84 C ATOM 0 H MET A 60 13.636 -6.974 -6.994 1.00 0.39 H new ATOM 0 HA MET A 60 13.716 -4.356 -5.863 1.00 0.41 H new ATOM 0 HB2 MET A 60 15.402 -6.233 -5.526 1.00 0.45 H new ATOM 0 HB3 MET A 60 15.981 -5.935 -7.153 1.00 0.45 H new ATOM 0 HG2 MET A 60 16.560 -3.588 -6.496 1.00 0.53 H new ATOM 0 HG3 MET A 60 16.025 -3.929 -4.862 1.00 0.53 H new ATOM 0 HE1 MET A 60 19.878 -5.494 -6.881 1.00 0.84 H new ATOM 0 HE2 MET A 60 18.285 -5.932 -7.543 1.00 0.84 H new ATOM 0 HE3 MET A 60 18.792 -4.226 -7.499 1.00 0.84 H new ATOM 958 N LYS A 61 14.296 -4.628 -9.140 1.00 0.44 N ATOM 959 CA LYS A 61 14.382 -3.850 -10.396 1.00 0.49 C ATOM 960 C LYS A 61 13.170 -2.909 -10.551 1.00 0.46 C ATOM 961 O LYS A 61 13.308 -1.812 -11.105 1.00 0.49 O ATOM 962 CB LYS A 61 14.500 -4.777 -11.628 1.00 0.59 C ATOM 963 CG LYS A 61 15.830 -5.541 -11.740 1.00 0.70 C ATOM 964 CD LYS A 61 17.060 -4.635 -11.947 1.00 1.11 C ATOM 965 CE LYS A 61 17.014 -3.817 -13.245 1.00 1.90 C ATOM 966 NZ LYS A 61 16.936 -4.661 -14.483 1.00 2.56 N ATOM 0 H LYS A 61 14.286 -5.639 -9.274 1.00 0.44 H new ATOM 0 HA LYS A 61 15.286 -3.244 -10.339 1.00 0.49 H new ATOM 0 HB2 LYS A 61 13.684 -5.499 -11.600 1.00 0.59 H new ATOM 0 HB3 LYS A 61 14.365 -4.178 -12.529 1.00 0.59 H new ATOM 0 HG2 LYS A 61 15.975 -6.131 -10.835 1.00 0.70 H new ATOM 0 HG3 LYS A 61 15.765 -6.243 -12.571 1.00 0.70 H new ATOM 0 HD2 LYS A 61 17.144 -3.953 -11.101 1.00 1.11 H new ATOM 0 HD3 LYS A 61 17.958 -5.252 -11.949 1.00 1.11 H new ATOM 0 HE2 LYS A 61 16.152 -3.151 -13.215 1.00 1.90 H new ATOM 0 HE3 LYS A 61 17.902 -3.187 -13.300 1.00 1.90 H new ATOM 0 HZ1 LYS A 61 16.925 -4.047 -15.322 1.00 2.56 H new ATOM 0 HZ2 LYS A 61 17.762 -5.291 -14.526 1.00 2.56 H new ATOM 0 HZ3 LYS A 61 16.066 -5.231 -14.460 1.00 2.56 H new ATOM 980 N SER A 62 11.984 -3.346 -10.058 1.00 0.44 N ATOM 981 CA SER A 62 10.763 -2.523 -10.098 1.00 0.46 C ATOM 982 C SER A 62 10.884 -1.339 -9.118 1.00 0.43 C ATOM 983 O SER A 62 10.427 -0.233 -9.423 1.00 0.47 O ATOM 984 CB SER A 62 9.514 -3.359 -9.768 1.00 0.53 C ATOM 985 OG SER A 62 9.336 -4.403 -10.710 1.00 0.61 O ATOM 0 H SER A 62 11.854 -4.263 -9.630 1.00 0.44 H new ATOM 0 HA SER A 62 10.652 -2.137 -11.111 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.608 -3.780 -8.767 1.00 0.53 H new ATOM 0 HB3 SER A 62 8.634 -2.716 -9.762 1.00 0.53 H new ATOM 0 HG SER A 62 8.537 -4.921 -10.478 1.00 0.61 H new ATOM 991 N LEU A 63 11.506 -1.583 -7.935 1.00 0.40 N ATOM 992 CA LEU A 63 11.721 -0.528 -6.921 1.00 0.43 C ATOM 993 C LEU A 63 12.716 0.526 -7.449 1.00 0.45 C ATOM 994 O LEU A 63 12.436 1.723 -7.387 1.00 0.53 O ATOM 995 CB LEU A 63 12.233 -1.115 -5.582 1.00 0.45 C ATOM 996 CG LEU A 63 11.321 -2.162 -4.897 1.00 0.42 C ATOM 997 CD1 LEU A 63 12.060 -2.874 -3.760 1.00 0.48 C ATOM 998 CD2 LEU A 63 10.024 -1.531 -4.376 1.00 0.68 C ATOM 0 H LEU A 63 11.865 -2.499 -7.665 1.00 0.40 H new ATOM 0 HA LEU A 63 10.758 -0.054 -6.731 1.00 0.43 H new ATOM 0 HB2 LEU A 63 13.206 -1.573 -5.759 1.00 0.45 H new ATOM 0 HB3 LEU A 63 12.391 -0.291 -4.886 1.00 0.45 H new ATOM 0 HG LEU A 63 11.054 -2.899 -5.654 1.00 0.42 H new ATOM 0 HD11 LEU A 63 11.397 -3.604 -3.296 1.00 0.48 H new ATOM 0 HD12 LEU A 63 12.937 -3.383 -4.159 1.00 0.48 H new ATOM 0 HD13 LEU A 63 12.372 -2.142 -3.015 1.00 0.48 H new ATOM 0 HD21 LEU A 63 9.411 -2.298 -3.902 1.00 0.68 H new ATOM 0 HD22 LEU A 63 10.263 -0.756 -3.648 1.00 0.68 H new ATOM 0 HD23 LEU A 63 9.474 -1.090 -5.208 1.00 0.68 H new ATOM 1010 N ASP A 64 13.871 0.070 -7.983 1.00 0.45 N ATOM 1011 CA ASP A 64 14.895 0.970 -8.543 1.00 0.51 C ATOM 1012 C ASP A 64 14.709 1.068 -10.077 1.00 0.50 C ATOM 1013 O ASP A 64 15.579 0.655 -10.854 1.00 0.54 O ATOM 1014 CB ASP A 64 16.312 0.474 -8.163 1.00 0.60 C ATOM 1015 CG ASP A 64 17.405 1.497 -8.453 1.00 0.83 C ATOM 1016 OD1 ASP A 64 17.636 2.381 -7.599 1.00 1.39 O ATOM 1017 OD2 ASP A 64 18.026 1.412 -9.533 1.00 1.28 O ATOM 0 H ASP A 64 14.114 -0.919 -8.036 1.00 0.45 H new ATOM 0 HA ASP A 64 14.780 1.969 -8.122 1.00 0.51 H new ATOM 0 HB2 ASP A 64 16.330 0.224 -7.102 1.00 0.60 H new ATOM 0 HB3 ASP A 64 16.528 -0.443 -8.711 1.00 0.60 H new ATOM 1022 N VAL A 65 13.550 1.615 -10.500 1.00 0.51 N ATOM 1023 CA VAL A 65 13.211 1.764 -11.932 1.00 0.55 C ATOM 1024 C VAL A 65 13.738 3.096 -12.528 1.00 0.55 C ATOM 1025 O VAL A 65 13.910 3.198 -13.747 1.00 0.60 O ATOM 1026 CB VAL A 65 11.665 1.609 -12.166 1.00 0.64 C ATOM 1027 CG1 VAL A 65 10.856 2.751 -11.534 1.00 0.67 C ATOM 1028 CG2 VAL A 65 11.339 1.466 -13.658 1.00 0.73 C ATOM 0 H VAL A 65 12.830 1.962 -9.867 1.00 0.51 H new ATOM 0 HA VAL A 65 13.718 0.959 -12.464 1.00 0.55 H new ATOM 0 HB VAL A 65 11.365 0.691 -11.661 1.00 0.64 H new ATOM 0 HG11 VAL A 65 9.794 2.594 -11.726 1.00 0.67 H new ATOM 0 HG12 VAL A 65 11.032 2.769 -10.458 1.00 0.67 H new ATOM 0 HG13 VAL A 65 11.167 3.701 -11.969 1.00 0.67 H new ATOM 0 HG21 VAL A 65 10.262 1.361 -13.787 1.00 0.73 H new ATOM 0 HG22 VAL A 65 11.683 2.352 -14.192 1.00 0.73 H new ATOM 0 HG23 VAL A 65 11.840 0.584 -14.057 1.00 0.73 H new ATOM 1038 N ASN A 66 13.991 4.106 -11.672 1.00 0.56 N ATOM 1039 CA ASN A 66 14.504 5.417 -12.125 1.00 0.60 C ATOM 1040 C ASN A 66 16.048 5.424 -12.248 1.00 0.59 C ATOM 1041 O ASN A 66 16.608 6.331 -12.876 1.00 0.66 O ATOM 1042 CB ASN A 66 14.036 6.528 -11.165 1.00 0.67 C ATOM 1043 CG ASN A 66 12.525 6.744 -11.205 1.00 0.94 C ATOM 1044 OD1 ASN A 66 11.780 6.076 -10.489 1.00 1.29 O ATOM 1045 ND2 ASN A 66 12.063 7.675 -12.043 1.00 1.44 N ATOM 0 H ASN A 66 13.849 4.040 -10.664 1.00 0.56 H new ATOM 0 HA ASN A 66 14.099 5.605 -13.119 1.00 0.60 H new ATOM 0 HB2 ASN A 66 14.336 6.274 -10.148 1.00 0.67 H new ATOM 0 HB3 ASN A 66 14.539 7.460 -11.422 1.00 0.67 H new ATOM 0 HD21 ASN A 66 11.061 7.853 -12.105 1.00 1.44 H new ATOM 0 HD22 ASN A 66 12.713 8.209 -12.621 1.00 1.44 H new ATOM 1052 N GLN A 67 16.730 4.409 -11.651 1.00 0.55 N ATOM 1053 CA GLN A 67 18.202 4.278 -11.680 1.00 0.60 C ATOM 1054 C GLN A 67 18.899 5.485 -11.016 1.00 0.63 C ATOM 1055 O GLN A 67 19.465 6.350 -11.699 1.00 0.78 O ATOM 1056 CB GLN A 67 18.734 4.052 -13.122 1.00 0.70 C ATOM 1057 CG GLN A 67 18.334 2.709 -13.750 1.00 0.88 C ATOM 1058 CD GLN A 67 16.965 2.718 -14.434 1.00 1.20 C ATOM 1059 OE1 GLN A 67 16.518 3.745 -14.948 1.00 1.96 O ATOM 1060 NE2 GLN A 67 16.293 1.562 -14.460 1.00 1.86 N ATOM 0 H GLN A 67 16.267 3.660 -11.136 1.00 0.55 H new ATOM 0 HA GLN A 67 18.449 3.392 -11.095 1.00 0.60 H new ATOM 0 HB2 GLN A 67 18.371 4.858 -13.759 1.00 0.70 H new ATOM 0 HB3 GLN A 67 19.822 4.122 -13.109 1.00 0.70 H new ATOM 0 HG2 GLN A 67 19.091 2.423 -14.481 1.00 0.88 H new ATOM 0 HG3 GLN A 67 18.335 1.944 -12.974 1.00 0.88 H new ATOM 0 HE21 GLN A 67 16.692 0.730 -14.025 1.00 1.86 H new ATOM 0 HE22 GLN A 67 15.382 1.512 -14.915 1.00 1.86 H new ATOM 1069 N ASP A 68 18.833 5.535 -9.670 1.00 0.62 N ATOM 1070 CA ASP A 68 19.449 6.626 -8.882 1.00 0.71 C ATOM 1071 C ASP A 68 19.923 6.149 -7.479 1.00 0.77 C ATOM 1072 O ASP A 68 20.195 6.979 -6.609 1.00 1.32 O ATOM 1073 CB ASP A 68 18.438 7.792 -8.744 1.00 0.78 C ATOM 1074 CG ASP A 68 19.100 9.132 -8.444 1.00 1.08 C ATOM 1075 OD1 ASP A 68 19.733 9.701 -9.360 1.00 1.41 O ATOM 1076 OD2 ASP A 68 18.986 9.611 -7.296 1.00 1.37 O ATOM 0 H ASP A 68 18.359 4.832 -9.104 1.00 0.62 H new ATOM 0 HA ASP A 68 20.337 6.965 -9.415 1.00 0.71 H new ATOM 0 HB2 ASP A 68 17.864 7.877 -9.667 1.00 0.78 H new ATOM 0 HB3 ASP A 68 17.730 7.558 -7.949 1.00 0.78 H new ATOM 1081 N SER A 69 20.038 4.810 -7.266 1.00 0.62 N ATOM 1082 CA SER A 69 20.470 4.230 -5.972 1.00 0.67 C ATOM 1083 C SER A 69 19.594 4.693 -4.772 1.00 0.68 C ATOM 1084 O SER A 69 20.059 4.679 -3.624 1.00 1.24 O ATOM 1085 CB SER A 69 21.961 4.549 -5.715 1.00 0.82 C ATOM 1086 OG SER A 69 22.780 4.087 -6.784 1.00 1.31 O ATOM 0 H SER A 69 19.835 4.112 -7.981 1.00 0.62 H new ATOM 0 HA SER A 69 20.337 3.151 -6.050 1.00 0.67 H new ATOM 0 HB2 SER A 69 22.089 5.625 -5.594 1.00 0.82 H new ATOM 0 HB3 SER A 69 22.279 4.083 -4.782 1.00 0.82 H new ATOM 0 HG SER A 69 23.717 4.304 -6.595 1.00 1.31 H new ATOM 1092 N GLU A 70 18.318 5.071 -5.040 1.00 0.66 N ATOM 1093 CA GLU A 70 17.384 5.529 -3.991 1.00 0.77 C ATOM 1094 C GLU A 70 16.113 4.674 -3.986 1.00 0.64 C ATOM 1095 O GLU A 70 15.710 4.137 -5.026 1.00 0.75 O ATOM 1096 CB GLU A 70 17.012 7.017 -4.179 1.00 1.13 C ATOM 1097 CG GLU A 70 18.161 7.989 -3.926 1.00 1.41 C ATOM 1098 CD GLU A 70 17.701 9.435 -3.814 1.00 1.90 C ATOM 1099 OE1 GLU A 70 17.077 9.783 -2.791 1.00 2.42 O ATOM 1100 OE2 GLU A 70 17.973 10.219 -4.749 1.00 2.41 O ATOM 0 H GLU A 70 17.916 5.066 -5.977 1.00 0.66 H new ATOM 0 HA GLU A 70 17.891 5.419 -3.032 1.00 0.77 H new ATOM 0 HB2 GLU A 70 16.646 7.162 -5.195 1.00 1.13 H new ATOM 0 HB3 GLU A 70 16.190 7.262 -3.506 1.00 1.13 H new ATOM 0 HG2 GLU A 70 18.675 7.705 -3.008 1.00 1.41 H new ATOM 0 HG3 GLU A 70 18.886 7.905 -4.736 1.00 1.41 H new ATOM 1107 N LEU A 71 15.476 4.577 -2.808 1.00 0.57 N ATOM 1108 CA LEU A 71 14.252 3.782 -2.628 1.00 0.51 C ATOM 1109 C LEU A 71 13.147 4.619 -1.950 1.00 0.51 C ATOM 1110 O LEU A 71 12.585 4.225 -0.919 1.00 0.53 O ATOM 1111 CB LEU A 71 14.583 2.499 -1.823 1.00 0.53 C ATOM 1112 CG LEU A 71 14.027 1.181 -2.404 1.00 0.66 C ATOM 1113 CD1 LEU A 71 14.782 0.780 -3.677 1.00 0.95 C ATOM 1114 CD2 LEU A 71 14.100 0.067 -1.360 1.00 0.74 C ATOM 0 H LEU A 71 15.793 5.045 -1.959 1.00 0.57 H new ATOM 0 HA LEU A 71 13.867 3.484 -3.603 1.00 0.51 H new ATOM 0 HB2 LEU A 71 15.667 2.411 -1.744 1.00 0.53 H new ATOM 0 HB3 LEU A 71 14.199 2.619 -0.810 1.00 0.53 H new ATOM 0 HG LEU A 71 12.982 1.340 -2.670 1.00 0.66 H new ATOM 0 HD11 LEU A 71 14.371 -0.152 -4.066 1.00 0.95 H new ATOM 0 HD12 LEU A 71 14.675 1.565 -4.426 1.00 0.95 H new ATOM 0 HD13 LEU A 71 15.838 0.641 -3.445 1.00 0.95 H new ATOM 0 HD21 LEU A 71 13.704 -0.856 -1.784 1.00 0.74 H new ATOM 0 HD22 LEU A 71 15.138 -0.086 -1.063 1.00 0.74 H new ATOM 0 HD23 LEU A 71 13.510 0.347 -0.487 1.00 0.74 H new ATOM 1126 N LYS A 72 12.829 5.781 -2.561 1.00 0.53 N ATOM 1127 CA LYS A 72 11.784 6.707 -2.058 1.00 0.56 C ATOM 1128 C LYS A 72 10.422 5.999 -1.980 1.00 0.50 C ATOM 1129 O LYS A 72 10.232 4.995 -2.652 1.00 0.48 O ATOM 1130 CB LYS A 72 11.711 7.939 -2.980 1.00 0.63 C ATOM 1131 CG LYS A 72 11.081 9.165 -2.334 1.00 0.86 C ATOM 1132 CD LYS A 72 11.195 10.397 -3.232 1.00 1.00 C ATOM 1133 CE LYS A 72 10.663 11.655 -2.549 1.00 1.43 C ATOM 1134 NZ LYS A 72 9.174 11.648 -2.422 1.00 1.89 N ATOM 0 H LYS A 72 13.286 6.105 -3.413 1.00 0.53 H new ATOM 0 HA LYS A 72 12.045 7.031 -1.050 1.00 0.56 H new ATOM 0 HB2 LYS A 72 12.719 8.193 -3.309 1.00 0.63 H new ATOM 0 HB3 LYS A 72 11.141 7.678 -3.872 1.00 0.63 H new ATOM 0 HG2 LYS A 72 10.031 8.965 -2.121 1.00 0.86 H new ATOM 0 HG3 LYS A 72 11.567 9.364 -1.379 1.00 0.86 H new ATOM 0 HD2 LYS A 72 12.238 10.549 -3.509 1.00 1.00 H new ATOM 0 HD3 LYS A 72 10.642 10.225 -4.155 1.00 1.00 H new ATOM 0 HE2 LYS A 72 11.109 11.743 -1.558 1.00 1.43 H new ATOM 0 HE3 LYS A 72 10.972 12.532 -3.117 1.00 1.43 H new ATOM 0 HZ1 LYS A 72 8.862 12.522 -1.953 1.00 1.89 H new ATOM 0 HZ2 LYS A 72 8.745 11.591 -3.368 1.00 1.89 H new ATOM 0 HZ3 LYS A 72 8.878 10.827 -1.857 1.00 1.89 H new ATOM 1148 N PHE A 73 9.469 6.516 -1.165 1.00 0.53 N ATOM 1149 CA PHE A 73 8.133 5.876 -1.038 1.00 0.50 C ATOM 1150 C PHE A 73 7.386 5.798 -2.389 1.00 0.47 C ATOM 1151 O PHE A 73 6.564 4.899 -2.582 1.00 0.47 O ATOM 1152 CB PHE A 73 7.252 6.566 0.033 1.00 0.56 C ATOM 1153 CG PHE A 73 6.543 5.574 0.942 1.00 0.69 C ATOM 1154 CD1 PHE A 73 5.447 4.847 0.483 1.00 0.89 C ATOM 1155 CD2 PHE A 73 6.988 5.349 2.242 1.00 0.87 C ATOM 1156 CE1 PHE A 73 4.819 3.923 1.293 1.00 1.12 C ATOM 1157 CE2 PHE A 73 6.354 4.427 3.055 1.00 1.11 C ATOM 1158 CZ PHE A 73 5.271 3.712 2.580 1.00 1.20 C ATOM 0 H PHE A 73 9.594 7.354 -0.598 1.00 0.53 H new ATOM 0 HA PHE A 73 8.323 4.855 -0.707 1.00 0.50 H new ATOM 0 HB2 PHE A 73 7.874 7.226 0.638 1.00 0.56 H new ATOM 0 HB3 PHE A 73 6.510 7.192 -0.462 1.00 0.56 H new ATOM 0 HD1 PHE A 73 5.084 5.009 -0.521 1.00 0.89 H new ATOM 0 HD2 PHE A 73 7.837 5.900 2.619 1.00 0.87 H new ATOM 0 HE1 PHE A 73 3.973 3.365 0.920 1.00 1.12 H new ATOM 0 HE2 PHE A 73 6.706 4.266 4.063 1.00 1.11 H new ATOM 0 HZ PHE A 73 4.779 2.990 3.215 1.00 1.20 H new ATOM 1168 N ASN A 74 7.669 6.741 -3.316 1.00 0.49 N ATOM 1169 CA ASN A 74 7.054 6.743 -4.662 1.00 0.51 C ATOM 1170 C ASN A 74 7.627 5.587 -5.524 1.00 0.49 C ATOM 1171 O ASN A 74 6.979 5.136 -6.469 1.00 0.53 O ATOM 1172 CB ASN A 74 7.288 8.107 -5.354 1.00 0.57 C ATOM 1173 CG ASN A 74 6.265 8.432 -6.449 1.00 0.65 C ATOM 1174 OD1 ASN A 74 6.039 9.725 -6.698 1.00 0.98 O flip ATOM 1175 ND2 ASN A 74 5.691 7.537 -7.071 1.00 0.91 N flip ATOM 0 H ASN A 74 8.319 7.510 -3.156 1.00 0.49 H new ATOM 0 HA ASN A 74 5.980 6.588 -4.555 1.00 0.51 H new ATOM 0 HB2 ASN A 74 7.262 8.895 -4.601 1.00 0.57 H new ATOM 0 HB3 ASN A 74 8.287 8.116 -5.790 1.00 0.57 H new ATOM 0 HD21 ASN A 74 5.887 6.560 -6.855 1.00 0.91 H new ATOM 0 HD22 ASN A 74 5.020 7.773 -7.802 1.00 0.91 H new ATOM 1182 N GLU A 75 8.858 5.133 -5.191 1.00 0.46 N ATOM 1183 CA GLU A 75 9.535 4.019 -5.883 1.00 0.47 C ATOM 1184 C GLU A 75 9.411 2.712 -5.069 1.00 0.43 C ATOM 1185 O GLU A 75 9.350 1.626 -5.648 1.00 0.44 O ATOM 1186 CB GLU A 75 11.023 4.361 -6.109 1.00 0.53 C ATOM 1187 CG GLU A 75 11.301 5.202 -7.351 1.00 0.61 C ATOM 1188 CD GLU A 75 10.807 6.636 -7.236 1.00 0.78 C ATOM 1189 OE1 GLU A 75 11.560 7.486 -6.716 1.00 0.98 O ATOM 1190 OE2 GLU A 75 9.668 6.906 -7.671 1.00 1.03 O ATOM 0 H GLU A 75 9.409 5.533 -4.431 1.00 0.46 H new ATOM 0 HA GLU A 75 9.052 3.871 -6.849 1.00 0.47 H new ATOM 0 HB2 GLU A 75 11.396 4.894 -5.235 1.00 0.53 H new ATOM 0 HB3 GLU A 75 11.589 3.432 -6.182 1.00 0.53 H new ATOM 0 HG2 GLU A 75 12.374 5.210 -7.542 1.00 0.61 H new ATOM 0 HG3 GLU A 75 10.828 4.731 -8.212 1.00 0.61 H new ATOM 1197 N TYR A 76 9.379 2.836 -3.721 1.00 0.42 N ATOM 1198 CA TYR A 76 9.260 1.692 -2.793 1.00 0.41 C ATOM 1199 C TYR A 76 7.807 1.162 -2.737 1.00 0.39 C ATOM 1200 O TYR A 76 7.575 0.050 -2.254 1.00 0.52 O ATOM 1201 CB TYR A 76 9.750 2.113 -1.385 1.00 0.44 C ATOM 1202 CG TYR A 76 9.959 0.972 -0.382 1.00 0.45 C ATOM 1203 CD1 TYR A 76 10.776 -0.116 -0.683 1.00 0.52 C ATOM 1204 CD2 TYR A 76 9.353 1.002 0.871 1.00 0.51 C ATOM 1205 CE1 TYR A 76 10.976 -1.137 0.229 1.00 0.59 C ATOM 1206 CE2 TYR A 76 9.553 -0.017 1.788 1.00 0.57 C ATOM 1207 CZ TYR A 76 10.362 -1.086 1.463 1.00 0.59 C ATOM 1208 OH TYR A 76 10.570 -2.101 2.377 1.00 0.69 O ATOM 0 H TYR A 76 9.435 3.737 -3.247 1.00 0.42 H new ATOM 0 HA TYR A 76 9.887 0.879 -3.160 1.00 0.41 H new ATOM 0 HB2 TYR A 76 10.691 2.652 -1.495 1.00 0.44 H new ATOM 0 HB3 TYR A 76 9.029 2.814 -0.964 1.00 0.44 H new ATOM 0 HD1 TYR A 76 11.262 -0.163 -1.646 1.00 0.52 H new ATOM 0 HD2 TYR A 76 8.716 1.834 1.133 1.00 0.51 H new ATOM 0 HE1 TYR A 76 11.612 -1.972 -0.025 1.00 0.59 H new ATOM 0 HE2 TYR A 76 9.076 0.026 2.756 1.00 0.57 H new ATOM 0 HH TYR A 76 10.066 -1.912 3.196 1.00 0.69 H new ATOM 1218 N TRP A 77 6.839 1.969 -3.249 1.00 0.40 N ATOM 1219 CA TRP A 77 5.405 1.601 -3.296 1.00 0.42 C ATOM 1220 C TRP A 77 5.168 0.266 -4.070 1.00 0.37 C ATOM 1221 O TRP A 77 4.155 -0.402 -3.839 1.00 0.39 O ATOM 1222 CB TRP A 77 4.587 2.809 -3.870 1.00 0.58 C ATOM 1223 CG TRP A 77 3.439 2.491 -4.804 1.00 0.49 C ATOM 1224 CD1 TRP A 77 2.243 1.909 -4.485 1.00 0.53 C ATOM 1225 CD2 TRP A 77 3.377 2.780 -6.209 1.00 0.78 C ATOM 1226 NE1 TRP A 77 1.458 1.804 -5.609 1.00 0.77 N ATOM 1227 CE2 TRP A 77 2.133 2.330 -6.677 1.00 0.97 C ATOM 1228 CE3 TRP A 77 4.260 3.373 -7.116 1.00 1.04 C ATOM 1229 CZ2 TRP A 77 1.751 2.452 -8.010 1.00 1.40 C ATOM 1230 CZ3 TRP A 77 3.880 3.493 -8.437 1.00 1.45 C ATOM 1231 CH2 TRP A 77 2.634 3.035 -8.874 1.00 1.62 C ATOM 0 H TRP A 77 7.035 2.891 -3.639 1.00 0.40 H new ATOM 0 HA TRP A 77 5.047 1.402 -2.286 1.00 0.42 H new ATOM 0 HB2 TRP A 77 4.190 3.377 -3.029 1.00 0.58 H new ATOM 0 HB3 TRP A 77 5.280 3.464 -4.398 1.00 0.58 H new ATOM 0 HD1 TRP A 77 1.957 1.581 -3.497 1.00 0.53 H new ATOM 0 HE1 TRP A 77 0.522 1.399 -5.642 1.00 0.77 H new ATOM 0 HE3 TRP A 77 5.224 3.732 -6.788 1.00 1.04 H new ATOM 0 HZ2 TRP A 77 0.789 2.098 -8.350 1.00 1.40 H new ATOM 0 HZ3 TRP A 77 4.557 3.948 -9.145 1.00 1.45 H new ATOM 0 HH2 TRP A 77 2.364 3.144 -9.914 1.00 1.62 H new ATOM 1242 N ARG A 78 6.114 -0.122 -4.968 1.00 0.39 N ATOM 1243 CA ARG A 78 6.017 -1.394 -5.727 1.00 0.42 C ATOM 1244 C ARG A 78 6.079 -2.610 -4.777 1.00 0.40 C ATOM 1245 O ARG A 78 5.431 -3.629 -5.037 1.00 0.45 O ATOM 1246 CB ARG A 78 7.140 -1.520 -6.793 1.00 0.49 C ATOM 1247 CG ARG A 78 7.293 -0.322 -7.745 1.00 0.64 C ATOM 1248 CD ARG A 78 6.084 -0.114 -8.661 1.00 0.82 C ATOM 1249 NE ARG A 78 5.932 -1.184 -9.670 1.00 1.11 N ATOM 1250 CZ ARG A 78 5.204 -1.084 -10.803 1.00 1.57 C ATOM 1251 NH1 ARG A 78 4.481 0.011 -11.081 1.00 1.96 N ATOM 1252 NH2 ARG A 78 5.178 -2.109 -11.661 1.00 1.93 N ATOM 0 H ARG A 78 6.947 0.426 -5.181 1.00 0.39 H new ATOM 0 HA ARG A 78 5.055 -1.381 -6.239 1.00 0.42 H new ATOM 0 HB2 ARG A 78 8.088 -1.675 -6.278 1.00 0.49 H new ATOM 0 HB3 ARG A 78 6.951 -2.413 -7.389 1.00 0.49 H new ATOM 0 HG2 ARG A 78 7.453 0.582 -7.157 1.00 0.64 H new ATOM 0 HG3 ARG A 78 8.183 -0.466 -8.358 1.00 0.64 H new ATOM 0 HD2 ARG A 78 5.180 -0.064 -8.054 1.00 0.82 H new ATOM 0 HD3 ARG A 78 6.181 0.846 -9.169 1.00 0.82 H new ATOM 0 HE ARG A 78 6.414 -2.066 -9.497 1.00 1.11 H new ATOM 0 HH11 ARG A 78 4.472 0.795 -10.429 1.00 1.96 H new ATOM 0 HH12 ARG A 78 3.940 0.059 -11.945 1.00 1.96 H new ATOM 0 HH21 ARG A 78 5.705 -2.958 -11.457 1.00 1.93 H new ATOM 0 HH22 ARG A 78 4.631 -2.042 -12.519 1.00 1.93 H new ATOM 1266 N LEU A 79 6.857 -2.491 -3.676 1.00 0.37 N ATOM 1267 CA LEU A 79 6.980 -3.569 -2.680 1.00 0.37 C ATOM 1268 C LEU A 79 5.864 -3.468 -1.628 1.00 0.36 C ATOM 1269 O LEU A 79 5.380 -4.496 -1.158 1.00 0.39 O ATOM 1270 CB LEU A 79 8.355 -3.555 -1.982 1.00 0.40 C ATOM 1271 CG LEU A 79 8.746 -4.874 -1.277 1.00 0.44 C ATOM 1272 CD1 LEU A 79 9.301 -5.891 -2.281 1.00 0.49 C ATOM 1273 CD2 LEU A 79 9.741 -4.613 -0.144 1.00 0.53 C ATOM 0 H LEU A 79 7.406 -1.659 -3.460 1.00 0.37 H new ATOM 0 HA LEU A 79 6.884 -4.512 -3.219 1.00 0.37 H new ATOM 0 HB2 LEU A 79 9.119 -3.317 -2.722 1.00 0.40 H new ATOM 0 HB3 LEU A 79 8.363 -2.751 -1.246 1.00 0.40 H new ATOM 0 HG LEU A 79 7.845 -5.302 -0.837 1.00 0.44 H new ATOM 0 HD11 LEU A 79 9.568 -6.810 -1.758 1.00 0.49 H new ATOM 0 HD12 LEU A 79 8.544 -6.109 -3.034 1.00 0.49 H new ATOM 0 HD13 LEU A 79 10.186 -5.478 -2.765 1.00 0.49 H new ATOM 0 HD21 LEU A 79 10.001 -5.556 0.337 1.00 0.53 H new ATOM 0 HD22 LEU A 79 10.642 -4.152 -0.550 1.00 0.53 H new ATOM 0 HD23 LEU A 79 9.290 -3.944 0.589 1.00 0.53 H new ATOM 1285 N ILE A 80 5.467 -2.223 -1.251 1.00 0.38 N ATOM 1286 CA ILE A 80 4.382 -1.998 -0.262 1.00 0.41 C ATOM 1287 C ILE A 80 3.093 -2.723 -0.708 1.00 0.40 C ATOM 1288 O ILE A 80 2.372 -3.277 0.127 1.00 0.43 O ATOM 1289 CB ILE A 80 4.102 -0.469 -0.023 1.00 0.49 C ATOM 1290 CG1 ILE A 80 5.378 0.271 0.468 1.00 0.53 C ATOM 1291 CG2 ILE A 80 2.942 -0.244 0.964 1.00 0.59 C ATOM 1292 CD1 ILE A 80 5.927 -0.195 1.812 1.00 0.61 C ATOM 0 H ILE A 80 5.881 -1.365 -1.616 1.00 0.38 H new ATOM 0 HA ILE A 80 4.716 -2.414 0.688 1.00 0.41 H new ATOM 0 HB ILE A 80 3.809 -0.050 -0.986 1.00 0.49 H new ATOM 0 HG12 ILE A 80 6.158 0.154 -0.284 1.00 0.53 H new ATOM 0 HG13 ILE A 80 5.157 1.336 0.534 1.00 0.53 H new ATOM 0 HG21 ILE A 80 2.783 0.826 1.100 1.00 0.59 H new ATOM 0 HG22 ILE A 80 2.034 -0.699 0.568 1.00 0.59 H new ATOM 0 HG23 ILE A 80 3.187 -0.699 1.923 1.00 0.59 H new ATOM 0 HD11 ILE A 80 6.816 0.384 2.062 1.00 0.61 H new ATOM 0 HD12 ILE A 80 5.171 -0.051 2.584 1.00 0.61 H new ATOM 0 HD13 ILE A 80 6.187 -1.252 1.752 1.00 0.61 H new ATOM 1304 N GLY A 81 2.810 -2.707 -2.032 1.00 0.40 N ATOM 1305 CA GLY A 81 1.655 -3.421 -2.574 1.00 0.44 C ATOM 1306 C GLY A 81 1.820 -4.927 -2.422 1.00 0.41 C ATOM 1307 O GLY A 81 0.864 -5.625 -2.081 1.00 0.47 O ATOM 0 H GLY A 81 3.365 -2.210 -2.729 1.00 0.40 H new ATOM 0 HA2 GLY A 81 0.750 -3.098 -2.060 1.00 0.44 H new ATOM 0 HA3 GLY A 81 1.530 -3.170 -3.627 1.00 0.44 H new ATOM 1311 N GLU A 82 3.055 -5.423 -2.677 1.00 0.38 N ATOM 1312 CA GLU A 82 3.385 -6.853 -2.527 1.00 0.38 C ATOM 1313 C GLU A 82 3.388 -7.263 -1.033 1.00 0.36 C ATOM 1314 O GLU A 82 3.167 -8.432 -0.716 1.00 0.42 O ATOM 1315 CB GLU A 82 4.749 -7.178 -3.181 1.00 0.43 C ATOM 1316 CG GLU A 82 4.792 -6.990 -4.702 1.00 0.51 C ATOM 1317 CD GLU A 82 3.900 -7.965 -5.462 1.00 0.62 C ATOM 1318 OE1 GLU A 82 4.261 -9.159 -5.551 1.00 0.83 O ATOM 1319 OE2 GLU A 82 2.843 -7.532 -5.972 1.00 0.86 O ATOM 0 H GLU A 82 3.838 -4.848 -2.988 1.00 0.38 H new ATOM 0 HA GLU A 82 2.616 -7.430 -3.040 1.00 0.38 H new ATOM 0 HB2 GLU A 82 5.513 -6.546 -2.729 1.00 0.43 H new ATOM 0 HB3 GLU A 82 5.011 -8.210 -2.949 1.00 0.43 H new ATOM 0 HG2 GLU A 82 4.490 -5.971 -4.943 1.00 0.51 H new ATOM 0 HG3 GLU A 82 5.820 -7.107 -5.045 1.00 0.51 H new ATOM 1326 N LEU A 83 3.645 -6.294 -0.120 1.00 0.36 N ATOM 1327 CA LEU A 83 3.629 -6.539 1.341 1.00 0.39 C ATOM 1328 C LEU A 83 2.203 -6.938 1.784 1.00 0.40 C ATOM 1329 O LEU A 83 2.025 -7.935 2.486 1.00 0.49 O ATOM 1330 CB LEU A 83 4.099 -5.273 2.120 1.00 0.44 C ATOM 1331 CG LEU A 83 5.549 -5.283 2.664 1.00 0.49 C ATOM 1332 CD1 LEU A 83 6.585 -5.359 1.542 1.00 0.67 C ATOM 1333 CD2 LEU A 83 5.798 -4.048 3.543 1.00 0.61 C ATOM 0 H LEU A 83 3.867 -5.331 -0.373 1.00 0.36 H new ATOM 0 HA LEU A 83 4.319 -7.352 1.567 1.00 0.39 H new ATOM 0 HB2 LEU A 83 3.989 -4.410 1.463 1.00 0.44 H new ATOM 0 HB3 LEU A 83 3.422 -5.121 2.961 1.00 0.44 H new ATOM 0 HG LEU A 83 5.663 -6.182 3.270 1.00 0.49 H new ATOM 0 HD11 LEU A 83 7.587 -5.363 1.971 1.00 0.67 H new ATOM 0 HD12 LEU A 83 6.433 -6.273 0.967 1.00 0.67 H new ATOM 0 HD13 LEU A 83 6.475 -4.495 0.886 1.00 0.67 H new ATOM 0 HD21 LEU A 83 6.821 -4.069 3.918 1.00 0.61 H new ATOM 0 HD22 LEU A 83 5.646 -3.145 2.952 1.00 0.61 H new ATOM 0 HD23 LEU A 83 5.103 -4.053 4.383 1.00 0.61 H new ATOM 1345 N ALA A 84 1.195 -6.151 1.339 1.00 0.39 N ATOM 1346 CA ALA A 84 -0.226 -6.402 1.657 1.00 0.45 C ATOM 1347 C ALA A 84 -0.868 -7.450 0.716 1.00 0.45 C ATOM 1348 O ALA A 84 -1.975 -7.919 0.992 1.00 0.55 O ATOM 1349 CB ALA A 84 -1.013 -5.093 1.612 1.00 0.54 C ATOM 0 H ALA A 84 1.345 -5.330 0.753 1.00 0.39 H new ATOM 0 HA ALA A 84 -0.264 -6.815 2.665 1.00 0.45 H new ATOM 0 HB1 ALA A 84 -2.059 -5.289 1.848 1.00 0.54 H new ATOM 0 HB2 ALA A 84 -0.601 -4.396 2.341 1.00 0.54 H new ATOM 0 HB3 ALA A 84 -0.941 -4.659 0.615 1.00 0.54 H new ATOM 1355 N LYS A 85 -0.185 -7.803 -0.400 1.00 0.42 N ATOM 1356 CA LYS A 85 -0.693 -8.806 -1.363 1.00 0.46 C ATOM 1357 C LYS A 85 -0.196 -10.224 -0.994 1.00 0.47 C ATOM 1358 O LYS A 85 -0.977 -11.181 -1.023 1.00 0.55 O ATOM 1359 CB LYS A 85 -0.251 -8.432 -2.796 1.00 0.49 C ATOM 1360 CG LYS A 85 -0.930 -9.237 -3.912 1.00 0.59 C ATOM 1361 CD LYS A 85 -0.278 -9.016 -5.285 1.00 0.64 C ATOM 1362 CE LYS A 85 -0.741 -7.729 -5.974 1.00 0.69 C ATOM 1363 NZ LYS A 85 -0.096 -6.495 -5.426 1.00 0.96 N ATOM 0 H LYS A 85 0.720 -7.407 -0.654 1.00 0.42 H new ATOM 0 HA LYS A 85 -1.782 -8.809 -1.319 1.00 0.46 H new ATOM 0 HB2 LYS A 85 -0.452 -7.373 -2.958 1.00 0.49 H new ATOM 0 HB3 LYS A 85 0.828 -8.567 -2.875 1.00 0.49 H new ATOM 0 HG2 LYS A 85 -0.893 -10.298 -3.663 1.00 0.59 H new ATOM 0 HG3 LYS A 85 -1.983 -8.959 -3.966 1.00 0.59 H new ATOM 0 HD2 LYS A 85 0.805 -8.987 -5.165 1.00 0.64 H new ATOM 0 HD3 LYS A 85 -0.504 -9.866 -5.928 1.00 0.64 H new ATOM 0 HE2 LYS A 85 -0.526 -7.799 -7.040 1.00 0.69 H new ATOM 0 HE3 LYS A 85 -1.823 -7.640 -5.872 1.00 0.69 H new ATOM 0 HZ1 LYS A 85 -0.007 -5.785 -6.181 1.00 0.96 H new ATOM 0 HZ2 LYS A 85 -0.680 -6.110 -4.657 1.00 0.96 H new ATOM 0 HZ3 LYS A 85 0.848 -6.731 -5.059 1.00 0.96 H new ATOM 1377 N GLU A 86 1.106 -10.344 -0.636 1.00 0.42 N ATOM 1378 CA GLU A 86 1.723 -11.639 -0.252 1.00 0.46 C ATOM 1379 C GLU A 86 1.297 -12.099 1.163 1.00 0.52 C ATOM 1380 O GLU A 86 1.560 -13.243 1.542 1.00 0.92 O ATOM 1381 CB GLU A 86 3.268 -11.557 -0.320 1.00 0.49 C ATOM 1382 CG GLU A 86 3.836 -11.283 -1.715 1.00 0.55 C ATOM 1383 CD GLU A 86 3.600 -12.422 -2.693 1.00 1.03 C ATOM 1384 OE1 GLU A 86 4.348 -13.420 -2.634 1.00 1.52 O ATOM 1385 OE2 GLU A 86 2.664 -12.315 -3.514 1.00 1.65 O ATOM 0 H GLU A 86 1.752 -9.556 -0.605 1.00 0.42 H new ATOM 0 HA GLU A 86 1.363 -12.376 -0.970 1.00 0.46 H new ATOM 0 HB2 GLU A 86 3.606 -10.771 0.355 1.00 0.49 H new ATOM 0 HB3 GLU A 86 3.684 -12.495 0.049 1.00 0.49 H new ATOM 0 HG2 GLU A 86 3.385 -10.373 -2.111 1.00 0.55 H new ATOM 0 HG3 GLU A 86 4.907 -11.099 -1.634 1.00 0.55 H new ATOM 1392 N ILE A 87 0.646 -11.213 1.945 1.00 0.44 N ATOM 1393 CA ILE A 87 0.177 -11.549 3.305 1.00 0.47 C ATOM 1394 C ILE A 87 -0.896 -12.672 3.274 1.00 0.51 C ATOM 1395 O ILE A 87 -0.962 -13.488 4.196 1.00 0.61 O ATOM 1396 CB ILE A 87 -0.357 -10.256 4.034 1.00 0.51 C ATOM 1397 CG1 ILE A 87 -0.369 -10.401 5.588 1.00 0.59 C ATOM 1398 CG2 ILE A 87 -1.721 -9.795 3.492 1.00 0.55 C ATOM 1399 CD1 ILE A 87 -1.369 -11.383 6.183 1.00 0.66 C ATOM 0 H ILE A 87 0.433 -10.258 1.657 1.00 0.44 H new ATOM 0 HA ILE A 87 1.023 -11.934 3.874 1.00 0.47 H new ATOM 0 HB ILE A 87 0.358 -9.467 3.801 1.00 0.51 H new ATOM 0 HG12 ILE A 87 0.630 -10.699 5.908 1.00 0.59 H new ATOM 0 HG13 ILE A 87 -0.562 -9.418 6.018 1.00 0.59 H new ATOM 0 HG21 ILE A 87 -2.042 -8.902 4.028 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -1.633 -9.568 2.429 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -2.456 -10.588 3.634 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -1.273 -11.387 7.269 1.00 0.66 H new ATOM 0 HD12 ILE A 87 -2.381 -11.083 5.909 1.00 0.66 H new ATOM 0 HD13 ILE A 87 -1.170 -12.383 5.797 1.00 0.66 H new ATOM 1411 N ARG A 88 -1.698 -12.724 2.187 1.00 0.54 N ATOM 1412 CA ARG A 88 -2.771 -13.719 2.048 1.00 0.68 C ATOM 1413 C ARG A 88 -2.566 -14.677 0.852 1.00 0.68 C ATOM 1414 O ARG A 88 -2.825 -15.873 0.996 1.00 0.87 O ATOM 1415 CB ARG A 88 -4.161 -13.013 1.994 1.00 0.83 C ATOM 1416 CG ARG A 88 -4.594 -12.405 0.641 1.00 0.91 C ATOM 1417 CD ARG A 88 -3.959 -11.044 0.352 1.00 1.05 C ATOM 1418 NE ARG A 88 -4.126 -10.668 -1.067 1.00 1.18 N ATOM 1419 CZ ARG A 88 -4.964 -9.722 -1.551 1.00 1.39 C ATOM 1420 NH1 ARG A 88 -5.679 -8.922 -0.744 1.00 1.74 N ATOM 1421 NH2 ARG A 88 -5.064 -9.560 -2.875 1.00 1.73 N ATOM 0 H ARG A 88 -1.618 -12.085 1.396 1.00 0.54 H new ATOM 0 HA ARG A 88 -2.736 -14.352 2.934 1.00 0.68 H new ATOM 0 HB2 ARG A 88 -4.919 -13.736 2.297 1.00 0.83 H new ATOM 0 HB3 ARG A 88 -4.164 -12.217 2.738 1.00 0.83 H new ATOM 0 HG2 ARG A 88 -4.332 -13.097 -0.160 1.00 0.91 H new ATOM 0 HG3 ARG A 88 -5.679 -12.301 0.629 1.00 0.91 H new ATOM 0 HD2 ARG A 88 -4.414 -10.285 0.988 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -2.898 -11.074 0.601 1.00 1.05 H new ATOM 0 HE ARG A 88 -3.555 -11.170 -1.747 1.00 1.18 H new ATOM 0 HH11 ARG A 88 -5.600 -9.017 0.269 1.00 1.74 H new ATOM 0 HH12 ARG A 88 -6.301 -8.219 -1.143 1.00 1.74 H new ATOM 0 HH21 ARG A 88 -4.513 -10.145 -3.503 1.00 1.73 H new ATOM 0 HH22 ARG A 88 -5.691 -8.851 -3.256 1.00 1.73 H new ATOM 1435 N LYS A 89 -2.086 -14.173 -0.316 1.00 0.58 N ATOM 1436 CA LYS A 89 -1.909 -15.033 -1.508 1.00 0.64 C ATOM 1437 C LYS A 89 -0.427 -15.270 -1.909 1.00 0.58 C ATOM 1438 O LYS A 89 -0.097 -15.315 -3.101 1.00 0.69 O ATOM 1439 CB LYS A 89 -2.767 -14.494 -2.689 1.00 0.76 C ATOM 1440 CG LYS A 89 -2.223 -13.262 -3.435 1.00 0.77 C ATOM 1441 CD LYS A 89 -3.053 -12.956 -4.690 1.00 1.00 C ATOM 1442 CE LYS A 89 -2.231 -12.273 -5.786 1.00 1.22 C ATOM 1443 NZ LYS A 89 -2.870 -12.390 -7.133 1.00 1.52 N ATOM 0 H LYS A 89 -1.821 -13.198 -0.453 1.00 0.58 H new ATOM 0 HA LYS A 89 -2.271 -16.025 -1.237 1.00 0.64 H new ATOM 0 HB2 LYS A 89 -2.895 -15.300 -3.412 1.00 0.76 H new ATOM 0 HB3 LYS A 89 -3.758 -14.249 -2.306 1.00 0.76 H new ATOM 0 HG2 LYS A 89 -2.234 -12.398 -2.770 1.00 0.77 H new ATOM 0 HG3 LYS A 89 -1.184 -13.435 -3.717 1.00 0.77 H new ATOM 0 HD2 LYS A 89 -3.472 -13.884 -5.080 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -3.893 -12.316 -4.419 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -2.103 -11.219 -5.538 1.00 1.22 H new ATOM 0 HE3 LYS A 89 -1.235 -12.716 -5.819 1.00 1.22 H new ATOM 0 HZ1 LYS A 89 -2.277 -11.913 -7.841 1.00 1.52 H new ATOM 0 HZ2 LYS A 89 -2.969 -13.394 -7.384 1.00 1.52 H new ATOM 0 HZ3 LYS A 89 -3.810 -11.945 -7.111 1.00 1.52 H new ATOM 1457 N LYS A 90 0.463 -15.471 -0.911 1.00 0.56 N ATOM 1458 CA LYS A 90 1.896 -15.763 -1.188 1.00 0.55 C ATOM 1459 C LYS A 90 2.027 -17.155 -1.839 1.00 0.55 C ATOM 1460 O LYS A 90 2.836 -17.353 -2.751 1.00 0.60 O ATOM 1461 CB LYS A 90 2.785 -15.681 0.084 1.00 0.61 C ATOM 1462 CG LYS A 90 2.240 -16.400 1.329 1.00 0.71 C ATOM 1463 CD LYS A 90 3.253 -16.425 2.482 1.00 0.97 C ATOM 1464 CE LYS A 90 4.288 -17.547 2.343 1.00 1.39 C ATOM 1465 NZ LYS A 90 3.732 -18.888 2.692 1.00 1.87 N ATOM 0 H LYS A 90 0.224 -15.438 0.080 1.00 0.56 H new ATOM 0 HA LYS A 90 2.255 -14.995 -1.873 1.00 0.55 H new ATOM 0 HB2 LYS A 90 3.764 -16.097 -0.153 1.00 0.61 H new ATOM 0 HB3 LYS A 90 2.936 -14.630 0.332 1.00 0.61 H new ATOM 0 HG2 LYS A 90 1.328 -15.904 1.661 1.00 0.71 H new ATOM 0 HG3 LYS A 90 1.969 -17.422 1.065 1.00 0.71 H new ATOM 0 HD2 LYS A 90 3.769 -15.466 2.527 1.00 0.97 H new ATOM 0 HD3 LYS A 90 2.720 -16.545 3.425 1.00 0.97 H new ATOM 0 HE2 LYS A 90 4.661 -17.568 1.319 1.00 1.39 H new ATOM 0 HE3 LYS A 90 5.140 -17.332 2.988 1.00 1.39 H new ATOM 0 HZ1 LYS A 90 4.472 -19.610 2.581 1.00 1.87 H new ATOM 0 HZ2 LYS A 90 3.400 -18.880 3.678 1.00 1.87 H new ATOM 0 HZ3 LYS A 90 2.936 -19.109 2.060 1.00 1.87 H new ATOM 1479 N LYS A 91 1.213 -18.106 -1.342 1.00 0.57 N ATOM 1480 CA LYS A 91 1.154 -19.480 -1.853 1.00 0.64 C ATOM 1481 C LYS A 91 -0.322 -19.932 -1.863 1.00 0.69 C ATOM 1482 O LYS A 91 -0.686 -20.930 -1.232 1.00 0.71 O ATOM 1483 CB LYS A 91 2.026 -20.419 -0.987 1.00 0.72 C ATOM 1484 CG LYS A 91 3.536 -20.162 -1.095 1.00 0.85 C ATOM 1485 CD LYS A 91 4.360 -21.285 -0.454 1.00 0.97 C ATOM 1486 CE LYS A 91 5.868 -21.007 -0.497 1.00 1.29 C ATOM 1487 NZ LYS A 91 6.444 -21.193 -1.865 1.00 1.53 N ATOM 0 H LYS A 91 0.573 -17.935 -0.566 1.00 0.57 H new ATOM 0 HA LYS A 91 1.550 -19.521 -2.868 1.00 0.64 H new ATOM 0 HB2 LYS A 91 1.726 -20.315 0.056 1.00 0.72 H new ATOM 0 HB3 LYS A 91 1.824 -21.451 -1.275 1.00 0.72 H new ATOM 0 HG2 LYS A 91 3.812 -20.064 -2.145 1.00 0.85 H new ATOM 0 HG3 LYS A 91 3.777 -19.215 -0.612 1.00 0.85 H new ATOM 0 HD2 LYS A 91 4.047 -21.414 0.582 1.00 0.97 H new ATOM 0 HD3 LYS A 91 4.152 -22.223 -0.969 1.00 0.97 H new ATOM 0 HE2 LYS A 91 6.056 -19.987 -0.162 1.00 1.29 H new ATOM 0 HE3 LYS A 91 6.377 -21.671 0.202 1.00 1.29 H new ATOM 0 HZ1 LYS A 91 7.464 -20.994 -1.842 1.00 1.53 H new ATOM 0 HZ2 LYS A 91 6.290 -22.173 -2.176 1.00 1.53 H new ATOM 0 HZ3 LYS A 91 5.979 -20.542 -2.529 1.00 1.53 H new ATOM 1501 N ASP A 92 -1.170 -19.170 -2.589 1.00 0.78 N ATOM 1502 CA ASP A 92 -2.625 -19.450 -2.677 1.00 0.87 C ATOM 1503 C ASP A 92 -2.946 -20.814 -3.331 1.00 1.03 C ATOM 1504 O ASP A 92 -4.007 -21.387 -3.065 1.00 1.81 O ATOM 1505 CB ASP A 92 -3.371 -18.304 -3.407 1.00 0.89 C ATOM 1506 CG ASP A 92 -2.864 -18.036 -4.820 1.00 0.98 C ATOM 1507 OD1 ASP A 92 -1.905 -17.248 -4.963 1.00 1.01 O ATOM 1508 OD2 ASP A 92 -3.426 -18.610 -5.776 1.00 1.18 O ATOM 0 H ASP A 92 -0.873 -18.354 -3.124 1.00 0.78 H new ATOM 0 HA ASP A 92 -2.984 -19.507 -1.649 1.00 0.87 H new ATOM 0 HB2 ASP A 92 -4.433 -18.546 -3.453 1.00 0.89 H new ATOM 0 HB3 ASP A 92 -3.278 -17.391 -2.819 1.00 0.89 H new ATOM 1513 N LEU A 93 -2.035 -21.331 -4.180 1.00 0.67 N ATOM 1514 CA LEU A 93 -2.238 -22.629 -4.852 1.00 0.70 C ATOM 1515 C LEU A 93 -1.902 -23.815 -3.922 1.00 0.70 C ATOM 1516 O LEU A 93 -2.571 -24.852 -3.975 1.00 0.79 O ATOM 1517 CB LEU A 93 -1.392 -22.702 -6.145 1.00 0.77 C ATOM 1518 CG LEU A 93 -1.987 -23.558 -7.288 1.00 0.97 C ATOM 1519 CD1 LEU A 93 -3.224 -22.884 -7.896 1.00 1.24 C ATOM 1520 CD2 LEU A 93 -0.934 -23.831 -8.365 1.00 1.15 C ATOM 0 H LEU A 93 -1.155 -20.871 -4.415 1.00 0.67 H new ATOM 0 HA LEU A 93 -3.294 -22.704 -5.112 1.00 0.70 H new ATOM 0 HB2 LEU A 93 -1.241 -21.688 -6.516 1.00 0.77 H new ATOM 0 HB3 LEU A 93 -0.409 -23.099 -5.892 1.00 0.77 H new ATOM 0 HG LEU A 93 -2.299 -24.513 -6.865 1.00 0.97 H new ATOM 0 HD11 LEU A 93 -3.621 -23.508 -8.697 1.00 1.24 H new ATOM 0 HD12 LEU A 93 -3.984 -22.755 -7.125 1.00 1.24 H new ATOM 0 HD13 LEU A 93 -2.947 -21.910 -8.298 1.00 1.24 H new ATOM 0 HD21 LEU A 93 -1.374 -24.434 -9.159 1.00 1.15 H new ATOM 0 HD22 LEU A 93 -0.584 -22.886 -8.779 1.00 1.15 H new ATOM 0 HD23 LEU A 93 -0.094 -24.368 -7.925 1.00 1.15 H new ATOM 1532 N LYS A 94 -0.866 -23.652 -3.070 1.00 0.70 N ATOM 1533 CA LYS A 94 -0.433 -24.702 -2.125 1.00 0.77 C ATOM 1534 C LYS A 94 -1.331 -24.727 -0.863 1.00 0.71 C ATOM 1535 O LYS A 94 -1.756 -25.799 -0.423 1.00 0.77 O ATOM 1536 CB LYS A 94 1.047 -24.470 -1.736 1.00 0.92 C ATOM 1537 CG LYS A 94 1.769 -25.686 -1.139 1.00 1.09 C ATOM 1538 CD LYS A 94 2.250 -26.673 -2.215 1.00 1.23 C ATOM 1539 CE LYS A 94 3.316 -27.638 -1.689 1.00 1.57 C ATOM 1540 NZ LYS A 94 2.778 -28.618 -0.698 1.00 1.73 N ATOM 0 H LYS A 94 -0.312 -22.797 -3.019 1.00 0.70 H new ATOM 0 HA LYS A 94 -0.529 -25.671 -2.614 1.00 0.77 H new ATOM 0 HB2 LYS A 94 1.591 -24.145 -2.623 1.00 0.92 H new ATOM 0 HB3 LYS A 94 1.092 -23.653 -1.016 1.00 0.92 H new ATOM 0 HG2 LYS A 94 2.624 -25.346 -0.555 1.00 1.09 H new ATOM 0 HG3 LYS A 94 1.098 -26.201 -0.452 1.00 1.09 H new ATOM 0 HD2 LYS A 94 1.399 -27.244 -2.587 1.00 1.23 H new ATOM 0 HD3 LYS A 94 2.654 -26.116 -3.060 1.00 1.23 H new ATOM 0 HE2 LYS A 94 3.753 -28.180 -2.528 1.00 1.57 H new ATOM 0 HE3 LYS A 94 4.120 -27.066 -1.226 1.00 1.57 H new ATOM 0 HZ1 LYS A 94 3.544 -29.244 -0.378 1.00 1.73 H new ATOM 0 HZ2 LYS A 94 2.385 -28.107 0.118 1.00 1.73 H new ATOM 0 HZ3 LYS A 94 2.030 -29.187 -1.143 1.00 1.73 H new ATOM 1554 N ILE A 95 -1.605 -23.532 -0.291 1.00 0.68 N ATOM 1555 CA ILE A 95 -2.451 -23.385 0.915 1.00 0.67 C ATOM 1556 C ILE A 95 -3.607 -22.401 0.660 1.00 0.67 C ATOM 1557 O ILE A 95 -3.495 -21.524 -0.205 1.00 0.77 O ATOM 1558 CB ILE A 95 -1.620 -22.899 2.154 1.00 0.75 C ATOM 1559 CG1 ILE A 95 -0.891 -21.553 1.861 1.00 0.87 C ATOM 1560 CG2 ILE A 95 -0.629 -23.987 2.591 1.00 0.85 C ATOM 1561 CD1 ILE A 95 -0.385 -20.827 3.095 1.00 1.06 C ATOM 0 H ILE A 95 -1.248 -22.647 -0.651 1.00 0.68 H new ATOM 0 HA ILE A 95 -2.858 -24.372 1.136 1.00 0.67 H new ATOM 0 HB ILE A 95 -2.312 -22.715 2.976 1.00 0.75 H new ATOM 0 HG12 ILE A 95 -0.047 -21.748 1.199 1.00 0.87 H new ATOM 0 HG13 ILE A 95 -1.573 -20.895 1.323 1.00 0.87 H new ATOM 0 HG21 ILE A 95 -0.059 -23.636 3.451 1.00 0.85 H new ATOM 0 HG22 ILE A 95 -1.176 -24.890 2.862 1.00 0.85 H new ATOM 0 HG23 ILE A 95 0.053 -24.209 1.770 1.00 0.85 H new ATOM 0 HD11 ILE A 95 0.108 -19.902 2.796 1.00 1.06 H new ATOM 0 HD12 ILE A 95 -1.224 -20.595 3.751 1.00 1.06 H new ATOM 0 HD13 ILE A 95 0.325 -21.462 3.625 1.00 1.06 H new ATOM 1573 N ARG A 96 -4.722 -22.548 1.409 1.00 0.71 N ATOM 1574 CA ARG A 96 -5.881 -21.640 1.266 1.00 0.77 C ATOM 1575 C ARG A 96 -6.627 -21.400 2.605 1.00 0.77 C ATOM 1576 O ARG A 96 -7.821 -21.073 2.601 1.00 0.93 O ATOM 1577 CB ARG A 96 -6.847 -22.145 0.169 1.00 0.93 C ATOM 1578 CG ARG A 96 -7.461 -23.527 0.414 1.00 1.05 C ATOM 1579 CD ARG A 96 -8.454 -23.915 -0.684 1.00 1.26 C ATOM 1580 NE ARG A 96 -9.617 -23.003 -0.758 1.00 1.40 N ATOM 1581 CZ ARG A 96 -10.456 -22.895 -1.814 1.00 1.83 C ATOM 1582 NH1 ARG A 96 -10.297 -23.637 -2.919 1.00 2.26 N ATOM 1583 NH2 ARG A 96 -11.470 -22.028 -1.757 1.00 2.18 N ATOM 0 H ARG A 96 -4.844 -23.278 2.111 1.00 0.71 H new ATOM 0 HA ARG A 96 -5.485 -20.673 0.958 1.00 0.77 H new ATOM 0 HB2 ARG A 96 -7.655 -21.422 0.061 1.00 0.93 H new ATOM 0 HB3 ARG A 96 -6.311 -22.168 -0.780 1.00 0.93 H new ATOM 0 HG2 ARG A 96 -6.667 -24.273 0.465 1.00 1.05 H new ATOM 0 HG3 ARG A 96 -7.967 -23.533 1.379 1.00 1.05 H new ATOM 0 HD2 ARG A 96 -7.941 -23.920 -1.646 1.00 1.26 H new ATOM 0 HD3 ARG A 96 -8.806 -24.931 -0.506 1.00 1.26 H new ATOM 0 HE ARG A 96 -9.801 -22.409 0.051 1.00 1.40 H new ATOM 0 HH11 ARG A 96 -9.528 -24.304 -2.979 1.00 2.26 H new ATOM 0 HH12 ARG A 96 -10.945 -23.534 -3.700 1.00 2.26 H new ATOM 0 HH21 ARG A 96 -11.606 -21.456 -0.924 1.00 2.18 H new ATOM 0 HH22 ARG A 96 -12.109 -21.938 -2.547 1.00 2.18 H new ATOM 1597 N LYS A 97 -5.912 -21.538 3.747 1.00 0.72 N ATOM 1598 CA LYS A 97 -6.501 -21.312 5.086 1.00 0.75 C ATOM 1599 C LYS A 97 -5.415 -21.287 6.185 1.00 0.74 C ATOM 1600 O LYS A 97 -5.021 -22.335 6.707 1.00 0.95 O ATOM 1601 CB LYS A 97 -7.594 -22.365 5.422 1.00 0.87 C ATOM 1602 CG LYS A 97 -7.210 -23.818 5.099 1.00 0.94 C ATOM 1603 CD LYS A 97 -8.076 -24.832 5.856 1.00 1.10 C ATOM 1604 CE LYS A 97 -7.800 -26.273 5.420 1.00 1.36 C ATOM 1605 NZ LYS A 97 -6.355 -26.653 5.527 1.00 1.74 N ATOM 0 H LYS A 97 -4.928 -21.805 3.766 1.00 0.72 H new ATOM 0 HA LYS A 97 -6.979 -20.333 5.059 1.00 0.75 H new ATOM 0 HB2 LYS A 97 -7.833 -22.294 6.483 1.00 0.87 H new ATOM 0 HB3 LYS A 97 -8.502 -22.113 4.874 1.00 0.87 H new ATOM 0 HG2 LYS A 97 -7.309 -23.988 4.027 1.00 0.94 H new ATOM 0 HG3 LYS A 97 -6.162 -23.979 5.351 1.00 0.94 H new ATOM 0 HD2 LYS A 97 -7.891 -24.737 6.926 1.00 1.10 H new ATOM 0 HD3 LYS A 97 -9.129 -24.601 5.693 1.00 1.10 H new ATOM 0 HE2 LYS A 97 -8.394 -26.952 6.032 1.00 1.36 H new ATOM 0 HE3 LYS A 97 -8.128 -26.403 4.389 1.00 1.36 H new ATOM 0 HZ1 LYS A 97 -6.246 -27.666 5.316 1.00 1.74 H new ATOM 0 HZ2 LYS A 97 -5.798 -26.096 4.848 1.00 1.74 H new ATOM 0 HZ3 LYS A 97 -6.016 -26.462 6.491 1.00 1.74 H new ATOM 1619 N LYS A 98 -4.918 -20.074 6.507 1.00 0.69 N ATOM 1620 CA LYS A 98 -3.890 -19.895 7.550 1.00 0.72 C ATOM 1621 C LYS A 98 -3.946 -18.472 8.117 1.00 0.76 C ATOM 1622 O LYS A 98 -3.677 -18.249 9.297 1.00 0.98 O ATOM 1623 CB LYS A 98 -2.478 -20.210 6.993 1.00 0.88 C ATOM 1624 CG LYS A 98 -1.372 -20.249 8.060 1.00 1.04 C ATOM 1625 CD LYS A 98 -0.001 -20.601 7.470 1.00 1.35 C ATOM 1626 CE LYS A 98 1.134 -20.404 8.482 1.00 1.61 C ATOM 1627 NZ LYS A 98 1.017 -21.295 9.679 1.00 1.71 N ATOM 0 H LYS A 98 -5.213 -19.206 6.059 1.00 0.69 H new ATOM 0 HA LYS A 98 -4.096 -20.596 8.359 1.00 0.72 H new ATOM 0 HB2 LYS A 98 -2.508 -21.172 6.482 1.00 0.88 H new ATOM 0 HB3 LYS A 98 -2.219 -19.460 6.245 1.00 0.88 H new ATOM 0 HG2 LYS A 98 -1.313 -19.279 8.554 1.00 1.04 H new ATOM 0 HG3 LYS A 98 -1.634 -20.981 8.824 1.00 1.04 H new ATOM 0 HD2 LYS A 98 -0.008 -21.637 7.132 1.00 1.35 H new ATOM 0 HD3 LYS A 98 0.185 -19.981 6.593 1.00 1.35 H new ATOM 0 HE2 LYS A 98 2.088 -20.591 7.989 1.00 1.61 H new ATOM 0 HE3 LYS A 98 1.143 -19.365 8.810 1.00 1.61 H new ATOM 0 HZ1 LYS A 98 1.812 -21.115 10.325 1.00 1.71 H new ATOM 0 HZ2 LYS A 98 0.121 -21.101 10.170 1.00 1.71 H new ATOM 0 HZ3 LYS A 98 1.037 -22.289 9.375 1.00 1.71 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 -5.336 -18.163 2.967 1.00 0.85 N ATOM 1643 CA MET B 1 -5.675 -16.859 2.396 1.00 0.86 C ATOM 1644 C MET B 1 -6.478 -16.022 3.411 1.00 0.76 C ATOM 1645 O MET B 1 -7.673 -15.762 3.227 1.00 0.93 O ATOM 1646 CB MET B 1 -6.415 -16.996 1.038 1.00 1.04 C ATOM 1647 CG MET B 1 -7.644 -17.914 1.045 1.00 1.09 C ATOM 1648 SD MET B 1 -8.531 -17.915 -0.529 1.00 1.44 S ATOM 1649 CE MET B 1 -9.942 -18.945 -0.130 1.00 1.75 C ATOM 0 H1 MET B 1 -4.795 -18.716 2.272 1.00 0.85 H new ATOM 0 H2 MET B 1 -4.763 -18.028 3.824 1.00 0.85 H new ATOM 0 H3 MET B 1 -6.209 -18.673 3.211 1.00 0.85 H new ATOM 0 HA MET B 1 -4.746 -16.330 2.185 1.00 0.86 H new ATOM 0 HB2 MET B 1 -6.726 -16.004 0.712 1.00 1.04 H new ATOM 0 HB3 MET B 1 -5.709 -17.368 0.296 1.00 1.04 H new ATOM 0 HG2 MET B 1 -7.330 -18.931 1.280 1.00 1.09 H new ATOM 0 HG3 MET B 1 -8.322 -17.599 1.838 1.00 1.09 H new ATOM 0 HE1 MET B 1 -10.669 -18.896 -0.940 1.00 1.75 H new ATOM 0 HE2 MET B 1 -9.614 -19.976 0.001 1.00 1.75 H new ATOM 0 HE3 MET B 1 -10.402 -18.590 0.792 1.00 1.75 H new ATOM 1659 N ALA B 2 -5.795 -15.613 4.498 1.00 0.73 N ATOM 1660 CA ALA B 2 -6.408 -14.807 5.571 1.00 0.67 C ATOM 1661 C ALA B 2 -5.372 -13.902 6.262 1.00 0.60 C ATOM 1662 O ALA B 2 -4.173 -14.205 6.259 1.00 0.68 O ATOM 1663 CB ALA B 2 -7.089 -15.717 6.593 1.00 0.78 C ATOM 0 H ALA B 2 -4.811 -15.830 4.656 1.00 0.73 H new ATOM 0 HA ALA B 2 -7.158 -14.161 5.116 1.00 0.67 H new ATOM 0 HB1 ALA B 2 -7.537 -15.110 7.379 1.00 0.78 H new ATOM 0 HB2 ALA B 2 -7.865 -16.302 6.099 1.00 0.78 H new ATOM 0 HB3 ALA B 2 -6.351 -16.389 7.030 1.00 0.78 H new ATOM 1669 N ALA B 3 -5.848 -12.794 6.866 1.00 0.57 N ATOM 1670 CA ALA B 3 -4.977 -11.829 7.567 1.00 0.57 C ATOM 1671 C ALA B 3 -4.698 -12.275 9.016 1.00 0.58 C ATOM 1672 O ALA B 3 -5.567 -12.142 9.888 1.00 0.69 O ATOM 1673 CB ALA B 3 -5.615 -10.437 7.531 1.00 0.64 C ATOM 0 H ALA B 3 -6.837 -12.545 6.882 1.00 0.57 H new ATOM 0 HA ALA B 3 -4.017 -11.790 7.053 1.00 0.57 H new ATOM 0 HB1 ALA B 3 -4.970 -9.728 8.049 1.00 0.64 H new ATOM 0 HB2 ALA B 3 -5.743 -10.122 6.495 1.00 0.64 H new ATOM 0 HB3 ALA B 3 -6.587 -10.469 8.023 1.00 0.64 H new ATOM 1679 N GLU B 4 -3.476 -12.807 9.265 1.00 0.56 N ATOM 1680 CA GLU B 4 -3.071 -13.286 10.605 1.00 0.59 C ATOM 1681 C GLU B 4 -1.949 -12.398 11.207 1.00 0.56 C ATOM 1682 O GLU B 4 -1.004 -12.048 10.495 1.00 0.54 O ATOM 1683 CB GLU B 4 -2.596 -14.752 10.510 1.00 0.66 C ATOM 1684 CG GLU B 4 -2.325 -15.425 11.857 1.00 0.79 C ATOM 1685 CD GLU B 4 -1.926 -16.885 11.716 1.00 0.91 C ATOM 1686 OE1 GLU B 4 -0.787 -17.151 11.278 1.00 1.00 O ATOM 1687 OE2 GLU B 4 -2.754 -17.760 12.045 1.00 1.10 O ATOM 0 H GLU B 4 -2.754 -12.914 8.552 1.00 0.56 H new ATOM 0 HA GLU B 4 -3.935 -13.225 11.267 1.00 0.59 H new ATOM 0 HB2 GLU B 4 -3.350 -15.330 9.976 1.00 0.66 H new ATOM 0 HB3 GLU B 4 -1.685 -14.786 9.912 1.00 0.66 H new ATOM 0 HG2 GLU B 4 -1.533 -14.885 12.375 1.00 0.79 H new ATOM 0 HG3 GLU B 4 -3.217 -15.355 12.479 1.00 0.79 H new ATOM 1694 N PRO B 5 -2.021 -12.037 12.536 1.00 0.62 N ATOM 1695 CA PRO B 5 -0.991 -11.198 13.194 1.00 0.65 C ATOM 1696 C PRO B 5 0.368 -11.918 13.336 1.00 0.59 C ATOM 1697 O PRO B 5 0.422 -13.057 13.816 1.00 0.68 O ATOM 1698 CB PRO B 5 -1.591 -10.884 14.585 1.00 0.83 C ATOM 1699 CG PRO B 5 -3.023 -11.288 14.505 1.00 0.80 C ATOM 1700 CD PRO B 5 -3.090 -12.396 13.499 1.00 0.73 C ATOM 0 HA PRO B 5 -0.773 -10.307 12.606 1.00 0.65 H new ATOM 0 HB2 PRO B 5 -1.072 -11.435 15.369 1.00 0.83 H new ATOM 0 HB3 PRO B 5 -1.495 -9.825 14.823 1.00 0.83 H new ATOM 0 HG2 PRO B 5 -3.388 -11.622 15.476 1.00 0.80 H new ATOM 0 HG3 PRO B 5 -3.648 -10.448 14.201 1.00 0.80 H new ATOM 0 HD2 PRO B 5 -2.910 -13.369 13.957 1.00 0.73 H new ATOM 0 HD3 PRO B 5 -4.067 -12.446 13.018 1.00 0.73 H new ATOM 1708 N LEU B 6 1.459 -11.244 12.909 1.00 0.61 N ATOM 1709 CA LEU B 6 2.820 -11.805 12.975 1.00 0.70 C ATOM 1710 C LEU B 6 3.763 -10.846 13.757 1.00 0.73 C ATOM 1711 O LEU B 6 3.640 -10.754 14.982 1.00 1.24 O ATOM 1712 CB LEU B 6 3.323 -12.130 11.540 1.00 0.87 C ATOM 1713 CG LEU B 6 2.533 -13.233 10.784 1.00 0.95 C ATOM 1714 CD1 LEU B 6 2.845 -13.212 9.285 1.00 1.18 C ATOM 1715 CD2 LEU B 6 2.827 -14.617 11.371 1.00 1.08 C ATOM 0 H LEU B 6 1.419 -10.305 12.513 1.00 0.61 H new ATOM 0 HA LEU B 6 2.813 -12.744 13.529 1.00 0.70 H new ATOM 0 HB2 LEU B 6 3.291 -11.215 10.948 1.00 0.87 H new ATOM 0 HB3 LEU B 6 4.368 -12.434 11.601 1.00 0.87 H new ATOM 0 HG LEU B 6 1.471 -13.022 10.912 1.00 0.95 H new ATOM 0 HD11 LEU B 6 2.277 -13.996 8.784 1.00 1.18 H new ATOM 0 HD12 LEU B 6 2.570 -12.242 8.870 1.00 1.18 H new ATOM 0 HD13 LEU B 6 3.911 -13.383 9.133 1.00 1.18 H new ATOM 0 HD21 LEU B 6 2.262 -15.372 10.824 1.00 1.08 H new ATOM 0 HD22 LEU B 6 3.893 -14.829 11.286 1.00 1.08 H new ATOM 0 HD23 LEU B 6 2.536 -14.636 12.421 1.00 1.08 H new ATOM 1727 N THR B 7 4.697 -10.137 13.070 1.00 0.52 N ATOM 1728 CA THR B 7 5.625 -9.193 13.729 1.00 0.50 C ATOM 1729 C THR B 7 5.044 -7.762 13.703 1.00 0.48 C ATOM 1730 O THR B 7 3.929 -7.562 13.224 1.00 0.53 O ATOM 1731 CB THR B 7 7.032 -9.210 13.053 1.00 0.53 C ATOM 1732 OG1 THR B 7 6.924 -8.844 11.672 1.00 0.92 O ATOM 1733 CG2 THR B 7 7.687 -10.585 13.154 1.00 1.06 C ATOM 0 H THR B 7 4.823 -10.205 12.060 1.00 0.52 H new ATOM 0 HA THR B 7 5.743 -9.513 14.764 1.00 0.50 H new ATOM 0 HB THR B 7 7.655 -8.488 13.582 1.00 0.53 H new ATOM 0 HG1 THR B 7 7.820 -8.750 11.287 1.00 0.92 H new ATOM 0 HG21 THR B 7 8.665 -10.559 12.673 1.00 1.06 H new ATOM 0 HG22 THR B 7 7.806 -10.855 14.203 1.00 1.06 H new ATOM 0 HG23 THR B 7 7.058 -11.325 12.658 1.00 1.06 H new ATOM 1741 N GLU B 8 5.800 -6.768 14.221 1.00 0.49 N ATOM 1742 CA GLU B 8 5.341 -5.358 14.262 1.00 0.49 C ATOM 1743 C GLU B 8 5.124 -4.762 12.852 1.00 0.44 C ATOM 1744 O GLU B 8 4.059 -4.200 12.583 1.00 0.47 O ATOM 1745 CB GLU B 8 6.339 -4.492 15.060 1.00 0.54 C ATOM 1746 CG GLU B 8 5.803 -3.115 15.461 1.00 0.95 C ATOM 1747 CD GLU B 8 6.832 -2.283 16.209 1.00 1.01 C ATOM 1748 OE1 GLU B 8 7.644 -1.606 15.542 1.00 1.29 O ATOM 1749 OE2 GLU B 8 6.826 -2.313 17.457 1.00 1.51 O ATOM 0 H GLU B 8 6.729 -6.914 14.616 1.00 0.49 H new ATOM 0 HA GLU B 8 4.373 -5.353 14.764 1.00 0.49 H new ATOM 0 HB2 GLU B 8 6.630 -5.032 15.961 1.00 0.54 H new ATOM 0 HB3 GLU B 8 7.242 -4.357 14.464 1.00 0.54 H new ATOM 0 HG2 GLU B 8 5.487 -2.578 14.567 1.00 0.95 H new ATOM 0 HG3 GLU B 8 4.919 -3.241 16.086 1.00 0.95 H new ATOM 1756 N LEU B 9 6.131 -4.891 11.959 1.00 0.42 N ATOM 1757 CA LEU B 9 6.040 -4.351 10.582 1.00 0.39 C ATOM 1758 C LEU B 9 5.041 -5.147 9.722 1.00 0.38 C ATOM 1759 O LEU B 9 4.344 -4.567 8.885 1.00 0.39 O ATOM 1760 CB LEU B 9 7.425 -4.330 9.900 1.00 0.41 C ATOM 1761 CG LEU B 9 8.543 -3.556 10.644 1.00 0.50 C ATOM 1762 CD1 LEU B 9 9.867 -3.672 9.894 1.00 0.63 C ATOM 1763 CD2 LEU B 9 8.175 -2.080 10.847 1.00 0.65 C ATOM 0 H LEU B 9 7.012 -5.362 12.165 1.00 0.42 H new ATOM 0 HA LEU B 9 5.675 -3.327 10.666 1.00 0.39 H new ATOM 0 HB2 LEU B 9 7.755 -5.360 9.762 1.00 0.41 H new ATOM 0 HB3 LEU B 9 7.311 -3.896 8.906 1.00 0.41 H new ATOM 0 HG LEU B 9 8.653 -4.010 11.629 1.00 0.50 H new ATOM 0 HD11 LEU B 9 10.639 -3.122 10.432 1.00 0.63 H new ATOM 0 HD12 LEU B 9 10.153 -4.721 9.821 1.00 0.63 H new ATOM 0 HD13 LEU B 9 9.756 -3.256 8.893 1.00 0.63 H new ATOM 0 HD21 LEU B 9 8.984 -1.572 11.372 1.00 0.65 H new ATOM 0 HD22 LEU B 9 8.019 -1.607 9.877 1.00 0.65 H new ATOM 0 HD23 LEU B 9 7.261 -2.011 11.436 1.00 0.65 H new ATOM 1775 N GLU B 10 4.988 -6.480 9.928 1.00 0.39 N ATOM 1776 CA GLU B 10 4.058 -7.361 9.195 1.00 0.41 C ATOM 1777 C GLU B 10 2.598 -7.129 9.640 1.00 0.42 C ATOM 1778 O GLU B 10 1.680 -7.240 8.823 1.00 0.47 O ATOM 1779 CB GLU B 10 4.441 -8.838 9.393 1.00 0.46 C ATOM 1780 CG GLU B 10 5.766 -9.230 8.737 1.00 0.50 C ATOM 1781 CD GLU B 10 6.103 -10.702 8.919 1.00 0.56 C ATOM 1782 OE1 GLU B 10 5.429 -11.544 8.289 1.00 0.95 O ATOM 1783 OE2 GLU B 10 7.035 -11.011 9.692 1.00 0.95 O ATOM 0 H GLU B 10 5.581 -6.970 10.598 1.00 0.39 H new ATOM 0 HA GLU B 10 4.135 -7.114 8.136 1.00 0.41 H new ATOM 0 HB2 GLU B 10 4.500 -9.047 10.461 1.00 0.46 H new ATOM 0 HB3 GLU B 10 3.647 -9.466 8.989 1.00 0.46 H new ATOM 0 HG2 GLU B 10 5.720 -9.002 7.672 1.00 0.50 H new ATOM 0 HG3 GLU B 10 6.568 -8.624 9.159 1.00 0.50 H new ATOM 1790 N GLU B 11 2.392 -6.811 10.941 1.00 0.42 N ATOM 1791 CA GLU B 11 1.046 -6.536 11.483 1.00 0.45 C ATOM 1792 C GLU B 11 0.498 -5.188 10.953 1.00 0.43 C ATOM 1793 O GLU B 11 -0.717 -5.017 10.865 1.00 0.45 O ATOM 1794 CB GLU B 11 1.051 -6.547 13.031 1.00 0.51 C ATOM 1795 CG GLU B 11 -0.339 -6.552 13.676 1.00 0.62 C ATOM 1796 CD GLU B 11 -0.295 -6.399 15.188 1.00 0.70 C ATOM 1797 OE1 GLU B 11 -0.328 -5.246 15.669 1.00 0.85 O ATOM 1798 OE2 GLU B 11 -0.232 -7.432 15.888 1.00 0.82 O ATOM 0 H GLU B 11 3.141 -6.740 11.630 1.00 0.42 H new ATOM 0 HA GLU B 11 0.386 -7.333 11.141 1.00 0.45 H new ATOM 0 HB2 GLU B 11 1.598 -7.426 13.373 1.00 0.51 H new ATOM 0 HB3 GLU B 11 1.598 -5.673 13.385 1.00 0.51 H new ATOM 0 HG2 GLU B 11 -0.933 -5.742 13.252 1.00 0.62 H new ATOM 0 HG3 GLU B 11 -0.846 -7.484 13.426 1.00 0.62 H new ATOM 1805 N SER B 12 1.404 -4.239 10.595 1.00 0.43 N ATOM 1806 CA SER B 12 1.007 -2.911 10.067 1.00 0.44 C ATOM 1807 C SER B 12 0.069 -3.033 8.848 1.00 0.42 C ATOM 1808 O SER B 12 -1.067 -2.554 8.892 1.00 0.47 O ATOM 1809 CB SER B 12 2.248 -2.085 9.685 1.00 0.48 C ATOM 1810 OG SER B 12 3.105 -1.898 10.796 1.00 0.56 O ATOM 0 H SER B 12 2.413 -4.372 10.664 1.00 0.43 H new ATOM 0 HA SER B 12 0.464 -2.401 10.862 1.00 0.44 H new ATOM 0 HB2 SER B 12 2.791 -2.589 8.886 1.00 0.48 H new ATOM 0 HB3 SER B 12 1.936 -1.115 9.296 1.00 0.48 H new ATOM 0 HG SER B 12 3.382 -2.770 11.146 1.00 0.56 H new ATOM 1816 N ILE B 13 0.550 -3.691 7.769 1.00 0.40 N ATOM 1817 CA ILE B 13 -0.258 -3.893 6.543 1.00 0.41 C ATOM 1818 C ILE B 13 -1.380 -4.929 6.772 1.00 0.41 C ATOM 1819 O ILE B 13 -2.439 -4.850 6.140 1.00 0.48 O ATOM 1820 CB ILE B 13 0.610 -4.308 5.297 1.00 0.46 C ATOM 1821 CG1 ILE B 13 1.446 -5.605 5.535 1.00 0.45 C ATOM 1822 CG2 ILE B 13 1.522 -3.154 4.875 1.00 0.53 C ATOM 1823 CD1 ILE B 13 0.679 -6.911 5.360 1.00 0.45 C ATOM 0 H ILE B 13 1.488 -4.089 7.721 1.00 0.40 H new ATOM 0 HA ILE B 13 -0.707 -2.925 6.320 1.00 0.41 H new ATOM 0 HB ILE B 13 -0.089 -4.533 4.492 1.00 0.46 H new ATOM 0 HG12 ILE B 13 2.292 -5.604 4.848 1.00 0.45 H new ATOM 0 HG13 ILE B 13 1.855 -5.575 6.545 1.00 0.45 H new ATOM 0 HG21 ILE B 13 2.116 -3.456 4.012 1.00 0.53 H new ATOM 0 HG22 ILE B 13 0.915 -2.288 4.612 1.00 0.53 H new ATOM 0 HG23 ILE B 13 2.186 -2.895 5.700 1.00 0.53 H new ATOM 0 HD11 ILE B 13 1.346 -7.753 5.547 1.00 0.45 H new ATOM 0 HD12 ILE B 13 -0.151 -6.943 6.066 1.00 0.45 H new ATOM 0 HD13 ILE B 13 0.293 -6.973 4.343 1.00 0.45 H new ATOM 1835 N GLU B 14 -1.130 -5.900 7.678 1.00 0.40 N ATOM 1836 CA GLU B 14 -2.104 -6.954 8.021 1.00 0.43 C ATOM 1837 C GLU B 14 -3.349 -6.363 8.725 1.00 0.45 C ATOM 1838 O GLU B 14 -4.459 -6.867 8.534 1.00 0.48 O ATOM 1839 CB GLU B 14 -1.411 -8.018 8.903 1.00 0.46 C ATOM 1840 CG GLU B 14 -2.277 -9.207 9.338 1.00 0.57 C ATOM 1841 CD GLU B 14 -2.961 -9.005 10.688 1.00 0.64 C ATOM 1842 OE1 GLU B 14 -2.296 -8.527 11.631 1.00 0.92 O ATOM 1843 OE2 GLU B 14 -4.160 -9.326 10.799 1.00 1.00 O ATOM 0 H GLU B 14 -0.250 -5.973 8.189 1.00 0.40 H new ATOM 0 HA GLU B 14 -2.456 -7.426 7.104 1.00 0.43 H new ATOM 0 HB2 GLU B 14 -0.548 -8.403 8.360 1.00 0.46 H new ATOM 0 HB3 GLU B 14 -1.031 -7.526 9.798 1.00 0.46 H new ATOM 0 HG2 GLU B 14 -3.038 -9.389 8.579 1.00 0.57 H new ATOM 0 HG3 GLU B 14 -1.655 -10.101 9.386 1.00 0.57 H new ATOM 1850 N THR B 15 -3.156 -5.295 9.535 1.00 0.45 N ATOM 1851 CA THR B 15 -4.270 -4.626 10.243 1.00 0.49 C ATOM 1852 C THR B 15 -5.201 -3.884 9.253 1.00 0.47 C ATOM 1853 O THR B 15 -6.395 -3.742 9.525 1.00 0.50 O ATOM 1854 CB THR B 15 -3.758 -3.632 11.333 1.00 0.54 C ATOM 1855 OG1 THR B 15 -2.868 -4.308 12.232 1.00 0.75 O ATOM 1856 CG2 THR B 15 -4.910 -3.028 12.143 1.00 0.88 C ATOM 0 H THR B 15 -2.241 -4.880 9.713 1.00 0.45 H new ATOM 0 HA THR B 15 -4.838 -5.412 10.740 1.00 0.49 H new ATOM 0 HB THR B 15 -3.239 -2.825 10.816 1.00 0.54 H new ATOM 0 HG1 THR B 15 -1.961 -4.301 11.861 1.00 0.75 H new ATOM 0 HG21 THR B 15 -4.509 -2.343 12.890 1.00 0.88 H new ATOM 0 HG22 THR B 15 -5.579 -2.486 11.475 1.00 0.88 H new ATOM 0 HG23 THR B 15 -5.462 -3.825 12.641 1.00 0.88 H new ATOM 1864 N VAL B 16 -4.647 -3.409 8.112 1.00 0.45 N ATOM 1865 CA VAL B 16 -5.441 -2.708 7.073 1.00 0.47 C ATOM 1866 C VAL B 16 -6.507 -3.663 6.485 1.00 0.47 C ATOM 1867 O VAL B 16 -7.609 -3.229 6.136 1.00 0.52 O ATOM 1868 CB VAL B 16 -4.541 -2.143 5.913 1.00 0.49 C ATOM 1869 CG1 VAL B 16 -5.362 -1.371 4.866 1.00 0.56 C ATOM 1870 CG2 VAL B 16 -3.422 -1.253 6.466 1.00 0.53 C ATOM 0 H VAL B 16 -3.656 -3.498 7.888 1.00 0.45 H new ATOM 0 HA VAL B 16 -5.926 -1.860 7.557 1.00 0.47 H new ATOM 0 HB VAL B 16 -4.094 -3.004 5.416 1.00 0.49 H new ATOM 0 HG11 VAL B 16 -4.699 -1.000 4.085 1.00 0.56 H new ATOM 0 HG12 VAL B 16 -6.106 -2.035 4.425 1.00 0.56 H new ATOM 0 HG13 VAL B 16 -5.864 -0.531 5.345 1.00 0.56 H new ATOM 0 HG21 VAL B 16 -2.816 -0.876 5.642 1.00 0.53 H new ATOM 0 HG22 VAL B 16 -3.859 -0.414 7.008 1.00 0.53 H new ATOM 0 HG23 VAL B 16 -2.795 -1.835 7.142 1.00 0.53 H new ATOM 1880 N VAL B 17 -6.164 -4.968 6.397 1.00 0.46 N ATOM 1881 CA VAL B 17 -7.076 -5.996 5.872 1.00 0.50 C ATOM 1882 C VAL B 17 -8.172 -6.318 6.912 1.00 0.57 C ATOM 1883 O VAL B 17 -9.354 -6.156 6.630 1.00 0.97 O ATOM 1884 CB VAL B 17 -6.312 -7.310 5.470 1.00 0.53 C ATOM 1885 CG1 VAL B 17 -7.248 -8.336 4.818 1.00 0.63 C ATOM 1886 CG2 VAL B 17 -5.130 -7.003 4.541 1.00 0.55 C ATOM 0 H VAL B 17 -5.255 -5.330 6.686 1.00 0.46 H new ATOM 0 HA VAL B 17 -7.538 -5.594 4.970 1.00 0.50 H new ATOM 0 HB VAL B 17 -5.925 -7.746 6.391 1.00 0.53 H new ATOM 0 HG11 VAL B 17 -6.682 -9.229 4.555 1.00 0.63 H new ATOM 0 HG12 VAL B 17 -8.041 -8.602 5.518 1.00 0.63 H new ATOM 0 HG13 VAL B 17 -7.688 -7.907 3.918 1.00 0.63 H new ATOM 0 HG21 VAL B 17 -4.621 -7.931 4.280 1.00 0.55 H new ATOM 0 HG22 VAL B 17 -5.496 -6.522 3.634 1.00 0.55 H new ATOM 0 HG23 VAL B 17 -4.432 -6.337 5.048 1.00 0.55 H new ATOM 1896 N THR B 18 -7.757 -6.724 8.132 1.00 0.50 N ATOM 1897 CA THR B 18 -8.691 -7.101 9.224 1.00 0.52 C ATOM 1898 C THR B 18 -9.767 -6.033 9.536 1.00 0.54 C ATOM 1899 O THR B 18 -10.898 -6.388 9.889 1.00 0.67 O ATOM 1900 CB THR B 18 -7.934 -7.438 10.544 1.00 0.56 C ATOM 1901 OG1 THR B 18 -7.152 -6.313 10.969 1.00 0.58 O ATOM 1902 CG2 THR B 18 -7.017 -8.646 10.379 1.00 0.62 C ATOM 0 H THR B 18 -6.773 -6.800 8.390 1.00 0.50 H new ATOM 0 HA THR B 18 -9.201 -7.986 8.843 1.00 0.52 H new ATOM 0 HB THR B 18 -8.687 -7.676 11.295 1.00 0.56 H new ATOM 0 HG1 THR B 18 -7.147 -5.633 10.263 1.00 0.58 H new ATOM 0 HG21 THR B 18 -6.508 -8.848 11.321 1.00 0.62 H new ATOM 0 HG22 THR B 18 -7.609 -9.516 10.093 1.00 0.62 H new ATOM 0 HG23 THR B 18 -6.278 -8.439 9.605 1.00 0.62 H new ATOM 1910 N THR B 19 -9.421 -4.736 9.395 1.00 0.53 N ATOM 1911 CA THR B 19 -10.360 -3.633 9.696 1.00 0.57 C ATOM 1912 C THR B 19 -11.410 -3.406 8.585 1.00 0.57 C ATOM 1913 O THR B 19 -12.567 -3.110 8.905 1.00 0.66 O ATOM 1914 CB THR B 19 -9.599 -2.297 9.977 1.00 0.60 C ATOM 1915 OG1 THR B 19 -8.489 -2.540 10.855 1.00 0.61 O ATOM 1916 CG2 THR B 19 -10.503 -1.237 10.618 1.00 0.69 C ATOM 0 H THR B 19 -8.503 -4.427 9.076 1.00 0.53 H new ATOM 0 HA THR B 19 -10.895 -3.943 10.594 1.00 0.57 H new ATOM 0 HB THR B 19 -9.255 -1.920 9.014 1.00 0.60 H new ATOM 0 HG1 THR B 19 -7.809 -3.067 10.385 1.00 0.61 H new ATOM 0 HG21 THR B 19 -9.929 -0.327 10.794 1.00 0.69 H new ATOM 0 HG22 THR B 19 -11.336 -1.017 9.950 1.00 0.69 H new ATOM 0 HG23 THR B 19 -10.888 -1.612 11.566 1.00 0.69 H new ATOM 1924 N PHE B 20 -11.024 -3.546 7.294 1.00 0.56 N ATOM 1925 CA PHE B 20 -11.967 -3.304 6.178 1.00 0.60 C ATOM 1926 C PHE B 20 -12.138 -4.512 5.225 1.00 0.60 C ATOM 1927 O PHE B 20 -12.481 -4.326 4.052 1.00 0.94 O ATOM 1928 CB PHE B 20 -11.533 -2.039 5.397 1.00 0.68 C ATOM 1929 CG PHE B 20 -12.663 -1.356 4.649 1.00 0.75 C ATOM 1930 CD1 PHE B 20 -13.671 -0.692 5.342 1.00 0.91 C ATOM 1931 CD2 PHE B 20 -12.724 -1.384 3.262 1.00 0.80 C ATOM 1932 CE1 PHE B 20 -14.705 -0.074 4.670 1.00 1.02 C ATOM 1933 CE2 PHE B 20 -13.759 -0.766 2.586 1.00 0.90 C ATOM 1934 CZ PHE B 20 -14.751 -0.110 3.291 1.00 0.97 C ATOM 0 H PHE B 20 -10.085 -3.820 7.004 1.00 0.56 H new ATOM 0 HA PHE B 20 -12.949 -3.149 6.624 1.00 0.60 H new ATOM 0 HB2 PHE B 20 -11.091 -1.328 6.095 1.00 0.68 H new ATOM 0 HB3 PHE B 20 -10.754 -2.313 4.686 1.00 0.68 H new ATOM 0 HD1 PHE B 20 -13.643 -0.660 6.421 1.00 0.91 H new ATOM 0 HD2 PHE B 20 -11.953 -1.895 2.705 1.00 0.80 H new ATOM 0 HE1 PHE B 20 -15.479 0.438 5.223 1.00 1.02 H new ATOM 0 HE2 PHE B 20 -13.793 -0.796 1.507 1.00 0.90 H new ATOM 0 HZ PHE B 20 -15.560 0.373 2.764 1.00 0.97 H new ATOM 1944 N PHE B 21 -11.930 -5.752 5.720 1.00 0.71 N ATOM 1945 CA PHE B 21 -12.133 -6.953 4.884 1.00 0.72 C ATOM 1946 C PHE B 21 -13.611 -7.381 4.943 1.00 0.68 C ATOM 1947 O PHE B 21 -14.131 -7.931 3.968 1.00 0.71 O ATOM 1948 CB PHE B 21 -11.220 -8.126 5.295 1.00 1.01 C ATOM 1949 CG PHE B 21 -11.153 -9.230 4.257 1.00 1.63 C ATOM 1950 CD1 PHE B 21 -10.258 -9.151 3.198 1.00 1.93 C ATOM 1951 CD2 PHE B 21 -11.992 -10.333 4.332 1.00 2.26 C ATOM 1952 CE1 PHE B 21 -10.197 -10.143 2.243 1.00 2.67 C ATOM 1953 CE2 PHE B 21 -11.937 -11.331 3.374 1.00 2.92 C ATOM 1954 CZ PHE B 21 -11.036 -11.236 2.330 1.00 3.08 C ATOM 0 H PHE B 21 -11.628 -5.945 6.675 1.00 0.71 H new ATOM 0 HA PHE B 21 -11.863 -6.688 3.862 1.00 0.72 H new ATOM 0 HB2 PHE B 21 -10.214 -7.747 5.477 1.00 1.01 H new ATOM 0 HB3 PHE B 21 -11.579 -8.543 6.236 1.00 1.01 H new ATOM 0 HD1 PHE B 21 -9.599 -8.299 3.122 1.00 1.93 H new ATOM 0 HD2 PHE B 21 -12.696 -10.414 5.147 1.00 2.26 H new ATOM 0 HE1 PHE B 21 -9.493 -10.065 1.427 1.00 2.67 H new ATOM 0 HE2 PHE B 21 -12.597 -12.183 3.442 1.00 2.92 H new ATOM 0 HZ PHE B 21 -10.988 -12.015 1.584 1.00 3.08 H new ATOM 1964 N THR B 22 -14.280 -7.131 6.100 1.00 0.76 N ATOM 1965 CA THR B 22 -15.714 -7.445 6.276 1.00 0.91 C ATOM 1966 C THR B 22 -16.560 -6.699 5.219 1.00 0.84 C ATOM 1967 O THR B 22 -17.506 -7.269 4.666 1.00 1.01 O ATOM 1968 CB THR B 22 -16.210 -7.076 7.709 1.00 1.10 C ATOM 1969 OG1 THR B 22 -15.292 -7.577 8.701 1.00 1.23 O ATOM 1970 CG2 THR B 22 -17.610 -7.626 7.988 1.00 1.37 C ATOM 0 H THR B 22 -13.844 -6.713 6.922 1.00 0.76 H new ATOM 0 HA THR B 22 -15.835 -8.520 6.143 1.00 0.91 H new ATOM 0 HB THR B 22 -16.256 -5.988 7.764 1.00 1.10 H new ATOM 0 HG1 THR B 22 -15.614 -7.337 9.595 1.00 1.23 H new ATOM 0 HG21 THR B 22 -17.917 -7.346 8.996 1.00 1.37 H new ATOM 0 HG22 THR B 22 -18.314 -7.212 7.266 1.00 1.37 H new ATOM 0 HG23 THR B 22 -17.598 -8.712 7.901 1.00 1.37 H new ATOM 1978 N PHE B 23 -16.207 -5.420 4.955 1.00 0.69 N ATOM 1979 CA PHE B 23 -16.894 -4.600 3.938 1.00 0.75 C ATOM 1980 C PHE B 23 -16.433 -5.008 2.522 1.00 0.70 C ATOM 1981 O PHE B 23 -17.218 -4.941 1.572 1.00 0.83 O ATOM 1982 CB PHE B 23 -16.642 -3.092 4.171 1.00 0.84 C ATOM 1983 CG PHE B 23 -17.213 -2.562 5.474 1.00 1.00 C ATOM 1984 CD1 PHE B 23 -18.530 -2.112 5.550 1.00 1.32 C ATOM 1985 CD2 PHE B 23 -16.433 -2.510 6.627 1.00 1.03 C ATOM 1986 CE1 PHE B 23 -19.048 -1.627 6.736 1.00 1.54 C ATOM 1987 CE2 PHE B 23 -16.952 -2.024 7.814 1.00 1.27 C ATOM 1988 CZ PHE B 23 -18.260 -1.583 7.869 1.00 1.48 C ATOM 0 H PHE B 23 -15.449 -4.935 5.435 1.00 0.69 H new ATOM 0 HA PHE B 23 -17.965 -4.779 4.027 1.00 0.75 H new ATOM 0 HB2 PHE B 23 -15.568 -2.908 4.156 1.00 0.84 H new ATOM 0 HB3 PHE B 23 -17.074 -2.530 3.343 1.00 0.84 H new ATOM 0 HD1 PHE B 23 -19.155 -2.143 4.669 1.00 1.32 H new ATOM 0 HD2 PHE B 23 -15.410 -2.854 6.594 1.00 1.03 H new ATOM 0 HE1 PHE B 23 -20.071 -1.282 6.777 1.00 1.54 H new ATOM 0 HE2 PHE B 23 -16.334 -1.989 8.699 1.00 1.27 H new ATOM 0 HZ PHE B 23 -18.665 -1.205 8.796 1.00 1.48 H new ATOM 1998 N ALA B 24 -15.150 -5.436 2.394 1.00 0.61 N ATOM 1999 CA ALA B 24 -14.577 -5.884 1.107 1.00 0.67 C ATOM 2000 C ALA B 24 -15.240 -7.179 0.593 1.00 0.65 C ATOM 2001 O ALA B 24 -15.361 -7.364 -0.622 1.00 0.85 O ATOM 2002 CB ALA B 24 -13.065 -6.072 1.229 1.00 0.77 C ATOM 0 H ALA B 24 -14.494 -5.478 3.174 1.00 0.61 H new ATOM 0 HA ALA B 24 -14.781 -5.102 0.375 1.00 0.67 H new ATOM 0 HB1 ALA B 24 -12.661 -6.402 0.272 1.00 0.77 H new ATOM 0 HB2 ALA B 24 -12.602 -5.126 1.512 1.00 0.77 H new ATOM 0 HB3 ALA B 24 -12.852 -6.822 1.991 1.00 0.77 H new ATOM 2008 N ARG B 25 -15.677 -8.075 1.520 1.00 0.62 N ATOM 2009 CA ARG B 25 -16.347 -9.341 1.142 1.00 0.68 C ATOM 2010 C ARG B 25 -17.895 -9.192 1.149 1.00 0.70 C ATOM 2011 O ARG B 25 -18.619 -10.177 1.354 1.00 0.87 O ATOM 2012 CB ARG B 25 -15.880 -10.512 2.054 1.00 0.77 C ATOM 2013 CG ARG B 25 -16.321 -10.443 3.526 1.00 0.80 C ATOM 2014 CD ARG B 25 -15.704 -11.574 4.355 1.00 1.01 C ATOM 2015 NE ARG B 25 -16.252 -11.656 5.723 1.00 1.10 N ATOM 2016 CZ ARG B 25 -15.924 -12.601 6.635 1.00 1.38 C ATOM 2017 NH1 ARG B 25 -15.009 -13.545 6.366 1.00 1.73 N ATOM 2018 NH2 ARG B 25 -16.510 -12.595 7.831 1.00 1.48 N ATOM 0 H ARG B 25 -15.576 -7.941 2.526 1.00 0.62 H new ATOM 0 HA ARG B 25 -16.053 -9.580 0.120 1.00 0.68 H new ATOM 0 HB2 ARG B 25 -16.249 -11.445 1.629 1.00 0.77 H new ATOM 0 HB3 ARG B 25 -14.791 -10.557 2.024 1.00 0.77 H new ATOM 0 HG2 ARG B 25 -16.030 -9.481 3.949 1.00 0.80 H new ATOM 0 HG3 ARG B 25 -17.408 -10.501 3.584 1.00 0.80 H new ATOM 0 HD2 ARG B 25 -15.872 -12.523 3.846 1.00 1.01 H new ATOM 0 HD3 ARG B 25 -14.625 -11.429 4.411 1.00 1.01 H new ATOM 0 HE ARG B 25 -16.929 -10.947 6.002 1.00 1.10 H new ATOM 0 HH11 ARG B 25 -14.544 -13.561 5.458 1.00 1.73 H new ATOM 0 HH12 ARG B 25 -14.778 -14.247 7.069 1.00 1.73 H new ATOM 0 HH21 ARG B 25 -17.202 -11.881 8.056 1.00 1.48 H new ATOM 0 HH22 ARG B 25 -16.266 -13.305 8.522 1.00 1.48 H new ATOM 2032 N GLN B 26 -18.398 -7.957 0.902 1.00 0.71 N ATOM 2033 CA GLN B 26 -19.844 -7.671 0.859 1.00 0.79 C ATOM 2034 C GLN B 26 -20.373 -7.831 -0.581 1.00 0.73 C ATOM 2035 O GLN B 26 -21.447 -8.405 -0.795 1.00 0.84 O ATOM 2036 CB GLN B 26 -20.123 -6.247 1.395 1.00 0.90 C ATOM 2037 CG GLN B 26 -21.569 -5.997 1.820 1.00 1.09 C ATOM 2038 CD GLN B 26 -21.774 -4.618 2.439 1.00 1.31 C ATOM 2039 OE1 GLN B 26 -22.116 -3.664 1.744 1.00 1.46 O ATOM 2040 NE2 GLN B 26 -21.557 -4.496 3.751 1.00 1.68 N ATOM 0 H GLN B 26 -17.813 -7.140 0.729 1.00 0.71 H new ATOM 0 HA GLN B 26 -20.367 -8.383 1.497 1.00 0.79 H new ATOM 0 HB2 GLN B 26 -19.470 -6.060 2.248 1.00 0.90 H new ATOM 0 HB3 GLN B 26 -19.855 -5.524 0.624 1.00 0.90 H new ATOM 0 HG2 GLN B 26 -22.221 -6.101 0.953 1.00 1.09 H new ATOM 0 HG3 GLN B 26 -21.869 -6.760 2.538 1.00 1.09 H new ATOM 0 HE21 GLN B 26 -21.274 -5.309 4.299 1.00 1.68 H new ATOM 0 HE22 GLN B 26 -21.674 -3.590 4.205 1.00 1.68 H new ATOM 2049 N GLU B 27 -19.604 -7.313 -1.562 1.00 0.66 N ATOM 2050 CA GLU B 27 -19.948 -7.406 -2.992 1.00 0.71 C ATOM 2051 C GLU B 27 -19.115 -8.536 -3.640 1.00 0.88 C ATOM 2052 O GLU B 27 -18.537 -9.358 -2.916 1.00 1.45 O ATOM 2053 CB GLU B 27 -19.687 -6.040 -3.683 1.00 0.83 C ATOM 2054 CG GLU B 27 -20.497 -4.870 -3.113 1.00 0.93 C ATOM 2055 CD GLU B 27 -21.982 -4.950 -3.437 1.00 1.04 C ATOM 2056 OE1 GLU B 27 -22.377 -4.484 -4.526 1.00 1.23 O ATOM 2057 OE2 GLU B 27 -22.745 -5.477 -2.601 1.00 1.16 O ATOM 0 H GLU B 27 -18.729 -6.820 -1.383 1.00 0.66 H new ATOM 0 HA GLU B 27 -21.005 -7.644 -3.111 1.00 0.71 H new ATOM 0 HB2 GLU B 27 -18.626 -5.804 -3.602 1.00 0.83 H new ATOM 0 HB3 GLU B 27 -19.912 -6.137 -4.745 1.00 0.83 H new ATOM 0 HG2 GLU B 27 -20.370 -4.842 -2.031 1.00 0.93 H new ATOM 0 HG3 GLU B 27 -20.097 -3.935 -3.505 1.00 0.93 H new ATOM 2064 N GLY B 28 -19.066 -8.602 -4.992 1.00 0.73 N ATOM 2065 CA GLY B 28 -18.282 -9.637 -5.682 1.00 0.86 C ATOM 2066 C GLY B 28 -16.798 -9.642 -5.282 1.00 0.69 C ATOM 2067 O GLY B 28 -16.254 -8.590 -4.928 1.00 0.66 O ATOM 0 H GLY B 28 -19.555 -7.957 -5.613 1.00 0.73 H new ATOM 0 HA2 GLY B 28 -18.713 -10.614 -5.465 1.00 0.86 H new ATOM 0 HA3 GLY B 28 -18.361 -9.485 -6.759 1.00 0.86 H new ATOM 2071 N ARG B 29 -16.150 -10.834 -5.337 1.00 0.68 N ATOM 2072 CA ARG B 29 -14.719 -11.020 -4.967 1.00 0.65 C ATOM 2073 C ARG B 29 -14.477 -10.741 -3.464 1.00 0.62 C ATOM 2074 O ARG B 29 -14.940 -9.733 -2.924 1.00 0.69 O ATOM 2075 CB ARG B 29 -13.772 -10.161 -5.855 1.00 0.66 C ATOM 2076 CG ARG B 29 -13.235 -10.871 -7.104 1.00 0.84 C ATOM 2077 CD ARG B 29 -14.334 -11.241 -8.104 1.00 1.28 C ATOM 2078 NE ARG B 29 -13.776 -11.663 -9.405 1.00 1.44 N ATOM 2079 CZ ARG B 29 -14.400 -12.451 -10.310 1.00 1.93 C ATOM 2080 NH1 ARG B 29 -15.629 -12.939 -10.092 1.00 2.62 N ATOM 2081 NH2 ARG B 29 -13.777 -12.746 -11.454 1.00 2.09 N ATOM 0 H ARG B 29 -16.604 -11.696 -5.639 1.00 0.68 H new ATOM 0 HA ARG B 29 -14.480 -12.067 -5.153 1.00 0.65 H new ATOM 0 HB2 ARG B 29 -14.306 -9.263 -6.167 1.00 0.66 H new ATOM 0 HB3 ARG B 29 -12.927 -9.835 -5.249 1.00 0.66 H new ATOM 0 HG2 ARG B 29 -12.506 -10.227 -7.596 1.00 0.84 H new ATOM 0 HG3 ARG B 29 -12.708 -11.776 -6.802 1.00 0.84 H new ATOM 0 HD2 ARG B 29 -14.943 -12.045 -7.692 1.00 1.28 H new ATOM 0 HD3 ARG B 29 -14.993 -10.386 -8.252 1.00 1.28 H new ATOM 0 HE ARG B 29 -12.841 -11.332 -9.641 1.00 1.44 H new ATOM 0 HH11 ARG B 29 -16.119 -12.719 -9.225 1.00 2.62 H new ATOM 0 HH12 ARG B 29 -16.075 -13.531 -10.793 1.00 2.62 H new ATOM 0 HH21 ARG B 29 -12.843 -12.378 -11.636 1.00 2.09 H new ATOM 0 HH22 ARG B 29 -14.235 -13.339 -12.146 1.00 2.09 H new ATOM 2095 N LYS B 30 -13.721 -11.642 -2.800 1.00 0.64 N ATOM 2096 CA LYS B 30 -13.437 -11.532 -1.349 1.00 0.65 C ATOM 2097 C LYS B 30 -12.345 -10.493 -1.047 1.00 0.63 C ATOM 2098 O LYS B 30 -12.517 -9.660 -0.150 1.00 0.67 O ATOM 2099 CB LYS B 30 -13.030 -12.905 -0.768 1.00 0.73 C ATOM 2100 CG LYS B 30 -14.075 -14.011 -0.949 1.00 0.79 C ATOM 2101 CD LYS B 30 -15.294 -13.839 -0.038 1.00 0.87 C ATOM 2102 CE LYS B 30 -16.379 -14.877 -0.335 1.00 1.01 C ATOM 2103 NZ LYS B 30 -17.082 -14.622 -1.629 1.00 1.11 N ATOM 0 H LYS B 30 -13.295 -12.455 -3.245 1.00 0.64 H new ATOM 0 HA LYS B 30 -14.357 -11.195 -0.871 1.00 0.65 H new ATOM 0 HB2 LYS B 30 -12.100 -13.222 -1.239 1.00 0.73 H new ATOM 0 HB3 LYS B 30 -12.825 -12.788 0.296 1.00 0.73 H new ATOM 0 HG2 LYS B 30 -14.404 -14.025 -1.988 1.00 0.79 H new ATOM 0 HG3 LYS B 30 -13.612 -14.977 -0.748 1.00 0.79 H new ATOM 0 HD2 LYS B 30 -14.984 -13.925 1.003 1.00 0.87 H new ATOM 0 HD3 LYS B 30 -15.705 -12.838 -0.166 1.00 0.87 H new ATOM 0 HE2 LYS B 30 -15.929 -15.870 -0.360 1.00 1.01 H new ATOM 0 HE3 LYS B 30 -17.108 -14.877 0.476 1.00 1.01 H new ATOM 0 HZ1 LYS B 30 -17.850 -15.313 -1.749 1.00 1.11 H new ATOM 0 HZ2 LYS B 30 -17.478 -13.660 -1.625 1.00 1.11 H new ATOM 0 HZ3 LYS B 30 -16.407 -14.715 -2.415 1.00 1.11 H new ATOM 2117 N ASP B 31 -11.226 -10.546 -1.794 1.00 0.65 N ATOM 2118 CA ASP B 31 -10.102 -9.609 -1.604 1.00 0.69 C ATOM 2119 C ASP B 31 -10.235 -8.405 -2.557 1.00 0.64 C ATOM 2120 O ASP B 31 -9.361 -8.165 -3.404 1.00 0.88 O ATOM 2121 CB ASP B 31 -8.753 -10.338 -1.820 1.00 0.83 C ATOM 2122 CG ASP B 31 -8.624 -11.620 -1.008 1.00 0.94 C ATOM 2123 OD1 ASP B 31 -9.046 -12.685 -1.510 1.00 1.24 O ATOM 2124 OD2 ASP B 31 -8.100 -11.561 0.124 1.00 1.36 O ATOM 0 H ASP B 31 -11.076 -11.229 -2.536 1.00 0.65 H new ATOM 0 HA ASP B 31 -10.129 -9.234 -0.581 1.00 0.69 H new ATOM 0 HB2 ASP B 31 -8.641 -10.574 -2.878 1.00 0.83 H new ATOM 0 HB3 ASP B 31 -7.938 -9.665 -1.555 1.00 0.83 H new ATOM 2129 N SER B 32 -11.345 -7.646 -2.413 1.00 0.65 N ATOM 2130 CA SER B 32 -11.607 -6.477 -3.272 1.00 0.59 C ATOM 2131 C SER B 32 -12.595 -5.483 -2.636 1.00 0.57 C ATOM 2132 O SER B 32 -13.597 -5.885 -2.038 1.00 0.64 O ATOM 2133 CB SER B 32 -12.162 -6.929 -4.634 1.00 0.59 C ATOM 2134 OG SER B 32 -13.449 -7.518 -4.504 1.00 1.13 O ATOM 0 H SER B 32 -12.067 -7.823 -1.714 1.00 0.65 H new ATOM 0 HA SER B 32 -10.652 -5.967 -3.400 1.00 0.59 H new ATOM 0 HB2 SER B 32 -12.219 -6.073 -5.307 1.00 0.59 H new ATOM 0 HB3 SER B 32 -11.477 -7.646 -5.087 1.00 0.59 H new ATOM 0 HG SER B 32 -13.413 -8.241 -3.843 1.00 1.13 H new ATOM 2140 N LEU B 33 -12.300 -4.179 -2.789 1.00 0.55 N ATOM 2141 CA LEU B 33 -13.159 -3.095 -2.288 1.00 0.56 C ATOM 2142 C LEU B 33 -14.046 -2.602 -3.449 1.00 0.55 C ATOM 2143 O LEU B 33 -13.525 -2.253 -4.508 1.00 0.72 O ATOM 2144 CB LEU B 33 -12.299 -1.927 -1.733 1.00 0.59 C ATOM 2145 CG LEU B 33 -11.626 -2.142 -0.349 1.00 0.69 C ATOM 2146 CD1 LEU B 33 -10.539 -3.223 -0.402 1.00 0.79 C ATOM 2147 CD2 LEU B 33 -11.044 -0.822 0.172 1.00 0.75 C ATOM 0 H LEU B 33 -11.459 -3.849 -3.263 1.00 0.55 H new ATOM 0 HA LEU B 33 -13.781 -3.466 -1.473 1.00 0.56 H new ATOM 0 HB2 LEU B 33 -11.517 -1.707 -2.460 1.00 0.59 H new ATOM 0 HB3 LEU B 33 -12.932 -1.042 -1.668 1.00 0.59 H new ATOM 0 HG LEU B 33 -12.397 -2.488 0.340 1.00 0.69 H new ATOM 0 HD11 LEU B 33 -10.095 -3.341 0.586 1.00 0.79 H new ATOM 0 HD12 LEU B 33 -10.981 -4.168 -0.716 1.00 0.79 H new ATOM 0 HD13 LEU B 33 -9.768 -2.929 -1.114 1.00 0.79 H new ATOM 0 HD21 LEU B 33 -10.576 -0.989 1.142 1.00 0.75 H new ATOM 0 HD22 LEU B 33 -10.299 -0.450 -0.531 1.00 0.75 H new ATOM 0 HD23 LEU B 33 -11.843 -0.088 0.276 1.00 0.75 H new ATOM 2159 N SER B 34 -15.382 -2.594 -3.263 1.00 0.52 N ATOM 2160 CA SER B 34 -16.321 -2.156 -4.323 1.00 0.53 C ATOM 2161 C SER B 34 -16.202 -0.641 -4.611 1.00 0.50 C ATOM 2162 O SER B 34 -15.593 0.099 -3.833 1.00 0.52 O ATOM 2163 CB SER B 34 -17.770 -2.519 -3.953 1.00 0.62 C ATOM 2164 OG SER B 34 -18.617 -2.478 -5.091 1.00 0.69 O ATOM 0 H SER B 34 -15.835 -2.883 -2.396 1.00 0.52 H new ATOM 0 HA SER B 34 -16.047 -2.687 -5.235 1.00 0.53 H new ATOM 0 HB2 SER B 34 -17.797 -3.516 -3.513 1.00 0.62 H new ATOM 0 HB3 SER B 34 -18.139 -1.826 -3.197 1.00 0.62 H new ATOM 0 HG SER B 34 -19.525 -2.236 -4.814 1.00 0.69 H new ATOM 2170 N VAL B 35 -16.799 -0.193 -5.741 1.00 0.52 N ATOM 2171 CA VAL B 35 -16.762 1.229 -6.158 1.00 0.53 C ATOM 2172 C VAL B 35 -17.311 2.188 -5.070 1.00 0.48 C ATOM 2173 O VAL B 35 -16.768 3.284 -4.893 1.00 0.52 O ATOM 2174 CB VAL B 35 -17.501 1.450 -7.529 1.00 0.64 C ATOM 2175 CG1 VAL B 35 -19.011 1.192 -7.433 1.00 0.67 C ATOM 2176 CG2 VAL B 35 -17.218 2.844 -8.110 1.00 0.71 C ATOM 0 H VAL B 35 -17.313 -0.798 -6.381 1.00 0.52 H new ATOM 0 HA VAL B 35 -15.710 1.477 -6.296 1.00 0.53 H new ATOM 0 HB VAL B 35 -17.093 0.709 -8.217 1.00 0.64 H new ATOM 0 HG11 VAL B 35 -19.471 1.359 -8.407 1.00 0.67 H new ATOM 0 HG12 VAL B 35 -19.185 0.162 -7.121 1.00 0.67 H new ATOM 0 HG13 VAL B 35 -19.450 1.871 -6.703 1.00 0.67 H new ATOM 0 HG21 VAL B 35 -17.746 2.958 -9.057 1.00 0.71 H new ATOM 0 HG22 VAL B 35 -17.560 3.606 -7.410 1.00 0.71 H new ATOM 0 HG23 VAL B 35 -16.147 2.958 -8.276 1.00 0.71 H new ATOM 2186 N ASN B 36 -18.366 1.760 -4.342 1.00 0.47 N ATOM 2187 CA ASN B 36 -18.980 2.571 -3.274 1.00 0.48 C ATOM 2188 C ASN B 36 -18.602 2.010 -1.880 1.00 0.46 C ATOM 2189 O ASN B 36 -19.468 1.784 -1.028 1.00 0.66 O ATOM 2190 CB ASN B 36 -20.514 2.614 -3.470 1.00 0.55 C ATOM 2191 CG ASN B 36 -21.180 3.794 -2.765 1.00 0.64 C ATOM 2192 OD1 ASN B 36 -21.255 4.893 -3.317 1.00 0.83 O ATOM 2193 ND2 ASN B 36 -21.675 3.576 -1.548 1.00 0.79 N ATOM 0 H ASN B 36 -18.810 0.852 -4.478 1.00 0.47 H new ATOM 0 HA ASN B 36 -18.598 3.590 -3.330 1.00 0.48 H new ATOM 0 HB2 ASN B 36 -20.736 2.664 -4.536 1.00 0.55 H new ATOM 0 HB3 ASN B 36 -20.947 1.686 -3.098 1.00 0.55 H new ATOM 0 HD21 ASN B 36 -22.135 4.333 -1.041 1.00 0.79 H new ATOM 0 HD22 ASN B 36 -21.594 2.652 -1.123 1.00 0.79 H new ATOM 2200 N GLU B 37 -17.291 1.786 -1.665 1.00 0.46 N ATOM 2201 CA GLU B 37 -16.764 1.269 -0.384 1.00 0.50 C ATOM 2202 C GLU B 37 -15.472 2.001 0.010 1.00 0.45 C ATOM 2203 O GLU B 37 -15.354 2.459 1.148 1.00 0.46 O ATOM 2204 CB GLU B 37 -16.529 -0.254 -0.451 1.00 0.62 C ATOM 2205 CG GLU B 37 -17.821 -1.076 -0.503 1.00 0.69 C ATOM 2206 CD GLU B 37 -17.596 -2.585 -0.441 1.00 0.88 C ATOM 2207 OE1 GLU B 37 -16.426 -3.030 -0.501 1.00 1.61 O ATOM 2208 OE2 GLU B 37 -18.597 -3.321 -0.334 1.00 1.28 O ATOM 0 H GLU B 37 -16.571 1.956 -2.367 1.00 0.46 H new ATOM 0 HA GLU B 37 -17.513 1.459 0.385 1.00 0.50 H new ATOM 0 HB2 GLU B 37 -15.929 -0.481 -1.332 1.00 0.62 H new ATOM 0 HB3 GLU B 37 -15.948 -0.561 0.419 1.00 0.62 H new ATOM 0 HG2 GLU B 37 -18.462 -0.780 0.327 1.00 0.69 H new ATOM 0 HG3 GLU B 37 -18.357 -0.836 -1.421 1.00 0.69 H new ATOM 2215 N PHE B 38 -14.503 2.109 -0.931 1.00 0.43 N ATOM 2216 CA PHE B 38 -13.238 2.827 -0.667 1.00 0.43 C ATOM 2217 C PHE B 38 -13.505 4.335 -0.514 1.00 0.39 C ATOM 2218 O PHE B 38 -12.826 5.010 0.261 1.00 0.42 O ATOM 2219 CB PHE B 38 -12.176 2.556 -1.767 1.00 0.48 C ATOM 2220 CG PHE B 38 -12.412 3.249 -3.104 1.00 0.46 C ATOM 2221 CD1 PHE B 38 -13.228 2.678 -4.075 1.00 0.52 C ATOM 2222 CD2 PHE B 38 -11.809 4.474 -3.386 1.00 0.55 C ATOM 2223 CE1 PHE B 38 -13.437 3.309 -5.287 1.00 0.61 C ATOM 2224 CE2 PHE B 38 -12.020 5.106 -4.598 1.00 0.65 C ATOM 2225 CZ PHE B 38 -12.833 4.523 -5.549 1.00 0.66 C ATOM 0 H PHE B 38 -14.574 1.712 -1.868 1.00 0.43 H new ATOM 0 HA PHE B 38 -12.828 2.447 0.269 1.00 0.43 H new ATOM 0 HB2 PHE B 38 -11.201 2.863 -1.388 1.00 0.48 H new ATOM 0 HB3 PHE B 38 -12.127 1.481 -1.940 1.00 0.48 H new ATOM 0 HD1 PHE B 38 -13.705 1.729 -3.879 1.00 0.52 H new ATOM 0 HD2 PHE B 38 -11.169 4.935 -2.649 1.00 0.55 H new ATOM 0 HE1 PHE B 38 -14.074 2.852 -6.030 1.00 0.61 H new ATOM 0 HE2 PHE B 38 -11.548 6.056 -4.800 1.00 0.65 H new ATOM 0 HZ PHE B 38 -12.996 5.015 -6.496 1.00 0.66 H new ATOM 2235 N LYS B 39 -14.506 4.851 -1.266 1.00 0.37 N ATOM 2236 CA LYS B 39 -14.899 6.270 -1.197 1.00 0.38 C ATOM 2237 C LYS B 39 -15.497 6.593 0.186 1.00 0.36 C ATOM 2238 O LYS B 39 -15.252 7.673 0.729 1.00 0.39 O ATOM 2239 CB LYS B 39 -15.909 6.606 -2.309 1.00 0.43 C ATOM 2240 CG LYS B 39 -16.176 8.100 -2.487 1.00 0.50 C ATOM 2241 CD LYS B 39 -17.109 8.366 -3.667 1.00 0.60 C ATOM 2242 CE LYS B 39 -17.410 9.854 -3.848 1.00 0.70 C ATOM 2243 NZ LYS B 39 -16.212 10.623 -4.296 1.00 0.81 N ATOM 0 H LYS B 39 -15.054 4.301 -1.927 1.00 0.37 H new ATOM 0 HA LYS B 39 -14.009 6.882 -1.344 1.00 0.38 H new ATOM 0 HB2 LYS B 39 -15.542 6.200 -3.252 1.00 0.43 H new ATOM 0 HB3 LYS B 39 -16.852 6.104 -2.091 1.00 0.43 H new ATOM 0 HG2 LYS B 39 -16.617 8.503 -1.575 1.00 0.50 H new ATOM 0 HG3 LYS B 39 -15.233 8.623 -2.643 1.00 0.50 H new ATOM 0 HD2 LYS B 39 -16.657 7.976 -4.579 1.00 0.60 H new ATOM 0 HD3 LYS B 39 -18.043 7.825 -3.517 1.00 0.60 H new ATOM 0 HE2 LYS B 39 -18.210 9.974 -4.578 1.00 0.70 H new ATOM 0 HE3 LYS B 39 -17.773 10.266 -2.906 1.00 0.70 H new ATOM 0 HZ1 LYS B 39 -16.476 11.616 -4.454 1.00 0.81 H new ATOM 0 HZ2 LYS B 39 -15.474 10.573 -3.565 1.00 0.81 H new ATOM 0 HZ3 LYS B 39 -15.850 10.216 -5.182 1.00 0.81 H new ATOM 2257 N GLU B 40 -16.292 5.647 0.743 1.00 0.35 N ATOM 2258 CA GLU B 40 -16.898 5.808 2.081 1.00 0.38 C ATOM 2259 C GLU B 40 -15.808 5.735 3.166 1.00 0.38 C ATOM 2260 O GLU B 40 -15.895 6.432 4.179 1.00 0.41 O ATOM 2261 CB GLU B 40 -17.966 4.728 2.354 1.00 0.43 C ATOM 2262 CG GLU B 40 -19.208 4.835 1.475 1.00 0.47 C ATOM 2263 CD GLU B 40 -20.299 3.860 1.879 1.00 0.56 C ATOM 2264 OE1 GLU B 40 -20.195 2.668 1.521 1.00 0.63 O ATOM 2265 OE2 GLU B 40 -21.256 4.289 2.557 1.00 0.69 O ATOM 0 H GLU B 40 -16.526 4.767 0.284 1.00 0.35 H new ATOM 0 HA GLU B 40 -17.383 6.784 2.108 1.00 0.38 H new ATOM 0 HB2 GLU B 40 -17.517 3.745 2.210 1.00 0.43 H new ATOM 0 HB3 GLU B 40 -18.269 4.790 3.399 1.00 0.43 H new ATOM 0 HG2 GLU B 40 -19.598 5.852 1.527 1.00 0.47 H new ATOM 0 HG3 GLU B 40 -18.930 4.653 0.437 1.00 0.47 H new ATOM 2272 N LEU B 41 -14.781 4.883 2.939 1.00 0.37 N ATOM 2273 CA LEU B 41 -13.654 4.726 3.875 1.00 0.40 C ATOM 2274 C LEU B 41 -12.839 6.032 3.965 1.00 0.38 C ATOM 2275 O LEU B 41 -12.458 6.445 5.059 1.00 0.40 O ATOM 2276 CB LEU B 41 -12.749 3.549 3.429 1.00 0.44 C ATOM 2277 CG LEU B 41 -11.655 3.098 4.431 1.00 0.55 C ATOM 2278 CD1 LEU B 41 -12.270 2.555 5.727 1.00 0.68 C ATOM 2279 CD2 LEU B 41 -10.722 2.064 3.780 1.00 0.64 C ATOM 0 H LEU B 41 -14.714 4.293 2.110 1.00 0.37 H new ATOM 0 HA LEU B 41 -14.052 4.504 4.865 1.00 0.40 H new ATOM 0 HB2 LEU B 41 -13.387 2.692 3.212 1.00 0.44 H new ATOM 0 HB3 LEU B 41 -12.262 3.829 2.495 1.00 0.44 H new ATOM 0 HG LEU B 41 -11.061 3.972 4.698 1.00 0.55 H new ATOM 0 HD11 LEU B 41 -11.475 2.248 6.406 1.00 0.68 H new ATOM 0 HD12 LEU B 41 -12.870 3.333 6.199 1.00 0.68 H new ATOM 0 HD13 LEU B 41 -12.903 1.697 5.498 1.00 0.68 H new ATOM 0 HD21 LEU B 41 -9.960 1.759 4.497 1.00 0.64 H new ATOM 0 HD22 LEU B 41 -11.302 1.193 3.473 1.00 0.64 H new ATOM 0 HD23 LEU B 41 -10.242 2.506 2.907 1.00 0.64 H new ATOM 2291 N VAL B 42 -12.596 6.676 2.803 1.00 0.37 N ATOM 2292 CA VAL B 42 -11.843 7.945 2.738 1.00 0.38 C ATOM 2293 C VAL B 42 -12.680 9.135 3.275 1.00 0.39 C ATOM 2294 O VAL B 42 -12.102 10.117 3.740 1.00 0.43 O ATOM 2295 CB VAL B 42 -11.349 8.235 1.272 1.00 0.43 C ATOM 2296 CG1 VAL B 42 -10.678 9.613 1.139 1.00 0.48 C ATOM 2297 CG2 VAL B 42 -10.388 7.134 0.801 1.00 0.47 C ATOM 0 H VAL B 42 -12.912 6.335 1.895 1.00 0.37 H new ATOM 0 HA VAL B 42 -10.969 7.835 3.381 1.00 0.38 H new ATOM 0 HB VAL B 42 -12.234 8.242 0.635 1.00 0.43 H new ATOM 0 HG11 VAL B 42 -10.356 9.763 0.109 1.00 0.48 H new ATOM 0 HG12 VAL B 42 -11.389 10.392 1.414 1.00 0.48 H new ATOM 0 HG13 VAL B 42 -9.813 9.662 1.800 1.00 0.48 H new ATOM 0 HG21 VAL B 42 -10.056 7.351 -0.214 1.00 0.47 H new ATOM 0 HG22 VAL B 42 -9.524 7.097 1.465 1.00 0.47 H new ATOM 0 HG23 VAL B 42 -10.900 6.172 0.818 1.00 0.47 H new ATOM 2307 N THR B 43 -14.029 9.040 3.229 1.00 0.38 N ATOM 2308 CA THR B 43 -14.908 10.129 3.699 1.00 0.42 C ATOM 2309 C THR B 43 -15.698 9.738 4.977 1.00 0.48 C ATOM 2310 O THR B 43 -16.881 10.073 5.112 1.00 0.83 O ATOM 2311 CB THR B 43 -15.882 10.569 2.554 1.00 0.44 C ATOM 2312 OG1 THR B 43 -15.199 10.553 1.285 1.00 0.46 O ATOM 2313 CG2 THR B 43 -16.449 11.973 2.794 1.00 0.49 C ATOM 0 H THR B 43 -14.527 8.224 2.873 1.00 0.38 H new ATOM 0 HA THR B 43 -14.271 10.972 3.968 1.00 0.42 H new ATOM 0 HB THR B 43 -16.709 9.859 2.546 1.00 0.44 H new ATOM 0 HG1 THR B 43 -15.149 9.633 0.952 1.00 0.46 H new ATOM 0 HG21 THR B 43 -17.119 12.239 1.977 1.00 0.49 H new ATOM 0 HG22 THR B 43 -17.000 11.987 3.735 1.00 0.49 H new ATOM 0 HG23 THR B 43 -15.631 12.692 2.842 1.00 0.49 H new ATOM 2321 N GLN B 44 -15.039 9.033 5.929 1.00 0.42 N ATOM 2322 CA GLN B 44 -15.688 8.631 7.200 1.00 0.44 C ATOM 2323 C GLN B 44 -14.640 8.291 8.284 1.00 0.44 C ATOM 2324 O GLN B 44 -14.547 8.999 9.291 1.00 0.50 O ATOM 2325 CB GLN B 44 -16.668 7.449 6.974 1.00 0.47 C ATOM 2326 CG GLN B 44 -17.660 7.213 8.123 1.00 0.58 C ATOM 2327 CD GLN B 44 -18.661 6.090 7.845 1.00 0.67 C ATOM 2328 OE1 GLN B 44 -19.007 5.817 6.693 1.00 0.91 O ATOM 2329 NE2 GLN B 44 -19.147 5.436 8.906 1.00 0.98 N ATOM 0 H GLN B 44 -14.068 8.734 5.842 1.00 0.42 H new ATOM 0 HA GLN B 44 -16.267 9.481 7.561 1.00 0.44 H new ATOM 0 HB2 GLN B 44 -17.230 7.630 6.058 1.00 0.47 H new ATOM 0 HB3 GLN B 44 -16.089 6.539 6.818 1.00 0.47 H new ATOM 0 HG2 GLN B 44 -17.103 6.976 9.030 1.00 0.58 H new ATOM 0 HG3 GLN B 44 -18.206 8.136 8.316 1.00 0.58 H new ATOM 0 HE21 GLN B 44 -18.839 5.688 9.845 1.00 0.98 H new ATOM 0 HE22 GLN B 44 -19.826 4.686 8.776 1.00 0.98 H new ATOM 2338 N GLN B 45 -13.851 7.215 8.071 1.00 0.42 N ATOM 2339 CA GLN B 45 -12.818 6.780 9.037 1.00 0.43 C ATOM 2340 C GLN B 45 -11.385 7.101 8.541 1.00 0.41 C ATOM 2341 O GLN B 45 -10.419 6.900 9.286 1.00 0.46 O ATOM 2342 CB GLN B 45 -12.970 5.269 9.330 1.00 0.47 C ATOM 2343 CG GLN B 45 -12.315 4.809 10.638 1.00 0.57 C ATOM 2344 CD GLN B 45 -12.637 3.359 11.009 1.00 0.62 C ATOM 2345 OE1 GLN B 45 -12.839 2.510 10.136 1.00 0.70 O ATOM 2346 NE2 GLN B 45 -12.680 3.064 12.310 1.00 0.73 N ATOM 0 H GLN B 45 -13.910 6.631 7.237 1.00 0.42 H new ATOM 0 HA GLN B 45 -12.969 7.340 9.960 1.00 0.43 H new ATOM 0 HB2 GLN B 45 -14.031 5.023 9.363 1.00 0.47 H new ATOM 0 HB3 GLN B 45 -12.537 4.706 8.503 1.00 0.47 H new ATOM 0 HG2 GLN B 45 -11.234 4.922 10.552 1.00 0.57 H new ATOM 0 HG3 GLN B 45 -12.641 5.463 11.447 1.00 0.57 H new ATOM 0 HE21 GLN B 45 -12.508 3.792 13.004 1.00 0.73 H new ATOM 0 HE22 GLN B 45 -12.885 2.111 12.610 1.00 0.73 H new ATOM 2355 N LEU B 46 -11.247 7.616 7.294 1.00 0.39 N ATOM 2356 CA LEU B 46 -9.933 7.956 6.720 1.00 0.38 C ATOM 2357 C LEU B 46 -9.948 9.347 6.002 1.00 0.38 C ATOM 2358 O LEU B 46 -9.360 9.481 4.920 1.00 0.41 O ATOM 2359 CB LEU B 46 -9.516 6.807 5.752 1.00 0.40 C ATOM 2360 CG LEU B 46 -8.004 6.570 5.551 1.00 0.41 C ATOM 2361 CD1 LEU B 46 -7.343 6.125 6.859 1.00 0.58 C ATOM 2362 CD2 LEU B 46 -7.772 5.533 4.441 1.00 0.62 C ATOM 0 H LEU B 46 -12.033 7.803 6.671 1.00 0.39 H new ATOM 0 HA LEU B 46 -9.198 8.048 7.520 1.00 0.38 H new ATOM 0 HB2 LEU B 46 -9.958 5.880 6.117 1.00 0.40 H new ATOM 0 HB3 LEU B 46 -9.959 7.009 4.777 1.00 0.40 H new ATOM 0 HG LEU B 46 -7.544 7.511 5.248 1.00 0.41 H new ATOM 0 HD11 LEU B 46 -6.278 5.964 6.692 1.00 0.58 H new ATOM 0 HD12 LEU B 46 -7.479 6.897 7.616 1.00 0.58 H new ATOM 0 HD13 LEU B 46 -7.801 5.197 7.201 1.00 0.58 H new ATOM 0 HD21 LEU B 46 -6.702 5.375 4.309 1.00 0.62 H new ATOM 0 HD22 LEU B 46 -8.247 4.592 4.718 1.00 0.62 H new ATOM 0 HD23 LEU B 46 -8.203 5.896 3.508 1.00 0.62 H new ATOM 2374 N PRO B 47 -10.598 10.420 6.592 1.00 0.40 N ATOM 2375 CA PRO B 47 -10.650 11.767 5.966 1.00 0.42 C ATOM 2376 C PRO B 47 -9.377 12.616 6.170 1.00 0.42 C ATOM 2377 O PRO B 47 -9.011 13.396 5.286 1.00 0.46 O ATOM 2378 CB PRO B 47 -11.853 12.417 6.661 1.00 0.48 C ATOM 2379 CG PRO B 47 -11.854 11.830 8.031 1.00 0.48 C ATOM 2380 CD PRO B 47 -11.349 10.416 7.883 1.00 0.44 C ATOM 0 HA PRO B 47 -10.731 11.694 4.881 1.00 0.42 H new ATOM 0 HB2 PRO B 47 -11.754 13.502 6.694 1.00 0.48 H new ATOM 0 HB3 PRO B 47 -12.782 12.198 6.134 1.00 0.48 H new ATOM 0 HG2 PRO B 47 -11.214 12.404 8.701 1.00 0.48 H new ATOM 0 HG3 PRO B 47 -12.856 11.843 8.459 1.00 0.48 H new ATOM 0 HD2 PRO B 47 -10.705 10.136 8.716 1.00 0.44 H new ATOM 0 HD3 PRO B 47 -12.171 9.701 7.861 1.00 0.44 H new ATOM 2388 N HIS B 48 -8.717 12.472 7.337 1.00 0.42 N ATOM 2389 CA HIS B 48 -7.492 13.236 7.656 1.00 0.44 C ATOM 2390 C HIS B 48 -6.246 12.711 6.910 1.00 0.43 C ATOM 2391 O HIS B 48 -5.223 13.403 6.870 1.00 0.49 O ATOM 2392 CB HIS B 48 -7.241 13.243 9.185 1.00 0.49 C ATOM 2393 CG HIS B 48 -7.726 14.486 9.869 1.00 0.56 C ATOM 2394 ND1 HIS B 48 -9.010 14.634 10.350 1.00 0.67 N ATOM 2395 CD2 HIS B 48 -7.088 15.651 10.137 1.00 0.70 C ATOM 2396 CE1 HIS B 48 -9.142 15.835 10.884 1.00 0.79 C ATOM 2397 NE2 HIS B 48 -7.990 16.471 10.768 1.00 0.81 N ATOM 0 H HIS B 48 -9.012 11.833 8.075 1.00 0.42 H new ATOM 0 HA HIS B 48 -7.660 14.256 7.311 1.00 0.44 H new ATOM 0 HB2 HIS B 48 -7.734 12.378 9.629 1.00 0.49 H new ATOM 0 HB3 HIS B 48 -6.173 13.130 9.370 1.00 0.49 H new ATOM 0 HD2 HIS B 48 -6.062 15.890 9.899 1.00 0.70 H new ATOM 0 HE1 HIS B 48 -10.039 16.230 11.338 1.00 0.79 H new ATOM 0 HE2 HIS B 48 -7.801 17.419 11.095 1.00 0.81 H new ATOM 2406 N LEU B 49 -6.329 11.499 6.313 1.00 0.41 N ATOM 2407 CA LEU B 49 -5.196 10.910 5.577 1.00 0.42 C ATOM 2408 C LEU B 49 -5.060 11.548 4.180 1.00 0.40 C ATOM 2409 O LEU B 49 -4.013 12.122 3.864 1.00 0.48 O ATOM 2410 CB LEU B 49 -5.356 9.371 5.493 1.00 0.43 C ATOM 2411 CG LEU B 49 -4.092 8.552 5.124 1.00 0.52 C ATOM 2412 CD1 LEU B 49 -2.871 8.989 5.929 1.00 0.88 C ATOM 2413 CD2 LEU B 49 -4.345 7.060 5.333 1.00 0.62 C ATOM 0 H LEU B 49 -7.166 10.916 6.329 1.00 0.41 H new ATOM 0 HA LEU B 49 -4.274 11.121 6.119 1.00 0.42 H new ATOM 0 HB2 LEU B 49 -5.721 9.015 6.456 1.00 0.43 H new ATOM 0 HB3 LEU B 49 -6.130 9.150 4.758 1.00 0.43 H new ATOM 0 HG LEU B 49 -3.881 8.741 4.071 1.00 0.52 H new ATOM 0 HD11 LEU B 49 -2.009 8.389 5.638 1.00 0.88 H new ATOM 0 HD12 LEU B 49 -2.663 10.041 5.733 1.00 0.88 H new ATOM 0 HD13 LEU B 49 -3.067 8.850 6.992 1.00 0.88 H new ATOM 0 HD21 LEU B 49 -3.449 6.499 5.070 1.00 0.62 H new ATOM 0 HD22 LEU B 49 -4.594 6.876 6.378 1.00 0.62 H new ATOM 0 HD23 LEU B 49 -5.173 6.739 4.701 1.00 0.62 H new ATOM 2425 N LEU B 50 -6.122 11.441 3.355 1.00 0.38 N ATOM 2426 CA LEU B 50 -6.145 12.045 2.012 1.00 0.41 C ATOM 2427 C LEU B 50 -6.858 13.405 2.098 1.00 0.45 C ATOM 2428 O LEU B 50 -8.065 13.452 2.361 1.00 0.52 O ATOM 2429 CB LEU B 50 -6.863 11.127 0.990 1.00 0.44 C ATOM 2430 CG LEU B 50 -6.323 9.678 0.852 1.00 0.51 C ATOM 2431 CD1 LEU B 50 -7.139 8.897 -0.182 1.00 0.57 C ATOM 2432 CD2 LEU B 50 -4.831 9.657 0.491 1.00 0.70 C ATOM 0 H LEU B 50 -6.976 10.940 3.599 1.00 0.38 H new ATOM 0 HA LEU B 50 -5.120 12.178 1.665 1.00 0.41 H new ATOM 0 HB2 LEU B 50 -7.917 11.072 1.264 1.00 0.44 H new ATOM 0 HB3 LEU B 50 -6.812 11.603 0.011 1.00 0.44 H new ATOM 0 HG LEU B 50 -6.431 9.194 1.823 1.00 0.51 H new ATOM 0 HD11 LEU B 50 -6.746 7.884 -0.265 1.00 0.57 H new ATOM 0 HD12 LEU B 50 -8.182 8.857 0.132 1.00 0.57 H new ATOM 0 HD13 LEU B 50 -7.070 9.393 -1.150 1.00 0.57 H new ATOM 0 HD21 LEU B 50 -4.492 8.625 0.404 1.00 0.70 H new ATOM 0 HD22 LEU B 50 -4.679 10.170 -0.459 1.00 0.70 H new ATOM 0 HD23 LEU B 50 -4.261 10.161 1.271 1.00 0.70 H new ATOM 2444 N LYS B 51 -6.102 14.511 1.894 1.00 0.50 N ATOM 2445 CA LYS B 51 -6.658 15.886 1.973 1.00 0.58 C ATOM 2446 C LYS B 51 -7.875 16.099 1.045 1.00 0.53 C ATOM 2447 O LYS B 51 -8.807 16.823 1.409 1.00 0.61 O ATOM 2448 CB LYS B 51 -5.572 16.955 1.687 1.00 0.68 C ATOM 2449 CG LYS B 51 -4.996 16.948 0.262 1.00 0.72 C ATOM 2450 CD LYS B 51 -4.077 18.148 0.013 1.00 1.06 C ATOM 2451 CE LYS B 51 -3.646 18.251 -1.451 1.00 1.03 C ATOM 2452 NZ LYS B 51 -2.714 19.392 -1.683 1.00 1.23 N ATOM 0 H LYS B 51 -5.107 14.479 1.674 1.00 0.50 H new ATOM 0 HA LYS B 51 -7.009 16.006 2.998 1.00 0.58 H new ATOM 0 HB2 LYS B 51 -5.996 17.940 1.884 1.00 0.68 H new ATOM 0 HB3 LYS B 51 -4.753 16.813 2.392 1.00 0.68 H new ATOM 0 HG2 LYS B 51 -4.440 16.025 0.099 1.00 0.72 H new ATOM 0 HG3 LYS B 51 -5.813 16.960 -0.460 1.00 0.72 H new ATOM 0 HD2 LYS B 51 -4.591 19.064 0.304 1.00 1.06 H new ATOM 0 HD3 LYS B 51 -3.193 18.064 0.645 1.00 1.06 H new ATOM 0 HE2 LYS B 51 -3.163 17.322 -1.752 1.00 1.03 H new ATOM 0 HE3 LYS B 51 -4.528 18.370 -2.080 1.00 1.03 H new ATOM 0 HZ1 LYS B 51 -2.448 19.424 -2.688 1.00 1.23 H new ATOM 0 HZ2 LYS B 51 -3.183 20.282 -1.421 1.00 1.23 H new ATOM 0 HZ3 LYS B 51 -1.860 19.266 -1.103 1.00 1.23 H new ATOM 2466 N ASP B 52 -7.855 15.464 -0.147 1.00 0.48 N ATOM 2467 CA ASP B 52 -8.949 15.578 -1.124 1.00 0.54 C ATOM 2468 C ASP B 52 -9.983 14.455 -0.898 1.00 0.48 C ATOM 2469 O ASP B 52 -9.892 13.384 -1.505 1.00 0.60 O ATOM 2470 CB ASP B 52 -8.370 15.532 -2.562 1.00 0.69 C ATOM 2471 CG ASP B 52 -9.338 16.005 -3.648 1.00 1.20 C ATOM 2472 OD1 ASP B 52 -10.518 16.283 -3.337 1.00 1.94 O ATOM 2473 OD2 ASP B 52 -8.906 16.097 -4.816 1.00 1.78 O ATOM 0 H ASP B 52 -7.088 14.866 -0.453 1.00 0.48 H new ATOM 0 HA ASP B 52 -9.460 16.532 -0.991 1.00 0.54 H new ATOM 0 HB2 ASP B 52 -7.472 16.149 -2.599 1.00 0.69 H new ATOM 0 HB3 ASP B 52 -8.064 14.510 -2.785 1.00 0.69 H new ATOM 2478 N VAL B 53 -10.954 14.708 0.004 1.00 0.44 N ATOM 2479 CA VAL B 53 -12.015 13.722 0.328 1.00 0.45 C ATOM 2480 C VAL B 53 -13.207 13.786 -0.655 1.00 0.46 C ATOM 2481 O VAL B 53 -13.945 12.801 -0.787 1.00 0.57 O ATOM 2482 CB VAL B 53 -12.534 13.866 1.803 1.00 0.53 C ATOM 2483 CG1 VAL B 53 -11.408 13.592 2.803 1.00 0.60 C ATOM 2484 CG2 VAL B 53 -13.177 15.237 2.069 1.00 0.58 C ATOM 0 H VAL B 53 -11.028 15.584 0.522 1.00 0.44 H new ATOM 0 HA VAL B 53 -11.542 12.746 0.223 1.00 0.45 H new ATOM 0 HB VAL B 53 -13.315 13.118 1.939 1.00 0.53 H new ATOM 0 HG11 VAL B 53 -11.790 13.697 3.819 1.00 0.60 H new ATOM 0 HG12 VAL B 53 -11.033 12.579 2.660 1.00 0.60 H new ATOM 0 HG13 VAL B 53 -10.599 14.305 2.644 1.00 0.60 H new ATOM 0 HG21 VAL B 53 -13.519 15.284 3.103 1.00 0.58 H new ATOM 0 HG22 VAL B 53 -12.443 16.023 1.893 1.00 0.58 H new ATOM 0 HG23 VAL B 53 -14.026 15.377 1.400 1.00 0.58 H new ATOM 2494 N GLY B 54 -13.397 14.937 -1.337 1.00 0.44 N ATOM 2495 CA GLY B 54 -14.498 15.092 -2.291 1.00 0.51 C ATOM 2496 C GLY B 54 -14.161 14.569 -3.682 1.00 0.51 C ATOM 2497 O GLY B 54 -14.751 13.580 -4.125 1.00 0.67 O ATOM 0 H GLY B 54 -12.804 15.761 -1.240 1.00 0.44 H new ATOM 0 HA2 GLY B 54 -15.375 14.565 -1.914 1.00 0.51 H new ATOM 0 HA3 GLY B 54 -14.765 16.147 -2.361 1.00 0.51 H new ATOM 2501 N SER B 55 -13.206 15.229 -4.375 1.00 0.51 N ATOM 2502 CA SER B 55 -12.798 14.828 -5.738 1.00 0.57 C ATOM 2503 C SER B 55 -11.854 13.606 -5.702 1.00 0.52 C ATOM 2504 O SER B 55 -10.628 13.754 -5.649 1.00 0.63 O ATOM 2505 CB SER B 55 -12.142 16.013 -6.474 1.00 0.74 C ATOM 2506 OG SER B 55 -11.825 15.678 -7.818 1.00 0.92 O ATOM 0 H SER B 55 -12.705 16.040 -4.013 1.00 0.51 H new ATOM 0 HA SER B 55 -13.692 14.535 -6.288 1.00 0.57 H new ATOM 0 HB2 SER B 55 -12.816 16.870 -6.460 1.00 0.74 H new ATOM 0 HB3 SER B 55 -11.235 16.312 -5.949 1.00 0.74 H new ATOM 0 HG SER B 55 -12.519 15.089 -8.181 1.00 0.92 H new ATOM 2512 N LEU B 56 -12.452 12.397 -5.717 1.00 0.47 N ATOM 2513 CA LEU B 56 -11.702 11.121 -5.701 1.00 0.47 C ATOM 2514 C LEU B 56 -11.554 10.520 -7.121 1.00 0.48 C ATOM 2515 O LEU B 56 -10.922 9.471 -7.274 1.00 0.81 O ATOM 2516 CB LEU B 56 -12.403 10.099 -4.753 1.00 0.58 C ATOM 2517 CG LEU B 56 -11.702 9.782 -3.404 1.00 0.75 C ATOM 2518 CD1 LEU B 56 -10.406 8.993 -3.611 1.00 1.09 C ATOM 2519 CD2 LEU B 56 -11.439 11.053 -2.590 1.00 1.24 C ATOM 0 H LEU B 56 -13.465 12.276 -5.740 1.00 0.47 H new ATOM 0 HA LEU B 56 -10.700 11.332 -5.328 1.00 0.47 H new ATOM 0 HB2 LEU B 56 -13.403 10.473 -4.534 1.00 0.58 H new ATOM 0 HB3 LEU B 56 -12.525 9.163 -5.298 1.00 0.58 H new ATOM 0 HG LEU B 56 -12.387 9.155 -2.833 1.00 0.75 H new ATOM 0 HD11 LEU B 56 -9.945 8.791 -2.644 1.00 1.09 H new ATOM 0 HD12 LEU B 56 -10.630 8.051 -4.111 1.00 1.09 H new ATOM 0 HD13 LEU B 56 -9.720 9.576 -4.225 1.00 1.09 H new ATOM 0 HD21 LEU B 56 -10.948 10.790 -1.653 1.00 1.24 H new ATOM 0 HD22 LEU B 56 -10.797 11.724 -3.161 1.00 1.24 H new ATOM 0 HD23 LEU B 56 -12.385 11.550 -2.376 1.00 1.24 H new ATOM 2531 N ASP B 57 -12.122 11.186 -8.159 1.00 0.48 N ATOM 2532 CA ASP B 57 -12.041 10.700 -9.559 1.00 0.49 C ATOM 2533 C ASP B 57 -10.607 10.775 -10.133 1.00 0.44 C ATOM 2534 O ASP B 57 -10.268 10.010 -11.043 1.00 0.46 O ATOM 2535 CB ASP B 57 -13.025 11.460 -10.475 1.00 0.60 C ATOM 2536 CG ASP B 57 -12.797 12.970 -10.514 1.00 0.64 C ATOM 2537 OD1 ASP B 57 -11.901 13.417 -11.259 1.00 0.69 O ATOM 2538 OD2 ASP B 57 -13.516 13.695 -9.795 1.00 0.73 O ATOM 0 H ASP B 57 -12.639 12.059 -8.052 1.00 0.48 H new ATOM 0 HA ASP B 57 -12.326 9.648 -9.534 1.00 0.49 H new ATOM 0 HB2 ASP B 57 -12.943 11.064 -11.487 1.00 0.60 H new ATOM 0 HB3 ASP B 57 -14.043 11.265 -10.138 1.00 0.60 H new ATOM 2543 N GLU B 58 -9.776 11.706 -9.607 1.00 0.45 N ATOM 2544 CA GLU B 58 -8.371 11.867 -10.049 1.00 0.50 C ATOM 2545 C GLU B 58 -7.560 10.579 -9.767 1.00 0.47 C ATOM 2546 O GLU B 58 -6.646 10.237 -10.528 1.00 0.57 O ATOM 2547 CB GLU B 58 -7.725 13.088 -9.349 1.00 0.59 C ATOM 2548 CG GLU B 58 -6.458 13.618 -10.027 1.00 0.73 C ATOM 2549 CD GLU B 58 -5.830 14.785 -9.277 1.00 0.92 C ATOM 2550 OE1 GLU B 58 -6.531 15.798 -9.054 1.00 1.10 O ATOM 2551 OE2 GLU B 58 -4.637 14.687 -8.916 1.00 1.06 O ATOM 0 H GLU B 58 -10.056 12.358 -8.874 1.00 0.45 H new ATOM 0 HA GLU B 58 -8.363 12.043 -11.125 1.00 0.50 H new ATOM 0 HB2 GLU B 58 -8.459 13.893 -9.301 1.00 0.59 H new ATOM 0 HB3 GLU B 58 -7.484 12.815 -8.322 1.00 0.59 H new ATOM 0 HG2 GLU B 58 -5.730 12.811 -10.108 1.00 0.73 H new ATOM 0 HG3 GLU B 58 -6.699 13.933 -11.042 1.00 0.73 H new ATOM 2558 N LYS B 59 -7.906 9.879 -8.663 1.00 0.43 N ATOM 2559 CA LYS B 59 -7.254 8.617 -8.269 1.00 0.48 C ATOM 2560 C LYS B 59 -8.081 7.399 -8.744 1.00 0.54 C ATOM 2561 O LYS B 59 -7.506 6.354 -9.038 1.00 0.91 O ATOM 2562 CB LYS B 59 -7.050 8.548 -6.736 1.00 0.52 C ATOM 2563 CG LYS B 59 -6.055 9.575 -6.166 1.00 0.59 C ATOM 2564 CD LYS B 59 -6.700 10.940 -5.903 1.00 0.79 C ATOM 2565 CE LYS B 59 -5.731 11.917 -5.236 1.00 1.19 C ATOM 2566 NZ LYS B 59 -6.330 13.278 -5.067 1.00 1.47 N ATOM 0 H LYS B 59 -8.644 10.175 -8.024 1.00 0.43 H new ATOM 0 HA LYS B 59 -6.276 8.589 -8.750 1.00 0.48 H new ATOM 0 HB2 LYS B 59 -8.015 8.690 -6.249 1.00 0.52 H new ATOM 0 HB3 LYS B 59 -6.706 7.547 -6.475 1.00 0.52 H new ATOM 0 HG2 LYS B 59 -5.635 9.191 -5.236 1.00 0.59 H new ATOM 0 HG3 LYS B 59 -5.226 9.698 -6.863 1.00 0.59 H new ATOM 0 HD2 LYS B 59 -7.049 11.363 -6.845 1.00 0.79 H new ATOM 0 HD3 LYS B 59 -7.576 10.810 -5.268 1.00 0.79 H new ATOM 0 HE2 LYS B 59 -5.438 11.527 -4.261 1.00 1.19 H new ATOM 0 HE3 LYS B 59 -4.824 11.993 -5.835 1.00 1.19 H new ATOM 0 HZ1 LYS B 59 -5.639 13.907 -4.611 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -6.587 13.662 -5.999 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -7.181 13.211 -4.474 1.00 1.47 H new ATOM 2580 N MET B 60 -9.428 7.548 -8.824 1.00 0.40 N ATOM 2581 CA MET B 60 -10.341 6.459 -9.263 1.00 0.43 C ATOM 2582 C MET B 60 -9.923 5.845 -10.618 1.00 0.45 C ATOM 2583 O MET B 60 -9.894 4.618 -10.747 1.00 0.49 O ATOM 2584 CB MET B 60 -11.800 6.965 -9.340 1.00 0.47 C ATOM 2585 CG MET B 60 -12.853 5.856 -9.450 1.00 0.55 C ATOM 2586 SD MET B 60 -14.553 6.482 -9.441 1.00 0.67 S ATOM 2587 CE MET B 60 -14.720 7.121 -11.108 1.00 0.81 C ATOM 0 H MET B 60 -9.909 8.416 -8.589 1.00 0.40 H new ATOM 0 HA MET B 60 -10.271 5.672 -8.512 1.00 0.43 H new ATOM 0 HB2 MET B 60 -12.011 7.562 -8.453 1.00 0.47 H new ATOM 0 HB3 MET B 60 -11.897 7.627 -10.201 1.00 0.47 H new ATOM 0 HG2 MET B 60 -12.685 5.294 -10.369 1.00 0.55 H new ATOM 0 HG3 MET B 60 -12.725 5.159 -8.622 1.00 0.55 H new ATOM 0 HE1 MET B 60 -15.719 7.536 -11.240 1.00 0.81 H new ATOM 0 HE2 MET B 60 -13.978 7.901 -11.275 1.00 0.81 H new ATOM 0 HE3 MET B 60 -14.565 6.314 -11.824 1.00 0.81 H new ATOM 2597 N LYS B 61 -9.602 6.697 -11.622 1.00 0.47 N ATOM 2598 CA LYS B 61 -9.176 6.207 -12.958 1.00 0.53 C ATOM 2599 C LYS B 61 -7.822 5.478 -12.877 1.00 0.48 C ATOM 2600 O LYS B 61 -7.601 4.495 -13.590 1.00 0.52 O ATOM 2601 CB LYS B 61 -9.087 7.351 -13.987 1.00 0.63 C ATOM 2602 CG LYS B 61 -10.418 8.058 -14.257 1.00 0.78 C ATOM 2603 CD LYS B 61 -10.320 9.083 -15.395 1.00 1.13 C ATOM 2604 CE LYS B 61 -9.575 10.360 -14.988 1.00 1.87 C ATOM 2605 NZ LYS B 61 -10.348 11.195 -14.017 1.00 2.39 N ATOM 0 H LYS B 61 -9.629 7.713 -11.536 1.00 0.47 H new ATOM 0 HA LYS B 61 -9.939 5.504 -13.292 1.00 0.53 H new ATOM 0 HB2 LYS B 61 -8.363 8.086 -13.635 1.00 0.63 H new ATOM 0 HB3 LYS B 61 -8.704 6.951 -14.926 1.00 0.63 H new ATOM 0 HG2 LYS B 61 -11.176 7.315 -14.506 1.00 0.78 H new ATOM 0 HG3 LYS B 61 -10.750 8.560 -13.348 1.00 0.78 H new ATOM 0 HD2 LYS B 61 -9.811 8.627 -16.244 1.00 1.13 H new ATOM 0 HD3 LYS B 61 -11.324 9.345 -15.728 1.00 1.13 H new ATOM 0 HE2 LYS B 61 -8.616 10.091 -14.546 1.00 1.87 H new ATOM 0 HE3 LYS B 61 -9.361 10.950 -15.879 1.00 1.87 H new ATOM 0 HZ1 LYS B 61 -9.953 12.157 -13.995 1.00 2.39 H new ATOM 0 HZ2 LYS B 61 -11.345 11.237 -14.312 1.00 2.39 H new ATOM 0 HZ3 LYS B 61 -10.285 10.773 -13.069 1.00 2.39 H new ATOM 2619 N SER B 62 -6.918 5.975 -12.004 1.00 0.46 N ATOM 2620 CA SER B 62 -5.594 5.360 -11.790 1.00 0.47 C ATOM 2621 C SER B 62 -5.734 4.000 -11.075 1.00 0.44 C ATOM 2622 O SER B 62 -4.976 3.067 -11.360 1.00 0.50 O ATOM 2623 CB SER B 62 -4.694 6.298 -10.964 1.00 0.54 C ATOM 2624 OG SER B 62 -4.552 7.561 -11.594 1.00 0.63 O ATOM 0 H SER B 62 -7.085 6.805 -11.435 1.00 0.46 H new ATOM 0 HA SER B 62 -5.134 5.195 -12.764 1.00 0.47 H new ATOM 0 HB2 SER B 62 -5.119 6.431 -9.969 1.00 0.54 H new ATOM 0 HB3 SER B 62 -3.713 5.842 -10.833 1.00 0.54 H new ATOM 0 HG SER B 62 -3.977 8.137 -11.047 1.00 0.63 H new ATOM 2630 N LEU B 63 -6.729 3.897 -10.160 1.00 0.41 N ATOM 2631 CA LEU B 63 -6.990 2.666 -9.396 1.00 0.44 C ATOM 2632 C LEU B 63 -7.598 1.570 -10.299 1.00 0.47 C ATOM 2633 O LEU B 63 -6.967 0.530 -10.517 1.00 0.57 O ATOM 2634 CB LEU B 63 -7.931 2.959 -8.200 1.00 0.45 C ATOM 2635 CG LEU B 63 -7.371 3.905 -7.113 1.00 0.42 C ATOM 2636 CD1 LEU B 63 -8.498 4.562 -6.307 1.00 0.47 C ATOM 2637 CD2 LEU B 63 -6.428 3.157 -6.179 1.00 0.69 C ATOM 0 H LEU B 63 -7.365 4.662 -9.937 1.00 0.41 H new ATOM 0 HA LEU B 63 -6.037 2.301 -9.012 1.00 0.44 H new ATOM 0 HB2 LEU B 63 -8.855 3.389 -8.587 1.00 0.45 H new ATOM 0 HB3 LEU B 63 -8.193 2.012 -7.729 1.00 0.45 H new ATOM 0 HG LEU B 63 -6.813 4.692 -7.621 1.00 0.42 H new ATOM 0 HD11 LEU B 63 -8.069 5.220 -5.552 1.00 0.47 H new ATOM 0 HD12 LEU B 63 -9.133 5.143 -6.976 1.00 0.47 H new ATOM 0 HD13 LEU B 63 -9.094 3.791 -5.819 1.00 0.47 H new ATOM 0 HD21 LEU B 63 -6.046 3.842 -5.422 1.00 0.69 H new ATOM 0 HD22 LEU B 63 -6.967 2.344 -5.693 1.00 0.69 H new ATOM 0 HD23 LEU B 63 -5.596 2.749 -6.753 1.00 0.69 H new ATOM 2649 N ASP B 64 -8.812 1.822 -10.838 1.00 0.47 N ATOM 2650 CA ASP B 64 -9.511 0.861 -11.713 1.00 0.55 C ATOM 2651 C ASP B 64 -8.959 0.945 -13.155 1.00 0.53 C ATOM 2652 O ASP B 64 -9.539 1.612 -14.021 1.00 0.60 O ATOM 2653 CB ASP B 64 -11.039 1.120 -11.674 1.00 0.66 C ATOM 2654 CG ASP B 64 -11.866 -0.048 -12.200 1.00 0.85 C ATOM 2655 OD1 ASP B 64 -11.814 -1.137 -11.590 1.00 1.27 O ATOM 2656 OD2 ASP B 64 -12.569 0.136 -13.216 1.00 1.32 O ATOM 0 H ASP B 64 -9.328 2.688 -10.680 1.00 0.47 H new ATOM 0 HA ASP B 64 -9.331 -0.150 -11.349 1.00 0.55 H new ATOM 0 HB2 ASP B 64 -11.338 1.333 -10.648 1.00 0.66 H new ATOM 0 HB3 ASP B 64 -11.264 2.009 -12.263 1.00 0.66 H new ATOM 2661 N VAL B 65 -7.824 0.256 -13.391 1.00 0.53 N ATOM 2662 CA VAL B 65 -7.146 0.245 -14.707 1.00 0.56 C ATOM 2663 C VAL B 65 -7.680 -0.877 -15.640 1.00 0.56 C ATOM 2664 O VAL B 65 -7.694 -0.704 -16.864 1.00 0.61 O ATOM 2665 CB VAL B 65 -5.587 0.142 -14.528 1.00 0.64 C ATOM 2666 CG1 VAL B 65 -5.140 -1.218 -13.964 1.00 0.68 C ATOM 2667 CG2 VAL B 65 -4.847 0.468 -15.829 1.00 0.72 C ATOM 0 H VAL B 65 -7.353 -0.305 -12.681 1.00 0.53 H new ATOM 0 HA VAL B 65 -7.376 1.192 -15.195 1.00 0.56 H new ATOM 0 HB VAL B 65 -5.317 0.894 -13.787 1.00 0.64 H new ATOM 0 HG11 VAL B 65 -4.055 -1.231 -13.862 1.00 0.68 H new ATOM 0 HG12 VAL B 65 -5.598 -1.375 -12.987 1.00 0.68 H new ATOM 0 HG13 VAL B 65 -5.450 -2.013 -14.642 1.00 0.68 H new ATOM 0 HG21 VAL B 65 -3.772 0.386 -15.667 1.00 0.72 H new ATOM 0 HG22 VAL B 65 -5.151 -0.234 -16.606 1.00 0.72 H new ATOM 0 HG23 VAL B 65 -5.091 1.483 -16.142 1.00 0.72 H new ATOM 2677 N ASN B 66 -8.119 -2.014 -15.055 1.00 0.56 N ATOM 2678 CA ASN B 66 -8.652 -3.161 -15.827 1.00 0.60 C ATOM 2679 C ASN B 66 -10.107 -2.929 -16.323 1.00 0.61 C ATOM 2680 O ASN B 66 -10.582 -3.672 -17.189 1.00 0.68 O ATOM 2681 CB ASN B 66 -8.580 -4.443 -14.960 1.00 0.65 C ATOM 2682 CG ASN B 66 -8.652 -5.752 -15.756 1.00 0.90 C ATOM 2683 OD1 ASN B 66 -8.229 -5.820 -16.914 1.00 1.38 O ATOM 2684 ND2 ASN B 66 -9.176 -6.809 -15.128 1.00 1.32 N ATOM 0 H ASN B 66 -8.115 -2.163 -14.046 1.00 0.56 H new ATOM 0 HA ASN B 66 -8.033 -3.273 -16.717 1.00 0.60 H new ATOM 0 HB2 ASN B 66 -7.651 -4.429 -14.390 1.00 0.65 H new ATOM 0 HB3 ASN B 66 -9.397 -4.425 -14.239 1.00 0.65 H new ATOM 0 HD21 ASN B 66 -9.236 -7.708 -15.606 1.00 1.32 H new ATOM 0 HD22 ASN B 66 -9.516 -6.717 -14.171 1.00 1.32 H new ATOM 2691 N GLN B 67 -10.811 -1.903 -15.771 1.00 0.59 N ATOM 2692 CA GLN B 67 -12.212 -1.573 -16.140 1.00 0.64 C ATOM 2693 C GLN B 67 -13.181 -2.738 -15.825 1.00 0.64 C ATOM 2694 O GLN B 67 -13.852 -3.269 -16.719 1.00 0.77 O ATOM 2695 CB GLN B 67 -12.330 -1.124 -17.623 1.00 0.75 C ATOM 2696 CG GLN B 67 -11.580 0.172 -17.948 1.00 0.96 C ATOM 2697 CD GLN B 67 -11.846 0.694 -19.361 1.00 1.28 C ATOM 2698 OE1 GLN B 67 -12.939 0.515 -19.906 1.00 2.02 O ATOM 2699 NE2 GLN B 67 -10.848 1.346 -19.968 1.00 1.87 N ATOM 0 H GLN B 67 -10.422 -1.284 -15.060 1.00 0.59 H new ATOM 0 HA GLN B 67 -12.509 -0.727 -15.520 1.00 0.64 H new ATOM 0 HB2 GLN B 67 -11.951 -1.920 -18.263 1.00 0.75 H new ATOM 0 HB3 GLN B 67 -13.384 -0.992 -17.868 1.00 0.75 H new ATOM 0 HG2 GLN B 67 -11.865 0.938 -17.227 1.00 0.96 H new ATOM 0 HG3 GLN B 67 -10.510 0.003 -17.827 1.00 0.96 H new ATOM 0 HE21 GLN B 67 -9.957 1.476 -19.488 1.00 1.87 H new ATOM 0 HE22 GLN B 67 -10.978 1.713 -20.911 1.00 1.87 H new ATOM 2708 N ASP B 68 -13.243 -3.121 -14.532 1.00 0.65 N ATOM 2709 CA ASP B 68 -14.114 -4.214 -14.058 1.00 0.72 C ATOM 2710 C ASP B 68 -15.112 -3.730 -12.968 1.00 0.79 C ATOM 2711 O ASP B 68 -15.808 -4.557 -12.375 1.00 1.30 O ATOM 2712 CB ASP B 68 -13.227 -5.363 -13.519 1.00 0.76 C ATOM 2713 CG ASP B 68 -13.985 -6.669 -13.300 1.00 0.97 C ATOM 2714 OD1 ASP B 68 -14.300 -7.349 -14.300 1.00 1.16 O ATOM 2715 OD2 ASP B 68 -14.262 -7.007 -12.128 1.00 1.25 O ATOM 0 H ASP B 68 -12.694 -2.683 -13.792 1.00 0.65 H new ATOM 0 HA ASP B 68 -14.714 -4.570 -14.895 1.00 0.72 H new ATOM 0 HB2 ASP B 68 -12.411 -5.540 -14.219 1.00 0.76 H new ATOM 0 HB3 ASP B 68 -12.777 -5.052 -12.576 1.00 0.76 H new ATOM 2720 N SER B 69 -15.198 -2.389 -12.726 1.00 0.66 N ATOM 2721 CA SER B 69 -16.089 -1.786 -11.695 1.00 0.71 C ATOM 2722 C SER B 69 -15.595 -2.092 -10.264 1.00 0.71 C ATOM 2723 O SER B 69 -15.227 -1.170 -9.529 1.00 1.26 O ATOM 2724 CB SER B 69 -17.567 -2.211 -11.867 1.00 0.86 C ATOM 2725 OG SER B 69 -18.413 -1.522 -10.953 1.00 1.35 O ATOM 0 H SER B 69 -14.651 -1.699 -13.241 1.00 0.66 H new ATOM 0 HA SER B 69 -16.043 -0.708 -11.847 1.00 0.71 H new ATOM 0 HB2 SER B 69 -17.890 -2.008 -12.888 1.00 0.86 H new ATOM 0 HB3 SER B 69 -17.659 -3.286 -11.711 1.00 0.86 H new ATOM 0 HG SER B 69 -19.341 -1.809 -11.086 1.00 1.35 H new ATOM 2731 N GLU B 70 -15.584 -3.389 -9.878 1.00 0.69 N ATOM 2732 CA GLU B 70 -15.121 -3.817 -8.544 1.00 0.75 C ATOM 2733 C GLU B 70 -13.597 -3.649 -8.432 1.00 0.62 C ATOM 2734 O GLU B 70 -12.843 -4.255 -9.199 1.00 0.78 O ATOM 2735 CB GLU B 70 -15.513 -5.283 -8.268 1.00 1.11 C ATOM 2736 CG GLU B 70 -17.019 -5.547 -8.334 1.00 1.39 C ATOM 2737 CD GLU B 70 -17.393 -7.006 -8.106 1.00 1.87 C ATOM 2738 OE1 GLU B 70 -16.534 -7.892 -8.308 1.00 2.37 O ATOM 2739 OE2 GLU B 70 -18.557 -7.259 -7.732 1.00 2.40 O ATOM 0 H GLU B 70 -15.892 -4.156 -10.475 1.00 0.69 H new ATOM 0 HA GLU B 70 -15.605 -3.187 -7.798 1.00 0.75 H new ATOM 0 HB2 GLU B 70 -15.010 -5.925 -8.991 1.00 1.11 H new ATOM 0 HB3 GLU B 70 -15.148 -5.567 -7.281 1.00 1.11 H new ATOM 0 HG2 GLU B 70 -17.520 -4.931 -7.587 1.00 1.39 H new ATOM 0 HG3 GLU B 70 -17.392 -5.233 -9.309 1.00 1.39 H new ATOM 2746 N LEU B 71 -13.159 -2.826 -7.463 1.00 0.54 N ATOM 2747 CA LEU B 71 -11.733 -2.520 -7.257 1.00 0.51 C ATOM 2748 C LEU B 71 -11.012 -3.642 -6.487 1.00 0.50 C ATOM 2749 O LEU B 71 -11.229 -3.806 -5.285 1.00 0.52 O ATOM 2750 CB LEU B 71 -11.601 -1.179 -6.486 1.00 0.58 C ATOM 2751 CG LEU B 71 -10.416 -0.278 -6.879 1.00 0.78 C ATOM 2752 CD1 LEU B 71 -10.712 0.453 -8.189 1.00 1.13 C ATOM 2753 CD2 LEU B 71 -10.100 0.717 -5.755 1.00 0.92 C ATOM 0 H LEU B 71 -13.780 -2.357 -6.804 1.00 0.54 H new ATOM 0 HA LEU B 71 -11.259 -2.437 -8.235 1.00 0.51 H new ATOM 0 HB2 LEU B 71 -12.522 -0.613 -6.625 1.00 0.58 H new ATOM 0 HB3 LEU B 71 -11.522 -1.403 -5.422 1.00 0.58 H new ATOM 0 HG LEU B 71 -9.538 -0.906 -7.031 1.00 0.78 H new ATOM 0 HD11 LEU B 71 -9.864 1.086 -8.452 1.00 1.13 H new ATOM 0 HD12 LEU B 71 -10.881 -0.275 -8.982 1.00 1.13 H new ATOM 0 HD13 LEU B 71 -11.602 1.071 -8.068 1.00 1.13 H new ATOM 0 HD21 LEU B 71 -9.260 1.345 -6.051 1.00 0.92 H new ATOM 0 HD22 LEU B 71 -10.972 1.343 -5.567 1.00 0.92 H new ATOM 0 HD23 LEU B 71 -9.843 0.171 -4.847 1.00 0.92 H new ATOM 2765 N LYS B 72 -10.152 -4.412 -7.183 1.00 0.52 N ATOM 2766 CA LYS B 72 -9.379 -5.501 -6.547 1.00 0.54 C ATOM 2767 C LYS B 72 -8.188 -4.886 -5.786 1.00 0.48 C ATOM 2768 O LYS B 72 -7.900 -3.701 -5.973 1.00 0.46 O ATOM 2769 CB LYS B 72 -8.907 -6.523 -7.615 1.00 0.60 C ATOM 2770 CG LYS B 72 -8.730 -7.955 -7.093 1.00 0.78 C ATOM 2771 CD LYS B 72 -8.337 -8.931 -8.206 1.00 0.91 C ATOM 2772 CE LYS B 72 -8.275 -10.379 -7.715 1.00 1.29 C ATOM 2773 NZ LYS B 72 -7.218 -10.596 -6.674 1.00 1.81 N ATOM 0 H LYS B 72 -9.975 -4.302 -8.181 1.00 0.52 H new ATOM 0 HA LYS B 72 -10.007 -6.041 -5.839 1.00 0.54 H new ATOM 0 HB2 LYS B 72 -9.628 -6.534 -8.432 1.00 0.60 H new ATOM 0 HB3 LYS B 72 -7.959 -6.182 -8.031 1.00 0.60 H new ATOM 0 HG2 LYS B 72 -7.965 -7.965 -6.316 1.00 0.78 H new ATOM 0 HG3 LYS B 72 -9.659 -8.289 -6.630 1.00 0.78 H new ATOM 0 HD2 LYS B 72 -9.056 -8.857 -9.022 1.00 0.91 H new ATOM 0 HD3 LYS B 72 -7.366 -8.645 -8.610 1.00 0.91 H new ATOM 0 HE2 LYS B 72 -9.245 -10.660 -7.305 1.00 1.29 H new ATOM 0 HE3 LYS B 72 -8.084 -11.037 -8.563 1.00 1.29 H new ATOM 0 HZ1 LYS B 72 -7.198 -11.600 -6.403 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 -6.291 -10.323 -7.058 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 -7.430 -10.016 -5.837 1.00 1.81 H new ATOM 2787 N PHE B 73 -7.491 -5.665 -4.928 1.00 0.51 N ATOM 2788 CA PHE B 73 -6.342 -5.124 -4.158 1.00 0.49 C ATOM 2789 C PHE B 73 -5.206 -4.638 -5.088 1.00 0.46 C ATOM 2790 O PHE B 73 -4.469 -3.719 -4.727 1.00 0.46 O ATOM 2791 CB PHE B 73 -5.818 -6.136 -3.111 1.00 0.55 C ATOM 2792 CG PHE B 73 -5.501 -5.498 -1.766 1.00 0.69 C ATOM 2793 CD1 PHE B 73 -6.479 -5.391 -0.780 1.00 0.90 C ATOM 2794 CD2 PHE B 73 -4.234 -4.998 -1.493 1.00 0.89 C ATOM 2795 CE1 PHE B 73 -6.194 -4.806 0.442 1.00 1.15 C ATOM 2796 CE2 PHE B 73 -3.949 -4.411 -0.272 1.00 1.14 C ATOM 2797 CZ PHE B 73 -4.928 -4.317 0.696 1.00 1.23 C ATOM 0 H PHE B 73 -7.695 -6.649 -4.752 1.00 0.51 H new ATOM 0 HA PHE B 73 -6.711 -4.256 -3.612 1.00 0.49 H new ATOM 0 HB2 PHE B 73 -6.563 -6.919 -2.968 1.00 0.55 H new ATOM 0 HB3 PHE B 73 -4.920 -6.617 -3.498 1.00 0.55 H new ATOM 0 HD1 PHE B 73 -7.472 -5.769 -0.971 1.00 0.90 H new ATOM 0 HD2 PHE B 73 -3.461 -5.068 -2.244 1.00 0.89 H new ATOM 0 HE1 PHE B 73 -6.963 -4.732 1.197 1.00 1.15 H new ATOM 0 HE2 PHE B 73 -2.959 -4.026 -0.077 1.00 1.14 H new ATOM 0 HZ PHE B 73 -4.705 -3.862 1.650 1.00 1.23 H new ATOM 2807 N ASN B 74 -5.071 -5.263 -6.284 1.00 0.47 N ATOM 2808 CA ASN B 74 -4.068 -4.844 -7.286 1.00 0.50 C ATOM 2809 C ASN B 74 -4.458 -3.467 -7.870 1.00 0.48 C ATOM 2810 O ASN B 74 -3.588 -2.696 -8.273 1.00 0.54 O ATOM 2811 CB ASN B 74 -3.934 -5.897 -8.409 1.00 0.55 C ATOM 2812 CG ASN B 74 -2.868 -5.543 -9.445 1.00 0.63 C ATOM 2813 OD1 ASN B 74 -3.168 -4.942 -10.478 1.00 0.99 O ATOM 2814 ND2 ASN B 74 -1.616 -5.902 -9.168 1.00 0.93 N ATOM 0 H ASN B 74 -5.643 -6.056 -6.574 1.00 0.47 H new ATOM 0 HA ASN B 74 -3.098 -4.759 -6.796 1.00 0.50 H new ATOM 0 HB2 ASN B 74 -3.693 -6.863 -7.965 1.00 0.55 H new ATOM 0 HB3 ASN B 74 -4.895 -6.008 -8.910 1.00 0.55 H new ATOM 0 HD21 ASN B 74 -0.865 -5.680 -9.822 1.00 0.93 H new ATOM 0 HD22 ASN B 74 -1.408 -6.399 -8.302 1.00 0.93 H new ATOM 2821 N GLU B 75 -5.780 -3.187 -7.940 1.00 0.44 N ATOM 2822 CA GLU B 75 -6.293 -1.893 -8.422 1.00 0.47 C ATOM 2823 C GLU B 75 -6.253 -0.850 -7.280 1.00 0.41 C ATOM 2824 O GLU B 75 -5.971 0.320 -7.527 1.00 0.42 O ATOM 2825 CB GLU B 75 -7.729 -2.036 -8.979 1.00 0.54 C ATOM 2826 CG GLU B 75 -7.806 -2.687 -10.367 1.00 0.64 C ATOM 2827 CD GLU B 75 -7.804 -4.210 -10.330 1.00 0.76 C ATOM 2828 OE1 GLU B 75 -6.717 -4.802 -10.157 1.00 0.93 O ATOM 2829 OE2 GLU B 75 -8.890 -4.810 -10.482 1.00 0.91 O ATOM 0 H GLU B 75 -6.509 -3.846 -7.667 1.00 0.44 H new ATOM 0 HA GLU B 75 -5.654 -1.551 -9.236 1.00 0.47 H new ATOM 0 HB2 GLU B 75 -8.320 -2.627 -8.280 1.00 0.54 H new ATOM 0 HB3 GLU B 75 -8.187 -1.048 -9.028 1.00 0.54 H new ATOM 0 HG2 GLU B 75 -8.711 -2.346 -10.869 1.00 0.64 H new ATOM 0 HG3 GLU B 75 -6.962 -2.346 -10.966 1.00 0.64 H new ATOM 2836 N TYR B 76 -6.527 -1.299 -6.029 1.00 0.41 N ATOM 2837 CA TYR B 76 -6.482 -0.435 -4.820 1.00 0.39 C ATOM 2838 C TYR B 76 -5.019 -0.093 -4.428 1.00 0.36 C ATOM 2839 O TYR B 76 -4.781 0.835 -3.649 1.00 0.43 O ATOM 2840 CB TYR B 76 -7.206 -1.144 -3.644 1.00 0.43 C ATOM 2841 CG TYR B 76 -7.504 -0.272 -2.420 1.00 0.44 C ATOM 2842 CD1 TYR B 76 -8.123 0.972 -2.546 1.00 0.50 C ATOM 2843 CD2 TYR B 76 -7.177 -0.707 -1.135 1.00 0.52 C ATOM 2844 CE1 TYR B 76 -8.401 1.749 -1.438 1.00 0.58 C ATOM 2845 CE2 TYR B 76 -7.456 0.066 -0.023 1.00 0.59 C ATOM 2846 CZ TYR B 76 -8.066 1.292 -0.179 1.00 0.59 C ATOM 2847 OH TYR B 76 -8.341 2.066 0.933 1.00 0.71 O ATOM 0 H TYR B 76 -6.784 -2.266 -5.830 1.00 0.41 H new ATOM 0 HA TYR B 76 -6.992 0.501 -5.045 1.00 0.39 H new ATOM 0 HB2 TYR B 76 -8.147 -1.551 -4.014 1.00 0.43 H new ATOM 0 HB3 TYR B 76 -6.597 -1.990 -3.324 1.00 0.43 H new ATOM 0 HD1 TYR B 76 -8.390 1.334 -3.528 1.00 0.50 H new ATOM 0 HD2 TYR B 76 -6.697 -1.666 -1.007 1.00 0.52 H new ATOM 0 HE1 TYR B 76 -8.879 2.710 -1.556 1.00 0.58 H new ATOM 0 HE2 TYR B 76 -7.197 -0.289 0.963 1.00 0.59 H new ATOM 0 HH TYR B 76 -8.042 1.597 1.740 1.00 0.71 H new ATOM 2857 N TRP B 77 -4.053 -0.869 -4.983 1.00 0.39 N ATOM 2858 CA TRP B 77 -2.595 -0.701 -4.760 1.00 0.40 C ATOM 2859 C TRP B 77 -2.106 0.744 -5.041 1.00 0.35 C ATOM 2860 O TRP B 77 -1.156 1.204 -4.399 1.00 0.37 O ATOM 2861 CB TRP B 77 -1.862 -1.745 -5.651 1.00 0.58 C ATOM 2862 CG TRP B 77 -0.376 -1.584 -5.865 1.00 0.48 C ATOM 2863 CD1 TRP B 77 0.577 -1.203 -4.960 1.00 0.56 C ATOM 2864 CD2 TRP B 77 0.324 -1.851 -7.091 1.00 0.74 C ATOM 2865 NE1 TRP B 77 1.816 -1.194 -5.558 1.00 0.79 N ATOM 2866 CE2 TRP B 77 1.682 -1.591 -6.867 1.00 0.94 C ATOM 2867 CE3 TRP B 77 -0.080 -2.277 -8.365 1.00 0.98 C ATOM 2868 CZ2 TRP B 77 2.643 -1.744 -7.868 1.00 1.34 C ATOM 2869 CZ3 TRP B 77 0.873 -2.430 -9.351 1.00 1.37 C ATOM 2870 CH2 TRP B 77 2.219 -2.165 -9.099 1.00 1.54 C ATOM 0 H TRP B 77 -4.271 -1.644 -5.610 1.00 0.39 H new ATOM 0 HA TRP B 77 -2.367 -0.873 -3.708 1.00 0.40 H new ATOM 0 HB2 TRP B 77 -2.031 -2.730 -5.216 1.00 0.58 H new ATOM 0 HB3 TRP B 77 -2.341 -1.742 -6.630 1.00 0.58 H new ATOM 0 HD1 TRP B 77 0.385 -0.947 -3.928 1.00 0.56 H new ATOM 0 HE1 TRP B 77 2.692 -0.935 -5.104 1.00 0.79 H new ATOM 0 HE3 TRP B 77 -1.120 -2.482 -8.571 1.00 0.98 H new ATOM 0 HZ2 TRP B 77 3.686 -1.537 -7.677 1.00 1.34 H new ATOM 0 HZ3 TRP B 77 0.572 -2.760 -10.334 1.00 1.37 H new ATOM 0 HH2 TRP B 77 2.941 -2.295 -9.891 1.00 1.54 H new ATOM 2881 N ARG B 78 -2.758 1.456 -5.990 1.00 0.37 N ATOM 2882 CA ARG B 78 -2.377 2.845 -6.338 1.00 0.41 C ATOM 2883 C ARG B 78 -2.676 3.834 -5.187 1.00 0.38 C ATOM 2884 O ARG B 78 -1.948 4.820 -5.029 1.00 0.45 O ATOM 2885 CB ARG B 78 -3.076 3.292 -7.644 1.00 0.49 C ATOM 2886 CG ARG B 78 -2.691 2.463 -8.874 1.00 0.68 C ATOM 2887 CD ARG B 78 -1.428 2.988 -9.564 1.00 0.88 C ATOM 2888 NE ARG B 78 -1.734 3.909 -10.670 1.00 1.17 N ATOM 2889 CZ ARG B 78 -1.747 3.589 -11.987 1.00 1.72 C ATOM 2890 NH1 ARG B 78 -1.483 2.345 -12.418 1.00 2.14 N ATOM 2891 NH2 ARG B 78 -2.035 4.533 -12.883 1.00 2.15 N ATOM 0 H ARG B 78 -3.547 1.094 -6.526 1.00 0.37 H new ATOM 0 HA ARG B 78 -1.299 2.856 -6.499 1.00 0.41 H new ATOM 0 HB2 ARG B 78 -4.155 3.235 -7.504 1.00 0.49 H new ATOM 0 HB3 ARG B 78 -2.834 4.338 -7.834 1.00 0.49 H new ATOM 0 HG2 ARG B 78 -2.533 1.427 -8.575 1.00 0.68 H new ATOM 0 HG3 ARG B 78 -3.518 2.468 -9.584 1.00 0.68 H new ATOM 0 HD2 ARG B 78 -0.803 3.499 -8.832 1.00 0.88 H new ATOM 0 HD3 ARG B 78 -0.849 2.147 -9.945 1.00 0.88 H new ATOM 0 HE ARG B 78 -1.956 4.874 -10.424 1.00 1.17 H new ATOM 0 HH11 ARG B 78 -1.265 1.608 -11.747 1.00 2.14 H new ATOM 0 HH12 ARG B 78 -1.501 2.137 -13.416 1.00 2.14 H new ATOM 0 HH21 ARG B 78 -2.242 5.483 -12.574 1.00 2.15 H new ATOM 0 HH22 ARG B 78 -2.048 4.305 -13.877 1.00 2.15 H new ATOM 2905 N LEU B 79 -3.736 3.561 -4.379 1.00 0.33 N ATOM 2906 CA LEU B 79 -4.096 4.426 -3.229 1.00 0.34 C ATOM 2907 C LEU B 79 -3.199 4.090 -2.030 1.00 0.32 C ATOM 2908 O LEU B 79 -2.826 4.986 -1.281 1.00 0.36 O ATOM 2909 CB LEU B 79 -5.594 4.290 -2.836 1.00 0.36 C ATOM 2910 CG LEU B 79 -6.247 5.543 -2.191 1.00 0.41 C ATOM 2911 CD1 LEU B 79 -6.399 6.687 -3.205 1.00 0.49 C ATOM 2912 CD2 LEU B 79 -7.601 5.186 -1.568 1.00 0.48 C ATOM 0 H LEU B 79 -4.349 2.756 -4.503 1.00 0.33 H new ATOM 0 HA LEU B 79 -3.937 5.461 -3.530 1.00 0.34 H new ATOM 0 HB2 LEU B 79 -6.161 4.029 -3.730 1.00 0.36 H new ATOM 0 HB3 LEU B 79 -5.692 3.456 -2.141 1.00 0.36 H new ATOM 0 HG LEU B 79 -5.583 5.892 -1.400 1.00 0.41 H new ATOM 0 HD11 LEU B 79 -6.859 7.546 -2.718 1.00 0.49 H new ATOM 0 HD12 LEU B 79 -5.417 6.969 -3.586 1.00 0.49 H new ATOM 0 HD13 LEU B 79 -7.028 6.359 -4.032 1.00 0.49 H new ATOM 0 HD21 LEU B 79 -8.042 6.077 -1.121 1.00 0.48 H new ATOM 0 HD22 LEU B 79 -8.266 4.800 -2.340 1.00 0.48 H new ATOM 0 HD23 LEU B 79 -7.459 4.427 -0.799 1.00 0.48 H new ATOM 2924 N ILE B 80 -2.866 2.783 -1.854 1.00 0.34 N ATOM 2925 CA ILE B 80 -1.966 2.316 -0.768 1.00 0.37 C ATOM 2926 C ILE B 80 -0.641 3.121 -0.781 1.00 0.36 C ATOM 2927 O ILE B 80 -0.085 3.417 0.282 1.00 0.39 O ATOM 2928 CB ILE B 80 -1.688 0.770 -0.885 1.00 0.44 C ATOM 2929 CG1 ILE B 80 -2.984 -0.053 -0.603 1.00 0.47 C ATOM 2930 CG2 ILE B 80 -0.528 0.305 0.020 1.00 0.54 C ATOM 2931 CD1 ILE B 80 -3.459 -0.066 0.847 1.00 0.56 C ATOM 0 H ILE B 80 -3.210 2.033 -2.454 1.00 0.34 H new ATOM 0 HA ILE B 80 -2.465 2.489 0.186 1.00 0.37 H new ATOM 0 HB ILE B 80 -1.377 0.583 -1.913 1.00 0.44 H new ATOM 0 HG12 ILE B 80 -3.786 0.344 -1.225 1.00 0.47 H new ATOM 0 HG13 ILE B 80 -2.814 -1.082 -0.919 1.00 0.47 H new ATOM 0 HG21 ILE B 80 -0.380 -0.768 -0.101 1.00 0.54 H new ATOM 0 HG22 ILE B 80 0.385 0.831 -0.260 1.00 0.54 H new ATOM 0 HG23 ILE B 80 -0.768 0.523 1.061 1.00 0.54 H new ATOM 0 HD11 ILE B 80 -4.365 -0.666 0.928 1.00 0.56 H new ATOM 0 HD12 ILE B 80 -2.682 -0.494 1.480 1.00 0.56 H new ATOM 0 HD13 ILE B 80 -3.669 0.954 1.170 1.00 0.56 H new ATOM 2943 N GLY B 81 -0.145 3.463 -1.995 1.00 0.36 N ATOM 2944 CA GLY B 81 1.069 4.271 -2.135 1.00 0.39 C ATOM 2945 C GLY B 81 0.823 5.733 -1.760 1.00 0.37 C ATOM 2946 O GLY B 81 1.693 6.372 -1.166 1.00 0.42 O ATOM 0 H GLY B 81 -0.571 3.189 -2.880 1.00 0.36 H new ATOM 0 HA2 GLY B 81 1.855 3.860 -1.501 1.00 0.39 H new ATOM 0 HA3 GLY B 81 1.427 4.214 -3.163 1.00 0.39 H new ATOM 2950 N GLU B 82 -0.373 6.260 -2.118 1.00 0.34 N ATOM 2951 CA GLU B 82 -0.770 7.649 -1.792 1.00 0.36 C ATOM 2952 C GLU B 82 -1.115 7.804 -0.296 1.00 0.33 C ATOM 2953 O GLU B 82 -0.997 8.902 0.252 1.00 0.40 O ATOM 2954 CB GLU B 82 -1.986 8.090 -2.639 1.00 0.41 C ATOM 2955 CG GLU B 82 -1.686 8.301 -4.121 1.00 0.49 C ATOM 2956 CD GLU B 82 -0.981 9.620 -4.400 1.00 0.61 C ATOM 2957 OE1 GLU B 82 -1.655 10.672 -4.376 1.00 0.91 O ATOM 2958 OE2 GLU B 82 0.245 9.599 -4.636 1.00 0.79 O ATOM 0 H GLU B 82 -1.082 5.740 -2.635 1.00 0.34 H new ATOM 0 HA GLU B 82 0.084 8.285 -2.024 1.00 0.36 H new ATOM 0 HB2 GLU B 82 -2.770 7.339 -2.544 1.00 0.41 H new ATOM 0 HB3 GLU B 82 -2.382 9.018 -2.226 1.00 0.41 H new ATOM 0 HG2 GLU B 82 -1.066 7.480 -4.482 1.00 0.49 H new ATOM 0 HG3 GLU B 82 -2.619 8.267 -4.684 1.00 0.49 H new ATOM 2965 N LEU B 83 -1.548 6.695 0.353 1.00 0.33 N ATOM 2966 CA LEU B 83 -1.912 6.686 1.789 1.00 0.35 C ATOM 2967 C LEU B 83 -0.736 7.160 2.668 1.00 0.37 C ATOM 2968 O LEU B 83 -0.907 8.053 3.502 1.00 0.45 O ATOM 2969 CB LEU B 83 -2.389 5.264 2.219 1.00 0.42 C ATOM 2970 CG LEU B 83 -3.919 5.064 2.387 1.00 0.51 C ATOM 2971 CD1 LEU B 83 -4.694 5.374 1.103 1.00 0.69 C ATOM 2972 CD2 LEU B 83 -4.226 3.641 2.869 1.00 0.63 C ATOM 0 H LEU B 83 -1.654 5.788 -0.102 1.00 0.33 H new ATOM 0 HA LEU B 83 -2.734 7.386 1.934 1.00 0.35 H new ATOM 0 HB2 LEU B 83 -2.031 4.547 1.480 1.00 0.42 H new ATOM 0 HB3 LEU B 83 -1.907 5.015 3.164 1.00 0.42 H new ATOM 0 HG LEU B 83 -4.253 5.776 3.142 1.00 0.51 H new ATOM 0 HD11 LEU B 83 -5.759 5.218 1.274 1.00 0.69 H new ATOM 0 HD12 LEU B 83 -4.521 6.411 0.815 1.00 0.69 H new ATOM 0 HD13 LEU B 83 -4.355 4.714 0.305 1.00 0.69 H new ATOM 0 HD21 LEU B 83 -5.303 3.519 2.981 1.00 0.63 H new ATOM 0 HD22 LEU B 83 -3.853 2.922 2.140 1.00 0.63 H new ATOM 0 HD23 LEU B 83 -3.740 3.469 3.829 1.00 0.63 H new ATOM 2984 N ALA B 84 0.455 6.563 2.459 1.00 0.38 N ATOM 2985 CA ALA B 84 1.672 6.927 3.214 1.00 0.44 C ATOM 2986 C ALA B 84 2.376 8.173 2.626 1.00 0.45 C ATOM 2987 O ALA B 84 3.188 8.802 3.310 1.00 0.55 O ATOM 2988 CB ALA B 84 2.636 5.747 3.255 1.00 0.55 C ATOM 0 H ALA B 84 0.600 5.824 1.771 1.00 0.38 H new ATOM 0 HA ALA B 84 1.362 7.180 4.228 1.00 0.44 H new ATOM 0 HB1 ALA B 84 3.529 6.026 3.814 1.00 0.55 H new ATOM 0 HB2 ALA B 84 2.153 4.900 3.742 1.00 0.55 H new ATOM 0 HB3 ALA B 84 2.916 5.470 2.239 1.00 0.55 H new ATOM 2994 N LYS B 85 2.064 8.514 1.354 1.00 0.41 N ATOM 2995 CA LYS B 85 2.655 9.682 0.668 1.00 0.45 C ATOM 2996 C LYS B 85 1.982 11.002 1.104 1.00 0.47 C ATOM 2997 O LYS B 85 2.643 12.048 1.139 1.00 0.57 O ATOM 2998 CB LYS B 85 2.537 9.509 -0.865 1.00 0.49 C ATOM 2999 CG LYS B 85 3.512 10.367 -1.683 1.00 0.57 C ATOM 3000 CD LYS B 85 3.250 10.282 -3.194 1.00 0.66 C ATOM 3001 CE LYS B 85 3.572 8.902 -3.784 1.00 0.79 C ATOM 3002 NZ LYS B 85 3.081 8.766 -5.187 1.00 1.10 N ATOM 0 H LYS B 85 1.402 7.991 0.781 1.00 0.41 H new ATOM 0 HA LYS B 85 3.707 9.737 0.950 1.00 0.45 H new ATOM 0 HB2 LYS B 85 2.701 8.460 -1.113 1.00 0.49 H new ATOM 0 HB3 LYS B 85 1.518 9.752 -1.167 1.00 0.49 H new ATOM 0 HG2 LYS B 85 3.433 11.406 -1.362 1.00 0.57 H new ATOM 0 HG3 LYS B 85 4.533 10.047 -1.477 1.00 0.57 H new ATOM 0 HD2 LYS B 85 2.204 10.519 -3.389 1.00 0.66 H new ATOM 0 HD3 LYS B 85 3.849 11.037 -3.704 1.00 0.66 H new ATOM 0 HE2 LYS B 85 4.650 8.740 -3.760 1.00 0.79 H new ATOM 0 HE3 LYS B 85 3.119 8.128 -3.165 1.00 0.79 H new ATOM 0 HZ1 LYS B 85 3.212 7.785 -5.507 1.00 1.10 H new ATOM 0 HZ2 LYS B 85 2.071 9.012 -5.227 1.00 1.10 H new ATOM 0 HZ3 LYS B 85 3.618 9.406 -5.806 1.00 1.10 H new ATOM 3016 N GLU B 86 0.676 10.948 1.442 1.00 0.42 N ATOM 3017 CA GLU B 86 -0.083 12.146 1.854 1.00 0.46 C ATOM 3018 C GLU B 86 -0.174 12.306 3.390 1.00 0.50 C ATOM 3019 O GLU B 86 -0.689 13.324 3.860 1.00 0.81 O ATOM 3020 CB GLU B 86 -1.494 12.126 1.227 1.00 0.52 C ATOM 3021 CG GLU B 86 -1.494 12.217 -0.306 1.00 0.59 C ATOM 3022 CD GLU B 86 -2.880 12.436 -0.899 1.00 1.01 C ATOM 3023 OE1 GLU B 86 -3.549 13.416 -0.506 1.00 1.68 O ATOM 3024 OE2 GLU B 86 -3.288 11.636 -1.769 1.00 1.48 O ATOM 0 H GLU B 86 0.127 10.088 1.437 1.00 0.42 H new ATOM 0 HA GLU B 86 0.468 13.011 1.484 1.00 0.46 H new ATOM 0 HB2 GLU B 86 -2.001 11.209 1.527 1.00 0.52 H new ATOM 0 HB3 GLU B 86 -2.072 12.957 1.631 1.00 0.52 H new ATOM 0 HG2 GLU B 86 -0.842 13.034 -0.614 1.00 0.59 H new ATOM 0 HG3 GLU B 86 -1.072 11.300 -0.717 1.00 0.59 H new ATOM 3031 N ILE B 87 0.330 11.323 4.175 1.00 0.48 N ATOM 3032 CA ILE B 87 0.303 11.413 5.651 1.00 0.51 C ATOM 3033 C ILE B 87 1.458 12.310 6.157 1.00 0.53 C ATOM 3034 O ILE B 87 1.242 13.186 7.002 1.00 0.58 O ATOM 3035 CB ILE B 87 0.336 9.986 6.335 1.00 0.56 C ATOM 3036 CG1 ILE B 87 -0.322 10.008 7.749 1.00 0.61 C ATOM 3037 CG2 ILE B 87 1.743 9.360 6.384 1.00 0.62 C ATOM 3038 CD1 ILE B 87 0.380 10.845 8.812 1.00 0.63 C ATOM 0 H ILE B 87 0.755 10.469 3.814 1.00 0.48 H new ATOM 0 HA ILE B 87 -0.642 11.874 5.938 1.00 0.51 H new ATOM 0 HB ILE B 87 -0.261 9.339 5.692 1.00 0.56 H new ATOM 0 HG12 ILE B 87 -1.343 10.375 7.645 1.00 0.61 H new ATOM 0 HG13 ILE B 87 -0.388 8.982 8.111 1.00 0.61 H new ATOM 0 HG21 ILE B 87 1.690 8.384 6.866 1.00 0.62 H new ATOM 0 HG22 ILE B 87 2.125 9.244 5.370 1.00 0.62 H new ATOM 0 HG23 ILE B 87 2.410 10.009 6.951 1.00 0.62 H new ATOM 0 HD11 ILE B 87 -0.172 10.780 9.750 1.00 0.63 H new ATOM 0 HD12 ILE B 87 1.393 10.470 8.961 1.00 0.63 H new ATOM 0 HD13 ILE B 87 0.422 11.885 8.487 1.00 0.63 H new ATOM 3050 N ARG B 88 2.673 12.098 5.607 1.00 0.57 N ATOM 3051 CA ARG B 88 3.865 12.867 6.003 1.00 0.67 C ATOM 3052 C ARG B 88 3.880 14.263 5.361 1.00 0.67 C ATOM 3053 O ARG B 88 4.213 15.243 6.035 1.00 0.84 O ATOM 3054 CB ARG B 88 5.168 12.088 5.677 1.00 0.75 C ATOM 3055 CG ARG B 88 5.398 11.785 4.190 1.00 0.82 C ATOM 3056 CD ARG B 88 6.700 11.023 3.950 1.00 1.05 C ATOM 3057 NE ARG B 88 7.061 10.982 2.522 1.00 1.17 N ATOM 3058 CZ ARG B 88 6.668 10.041 1.633 1.00 1.26 C ATOM 3059 NH1 ARG B 88 5.893 9.006 1.992 1.00 1.64 N ATOM 3060 NH2 ARG B 88 7.065 10.143 0.359 1.00 1.55 N ATOM 0 H ARG B 88 2.851 11.398 4.886 1.00 0.57 H new ATOM 0 HA ARG B 88 3.817 13.006 7.083 1.00 0.67 H new ATOM 0 HB2 ARG B 88 6.017 12.661 6.049 1.00 0.75 H new ATOM 0 HB3 ARG B 88 5.155 11.146 6.225 1.00 0.75 H new ATOM 0 HG2 ARG B 88 4.561 11.201 3.807 1.00 0.82 H new ATOM 0 HG3 ARG B 88 5.418 12.720 3.629 1.00 0.82 H new ATOM 0 HD2 ARG B 88 7.505 11.494 4.514 1.00 1.05 H new ATOM 0 HD3 ARG B 88 6.599 10.006 4.328 1.00 1.05 H new ATOM 0 HE ARG B 88 7.661 11.730 2.173 1.00 1.17 H new ATOM 0 HH11 ARG B 88 5.583 8.912 2.959 1.00 1.64 H new ATOM 0 HH12 ARG B 88 5.614 8.313 1.298 1.00 1.64 H new ATOM 0 HH21 ARG B 88 7.656 10.923 0.070 1.00 1.55 H new ATOM 0 HH22 ARG B 88 6.777 9.441 -0.323 1.00 1.55 H new ATOM 3074 N LYS B 89 3.513 14.356 4.065 1.00 0.60 N ATOM 3075 CA LYS B 89 3.498 15.643 3.362 1.00 0.67 C ATOM 3076 C LYS B 89 2.350 15.740 2.330 1.00 0.63 C ATOM 3077 O LYS B 89 2.531 15.444 1.143 1.00 0.76 O ATOM 3078 CB LYS B 89 4.884 15.921 2.722 1.00 0.76 C ATOM 3079 CG LYS B 89 5.337 14.926 1.642 1.00 0.78 C ATOM 3080 CD LYS B 89 6.825 15.070 1.321 1.00 1.06 C ATOM 3081 CE LYS B 89 7.191 14.426 -0.016 1.00 1.32 C ATOM 3082 NZ LYS B 89 8.486 14.942 -0.553 1.00 1.65 N ATOM 0 H LYS B 89 3.227 13.560 3.495 1.00 0.60 H new ATOM 0 HA LYS B 89 3.300 16.422 4.098 1.00 0.67 H new ATOM 0 HB2 LYS B 89 4.867 16.919 2.285 1.00 0.76 H new ATOM 0 HB3 LYS B 89 5.633 15.933 3.514 1.00 0.76 H new ATOM 0 HG2 LYS B 89 5.135 13.909 1.978 1.00 0.78 H new ATOM 0 HG3 LYS B 89 4.753 15.084 0.735 1.00 0.78 H new ATOM 0 HD2 LYS B 89 7.090 16.127 1.298 1.00 1.06 H new ATOM 0 HD3 LYS B 89 7.413 14.612 2.116 1.00 1.06 H new ATOM 0 HE2 LYS B 89 7.256 13.345 0.109 1.00 1.32 H new ATOM 0 HE3 LYS B 89 6.398 14.617 -0.739 1.00 1.32 H new ATOM 0 HZ1 LYS B 89 8.695 14.478 -1.460 1.00 1.65 H new ATOM 0 HZ2 LYS B 89 8.417 15.970 -0.697 1.00 1.65 H new ATOM 0 HZ3 LYS B 89 9.249 14.738 0.124 1.00 1.65 H new ATOM 3096 N LYS B 90 1.149 16.133 2.804 1.00 0.58 N ATOM 3097 CA LYS B 90 -0.019 16.324 1.910 1.00 0.56 C ATOM 3098 C LYS B 90 0.156 17.615 1.082 1.00 0.54 C ATOM 3099 O LYS B 90 -0.195 17.651 -0.101 1.00 0.58 O ATOM 3100 CB LYS B 90 -1.377 16.338 2.674 1.00 0.59 C ATOM 3101 CG LYS B 90 -1.401 17.094 4.018 1.00 0.66 C ATOM 3102 CD LYS B 90 -1.454 16.135 5.216 1.00 0.96 C ATOM 3103 CE LYS B 90 -1.424 16.868 6.561 1.00 1.48 C ATOM 3104 NZ LYS B 90 -0.044 17.290 6.950 1.00 2.03 N ATOM 0 H LYS B 90 0.961 16.323 3.788 1.00 0.58 H new ATOM 0 HA LYS B 90 -0.054 15.464 1.242 1.00 0.56 H new ATOM 0 HB2 LYS B 90 -2.131 16.778 2.021 1.00 0.59 H new ATOM 0 HB3 LYS B 90 -1.676 15.306 2.857 1.00 0.59 H new ATOM 0 HG2 LYS B 90 -0.514 17.723 4.096 1.00 0.66 H new ATOM 0 HG3 LYS B 90 -2.266 17.757 4.046 1.00 0.66 H new ATOM 0 HD2 LYS B 90 -2.361 15.533 5.155 1.00 0.96 H new ATOM 0 HD3 LYS B 90 -0.611 15.447 5.163 1.00 0.96 H new ATOM 0 HE2 LYS B 90 -2.068 17.746 6.508 1.00 1.48 H new ATOM 0 HE3 LYS B 90 -1.834 16.219 7.335 1.00 1.48 H new ATOM 0 HZ1 LYS B 90 -0.076 17.781 7.866 1.00 2.03 H new ATOM 0 HZ2 LYS B 90 0.566 16.452 7.028 1.00 2.03 H new ATOM 0 HZ3 LYS B 90 0.340 17.931 6.227 1.00 2.03 H new ATOM 3118 N LYS B 91 0.702 18.668 1.727 1.00 0.55 N ATOM 3119 CA LYS B 91 0.980 19.957 1.076 1.00 0.59 C ATOM 3120 C LYS B 91 2.482 20.257 1.223 1.00 0.62 C ATOM 3121 O LYS B 91 2.888 21.028 2.103 1.00 0.69 O ATOM 3122 CB LYS B 91 0.123 21.082 1.701 1.00 0.64 C ATOM 3123 CG LYS B 91 -1.385 20.934 1.458 1.00 0.74 C ATOM 3124 CD LYS B 91 -2.210 21.867 2.349 1.00 0.84 C ATOM 3125 CE LYS B 91 -3.717 21.695 2.137 1.00 1.14 C ATOM 3126 NZ LYS B 91 -4.220 22.448 0.947 1.00 1.36 N ATOM 0 H LYS B 91 0.961 18.644 2.713 1.00 0.55 H new ATOM 0 HA LYS B 91 0.719 19.905 0.019 1.00 0.59 H new ATOM 0 HB2 LYS B 91 0.306 21.108 2.775 1.00 0.64 H new ATOM 0 HB3 LYS B 91 0.452 22.040 1.299 1.00 0.64 H new ATOM 0 HG2 LYS B 91 -1.605 21.146 0.412 1.00 0.74 H new ATOM 0 HG3 LYS B 91 -1.681 19.902 1.644 1.00 0.74 H new ATOM 0 HD2 LYS B 91 -1.969 21.674 3.394 1.00 0.84 H new ATOM 0 HD3 LYS B 91 -1.933 22.901 2.143 1.00 0.84 H new ATOM 0 HE2 LYS B 91 -3.944 20.636 2.015 1.00 1.14 H new ATOM 0 HE3 LYS B 91 -4.246 22.034 3.027 1.00 1.14 H new ATOM 0 HZ1 LYS B 91 -5.244 22.298 0.849 1.00 1.36 H new ATOM 0 HZ2 LYS B 91 -4.029 23.463 1.072 1.00 1.36 H new ATOM 0 HZ3 LYS B 91 -3.737 22.108 0.091 1.00 1.36 H new ATOM 3140 N ASP B 92 3.311 19.607 0.371 1.00 0.66 N ATOM 3141 CA ASP B 92 4.784 19.778 0.408 1.00 0.74 C ATOM 3142 C ASP B 92 5.228 21.124 -0.214 1.00 0.92 C ATOM 3143 O ASP B 92 5.867 21.166 -1.274 1.00 1.72 O ATOM 3144 CB ASP B 92 5.510 18.571 -0.253 1.00 0.75 C ATOM 3145 CG ASP B 92 5.083 18.289 -1.693 1.00 0.88 C ATOM 3146 OD1 ASP B 92 4.038 17.631 -1.886 1.00 0.93 O ATOM 3147 OD2 ASP B 92 5.798 18.719 -2.622 1.00 1.15 O ATOM 0 H ASP B 92 2.986 18.961 -0.348 1.00 0.66 H new ATOM 0 HA ASP B 92 5.079 19.804 1.457 1.00 0.74 H new ATOM 0 HB2 ASP B 92 6.584 18.754 -0.235 1.00 0.75 H new ATOM 0 HB3 ASP B 92 5.329 17.680 0.348 1.00 0.75 H new ATOM 3152 N LEU B 93 4.877 22.225 0.482 1.00 0.63 N ATOM 3153 CA LEU B 93 5.205 23.605 0.055 1.00 0.66 C ATOM 3154 C LEU B 93 4.763 24.624 1.132 1.00 0.69 C ATOM 3155 O LEU B 93 5.529 25.523 1.496 1.00 0.82 O ATOM 3156 CB LEU B 93 4.538 23.956 -1.306 1.00 0.71 C ATOM 3157 CG LEU B 93 5.231 25.081 -2.114 1.00 0.97 C ATOM 3158 CD1 LEU B 93 6.541 24.588 -2.739 1.00 1.27 C ATOM 3159 CD2 LEU B 93 4.299 25.644 -3.192 1.00 1.18 C ATOM 0 H LEU B 93 4.357 22.184 1.358 1.00 0.63 H new ATOM 0 HA LEU B 93 6.286 23.660 -0.072 1.00 0.66 H new ATOM 0 HB2 LEU B 93 4.509 23.056 -1.920 1.00 0.71 H new ATOM 0 HB3 LEU B 93 3.505 24.249 -1.120 1.00 0.71 H new ATOM 0 HG LEU B 93 5.469 25.885 -1.417 1.00 0.97 H new ATOM 0 HD11 LEU B 93 7.005 25.400 -3.300 1.00 1.27 H new ATOM 0 HD12 LEU B 93 7.218 24.258 -1.951 1.00 1.27 H new ATOM 0 HD13 LEU B 93 6.333 23.755 -3.411 1.00 1.27 H new ATOM 0 HD21 LEU B 93 4.813 26.432 -3.742 1.00 1.18 H new ATOM 0 HD22 LEU B 93 4.015 24.847 -3.879 1.00 1.18 H new ATOM 0 HD23 LEU B 93 3.405 26.054 -2.722 1.00 1.18 H new ATOM 3171 N LYS B 94 3.517 24.459 1.634 1.00 0.66 N ATOM 3172 CA LYS B 94 2.930 25.344 2.656 1.00 0.74 C ATOM 3173 C LYS B 94 3.318 24.896 4.084 1.00 0.70 C ATOM 3174 O LYS B 94 3.858 25.699 4.851 1.00 0.79 O ATOM 3175 CB LYS B 94 1.388 25.367 2.486 1.00 0.84 C ATOM 3176 CG LYS B 94 0.642 26.396 3.341 1.00 1.00 C ATOM 3177 CD LYS B 94 0.811 27.826 2.825 1.00 1.15 C ATOM 3178 CE LYS B 94 0.010 28.830 3.653 1.00 1.45 C ATOM 3179 NZ LYS B 94 0.538 28.979 5.045 1.00 1.61 N ATOM 0 H LYS B 94 2.894 23.707 1.339 1.00 0.66 H new ATOM 0 HA LYS B 94 3.326 26.350 2.517 1.00 0.74 H new ATOM 0 HB2 LYS B 94 1.159 25.558 1.438 1.00 0.84 H new ATOM 0 HB3 LYS B 94 1.000 24.376 2.721 1.00 0.84 H new ATOM 0 HG2 LYS B 94 -0.418 26.145 3.362 1.00 1.00 H new ATOM 0 HG3 LYS B 94 1.003 26.340 4.368 1.00 1.00 H new ATOM 0 HD2 LYS B 94 1.866 28.097 2.847 1.00 1.15 H new ATOM 0 HD3 LYS B 94 0.491 27.876 1.784 1.00 1.15 H new ATOM 0 HE2 LYS B 94 0.026 29.800 3.156 1.00 1.45 H new ATOM 0 HE3 LYS B 94 -1.032 28.511 3.696 1.00 1.45 H new ATOM 0 HZ1 LYS B 94 -0.008 29.707 5.547 1.00 1.61 H new ATOM 0 HZ2 LYS B 94 0.451 28.073 5.548 1.00 1.61 H new ATOM 0 HZ3 LYS B 94 1.539 29.260 5.009 1.00 1.61 H new ATOM 3193 N ILE B 95 3.039 23.619 4.430 1.00 0.65 N ATOM 3194 CA ILE B 95 3.343 23.069 5.771 1.00 0.66 C ATOM 3195 C ILE B 95 4.121 21.739 5.670 1.00 0.68 C ATOM 3196 O ILE B 95 3.794 20.887 4.835 1.00 0.78 O ATOM 3197 CB ILE B 95 2.041 22.862 6.622 1.00 0.74 C ATOM 3198 CG1 ILE B 95 0.953 22.089 5.820 1.00 0.83 C ATOM 3199 CG2 ILE B 95 1.510 24.216 7.114 1.00 0.84 C ATOM 3200 CD1 ILE B 95 -0.237 21.621 6.643 1.00 1.04 C ATOM 0 H ILE B 95 2.603 22.948 3.797 1.00 0.65 H new ATOM 0 HA ILE B 95 3.970 23.803 6.277 1.00 0.66 H new ATOM 0 HB ILE B 95 2.294 22.253 7.490 1.00 0.74 H new ATOM 0 HG12 ILE B 95 0.591 22.730 5.016 1.00 0.83 H new ATOM 0 HG13 ILE B 95 1.416 21.221 5.351 1.00 0.83 H new ATOM 0 HG21 ILE B 95 0.606 24.060 7.703 1.00 0.84 H new ATOM 0 HG22 ILE B 95 2.266 24.701 7.731 1.00 0.84 H new ATOM 0 HG23 ILE B 95 1.280 24.849 6.257 1.00 0.84 H new ATOM 0 HD11 ILE B 95 -0.940 21.093 5.999 1.00 1.04 H new ATOM 0 HD12 ILE B 95 0.107 20.951 7.431 1.00 1.04 H new ATOM 0 HD13 ILE B 95 -0.732 22.483 7.090 1.00 1.04 H new ATOM 3212 N ARG B 96 5.154 21.568 6.529 1.00 0.70 N ATOM 3213 CA ARG B 96 5.983 20.341 6.525 1.00 0.79 C ATOM 3214 C ARG B 96 6.746 20.142 7.857 1.00 0.79 C ATOM 3215 O ARG B 96 7.983 20.149 7.886 1.00 1.02 O ATOM 3216 CB ARG B 96 6.952 20.342 5.309 1.00 0.99 C ATOM 3217 CG ARG B 96 7.719 21.656 5.090 1.00 1.12 C ATOM 3218 CD ARG B 96 8.630 21.610 3.856 1.00 1.41 C ATOM 3219 NE ARG B 96 9.998 21.134 4.162 1.00 1.59 N ATOM 3220 CZ ARG B 96 10.993 20.995 3.256 1.00 2.01 C ATOM 3221 NH1 ARG B 96 10.782 21.186 1.945 1.00 2.42 N ATOM 3222 NH2 ARG B 96 12.214 20.641 3.669 1.00 2.37 N ATOM 0 H ARG B 96 5.431 22.258 7.227 1.00 0.70 H new ATOM 0 HA ARG B 96 5.308 19.491 6.427 1.00 0.79 H new ATOM 0 HB2 ARG B 96 7.673 19.535 5.438 1.00 0.99 H new ATOM 0 HB3 ARG B 96 6.381 20.118 4.408 1.00 0.99 H new ATOM 0 HG2 ARG B 96 7.007 22.474 4.981 1.00 1.12 H new ATOM 0 HG3 ARG B 96 8.320 21.873 5.973 1.00 1.12 H new ATOM 0 HD2 ARG B 96 8.184 20.957 3.106 1.00 1.41 H new ATOM 0 HD3 ARG B 96 8.688 22.606 3.417 1.00 1.41 H new ATOM 0 HE ARG B 96 10.206 20.892 5.131 1.00 1.59 H new ATOM 0 HH11 ARG B 96 9.853 21.443 1.610 1.00 2.42 H new ATOM 0 HH12 ARG B 96 11.550 21.075 1.283 1.00 2.42 H new ATOM 0 HH21 ARG B 96 12.390 20.478 4.660 1.00 2.37 H new ATOM 0 HH22 ARG B 96 12.970 20.534 2.993 1.00 2.37 H new ATOM 3236 N LYS B 97 5.983 19.972 8.963 1.00 0.72 N ATOM 3237 CA LYS B 97 6.556 19.731 10.310 1.00 0.76 C ATOM 3238 C LYS B 97 5.457 19.352 11.343 1.00 0.76 C ATOM 3239 O LYS B 97 5.424 19.891 12.456 1.00 1.04 O ATOM 3240 CB LYS B 97 7.395 20.944 10.806 1.00 0.89 C ATOM 3241 CG LYS B 97 6.643 22.282 10.864 1.00 0.94 C ATOM 3242 CD LYS B 97 7.485 23.385 11.520 1.00 1.16 C ATOM 3243 CE LYS B 97 6.662 24.636 11.838 1.00 1.49 C ATOM 3244 NZ LYS B 97 5.682 24.408 12.944 1.00 1.86 N ATOM 0 H LYS B 97 4.963 19.998 8.948 1.00 0.72 H new ATOM 0 HA LYS B 97 7.231 18.880 10.219 1.00 0.76 H new ATOM 0 HB2 LYS B 97 7.778 20.718 11.801 1.00 0.89 H new ATOM 0 HB3 LYS B 97 8.259 21.059 10.151 1.00 0.89 H new ATOM 0 HG2 LYS B 97 6.368 22.588 9.855 1.00 0.94 H new ATOM 0 HG3 LYS B 97 5.716 22.153 11.422 1.00 0.94 H new ATOM 0 HD2 LYS B 97 7.928 23.002 12.439 1.00 1.16 H new ATOM 0 HD3 LYS B 97 8.308 23.653 10.857 1.00 1.16 H new ATOM 0 HE2 LYS B 97 7.334 25.449 12.113 1.00 1.49 H new ATOM 0 HE3 LYS B 97 6.128 24.953 10.943 1.00 1.49 H new ATOM 0 HZ1 LYS B 97 5.284 25.319 13.248 1.00 1.86 H new ATOM 0 HZ2 LYS B 97 4.916 23.791 12.607 1.00 1.86 H new ATOM 0 HZ3 LYS B 97 6.164 23.955 13.747 1.00 1.86 H new ATOM 3258 N LYS B 98 4.570 18.402 10.965 1.00 0.71 N ATOM 3259 CA LYS B 98 3.470 17.940 11.834 1.00 0.74 C ATOM 3260 C LYS B 98 3.408 16.403 11.870 1.00 0.90 C ATOM 3261 O LYS B 98 3.754 15.823 12.922 1.00 1.07 O ATOM 3262 CB LYS B 98 2.130 18.536 11.346 1.00 0.96 C ATOM 3263 CG LYS B 98 0.959 18.360 12.316 1.00 1.08 C ATOM 3264 CD LYS B 98 -0.355 18.854 11.706 1.00 1.52 C ATOM 3265 CE LYS B 98 -1.559 18.587 12.612 1.00 1.69 C ATOM 3266 NZ LYS B 98 -1.601 19.489 13.803 1.00 1.85 N ATOM 3267 OXT LYS B 98 3.020 15.794 10.847 1.00 1.15 O ATOM 0 H LYS B 98 4.598 17.940 10.056 1.00 0.71 H new ATOM 0 HA LYS B 98 3.657 18.286 12.850 1.00 0.74 H new ATOM 0 HB2 LYS B 98 2.269 19.600 11.156 1.00 0.96 H new ATOM 0 HB3 LYS B 98 1.868 18.074 10.394 1.00 0.96 H new ATOM 0 HG2 LYS B 98 0.863 17.308 12.585 1.00 1.08 H new ATOM 0 HG3 LYS B 98 1.162 18.907 13.236 1.00 1.08 H new ATOM 0 HD2 LYS B 98 -0.282 19.924 11.511 1.00 1.52 H new ATOM 0 HD3 LYS B 98 -0.512 18.365 10.745 1.00 1.52 H new ATOM 0 HE2 LYS B 98 -2.476 18.711 12.036 1.00 1.69 H new ATOM 0 HE3 LYS B 98 -1.532 17.550 12.948 1.00 1.69 H new ATOM 0 HZ1 LYS B 98 -2.436 19.263 14.380 1.00 1.85 H new ATOM 0 HZ2 LYS B 98 -0.741 19.354 14.371 1.00 1.85 H new ATOM 0 HZ3 LYS B 98 -1.655 20.478 13.487 1.00 1.85 H new TER 3281 LYS B 98 HETATM 3282 NAA ANW A 99 11.340 17.292 13.927 1.00 4.56 N HETATM 3283 NAB ANW A 99 12.656 19.200 14.127 1.00 6.22 N HETATM 3284 CAC ANW A 99 8.459 9.837 11.018 1.00 5.26 C HETATM 3285 CAD ANW A 99 9.481 10.101 12.126 1.00 4.51 C HETATM 3286 CAE ANW A 99 9.059 9.362 13.400 1.00 5.16 C HETATM 3287 CAF ANW A 99 9.566 11.465 12.379 1.00 3.64 C HETATM 3288 CAG ANW A 99 10.797 12.102 12.262 1.00 3.13 C HETATM 3289 CAH ANW A 99 10.950 13.417 12.686 1.00 2.76 C HETATM 3290 CAI ANW A 99 9.864 14.104 13.219 1.00 3.04 C HETATM 3291 CAJ ANW A 99 8.626 13.476 13.317 1.00 3.59 C HETATM 3292 CAK ANW A 99 8.478 12.160 12.894 1.00 3.84 C HETATM 3293 CAL ANW A 99 11.218 16.020 13.527 1.00 3.63 C HETATM 3294 CAM ANW A 99 12.543 17.879 14.020 1.00 5.17 C HETATM 3295 CAN ANW A 99 13.706 17.182 13.713 1.00 5.05 C HETATM 3296 CAO ANW A 99 13.602 15.861 13.293 1.00 4.25 C HETATM 3297 CAP ANW A 99 12.346 15.277 13.201 1.00 3.42 C HETATM 3298 CAQ ANW A 99 12.212 13.994 12.688 1.00 3.01 C HETATM 3299 CAR ANW A 99 14.959 17.737 13.953 1.00 6.05 C HETATM 3300 OAS ANW A 99 10.011 15.392 13.635 1.00 3.49 O HETATM 3301 OAT ANW A 99 13.190 13.379 12.259 1.00 3.52 O HETATM 3302 OAU ANW A 99 15.988 17.139 13.570 1.00 6.33 O HETATM 3303 OAV ANW A 99 15.059 18.819 14.571 1.00 6.88 O HETATM 0 HOAV ANW A 99 16.006 19.052 14.671 1.00 6.88 H new HETATM 0 HNAB ANW A 99 11.820 19.784 14.139 1.00 6.22 H new HETATM 0 HNAA ANW A 99 13.579 19.629 14.197 1.00 6.22 H new HETATM 0 HAEB ANW A 99 8.079 9.717 13.719 1.00 5.16 H new HETATM 0 HAEA ANW A 99 9.010 8.292 13.200 1.00 5.16 H new HETATM 0 HACB ANW A 99 8.409 8.767 10.816 1.00 5.26 H new HETATM 0 HACA ANW A 99 7.479 10.193 11.335 1.00 5.26 H new HETATM 0 HAO ANW A 99 14.496 15.291 13.039 1.00 4.25 H new HETATM 0 HAK ANW A 99 7.506 11.672 12.966 1.00 3.84 H new HETATM 0 HAJ ANW A 99 7.772 14.016 13.726 1.00 3.59 H new HETATM 0 HAG ANW A 99 11.646 11.567 11.836 1.00 3.13 H new HETATM 0 HAE ANW A 99 9.788 9.551 14.188 1.00 5.16 H new HETATM 0 HAD ANW A 99 10.458 9.739 11.805 1.00 4.51 H new HETATM 0 HAC ANW A 99 8.760 10.363 10.112 1.00 5.26 H new HETATM 3317 NAA ANW B 99 -10.825 -15.314 2.486 1.00 4.81 N HETATM 3318 NAB ANW B 99 -11.875 -16.311 0.669 1.00 6.57 N HETATM 3319 CAC ANW B 99 -10.982 -10.218 9.080 1.00 5.53 C HETATM 3320 CAD ANW B 99 -10.525 -11.674 9.196 1.00 4.77 C HETATM 3321 CAE ANW B 99 -9.195 -11.742 9.953 1.00 5.55 C HETATM 3322 CAF ANW B 99 -10.372 -12.228 7.929 1.00 3.85 C HETATM 3323 CAG ANW B 99 -11.121 -13.344 7.578 1.00 3.21 C HETATM 3324 CAH ANW B 99 -11.037 -13.871 6.296 1.00 2.83 C HETATM 3325 CAI ANW B 99 -10.175 -13.294 5.369 1.00 3.21 C HETATM 3326 CAJ ANW B 99 -9.411 -12.188 5.722 1.00 3.83 C HETATM 3327 CAK ANW B 99 -9.514 -11.651 7.000 1.00 4.12 C HETATM 3328 CAL ANW B 99 -10.904 -14.833 3.734 1.00 3.82 C HETATM 3329 CAM ANW B 99 -11.788 -16.100 1.980 1.00 5.45 C HETATM 3330 CAN ANW B 99 -12.894 -16.463 2.741 1.00 5.26 C HETATM 3331 CAO ANW B 99 -12.995 -15.982 4.041 1.00 4.33 C HETATM 3332 CAP ANW B 99 -11.992 -15.157 4.540 1.00 3.50 C HETATM 3333 CAQ ANW B 99 -11.978 -14.805 5.882 1.00 3.00 C HETATM 3334 CAR ANW B 99 -13.795 -17.414 2.280 1.00 6.31 C HETATM 3335 OAS ANW B 99 -10.118 -13.781 4.096 1.00 3.68 O HETATM 3336 OAT ANW B 99 -12.756 -15.321 6.682 1.00 3.40 O HETATM 3337 OAU ANW B 99 -14.833 -17.656 2.933 1.00 6.52 O HETATM 3338 OAV ANW B 99 -13.561 -18.045 1.227 1.00 7.25 O HETATM 0 HOAV ANW B 99 -14.284 -18.685 1.062 1.00 7.25 H new HETATM 0 HNAB ANW B 99 -11.205 -15.873 0.036 1.00 6.57 H new HETATM 0 HNAA ANW B 99 -12.611 -16.911 0.297 1.00 6.57 H new HETATM 0 HAEB ANW B 99 -8.440 -11.169 9.414 1.00 5.55 H new HETATM 0 HAEA ANW B 99 -9.323 -11.324 10.952 1.00 5.55 H new HETATM 0 HACB ANW B 99 -11.113 -9.797 10.077 1.00 5.53 H new HETATM 0 HACA ANW B 99 -10.230 -9.643 8.540 1.00 5.53 H new HETATM 0 HAO ANW B 99 -13.850 -16.248 4.662 1.00 4.33 H new HETATM 0 HAK ANW B 99 -8.922 -10.778 7.274 1.00 4.12 H new HETATM 0 HAJ ANW B 99 -8.731 -11.742 4.997 1.00 3.83 H new HETATM 0 HAG ANW B 99 -11.778 -13.809 8.313 1.00 3.21 H new HETATM 0 HAE ANW B 99 -8.874 -12.781 10.033 1.00 5.55 H new HETATM 0 HAD ANW B 99 -11.280 -12.239 9.743 1.00 4.77 H new HETATM 0 HAC ANW B 99 -11.928 -10.176 8.541 1.00 5.53 H new