USER MOD reduce.3.24.130724 H: found=0, std=0, add=1238, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1232 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 14 LYS NZ :NH3+ -134:sc= 2.25 (180deg=0.0873) USER MOD Set 1.2: B 81 ASN : amide:sc= 1.01 K(o=5.6,f=-7.8!) USER MOD Set 1.3: B 83 SER OG : rot -57:sc= 1.21 USER MOD Set 1.4: B 84 THR OG1 : rot 47:sc= 1.11 USER MOD Set 2.1: B 45 HIS : no HD1:sc= -2.41 K(o=-2.4,f=-5.3!) USER MOD Set 2.2: B 75 THR OG1 : rot 150:sc=-0.00102 USER MOD Set 3.1: B 70 HIS : no HE2:sc= -6.28! C(o=-4.9!,f=-16!) USER MOD Set 3.2: B 106 LYS NZ :NH3+ 144:sc= 1.35 (180deg=-0.0645!) USER MOD Set 4.1: B 66 GLN : amide:sc= -1.93 K(o=-4,f=-4.6!) USER MOD Set 4.2: B 76 ASN :FLIP amide:sc= -2.03 F(o=-4.8!,f=-4) USER MOD Set 5.1: A 129 SER OG : rot 108:sc= 2.16 USER MOD Set 5.2: B 56 SER OG : rot 114:sc= 0.179 USER MOD Set 5.3: B 60 LYS NZ :NH3+ -161:sc= 0.978 (180deg=-0.802) USER MOD Set 5.4: B 64 GLN : amide:sc= -1.85! C(o=1.5!,f=-9.4!) USER MOD Set 6.1: B 17 GLN :FLIP amide:sc= 0.681 F(o=-1.2!,f=1.6) USER MOD Set 6.2: B 20 GLN :FLIP amide:sc= 0.9 F(o=-1.9,f=1.6) USER MOD Set 7.1: B 13 LYS NZ :NH3+ -174:sc= 1.98 (180deg=0.673) USER MOD Set 7.2: B 25 TYR OH : rot 150:sc= 0.973 USER MOD Set 8.1: B 1 MET N :NH3+ 159:sc= 2.79 (180deg=-0.283!) USER MOD Set 8.2: B 4 SER OG : rot 36:sc= 2.07 USER MOD Set 9.1: A 111 HIS : +bothHN:sc= 1.33 K(o=4.4,f=-5.1!) USER MOD Set 9.2: A 113 LYS NZ :NH3+ -157:sc= 1.75 (180deg=0.62) USER MOD Set 9.3: A 117 THR OG1 : rot -178:sc= 1.32 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 MET CE :methyl -113:sc= -0.0117 (180deg=-0.991) USER MOD Single : A 119 ASN : amide:sc= -6.04! C(o=-6!,f=-8.9!) USER MOD Single : A 122 SER OG : rot -77:sc= 1.86 USER MOD Single : A 123 ASN : amide:sc= 0.96 K(o=0.96,f=-1.2!) USER MOD Single : A 131 ASN :FLIP amide:sc= 0.175 F(o=-2.3!,f=0.18) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 87:sc= 1.24 USER MOD Single : A 151 THR OG1 : rot 159:sc= -0.301 USER MOD Single : A 154 SER OG : rot 180:sc= -0.142 USER MOD Single : A 156 SER OG : rot 180:sc= -0.174 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 3 THR OG1 : rot 180:sc= -0.0185 USER MOD Single : B 5 SER OG : rot 180:sc= 0.0561 USER MOD Single : B 18 LYS NZ :NH3+ 131:sc= 3.64 (180deg=0.51) USER MOD Single : B 19 LYS NZ :NH3+ 169:sc= 2.26 (180deg=1.6) USER MOD Single : B 27 MET CE :methyl 156:sc= -1.37 (180deg=-2.83!) USER MOD Single : B 38 LYS NZ :NH3+ -162:sc= 1.31 (180deg=0.934) USER MOD Single : B 42 THR OG1 : rot 180:sc= 0.00913 USER MOD Single : B 44 SER OG : rot -2:sc= -0.198 USER MOD Single : B 46 MET CE :methyl -159:sc= -0.114 (180deg=-0.671) USER MOD Single : B 47 TYR OH : rot 171:sc= 1.26 USER MOD Single : B 51 LYS NZ :NH3+ -137:sc= 0.526 (180deg=-0.86!) USER MOD Single : B 52 CYS SG : rot 72:sc= 0.868 USER MOD Single : B 53 GLN : amide:sc= -4.4! C(o=-4.4!,f=-12!) USER MOD Single : B 54 LYS NZ :NH3+ 156:sc= 1.13 (180deg=-0.138!) USER MOD Single : B 62 LYS NZ :NH3+ 167:sc= 1.44 (180deg=0.0462) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 HIS : no HE2:sc= -4.48! C(o=-4.5!,f=-6.8!) USER MOD Single : B 80 SER OG : rot 34:sc= 0.0923 USER MOD Single : B 87 LYS NZ :NH3+ 171:sc= 1.23 (180deg=1.18) USER MOD Single : B 93 LYS NZ :NH3+ 148:sc= -0.673 (180deg=-1.08!) USER MOD Single : B 97 GLN :FLIP amide:sc= -1.49 F(o=-3.6!,f=-1.5) USER MOD Single : B 98 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.26) USER MOD Single : B 102 LYS NZ :NH3+ -108:sc= 1.58 (180deg=-2.34!) USER MOD Single : B 104 LYS NZ :NH3+ 153:sc= 3.41 (180deg=2.03) USER MOD Single : B 108 ASN : amide:sc= -0.985! C(o=-0.98!,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 109 1.476 31.127 4.184 1.00 0.00 N ATOM 2 CA ALA A 109 1.947 30.243 3.094 1.00 0.00 C ATOM 3 C ALA A 109 1.737 28.790 3.482 1.00 0.00 C ATOM 4 O ALA A 109 1.466 28.496 4.644 1.00 0.00 O ATOM 5 CB ALA A 109 3.414 30.507 2.788 1.00 0.00 C ATOM 0 HA ALA A 109 1.369 30.455 2.194 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.742 29.848 1.984 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.540 31.545 2.481 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.012 30.317 3.680 1.00 0.00 H new ATOM 11 N HIS A 110 1.855 27.892 2.515 1.00 0.00 N ATOM 12 CA HIS A 110 1.671 26.468 2.768 1.00 0.00 C ATOM 13 C HIS A 110 2.899 25.698 2.309 1.00 0.00 C ATOM 14 O HIS A 110 3.698 26.207 1.520 1.00 0.00 O ATOM 15 CB HIS A 110 0.421 25.943 2.045 1.00 0.00 C ATOM 16 CG HIS A 110 -0.852 26.617 2.463 1.00 0.00 C ATOM 17 ND1 HIS A 110 -1.751 26.081 3.360 1.00 0.00 N ATOM 18 CD2 HIS A 110 -1.367 27.817 2.092 1.00 0.00 C ATOM 19 CE1 HIS A 110 -2.759 26.952 3.504 1.00 0.00 C ATOM 20 NE2 HIS A 110 -2.571 28.023 2.756 1.00 0.00 N ATOM 0 H HIS A 110 2.077 28.123 1.547 1.00 0.00 H new ATOM 0 HA HIS A 110 1.535 26.322 3.840 1.00 0.00 H new ATOM 0 HB2 HIS A 110 0.553 26.073 0.971 1.00 0.00 H new ATOM 0 HB3 HIS A 110 0.331 24.872 2.228 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -0.913 28.503 1.392 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -3.613 26.798 4.147 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -3.183 28.835 2.681 1.00 0.00 H new ATOM 28 N HIS A 111 3.052 24.480 2.806 1.00 0.00 N ATOM 29 CA HIS A 111 4.187 23.644 2.442 1.00 0.00 C ATOM 30 C HIS A 111 3.944 22.996 1.081 1.00 0.00 C ATOM 31 O HIS A 111 3.503 21.853 0.994 1.00 0.00 O ATOM 32 CB HIS A 111 4.424 22.572 3.511 1.00 0.00 C ATOM 33 CG HIS A 111 5.848 22.112 3.603 1.00 0.00 C ATOM 34 ND1 HIS A 111 6.355 21.031 2.918 1.00 0.00 N ATOM 35 CD2 HIS A 111 6.881 22.609 4.329 1.00 0.00 C ATOM 36 CE1 HIS A 111 7.647 20.903 3.243 1.00 0.00 C ATOM 37 NE2 HIS A 111 8.017 21.838 4.097 1.00 0.00 N ATOM 0 H HIS A 111 2.403 24.047 3.464 1.00 0.00 H new ATOM 0 HA HIS A 111 5.078 24.269 2.378 1.00 0.00 H new ATOM 0 HB2 HIS A 111 4.116 22.964 4.480 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.788 21.713 3.298 1.00 0.00 H new ATOM 0 HD1 HIS A 111 5.837 20.432 2.275 1.00 0.00 H new ATOM 0 HD2 HIS A 111 6.830 23.467 4.983 1.00 0.00 H new ATOM 0 HE1 HIS A 111 8.301 20.135 2.857 1.00 0.00 H new ATOM 0 HE2 HIS A 111 8.943 21.969 4.503 1.00 0.00 H new ATOM 45 N LEU A 112 4.222 23.748 0.022 1.00 0.00 N ATOM 46 CA LEU A 112 4.033 23.262 -1.343 1.00 0.00 C ATOM 47 C LEU A 112 5.083 22.209 -1.698 1.00 0.00 C ATOM 48 O LEU A 112 4.954 21.491 -2.692 1.00 0.00 O ATOM 49 CB LEU A 112 4.103 24.432 -2.331 1.00 0.00 C ATOM 50 CG LEU A 112 3.695 24.099 -3.770 1.00 0.00 C ATOM 51 CD1 LEU A 112 2.212 23.767 -3.847 1.00 0.00 C ATOM 52 CD2 LEU A 112 4.033 25.256 -4.698 1.00 0.00 C ATOM 0 H LEU A 112 4.581 24.701 0.082 1.00 0.00 H new ATOM 0 HA LEU A 112 3.049 22.797 -1.409 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.462 25.234 -1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.122 24.818 -2.340 1.00 0.00 H new ATOM 0 HG LEU A 112 4.256 23.222 -4.092 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.944 23.534 -4.878 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.998 22.906 -3.213 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.629 24.623 -3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.737 25.004 -5.716 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.498 26.149 -4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.106 25.445 -4.668 1.00 0.00 H new ATOM 64 N LYS A 113 6.122 22.124 -0.884 1.00 0.00 N ATOM 65 CA LYS A 113 7.188 21.162 -1.106 1.00 0.00 C ATOM 66 C LYS A 113 6.764 19.789 -0.595 1.00 0.00 C ATOM 67 O LYS A 113 6.238 19.665 0.511 1.00 0.00 O ATOM 68 CB LYS A 113 8.470 21.621 -0.408 1.00 0.00 C ATOM 69 CG LYS A 113 8.883 23.043 -0.767 1.00 0.00 C ATOM 70 CD LYS A 113 10.248 23.399 -0.193 1.00 0.00 C ATOM 71 CE LYS A 113 10.257 23.328 1.326 1.00 0.00 C ATOM 72 NZ LYS A 113 11.306 22.404 1.828 1.00 0.00 N ATOM 0 H LYS A 113 6.250 22.712 -0.060 1.00 0.00 H new ATOM 0 HA LYS A 113 7.385 21.092 -2.176 1.00 0.00 H new ATOM 0 HB2 LYS A 113 8.331 21.553 0.671 1.00 0.00 H new ATOM 0 HB3 LYS A 113 9.280 20.939 -0.668 1.00 0.00 H new ATOM 0 HG2 LYS A 113 8.905 23.152 -1.851 1.00 0.00 H new ATOM 0 HG3 LYS A 113 8.137 23.744 -0.392 1.00 0.00 H new ATOM 0 HD2 LYS A 113 10.999 22.718 -0.593 1.00 0.00 H new ATOM 0 HD3 LYS A 113 10.526 24.404 -0.512 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.424 24.324 1.736 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.281 22.997 1.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.053 22.077 2.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 11.382 21.586 1.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 12.219 22.901 1.864 1.00 0.00 H new ATOM 86 N ARG A 114 6.982 18.762 -1.401 1.00 0.00 N ATOM 87 CA ARG A 114 6.603 17.408 -1.021 1.00 0.00 C ATOM 88 C ARG A 114 7.795 16.646 -0.455 1.00 0.00 C ATOM 89 O ARG A 114 8.441 15.855 -1.148 1.00 0.00 O ATOM 90 CB ARG A 114 6.002 16.668 -2.216 1.00 0.00 C ATOM 91 CG ARG A 114 4.497 16.852 -2.340 1.00 0.00 C ATOM 92 CD ARG A 114 4.098 17.306 -3.734 1.00 0.00 C ATOM 93 NE ARG A 114 4.375 18.728 -3.955 1.00 0.00 N ATOM 94 CZ ARG A 114 4.236 19.343 -5.130 1.00 0.00 C ATOM 95 NH1 ARG A 114 3.782 18.679 -6.187 1.00 0.00 N ATOM 96 NH2 ARG A 114 4.529 20.634 -5.237 1.00 0.00 N ATOM 0 H ARG A 114 7.418 18.838 -2.320 1.00 0.00 H new ATOM 0 HA ARG A 114 5.846 17.472 -0.239 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.481 17.018 -3.130 1.00 0.00 H new ATOM 0 HB3 ARG A 114 6.225 15.605 -2.126 1.00 0.00 H new ATOM 0 HG2 ARG A 114 3.995 15.913 -2.106 1.00 0.00 H new ATOM 0 HG3 ARG A 114 4.159 17.585 -1.608 1.00 0.00 H new ATOM 0 HD2 ARG A 114 4.636 16.714 -4.475 1.00 0.00 H new ATOM 0 HD3 ARG A 114 3.035 17.117 -3.885 1.00 0.00 H new ATOM 0 HE ARG A 114 4.694 19.282 -3.160 1.00 0.00 H new ATOM 0 HH11 ARG A 114 3.537 17.692 -6.103 1.00 0.00 H new ATOM 0 HH12 ARG A 114 3.678 19.156 -7.083 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.859 21.151 -4.422 1.00 0.00 H new ATOM 0 HH22 ARG A 114 4.424 21.108 -6.134 1.00 0.00 H new ATOM 110 N GLY A 115 8.084 16.901 0.810 1.00 0.00 N ATOM 111 CA GLY A 115 9.189 16.245 1.468 1.00 0.00 C ATOM 112 C GLY A 115 9.345 16.701 2.901 1.00 0.00 C ATOM 113 O GLY A 115 8.667 16.193 3.796 1.00 0.00 O ATOM 0 H GLY A 115 7.567 17.557 1.396 1.00 0.00 H new ATOM 0 HA2 GLY A 115 9.036 15.166 1.445 1.00 0.00 H new ATOM 0 HA3 GLY A 115 10.109 16.448 0.921 1.00 0.00 H new ATOM 117 N ALA A 116 10.221 17.674 3.111 1.00 0.00 N ATOM 118 CA ALA A 116 10.480 18.212 4.442 1.00 0.00 C ATOM 119 C ALA A 116 11.258 19.514 4.337 1.00 0.00 C ATOM 120 O ALA A 116 11.369 20.086 3.257 1.00 0.00 O ATOM 121 CB ALA A 116 11.257 17.205 5.278 1.00 0.00 C ATOM 0 H ALA A 116 10.769 18.111 2.370 1.00 0.00 H new ATOM 0 HA ALA A 116 9.526 18.409 4.930 1.00 0.00 H new ATOM 0 HB1 ALA A 116 11.443 17.621 6.268 1.00 0.00 H new ATOM 0 HB2 ALA A 116 10.678 16.287 5.373 1.00 0.00 H new ATOM 0 HB3 ALA A 116 12.208 16.986 4.792 1.00 0.00 H new ATOM 127 N THR A 117 11.786 19.987 5.454 1.00 0.00 N ATOM 128 CA THR A 117 12.566 21.211 5.457 1.00 0.00 C ATOM 129 C THR A 117 13.696 21.135 6.483 1.00 0.00 C ATOM 130 O THR A 117 13.537 21.514 7.642 1.00 0.00 O ATOM 131 CB THR A 117 11.687 22.459 5.709 1.00 0.00 C ATOM 132 OG1 THR A 117 10.706 22.578 4.666 1.00 0.00 O ATOM 133 CG2 THR A 117 12.529 23.728 5.744 1.00 0.00 C ATOM 0 H THR A 117 11.689 19.543 6.367 1.00 0.00 H new ATOM 0 HA THR A 117 13.003 21.314 4.464 1.00 0.00 H new ATOM 0 HB THR A 117 11.198 22.337 6.675 1.00 0.00 H new ATOM 0 HG1 THR A 117 10.170 23.386 4.811 1.00 0.00 H new ATOM 0 HG21 THR A 117 11.884 24.588 5.923 1.00 0.00 H new ATOM 0 HG22 THR A 117 13.265 23.654 6.544 1.00 0.00 H new ATOM 0 HG23 THR A 117 13.042 23.851 4.790 1.00 0.00 H new ATOM 141 N MET A 118 14.818 20.583 6.046 1.00 0.00 N ATOM 142 CA MET A 118 16.012 20.463 6.875 1.00 0.00 C ATOM 143 C MET A 118 17.183 21.048 6.106 1.00 0.00 C ATOM 144 O MET A 118 17.884 21.941 6.576 1.00 0.00 O ATOM 145 CB MET A 118 16.299 18.999 7.224 1.00 0.00 C ATOM 146 CG MET A 118 15.336 18.405 8.240 1.00 0.00 C ATOM 147 SD MET A 118 15.776 16.717 8.698 1.00 0.00 S ATOM 148 CE MET A 118 14.477 16.331 9.870 1.00 0.00 C ATOM 0 H MET A 118 14.928 20.204 5.105 1.00 0.00 H new ATOM 0 HA MET A 118 15.857 21.002 7.810 1.00 0.00 H new ATOM 0 HB2 MET A 118 16.260 18.404 6.311 1.00 0.00 H new ATOM 0 HB3 MET A 118 17.314 18.921 7.612 1.00 0.00 H new ATOM 0 HG2 MET A 118 15.324 19.030 9.133 1.00 0.00 H new ATOM 0 HG3 MET A 118 14.326 18.416 7.829 1.00 0.00 H new ATOM 0 HE1 MET A 118 14.907 16.218 10.865 1.00 0.00 H new ATOM 0 HE2 MET A 118 13.745 17.138 9.881 1.00 0.00 H new ATOM 0 HE3 MET A 118 13.988 15.402 9.578 1.00 0.00 H new ATOM 158 N ASN A 119 17.370 20.516 4.912 1.00 0.00 N ATOM 159 CA ASN A 119 18.407 20.964 4.000 1.00 0.00 C ATOM 160 C ASN A 119 17.729 21.691 2.837 1.00 0.00 C ATOM 161 O ASN A 119 16.944 22.610 3.074 1.00 0.00 O ATOM 162 CB ASN A 119 19.240 19.768 3.514 1.00 0.00 C ATOM 163 CG ASN A 119 18.397 18.615 2.979 1.00 0.00 C ATOM 164 OD1 ASN A 119 17.414 18.194 3.590 1.00 0.00 O ATOM 165 ND2 ASN A 119 18.769 18.110 1.822 1.00 0.00 N ATOM 0 H ASN A 119 16.801 19.753 4.544 1.00 0.00 H new ATOM 0 HA ASN A 119 19.094 21.647 4.500 1.00 0.00 H new ATOM 0 HB2 ASN A 119 19.920 20.104 2.731 1.00 0.00 H new ATOM 0 HB3 ASN A 119 19.855 19.406 4.337 1.00 0.00 H new ATOM 0 HD21 ASN A 119 18.238 17.346 1.405 1.00 0.00 H new ATOM 0 HD22 ASN A 119 19.589 18.483 1.343 1.00 0.00 H new ATOM 172 N GLU A 120 17.999 21.291 1.592 1.00 0.00 N ATOM 173 CA GLU A 120 17.338 21.919 0.443 1.00 0.00 C ATOM 174 C GLU A 120 15.846 21.647 0.532 1.00 0.00 C ATOM 175 O GLU A 120 15.003 22.423 0.079 1.00 0.00 O ATOM 176 CB GLU A 120 17.881 21.394 -0.897 1.00 0.00 C ATOM 177 CG GLU A 120 19.391 21.215 -0.946 1.00 0.00 C ATOM 178 CD GLU A 120 19.832 19.888 -0.366 1.00 0.00 C ATOM 179 OE1 GLU A 120 19.509 18.837 -0.953 1.00 0.00 O ATOM 180 OE2 GLU A 120 20.469 19.891 0.705 1.00 0.00 O ATOM 0 H GLU A 120 18.658 20.549 1.355 1.00 0.00 H new ATOM 0 HA GLU A 120 17.539 22.990 0.476 1.00 0.00 H new ATOM 0 HB2 GLU A 120 17.408 20.436 -1.115 1.00 0.00 H new ATOM 0 HB3 GLU A 120 17.585 22.083 -1.688 1.00 0.00 H new ATOM 0 HG2 GLU A 120 19.730 21.288 -1.979 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.869 22.026 -0.396 1.00 0.00 H new ATOM 187 N ASP A 121 15.571 20.533 1.161 1.00 0.00 N ATOM 188 CA ASP A 121 14.222 20.041 1.406 1.00 0.00 C ATOM 189 C ASP A 121 14.306 18.795 2.272 1.00 0.00 C ATOM 190 O ASP A 121 14.241 18.873 3.500 1.00 0.00 O ATOM 191 CB ASP A 121 13.478 19.720 0.104 1.00 0.00 C ATOM 192 CG ASP A 121 12.016 19.389 0.349 1.00 0.00 C ATOM 193 OD1 ASP A 121 11.705 18.218 0.648 1.00 0.00 O ATOM 194 OD2 ASP A 121 11.179 20.309 0.267 1.00 0.00 O ATOM 0 H ASP A 121 16.296 19.918 1.532 1.00 0.00 H new ATOM 0 HA ASP A 121 13.659 20.825 1.913 1.00 0.00 H new ATOM 0 HB2 ASP A 121 13.548 20.572 -0.573 1.00 0.00 H new ATOM 0 HB3 ASP A 121 13.962 18.878 -0.392 1.00 0.00 H new ATOM 199 N SER A 122 14.495 17.653 1.627 1.00 0.00 N ATOM 200 CA SER A 122 14.603 16.387 2.325 1.00 0.00 C ATOM 201 C SER A 122 15.531 15.441 1.570 1.00 0.00 C ATOM 202 O SER A 122 15.154 14.870 0.545 1.00 0.00 O ATOM 203 CB SER A 122 13.219 15.758 2.491 1.00 0.00 C ATOM 204 OG SER A 122 12.453 15.881 1.302 1.00 0.00 O ATOM 0 H SER A 122 14.577 17.581 0.613 1.00 0.00 H new ATOM 0 HA SER A 122 15.026 16.567 3.313 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.324 14.705 2.752 1.00 0.00 H new ATOM 0 HB3 SER A 122 12.694 16.240 3.316 1.00 0.00 H new ATOM 0 HG SER A 122 12.117 16.798 1.223 1.00 0.00 H new ATOM 210 N ASN A 123 16.752 15.303 2.064 1.00 0.00 N ATOM 211 CA ASN A 123 17.738 14.423 1.442 1.00 0.00 C ATOM 212 C ASN A 123 18.412 13.572 2.507 1.00 0.00 C ATOM 213 O ASN A 123 19.559 13.152 2.359 1.00 0.00 O ATOM 214 CB ASN A 123 18.783 15.235 0.667 1.00 0.00 C ATOM 215 CG ASN A 123 18.595 15.147 -0.838 1.00 0.00 C ATOM 216 OD1 ASN A 123 18.164 14.122 -1.363 1.00 0.00 O ATOM 217 ND2 ASN A 123 18.907 16.225 -1.545 1.00 0.00 N ATOM 0 H ASN A 123 17.087 15.789 2.896 1.00 0.00 H new ATOM 0 HA ASN A 123 17.226 13.771 0.735 1.00 0.00 H new ATOM 0 HB2 ASN A 123 18.728 16.279 0.976 1.00 0.00 H new ATOM 0 HB3 ASN A 123 19.780 14.878 0.926 1.00 0.00 H new ATOM 0 HD21 ASN A 123 18.792 16.221 -2.558 1.00 0.00 H new ATOM 0 HD22 ASN A 123 19.262 17.058 -1.075 1.00 0.00 H new ATOM 224 N GLU A 124 17.687 13.339 3.592 1.00 0.00 N ATOM 225 CA GLU A 124 18.191 12.538 4.698 1.00 0.00 C ATOM 226 C GLU A 124 17.366 11.257 4.847 1.00 0.00 C ATOM 227 O GLU A 124 17.107 10.572 3.862 1.00 0.00 O ATOM 228 CB GLU A 124 18.195 13.348 6.005 1.00 0.00 C ATOM 229 CG GLU A 124 17.246 14.540 6.012 1.00 0.00 C ATOM 230 CD GLU A 124 15.808 14.138 5.773 1.00 0.00 C ATOM 231 OE1 GLU A 124 15.274 13.336 6.563 1.00 0.00 O ATOM 232 OE2 GLU A 124 15.216 14.601 4.776 1.00 0.00 O ATOM 0 H GLU A 124 16.742 13.696 3.730 1.00 0.00 H new ATOM 0 HA GLU A 124 19.221 12.257 4.479 1.00 0.00 H new ATOM 0 HB2 GLU A 124 17.932 12.685 6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 124 19.208 13.705 6.194 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.321 15.054 6.970 1.00 0.00 H new ATOM 0 HG3 GLU A 124 17.554 15.250 5.244 1.00 0.00 H new ATOM 239 N GLU A 125 16.937 10.945 6.067 1.00 0.00 N ATOM 240 CA GLU A 125 16.162 9.731 6.312 1.00 0.00 C ATOM 241 C GLU A 125 15.347 9.849 7.602 1.00 0.00 C ATOM 242 O GLU A 125 15.003 8.842 8.220 1.00 0.00 O ATOM 243 CB GLU A 125 17.118 8.536 6.410 1.00 0.00 C ATOM 244 CG GLU A 125 16.521 7.222 5.937 1.00 0.00 C ATOM 245 CD GLU A 125 16.947 6.050 6.799 1.00 0.00 C ATOM 246 OE1 GLU A 125 18.098 5.597 6.663 1.00 0.00 O ATOM 247 OE2 GLU A 125 16.120 5.585 7.616 1.00 0.00 O ATOM 0 H GLU A 125 17.111 11.512 6.897 1.00 0.00 H new ATOM 0 HA GLU A 125 15.467 9.587 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 125 18.010 8.750 5.822 1.00 0.00 H new ATOM 0 HB3 GLU A 125 17.438 8.425 7.446 1.00 0.00 H new ATOM 0 HG2 GLU A 125 15.434 7.297 5.943 1.00 0.00 H new ATOM 0 HG3 GLU A 125 16.823 7.039 4.906 1.00 0.00 H new ATOM 254 N GLU A 126 15.004 11.069 7.987 1.00 0.00 N ATOM 255 CA GLU A 126 14.263 11.291 9.224 1.00 0.00 C ATOM 256 C GLU A 126 12.830 11.762 8.968 1.00 0.00 C ATOM 257 O GLU A 126 12.453 12.045 7.834 1.00 0.00 O ATOM 258 CB GLU A 126 15.002 12.323 10.083 1.00 0.00 C ATOM 259 CG GLU A 126 15.388 11.813 11.462 1.00 0.00 C ATOM 260 CD GLU A 126 14.246 11.900 12.456 1.00 0.00 C ATOM 261 OE1 GLU A 126 13.276 11.126 12.317 1.00 0.00 O ATOM 262 OE2 GLU A 126 14.318 12.747 13.369 1.00 0.00 O ATOM 0 H GLU A 126 15.224 11.918 7.466 1.00 0.00 H new ATOM 0 HA GLU A 126 14.201 10.337 9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 126 15.903 12.640 9.558 1.00 0.00 H new ATOM 0 HB3 GLU A 126 14.372 13.205 10.196 1.00 0.00 H new ATOM 0 HG2 GLU A 126 15.718 10.777 11.383 1.00 0.00 H new ATOM 0 HG3 GLU A 126 16.234 12.390 11.835 1.00 0.00 H new ATOM 269 N GLU A 127 12.057 11.809 10.053 1.00 0.00 N ATOM 270 CA GLU A 127 10.652 12.255 10.091 1.00 0.00 C ATOM 271 C GLU A 127 9.768 11.742 8.946 1.00 0.00 C ATOM 272 O GLU A 127 8.781 12.389 8.586 1.00 0.00 O ATOM 273 CB GLU A 127 10.559 13.792 10.207 1.00 0.00 C ATOM 274 CG GLU A 127 11.303 14.580 9.133 1.00 0.00 C ATOM 275 CD GLU A 127 10.456 14.860 7.909 1.00 0.00 C ATOM 276 OE1 GLU A 127 9.358 15.439 8.051 1.00 0.00 O ATOM 277 OE2 GLU A 127 10.879 14.496 6.787 1.00 0.00 O ATOM 0 H GLU A 127 12.401 11.527 10.971 1.00 0.00 H new ATOM 0 HA GLU A 127 10.244 11.792 10.990 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.507 14.078 10.179 1.00 0.00 H new ATOM 0 HB3 GLU A 127 10.944 14.089 11.183 1.00 0.00 H new ATOM 0 HG2 GLU A 127 11.645 15.525 9.555 1.00 0.00 H new ATOM 0 HG3 GLU A 127 12.192 14.025 8.833 1.00 0.00 H new ATOM 284 N GLU A 128 10.054 10.562 8.415 1.00 0.00 N ATOM 285 CA GLU A 128 9.229 10.025 7.339 1.00 0.00 C ATOM 286 C GLU A 128 8.419 8.835 7.843 1.00 0.00 C ATOM 287 O GLU A 128 8.200 7.866 7.118 1.00 0.00 O ATOM 288 CB GLU A 128 10.061 9.644 6.105 1.00 0.00 C ATOM 289 CG GLU A 128 9.203 9.463 4.854 1.00 0.00 C ATOM 290 CD GLU A 128 9.899 9.865 3.570 1.00 0.00 C ATOM 291 OE1 GLU A 128 9.844 11.060 3.207 1.00 0.00 O ATOM 292 OE2 GLU A 128 10.477 8.984 2.908 1.00 0.00 O ATOM 0 H GLU A 128 10.832 9.968 8.702 1.00 0.00 H new ATOM 0 HA GLU A 128 8.543 10.811 7.023 1.00 0.00 H new ATOM 0 HB2 GLU A 128 10.807 10.417 5.921 1.00 0.00 H new ATOM 0 HB3 GLU A 128 10.603 8.720 6.307 1.00 0.00 H new ATOM 0 HG2 GLU A 128 8.901 8.418 4.780 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.292 10.052 4.962 1.00 0.00 H new ATOM 299 N SER A 129 7.979 8.941 9.099 1.00 0.00 N ATOM 300 CA SER A 129 7.167 7.916 9.760 1.00 0.00 C ATOM 301 C SER A 129 7.908 6.589 9.879 1.00 0.00 C ATOM 302 O SER A 129 8.348 6.013 8.894 1.00 0.00 O ATOM 303 CB SER A 129 5.841 7.724 9.029 1.00 0.00 C ATOM 304 OG SER A 129 5.251 8.981 8.722 1.00 0.00 O ATOM 0 H SER A 129 8.178 9.747 9.691 1.00 0.00 H new ATOM 0 HA SER A 129 6.964 8.268 10.771 1.00 0.00 H new ATOM 0 HB2 SER A 129 6.004 7.159 8.111 1.00 0.00 H new ATOM 0 HB3 SER A 129 5.161 7.138 9.647 1.00 0.00 H new ATOM 0 HG SER A 129 5.323 9.150 7.759 1.00 0.00 H new ATOM 310 N GLU A 130 8.019 6.088 11.092 1.00 0.00 N ATOM 311 CA GLU A 130 8.747 4.848 11.326 1.00 0.00 C ATOM 312 C GLU A 130 7.966 3.931 12.253 1.00 0.00 C ATOM 313 O GLU A 130 7.665 2.787 11.913 1.00 0.00 O ATOM 314 CB GLU A 130 10.114 5.174 11.926 1.00 0.00 C ATOM 315 CG GLU A 130 10.544 6.615 11.677 1.00 0.00 C ATOM 316 CD GLU A 130 11.252 6.801 10.339 1.00 0.00 C ATOM 317 OE1 GLU A 130 11.986 5.881 9.912 1.00 0.00 O ATOM 318 OE2 GLU A 130 11.070 7.864 9.707 1.00 0.00 O ATOM 0 H GLU A 130 7.619 6.513 11.929 1.00 0.00 H new ATOM 0 HA GLU A 130 8.881 4.328 10.377 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.087 4.989 13.000 1.00 0.00 H new ATOM 0 HB3 GLU A 130 10.860 4.500 11.505 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.667 7.261 11.711 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.207 6.935 12.481 1.00 0.00 H new ATOM 325 N ASN A 131 7.624 4.453 13.413 1.00 0.00 N ATOM 326 CA ASN A 131 6.872 3.709 14.414 1.00 0.00 C ATOM 327 C ASN A 131 5.556 4.415 14.693 1.00 0.00 C ATOM 328 O ASN A 131 5.164 4.596 15.843 1.00 0.00 O ATOM 329 CB ASN A 131 7.689 3.586 15.708 1.00 0.00 C ATOM 330 CG ASN A 131 8.498 4.839 16.032 1.00 0.00 C ATOM 331 OD1 ASN A 131 7.955 6.018 15.738 1.00 0.00 O flip ATOM 332 ND2 ASN A 131 9.609 4.747 16.551 1.00 0.00 N flip ATOM 0 H ASN A 131 7.858 5.406 13.693 1.00 0.00 H new ATOM 0 HA ASN A 131 6.668 2.708 14.035 1.00 0.00 H new ATOM 0 HB2 ASN A 131 7.014 3.373 16.537 1.00 0.00 H new ATOM 0 HB3 ASN A 131 8.366 2.736 15.622 1.00 0.00 H new ATOM 0 HD21 ASN A 131 9.998 3.828 16.764 1.00 0.00 H new ATOM 0 HD22 ASN A 131 10.142 5.589 16.768 1.00 0.00 H new ATOM 339 N ASP A 132 4.868 4.796 13.628 1.00 0.00 N ATOM 340 CA ASP A 132 3.624 5.534 13.748 1.00 0.00 C ATOM 341 C ASP A 132 2.718 5.284 12.561 1.00 0.00 C ATOM 342 O ASP A 132 2.532 6.145 11.700 1.00 0.00 O ATOM 343 CB ASP A 132 3.898 7.022 13.864 1.00 0.00 C ATOM 344 CG ASP A 132 5.346 7.400 13.580 1.00 0.00 C ATOM 345 OD1 ASP A 132 5.754 7.387 12.397 1.00 0.00 O ATOM 346 OD2 ASP A 132 6.076 7.722 14.529 1.00 0.00 O ATOM 0 H ASP A 132 5.153 4.604 12.668 1.00 0.00 H new ATOM 0 HA ASP A 132 3.123 5.184 14.650 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.249 7.557 13.171 1.00 0.00 H new ATOM 0 HB3 ASP A 132 3.635 7.354 14.868 1.00 0.00 H new ATOM 351 N TRP A 133 2.172 4.091 12.519 1.00 0.00 N ATOM 352 CA TRP A 133 1.276 3.686 11.450 1.00 0.00 C ATOM 353 C TRP A 133 0.102 2.907 12.014 1.00 0.00 C ATOM 354 O TRP A 133 0.262 2.149 12.970 1.00 0.00 O ATOM 355 CB TRP A 133 1.995 2.767 10.454 1.00 0.00 C ATOM 356 CG TRP A 133 3.396 3.149 10.073 1.00 0.00 C ATOM 357 CD1 TRP A 133 4.513 3.051 10.842 1.00 0.00 C ATOM 358 CD2 TRP A 133 3.833 3.631 8.805 1.00 0.00 C ATOM 359 NE1 TRP A 133 5.608 3.484 10.138 1.00 0.00 N ATOM 360 CE2 TRP A 133 5.217 3.846 8.890 1.00 0.00 C ATOM 361 CE3 TRP A 133 3.190 3.916 7.613 1.00 0.00 C ATOM 362 CZ2 TRP A 133 5.965 4.332 7.829 1.00 0.00 C ATOM 363 CZ3 TRP A 133 3.934 4.397 6.560 1.00 0.00 C ATOM 364 CH2 TRP A 133 5.308 4.603 6.672 1.00 0.00 C ATOM 0 H TRP A 133 2.334 3.371 13.223 1.00 0.00 H new ATOM 0 HA TRP A 133 0.936 4.594 10.951 1.00 0.00 H new ATOM 0 HB2 TRP A 133 2.019 1.762 10.875 1.00 0.00 H new ATOM 0 HB3 TRP A 133 1.397 2.717 9.544 1.00 0.00 H new ATOM 0 HD1 TRP A 133 4.535 2.686 11.858 1.00 0.00 H new ATOM 0 HE1 TRP A 133 6.562 3.527 10.495 1.00 0.00 H new ATOM 0 HE3 TRP A 133 2.126 3.764 7.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 7.030 4.489 7.919 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 3.442 4.620 5.625 1.00 0.00 H new ATOM 0 HH2 TRP A 133 5.859 4.984 5.825 1.00 0.00 H new ATOM 375 N GLU A 134 -1.071 3.107 11.432 1.00 0.00 N ATOM 376 CA GLU A 134 -2.239 2.346 11.810 1.00 0.00 C ATOM 377 C GLU A 134 -1.996 0.998 11.171 1.00 0.00 C ATOM 378 O GLU A 134 -2.160 0.830 9.963 1.00 0.00 O ATOM 379 CB GLU A 134 -3.529 2.982 11.279 1.00 0.00 C ATOM 380 CG GLU A 134 -3.553 4.501 11.379 1.00 0.00 C ATOM 381 CD GLU A 134 -4.699 5.121 10.605 1.00 0.00 C ATOM 382 OE1 GLU A 134 -5.839 5.097 11.106 1.00 0.00 O ATOM 383 OE2 GLU A 134 -4.454 5.646 9.495 1.00 0.00 O ATOM 0 H GLU A 134 -1.233 3.793 10.695 1.00 0.00 H new ATOM 0 HA GLU A 134 -2.373 2.294 12.890 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -3.662 2.694 10.236 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -4.377 2.578 11.832 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -3.629 4.791 12.427 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -2.610 4.900 11.006 1.00 0.00 H new ATOM 390 N GLU A 135 -1.537 0.065 11.969 1.00 0.00 N ATOM 391 CA GLU A 135 -1.148 -1.224 11.457 1.00 0.00 C ATOM 392 C GLU A 135 -2.292 -2.061 10.904 1.00 0.00 C ATOM 393 O GLU A 135 -3.185 -2.518 11.616 1.00 0.00 O ATOM 394 CB GLU A 135 -0.327 -1.965 12.505 1.00 0.00 C ATOM 395 CG GLU A 135 -0.871 -1.899 13.918 1.00 0.00 C ATOM 396 CD GLU A 135 0.242 -2.061 14.931 1.00 0.00 C ATOM 397 OE1 GLU A 135 1.172 -1.223 14.925 1.00 0.00 O ATOM 398 OE2 GLU A 135 0.226 -3.044 15.693 1.00 0.00 O ATOM 0 H GLU A 135 -1.424 0.175 12.977 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.526 -1.042 10.581 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.252 -3.012 12.211 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.685 -1.560 12.503 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.375 -0.945 14.074 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.617 -2.681 14.062 1.00 0.00 H new ATOM 405 N VAL A 136 -2.229 -2.210 9.587 1.00 0.00 N ATOM 406 CA VAL A 136 -3.161 -3.000 8.808 1.00 0.00 C ATOM 407 C VAL A 136 -2.668 -4.428 8.709 1.00 0.00 C ATOM 408 O VAL A 136 -1.476 -4.686 8.551 1.00 0.00 O ATOM 409 CB VAL A 136 -3.301 -2.454 7.381 1.00 0.00 C ATOM 410 CG1 VAL A 136 -4.269 -3.254 6.566 1.00 0.00 C ATOM 411 CG2 VAL A 136 -3.686 -1.011 7.408 1.00 0.00 C ATOM 0 H VAL A 136 -1.505 -1.770 9.019 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.127 -2.954 9.312 1.00 0.00 H new ATOM 0 HB VAL A 136 -2.328 -2.545 6.898 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -4.337 -2.832 5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -3.925 -4.286 6.503 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -5.251 -3.227 7.038 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -3.781 -0.641 6.387 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.639 -0.898 7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.920 -0.440 7.932 1.00 0.00 H new ATOM 421 N GLU A 137 -3.581 -5.345 8.792 1.00 0.00 N ATOM 422 CA GLU A 137 -3.237 -6.749 8.723 1.00 0.00 C ATOM 423 C GLU A 137 -3.943 -7.423 7.548 1.00 0.00 C ATOM 424 O GLU A 137 -4.985 -6.950 7.113 1.00 0.00 O ATOM 425 CB GLU A 137 -3.595 -7.442 10.027 1.00 0.00 C ATOM 426 CG GLU A 137 -3.371 -8.928 9.960 1.00 0.00 C ATOM 427 CD GLU A 137 -1.964 -9.335 10.346 1.00 0.00 C ATOM 428 OE1 GLU A 137 -1.006 -8.830 9.726 1.00 0.00 O ATOM 429 OE2 GLU A 137 -1.803 -10.177 11.251 1.00 0.00 O ATOM 0 H GLU A 137 -4.576 -5.155 8.908 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.162 -6.833 8.566 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -2.997 -7.022 10.836 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -4.640 -7.244 10.267 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -4.081 -9.426 10.620 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -3.579 -9.275 8.948 1.00 0.00 H new ATOM 436 N GLU A 138 -3.349 -8.503 7.028 1.00 0.00 N ATOM 437 CA GLU A 138 -3.918 -9.260 5.908 1.00 0.00 C ATOM 438 C GLU A 138 -5.424 -9.472 6.091 1.00 0.00 C ATOM 439 O GLU A 138 -5.882 -9.921 7.141 1.00 0.00 O ATOM 440 CB GLU A 138 -3.203 -10.608 5.746 1.00 0.00 C ATOM 441 CG GLU A 138 -2.339 -11.011 6.935 1.00 0.00 C ATOM 442 CD GLU A 138 -1.207 -11.943 6.543 1.00 0.00 C ATOM 443 OE1 GLU A 138 -1.067 -12.237 5.336 1.00 0.00 O ATOM 444 OE2 GLU A 138 -0.442 -12.376 7.436 1.00 0.00 O ATOM 0 H GLU A 138 -2.463 -8.876 7.370 1.00 0.00 H new ATOM 0 HA GLU A 138 -3.767 -8.675 5.000 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -3.950 -11.383 5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -2.577 -10.568 4.855 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -1.924 -10.116 7.398 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -2.963 -11.498 7.685 1.00 0.00 H new ATOM 451 N LEU A 139 -6.182 -9.149 5.054 1.00 0.00 N ATOM 452 CA LEU A 139 -7.630 -9.245 5.095 1.00 0.00 C ATOM 453 C LEU A 139 -8.168 -10.155 3.993 1.00 0.00 C ATOM 454 O LEU A 139 -7.766 -10.059 2.835 1.00 0.00 O ATOM 455 CB LEU A 139 -8.210 -7.833 4.973 1.00 0.00 C ATOM 456 CG LEU A 139 -9.418 -7.655 4.044 1.00 0.00 C ATOM 457 CD1 LEU A 139 -10.692 -8.169 4.703 1.00 0.00 C ATOM 458 CD2 LEU A 139 -9.581 -6.194 3.658 1.00 0.00 C ATOM 0 H LEU A 139 -5.811 -8.815 4.165 1.00 0.00 H new ATOM 0 HA LEU A 139 -7.934 -9.692 6.041 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.496 -7.497 5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -7.417 -7.169 4.629 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.238 -8.240 3.142 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -11.534 -8.031 4.024 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -10.581 -9.229 4.933 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -10.874 -7.615 5.624 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -10.442 -6.086 2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -9.734 -5.595 4.556 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -8.684 -5.852 3.142 1.00 0.00 H new ATOM 470 N SER A 140 -9.078 -11.038 4.368 1.00 0.00 N ATOM 471 CA SER A 140 -9.693 -11.957 3.422 1.00 0.00 C ATOM 472 C SER A 140 -11.186 -11.682 3.327 1.00 0.00 C ATOM 473 O SER A 140 -11.800 -11.219 4.290 1.00 0.00 O ATOM 474 CB SER A 140 -9.463 -13.404 3.851 1.00 0.00 C ATOM 475 OG SER A 140 -8.222 -13.541 4.523 1.00 0.00 O ATOM 0 H SER A 140 -9.410 -11.139 5.327 1.00 0.00 H new ATOM 0 HA SER A 140 -9.234 -11.805 2.445 1.00 0.00 H new ATOM 0 HB2 SER A 140 -10.273 -13.727 4.505 1.00 0.00 H new ATOM 0 HB3 SER A 140 -9.481 -14.054 2.976 1.00 0.00 H new ATOM 0 HG SER A 140 -8.096 -14.475 4.790 1.00 0.00 H new ATOM 481 N GLU A 141 -11.754 -11.954 2.163 1.00 0.00 N ATOM 482 CA GLU A 141 -13.173 -11.747 1.921 1.00 0.00 C ATOM 483 C GLU A 141 -14.029 -12.628 2.827 1.00 0.00 C ATOM 484 O GLU A 141 -13.952 -13.856 2.768 1.00 0.00 O ATOM 485 CB GLU A 141 -13.499 -12.053 0.461 1.00 0.00 C ATOM 486 CG GLU A 141 -13.041 -10.980 -0.515 1.00 0.00 C ATOM 487 CD GLU A 141 -11.541 -10.985 -0.736 1.00 0.00 C ATOM 488 OE1 GLU A 141 -10.882 -12.001 -0.418 1.00 0.00 O ATOM 489 OE2 GLU A 141 -11.005 -9.981 -1.241 1.00 0.00 O ATOM 0 H GLU A 141 -11.245 -12.324 1.360 1.00 0.00 H new ATOM 0 HA GLU A 141 -13.401 -10.705 2.143 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -13.035 -13.000 0.187 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -14.576 -12.185 0.360 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -13.544 -11.126 -1.471 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -13.345 -10.002 -0.141 1.00 0.00 H new ATOM 496 N PRO A 142 -14.850 -12.010 3.686 1.00 0.00 N ATOM 497 CA PRO A 142 -15.733 -12.731 4.590 1.00 0.00 C ATOM 498 C PRO A 142 -16.984 -13.214 3.874 1.00 0.00 C ATOM 499 O PRO A 142 -17.924 -12.450 3.649 1.00 0.00 O ATOM 500 CB PRO A 142 -16.098 -11.701 5.664 1.00 0.00 C ATOM 501 CG PRO A 142 -15.359 -10.446 5.309 1.00 0.00 C ATOM 502 CD PRO A 142 -14.980 -10.564 3.860 1.00 0.00 C ATOM 0 HA PRO A 142 -15.257 -13.622 5.000 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -17.174 -11.526 5.686 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -15.812 -12.054 6.655 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -15.984 -9.569 5.475 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -14.473 -10.329 5.933 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -15.743 -10.143 3.205 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -14.048 -10.043 3.640 1.00 0.00 H new ATOM 510 N VAL A 143 -16.981 -14.478 3.507 1.00 0.00 N ATOM 511 CA VAL A 143 -18.105 -15.074 2.805 1.00 0.00 C ATOM 512 C VAL A 143 -18.666 -16.249 3.591 1.00 0.00 C ATOM 513 O VAL A 143 -17.923 -16.981 4.247 1.00 0.00 O ATOM 514 CB VAL A 143 -17.715 -15.544 1.384 1.00 0.00 C ATOM 515 CG1 VAL A 143 -17.464 -14.349 0.475 1.00 0.00 C ATOM 516 CG2 VAL A 143 -16.491 -16.447 1.425 1.00 0.00 C ATOM 0 H VAL A 143 -16.208 -15.119 3.684 1.00 0.00 H new ATOM 0 HA VAL A 143 -18.867 -14.301 2.711 1.00 0.00 H new ATOM 0 HB VAL A 143 -18.548 -16.119 0.979 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -17.191 -14.700 -0.520 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -18.369 -13.744 0.411 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -16.653 -13.746 0.882 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -16.238 -16.763 0.413 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.651 -15.902 1.855 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -16.706 -17.324 2.036 1.00 0.00 H new ATOM 526 N LEU A 144 -19.977 -16.417 3.533 1.00 0.00 N ATOM 527 CA LEU A 144 -20.644 -17.499 4.237 1.00 0.00 C ATOM 528 C LEU A 144 -21.740 -18.089 3.363 1.00 0.00 C ATOM 529 O LEU A 144 -22.259 -17.416 2.472 1.00 0.00 O ATOM 530 CB LEU A 144 -21.238 -16.995 5.557 1.00 0.00 C ATOM 531 CG LEU A 144 -20.217 -16.657 6.646 1.00 0.00 C ATOM 532 CD1 LEU A 144 -20.886 -15.911 7.790 1.00 0.00 C ATOM 533 CD2 LEU A 144 -19.544 -17.923 7.156 1.00 0.00 C ATOM 0 H LEU A 144 -20.604 -15.813 3.001 1.00 0.00 H new ATOM 0 HA LEU A 144 -19.911 -18.274 4.461 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -21.834 -16.106 5.352 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -21.919 -17.753 5.943 1.00 0.00 H new ATOM 0 HG LEU A 144 -19.453 -16.011 6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -20.145 -15.679 8.555 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -21.323 -14.985 7.415 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -21.670 -16.533 8.221 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -18.821 -17.664 7.930 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -20.297 -18.593 7.572 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -19.032 -18.420 6.332 1.00 0.00 H new ATOM 545 N GLY A 145 -22.083 -19.342 3.615 1.00 0.00 N ATOM 546 CA GLY A 145 -23.114 -20.000 2.844 1.00 0.00 C ATOM 547 C GLY A 145 -23.500 -21.329 3.449 1.00 0.00 C ATOM 548 O GLY A 145 -23.041 -21.669 4.542 1.00 0.00 O ATOM 0 H GLY A 145 -21.662 -19.918 4.345 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -23.992 -19.357 2.787 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -22.764 -20.153 1.823 1.00 0.00 H new ATOM 552 N ASP A 146 -24.335 -22.079 2.747 1.00 0.00 N ATOM 553 CA ASP A 146 -24.778 -23.381 3.227 1.00 0.00 C ATOM 554 C ASP A 146 -23.708 -24.435 2.963 1.00 0.00 C ATOM 555 O ASP A 146 -23.617 -24.988 1.867 1.00 0.00 O ATOM 556 CB ASP A 146 -26.098 -23.783 2.560 1.00 0.00 C ATOM 557 CG ASP A 146 -26.663 -25.065 3.135 1.00 0.00 C ATOM 558 OD1 ASP A 146 -26.557 -25.264 4.362 1.00 0.00 O ATOM 559 OD2 ASP A 146 -27.195 -25.890 2.364 1.00 0.00 O ATOM 0 H ASP A 146 -24.721 -21.809 1.842 1.00 0.00 H new ATOM 0 HA ASP A 146 -24.944 -23.313 4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -26.825 -22.980 2.684 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -25.939 -23.907 1.489 1.00 0.00 H new ATOM 564 N VAL A 147 -22.880 -24.681 3.967 1.00 0.00 N ATOM 565 CA VAL A 147 -21.803 -25.655 3.860 1.00 0.00 C ATOM 566 C VAL A 147 -21.938 -26.729 4.933 1.00 0.00 C ATOM 567 O VAL A 147 -22.874 -26.701 5.738 1.00 0.00 O ATOM 568 CB VAL A 147 -20.419 -24.980 3.979 1.00 0.00 C ATOM 569 CG1 VAL A 147 -20.061 -24.257 2.690 1.00 0.00 C ATOM 570 CG2 VAL A 147 -20.387 -24.018 5.159 1.00 0.00 C ATOM 0 H VAL A 147 -22.934 -24.215 4.873 1.00 0.00 H new ATOM 0 HA VAL A 147 -21.881 -26.117 2.876 1.00 0.00 H new ATOM 0 HB VAL A 147 -19.676 -25.758 4.153 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -19.082 -23.789 2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -20.035 -24.972 1.867 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -20.809 -23.492 2.482 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -19.403 -23.554 5.224 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -21.144 -23.246 5.020 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -20.592 -24.565 6.080 1.00 0.00 H new ATOM 580 N ARG A 148 -21.011 -27.678 4.951 1.00 0.00 N ATOM 581 CA ARG A 148 -21.051 -28.759 5.932 1.00 0.00 C ATOM 582 C ARG A 148 -19.743 -28.826 6.710 1.00 0.00 C ATOM 583 O ARG A 148 -19.730 -28.803 7.940 1.00 0.00 O ATOM 584 CB ARG A 148 -21.301 -30.107 5.245 1.00 0.00 C ATOM 585 CG ARG A 148 -22.425 -30.088 4.220 1.00 0.00 C ATOM 586 CD ARG A 148 -23.780 -29.870 4.872 1.00 0.00 C ATOM 587 NE ARG A 148 -24.831 -29.642 3.880 1.00 0.00 N ATOM 588 CZ ARG A 148 -25.506 -28.496 3.764 1.00 0.00 C ATOM 589 NH1 ARG A 148 -25.253 -27.488 4.584 1.00 0.00 N ATOM 590 NH2 ARG A 148 -26.432 -28.356 2.824 1.00 0.00 N ATOM 0 H ARG A 148 -20.225 -27.723 4.302 1.00 0.00 H new ATOM 0 HA ARG A 148 -21.869 -28.552 6.621 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -20.382 -30.427 4.754 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -21.532 -30.852 6.006 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -22.240 -29.297 3.493 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -22.433 -31.030 3.672 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -24.035 -30.739 5.479 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -23.725 -29.015 5.546 1.00 0.00 H new ATOM 0 HE ARG A 148 -25.061 -30.402 3.240 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -24.540 -27.585 5.307 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.771 -26.614 4.492 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -26.631 -29.126 2.186 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -26.945 -27.478 2.740 1.00 0.00 H new ATOM 604 N GLU A 149 -18.652 -28.898 5.970 1.00 0.00 N ATOM 605 CA GLU A 149 -17.311 -28.988 6.533 1.00 0.00 C ATOM 606 C GLU A 149 -16.926 -27.728 7.316 1.00 0.00 C ATOM 607 O GLU A 149 -16.416 -27.820 8.434 1.00 0.00 O ATOM 608 CB GLU A 149 -16.286 -29.283 5.415 1.00 0.00 C ATOM 609 CG GLU A 149 -16.125 -28.188 4.352 1.00 0.00 C ATOM 610 CD GLU A 149 -17.441 -27.610 3.861 1.00 0.00 C ATOM 611 OE1 GLU A 149 -18.289 -28.380 3.363 1.00 0.00 O ATOM 612 OE2 GLU A 149 -17.653 -26.395 4.035 1.00 0.00 O ATOM 0 H GLU A 149 -18.669 -28.896 4.950 1.00 0.00 H new ATOM 0 HA GLU A 149 -17.304 -29.813 7.246 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -15.315 -29.461 5.876 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -16.576 -30.208 4.916 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -15.516 -27.383 4.763 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -15.579 -28.598 3.502 1.00 0.00 H new ATOM 619 N SER A 150 -17.188 -26.559 6.742 1.00 0.00 N ATOM 620 CA SER A 150 -16.857 -25.294 7.385 1.00 0.00 C ATOM 621 C SER A 150 -17.734 -25.048 8.610 1.00 0.00 C ATOM 622 O SER A 150 -17.322 -24.379 9.555 1.00 0.00 O ATOM 623 CB SER A 150 -17.006 -24.146 6.385 1.00 0.00 C ATOM 624 OG SER A 150 -16.307 -24.426 5.183 1.00 0.00 O ATOM 0 H SER A 150 -17.631 -26.462 5.828 1.00 0.00 H new ATOM 0 HA SER A 150 -15.822 -25.344 7.722 1.00 0.00 H new ATOM 0 HB2 SER A 150 -18.062 -23.984 6.167 1.00 0.00 H new ATOM 0 HB3 SER A 150 -16.626 -23.224 6.825 1.00 0.00 H new ATOM 0 HG SER A 150 -16.888 -24.931 4.577 1.00 0.00 H new ATOM 630 N THR A 151 -18.942 -25.596 8.589 1.00 0.00 N ATOM 631 CA THR A 151 -19.871 -25.441 9.697 1.00 0.00 C ATOM 632 C THR A 151 -19.494 -26.359 10.856 1.00 0.00 C ATOM 633 O THR A 151 -19.911 -26.150 11.997 1.00 0.00 O ATOM 634 CB THR A 151 -21.304 -25.754 9.242 1.00 0.00 C ATOM 635 OG1 THR A 151 -21.355 -25.746 7.810 1.00 0.00 O ATOM 636 CG2 THR A 151 -22.288 -24.735 9.797 1.00 0.00 C ATOM 0 H THR A 151 -19.301 -26.153 7.814 1.00 0.00 H new ATOM 0 HA THR A 151 -19.817 -24.406 10.036 1.00 0.00 H new ATOM 0 HB THR A 151 -21.584 -26.737 9.620 1.00 0.00 H new ATOM 0 HG1 THR A 151 -22.133 -26.260 7.507 1.00 0.00 H new ATOM 0 HG21 THR A 151 -23.295 -24.980 9.459 1.00 0.00 H new ATOM 0 HG22 THR A 151 -22.256 -24.754 10.886 1.00 0.00 H new ATOM 0 HG23 THR A 151 -22.019 -23.740 9.443 1.00 0.00 H new ATOM 644 N ALA A 152 -18.704 -27.381 10.555 1.00 0.00 N ATOM 645 CA ALA A 152 -18.271 -28.323 11.569 1.00 0.00 C ATOM 646 C ALA A 152 -16.917 -27.936 12.122 1.00 0.00 C ATOM 647 O ALA A 152 -16.797 -27.704 13.324 1.00 0.00 O ATOM 648 CB ALA A 152 -18.207 -29.734 11.012 1.00 0.00 C ATOM 0 H ALA A 152 -18.352 -27.576 9.618 1.00 0.00 H new ATOM 0 HA ALA A 152 -19.005 -28.295 12.374 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -17.880 -30.419 11.794 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -19.195 -30.031 10.659 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -17.501 -29.766 10.182 1.00 0.00 H new ATOM 654 N PHE A 153 -15.930 -27.843 11.209 1.00 0.00 N ATOM 655 CA PHE A 153 -14.513 -27.523 11.495 1.00 0.00 C ATOM 656 C PHE A 153 -13.901 -28.463 12.547 1.00 0.00 C ATOM 657 O PHE A 153 -12.924 -29.157 12.273 1.00 0.00 O ATOM 658 CB PHE A 153 -14.268 -26.025 11.830 1.00 0.00 C ATOM 659 CG PHE A 153 -15.112 -25.418 12.923 1.00 0.00 C ATOM 660 CD1 PHE A 153 -14.713 -25.488 14.249 1.00 0.00 C ATOM 661 CD2 PHE A 153 -16.298 -24.764 12.620 1.00 0.00 C ATOM 662 CE1 PHE A 153 -15.480 -24.923 15.249 1.00 0.00 C ATOM 663 CE2 PHE A 153 -17.070 -24.198 13.618 1.00 0.00 C ATOM 664 CZ PHE A 153 -16.660 -24.279 14.934 1.00 0.00 C ATOM 0 H PHE A 153 -16.102 -27.994 10.215 1.00 0.00 H new ATOM 0 HA PHE A 153 -13.982 -27.703 10.560 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -13.220 -25.907 12.107 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.424 -25.445 10.920 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -13.791 -25.990 14.503 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -16.622 -24.696 11.592 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -15.157 -24.985 16.278 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -17.992 -23.694 13.369 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.261 -23.839 15.716 1.00 0.00 H new ATOM 674 N SER A 154 -14.479 -28.483 13.727 1.00 0.00 N ATOM 675 CA SER A 154 -14.042 -29.333 14.815 1.00 0.00 C ATOM 676 C SER A 154 -15.211 -29.521 15.776 1.00 0.00 C ATOM 677 O SER A 154 -16.009 -30.449 15.624 1.00 0.00 O ATOM 678 CB SER A 154 -12.845 -28.717 15.536 1.00 0.00 C ATOM 679 OG SER A 154 -11.754 -28.522 14.653 1.00 0.00 O ATOM 0 H SER A 154 -15.281 -27.899 13.963 1.00 0.00 H new ATOM 0 HA SER A 154 -13.725 -30.300 14.424 1.00 0.00 H new ATOM 0 HB2 SER A 154 -13.135 -27.762 15.975 1.00 0.00 H new ATOM 0 HB3 SER A 154 -12.539 -29.366 16.357 1.00 0.00 H new ATOM 0 HG SER A 154 -11.004 -28.125 15.143 1.00 0.00 H new ATOM 685 N ARG A 155 -15.335 -28.612 16.739 1.00 0.00 N ATOM 686 CA ARG A 155 -16.424 -28.660 17.701 1.00 0.00 C ATOM 687 C ARG A 155 -16.402 -27.442 18.611 1.00 0.00 C ATOM 688 O ARG A 155 -15.435 -27.203 19.331 1.00 0.00 O ATOM 689 CB ARG A 155 -16.383 -29.940 18.542 1.00 0.00 C ATOM 690 CG ARG A 155 -17.679 -30.211 19.300 1.00 0.00 C ATOM 691 CD ARG A 155 -18.882 -30.286 18.363 1.00 0.00 C ATOM 692 NE ARG A 155 -19.438 -28.962 18.060 1.00 0.00 N ATOM 693 CZ ARG A 155 -19.665 -28.505 16.826 1.00 0.00 C ATOM 694 NH1 ARG A 155 -19.391 -29.261 15.768 1.00 0.00 N ATOM 695 NH2 ARG A 155 -20.144 -27.279 16.658 1.00 0.00 N ATOM 0 H ARG A 155 -14.691 -27.832 16.871 1.00 0.00 H new ATOM 0 HA ARG A 155 -17.353 -28.658 17.130 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -16.169 -30.787 17.890 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -15.562 -29.871 19.255 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -17.589 -31.148 19.850 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -17.841 -29.423 20.036 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -18.586 -30.774 17.434 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -19.655 -30.906 18.817 1.00 0.00 H new ATOM 0 HE ARG A 155 -19.666 -28.350 18.844 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -19.005 -30.196 15.896 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -19.567 -28.906 14.828 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -20.337 -26.691 17.469 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -20.319 -26.924 15.718 1.00 0.00 H new ATOM 709 N SER A 156 -17.472 -26.676 18.542 1.00 0.00 N ATOM 710 CA SER A 156 -17.648 -25.483 19.345 1.00 0.00 C ATOM 711 C SER A 156 -19.142 -25.238 19.497 1.00 0.00 C ATOM 712 O SER A 156 -19.919 -26.076 18.970 1.00 0.00 O ATOM 713 CB SER A 156 -16.966 -24.279 18.687 1.00 0.00 C ATOM 714 OG SER A 156 -15.586 -24.535 18.468 1.00 0.00 O ATOM 715 OXT SER A 156 -19.529 -24.240 20.125 1.00 0.00 O ATOM 0 H SER A 156 -18.255 -26.868 17.917 1.00 0.00 H new ATOM 0 HA SER A 156 -17.188 -25.620 20.324 1.00 0.00 H new ATOM 0 HB2 SER A 156 -17.453 -24.054 17.738 1.00 0.00 H new ATOM 0 HB3 SER A 156 -17.081 -23.400 19.321 1.00 0.00 H new ATOM 0 HG SER A 156 -15.171 -23.754 18.046 1.00 0.00 H new TER 721 SER A 156 ATOM 722 N MET B 1 1.760 -6.045 -19.224 1.00 0.00 N ATOM 723 CA MET B 1 1.130 -5.638 -20.500 1.00 0.00 C ATOM 724 C MET B 1 0.157 -6.706 -20.983 1.00 0.00 C ATOM 725 O MET B 1 0.558 -7.657 -21.656 1.00 0.00 O ATOM 726 CB MET B 1 2.198 -5.382 -21.569 1.00 0.00 C ATOM 727 CG MET B 1 2.923 -4.056 -21.405 1.00 0.00 C ATOM 728 SD MET B 1 3.773 -3.919 -19.820 1.00 0.00 S ATOM 729 CE MET B 1 4.601 -2.343 -20.008 1.00 0.00 C ATOM 0 H1 MET B 1 2.645 -5.516 -19.090 1.00 0.00 H new ATOM 0 H2 MET B 1 1.112 -5.841 -18.436 1.00 0.00 H new ATOM 0 H3 MET B 1 1.966 -7.064 -19.248 1.00 0.00 H new ATOM 0 HA MET B 1 0.578 -4.714 -20.326 1.00 0.00 H new ATOM 0 HB2 MET B 1 2.928 -6.191 -21.541 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.729 -5.410 -22.552 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.647 -3.940 -22.212 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.206 -3.240 -21.500 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.169 -2.121 -19.105 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.278 -2.387 -20.861 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.860 -1.560 -20.172 1.00 0.00 H new ATOM 739 N ALA B 2 -1.116 -6.545 -20.604 1.00 0.00 N ATOM 740 CA ALA B 2 -2.197 -7.465 -20.978 1.00 0.00 C ATOM 741 C ALA B 2 -2.102 -8.781 -20.210 1.00 0.00 C ATOM 742 O ALA B 2 -2.973 -9.102 -19.404 1.00 0.00 O ATOM 743 CB ALA B 2 -2.227 -7.710 -22.485 1.00 0.00 C ATOM 0 H ALA B 2 -1.428 -5.766 -20.024 1.00 0.00 H new ATOM 0 HA ALA B 2 -3.137 -6.987 -20.702 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -3.039 -8.396 -22.726 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -2.384 -6.765 -23.004 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -1.279 -8.145 -22.802 1.00 0.00 H new ATOM 749 N THR B 3 -1.051 -9.543 -20.466 1.00 0.00 N ATOM 750 CA THR B 3 -0.842 -10.809 -19.787 1.00 0.00 C ATOM 751 C THR B 3 0.645 -11.106 -19.663 1.00 0.00 C ATOM 752 O THR B 3 1.255 -11.702 -20.552 1.00 0.00 O ATOM 753 CB THR B 3 -1.543 -11.980 -20.506 1.00 0.00 C ATOM 754 OG1 THR B 3 -2.933 -11.679 -20.690 1.00 0.00 O ATOM 755 CG2 THR B 3 -1.397 -13.268 -19.703 1.00 0.00 C ATOM 0 H THR B 3 -0.326 -9.304 -21.143 1.00 0.00 H new ATOM 0 HA THR B 3 -1.283 -10.713 -18.795 1.00 0.00 H new ATOM 0 HB THR B 3 -1.071 -12.120 -21.479 1.00 0.00 H new ATOM 0 HG1 THR B 3 -3.372 -12.426 -21.148 1.00 0.00 H new ATOM 0 HG21 THR B 3 -1.898 -14.082 -20.227 1.00 0.00 H new ATOM 0 HG22 THR B 3 -0.340 -13.507 -19.588 1.00 0.00 H new ATOM 0 HG23 THR B 3 -1.849 -13.137 -18.720 1.00 0.00 H new ATOM 763 N SER B 4 1.229 -10.655 -18.571 1.00 0.00 N ATOM 764 CA SER B 4 2.638 -10.869 -18.314 1.00 0.00 C ATOM 765 C SER B 4 2.878 -10.938 -16.815 1.00 0.00 C ATOM 766 O SER B 4 2.017 -10.542 -16.030 1.00 0.00 O ATOM 767 CB SER B 4 3.461 -9.740 -18.939 1.00 0.00 C ATOM 768 OG SER B 4 2.704 -8.542 -19.007 1.00 0.00 O ATOM 0 H SER B 4 0.744 -10.133 -17.841 1.00 0.00 H new ATOM 0 HA SER B 4 2.949 -11.812 -18.764 1.00 0.00 H new ATOM 0 HB2 SER B 4 4.363 -9.573 -18.350 1.00 0.00 H new ATOM 0 HB3 SER B 4 3.783 -10.029 -19.939 1.00 0.00 H new ATOM 0 HG SER B 4 2.127 -8.475 -18.218 1.00 0.00 H new ATOM 774 N SER B 5 4.037 -11.438 -16.418 1.00 0.00 N ATOM 775 CA SER B 5 4.381 -11.544 -15.009 1.00 0.00 C ATOM 776 C SER B 5 4.858 -10.192 -14.477 1.00 0.00 C ATOM 777 O SER B 5 5.916 -10.083 -13.854 1.00 0.00 O ATOM 778 CB SER B 5 5.455 -12.615 -14.836 1.00 0.00 C ATOM 779 OG SER B 5 6.399 -12.555 -15.895 1.00 0.00 O ATOM 0 H SER B 5 4.758 -11.778 -17.054 1.00 0.00 H new ATOM 0 HA SER B 5 3.500 -11.833 -14.435 1.00 0.00 H new ATOM 0 HB2 SER B 5 5.963 -12.477 -13.881 1.00 0.00 H new ATOM 0 HB3 SER B 5 4.991 -13.601 -14.811 1.00 0.00 H new ATOM 0 HG SER B 5 7.080 -13.248 -15.766 1.00 0.00 H new ATOM 785 N GLU B 6 4.057 -9.172 -14.746 1.00 0.00 N ATOM 786 CA GLU B 6 4.336 -7.806 -14.340 1.00 0.00 C ATOM 787 C GLU B 6 3.108 -6.957 -14.648 1.00 0.00 C ATOM 788 O GLU B 6 3.207 -5.838 -15.154 1.00 0.00 O ATOM 789 CB GLU B 6 5.571 -7.267 -15.079 1.00 0.00 C ATOM 790 CG GLU B 6 6.206 -6.054 -14.416 1.00 0.00 C ATOM 791 CD GLU B 6 7.690 -5.939 -14.702 1.00 0.00 C ATOM 792 OE1 GLU B 6 8.487 -6.543 -13.951 1.00 0.00 O ATOM 793 OE2 GLU B 6 8.065 -5.236 -15.665 1.00 0.00 O ATOM 0 H GLU B 6 3.182 -9.273 -15.260 1.00 0.00 H new ATOM 0 HA GLU B 6 4.551 -7.769 -13.272 1.00 0.00 H new ATOM 0 HB2 GLU B 6 6.315 -8.061 -15.150 1.00 0.00 H new ATOM 0 HB3 GLU B 6 5.287 -7.004 -16.098 1.00 0.00 H new ATOM 0 HG2 GLU B 6 5.703 -5.151 -14.762 1.00 0.00 H new ATOM 0 HG3 GLU B 6 6.052 -6.112 -13.339 1.00 0.00 H new ATOM 800 N GLU B 7 1.942 -7.508 -14.343 1.00 0.00 N ATOM 801 CA GLU B 7 0.689 -6.820 -14.603 1.00 0.00 C ATOM 802 C GLU B 7 0.336 -5.903 -13.442 1.00 0.00 C ATOM 803 O GLU B 7 -0.104 -6.356 -12.389 1.00 0.00 O ATOM 804 CB GLU B 7 -0.430 -7.837 -14.842 1.00 0.00 C ATOM 805 CG GLU B 7 -1.223 -7.580 -16.114 1.00 0.00 C ATOM 806 CD GLU B 7 -0.338 -7.228 -17.291 1.00 0.00 C ATOM 807 OE1 GLU B 7 0.419 -8.103 -17.765 1.00 0.00 O ATOM 808 OE2 GLU B 7 -0.384 -6.066 -17.751 1.00 0.00 O ATOM 0 H GLU B 7 1.839 -8.428 -13.916 1.00 0.00 H new ATOM 0 HA GLU B 7 0.804 -6.210 -15.499 1.00 0.00 H new ATOM 0 HB2 GLU B 7 0.002 -8.836 -14.889 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -1.110 -7.823 -13.990 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -1.809 -8.466 -16.357 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -1.929 -6.768 -15.940 1.00 0.00 H new ATOM 815 N VAL B 8 0.537 -4.612 -13.647 1.00 0.00 N ATOM 816 CA VAL B 8 0.252 -3.615 -12.633 1.00 0.00 C ATOM 817 C VAL B 8 -1.237 -3.298 -12.574 1.00 0.00 C ATOM 818 O VAL B 8 -1.806 -2.746 -13.514 1.00 0.00 O ATOM 819 CB VAL B 8 1.035 -2.310 -12.888 1.00 0.00 C ATOM 820 CG1 VAL B 8 0.964 -1.403 -11.672 1.00 0.00 C ATOM 821 CG2 VAL B 8 2.482 -2.611 -13.251 1.00 0.00 C ATOM 0 H VAL B 8 0.901 -4.228 -14.519 1.00 0.00 H new ATOM 0 HA VAL B 8 0.568 -4.038 -11.679 1.00 0.00 H new ATOM 0 HB VAL B 8 0.576 -1.793 -13.731 1.00 0.00 H new ATOM 0 HG11 VAL B 8 1.521 -0.487 -11.868 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.077 -1.157 -11.462 1.00 0.00 H new ATOM 0 HG13 VAL B 8 1.397 -1.914 -10.812 1.00 0.00 H new ATOM 0 HG21 VAL B 8 3.015 -1.677 -13.426 1.00 0.00 H new ATOM 0 HG22 VAL B 8 2.957 -3.152 -12.433 1.00 0.00 H new ATOM 0 HG23 VAL B 8 2.511 -3.221 -14.154 1.00 0.00 H new ATOM 831 N LEU B 9 -1.851 -3.656 -11.460 1.00 0.00 N ATOM 832 CA LEU B 9 -3.266 -3.418 -11.236 1.00 0.00 C ATOM 833 C LEU B 9 -3.487 -1.989 -10.761 1.00 0.00 C ATOM 834 O LEU B 9 -4.416 -1.308 -11.194 1.00 0.00 O ATOM 835 CB LEU B 9 -3.798 -4.387 -10.181 1.00 0.00 C ATOM 836 CG LEU B 9 -3.684 -5.873 -10.529 1.00 0.00 C ATOM 837 CD1 LEU B 9 -4.095 -6.728 -9.340 1.00 0.00 C ATOM 838 CD2 LEU B 9 -4.534 -6.208 -11.744 1.00 0.00 C ATOM 0 H LEU B 9 -1.381 -4.121 -10.683 1.00 0.00 H new ATOM 0 HA LEU B 9 -3.798 -3.574 -12.174 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -3.264 -4.209 -9.248 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -4.847 -4.155 -9.997 1.00 0.00 H new ATOM 0 HG LEU B 9 -2.643 -6.090 -10.771 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.009 -7.782 -9.603 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -3.444 -6.511 -8.493 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -5.127 -6.505 -9.071 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -4.438 -7.269 -11.974 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -5.578 -5.975 -11.533 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -4.196 -5.620 -12.598 1.00 0.00 H new ATOM 850 N LEU B 10 -2.622 -1.544 -9.861 1.00 0.00 N ATOM 851 CA LEU B 10 -2.720 -0.198 -9.311 1.00 0.00 C ATOM 852 C LEU B 10 -1.427 0.577 -9.516 1.00 0.00 C ATOM 853 O LEU B 10 -0.365 0.166 -9.055 1.00 0.00 O ATOM 854 CB LEU B 10 -3.077 -0.242 -7.826 1.00 0.00 C ATOM 855 CG LEU B 10 -3.778 1.015 -7.307 1.00 0.00 C ATOM 856 CD1 LEU B 10 -5.163 1.147 -7.920 1.00 0.00 C ATOM 857 CD2 LEU B 10 -3.871 0.993 -5.789 1.00 0.00 C ATOM 0 H LEU B 10 -1.845 -2.094 -9.496 1.00 0.00 H new ATOM 0 HA LEU B 10 -3.517 0.318 -9.847 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.720 -1.103 -7.645 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -2.165 -0.399 -7.250 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.184 1.880 -7.602 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -5.645 2.047 -7.539 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -5.076 1.214 -9.004 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.762 0.275 -7.657 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.373 1.896 -5.442 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.438 0.118 -5.472 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.868 0.949 -5.364 1.00 0.00 H new ATOM 869 N ILE B 11 -1.525 1.701 -10.213 1.00 0.00 N ATOM 870 CA ILE B 11 -0.365 2.540 -10.481 1.00 0.00 C ATOM 871 C ILE B 11 -0.395 3.790 -9.613 1.00 0.00 C ATOM 872 O ILE B 11 -1.215 4.682 -9.822 1.00 0.00 O ATOM 873 CB ILE B 11 -0.291 2.955 -11.971 1.00 0.00 C ATOM 874 CG1 ILE B 11 -0.126 1.718 -12.858 1.00 0.00 C ATOM 875 CG2 ILE B 11 0.852 3.938 -12.199 1.00 0.00 C ATOM 876 CD1 ILE B 11 0.008 2.035 -14.332 1.00 0.00 C ATOM 0 H ILE B 11 -2.399 2.054 -10.604 1.00 0.00 H new ATOM 0 HA ILE B 11 0.519 1.949 -10.242 1.00 0.00 H new ATOM 0 HB ILE B 11 -1.223 3.452 -12.240 1.00 0.00 H new ATOM 0 HG12 ILE B 11 0.756 1.165 -12.534 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -0.985 1.062 -12.714 1.00 0.00 H new ATOM 0 HG21 ILE B 11 0.887 4.217 -13.252 1.00 0.00 H new ATOM 0 HG22 ILE B 11 0.692 4.829 -11.592 1.00 0.00 H new ATOM 0 HG23 ILE B 11 1.795 3.471 -11.916 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.121 1.108 -14.895 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.884 2.560 -14.674 1.00 0.00 H new ATOM 0 HD13 ILE B 11 0.883 2.665 -14.491 1.00 0.00 H new ATOM 888 N VAL B 12 0.493 3.834 -8.634 1.00 0.00 N ATOM 889 CA VAL B 12 0.595 4.967 -7.732 1.00 0.00 C ATOM 890 C VAL B 12 1.803 5.814 -8.109 1.00 0.00 C ATOM 891 O VAL B 12 2.880 5.285 -8.399 1.00 0.00 O ATOM 892 CB VAL B 12 0.710 4.499 -6.267 1.00 0.00 C ATOM 893 CG1 VAL B 12 0.904 5.674 -5.322 1.00 0.00 C ATOM 894 CG2 VAL B 12 -0.520 3.698 -5.879 1.00 0.00 C ATOM 0 H VAL B 12 1.161 3.087 -8.443 1.00 0.00 H new ATOM 0 HA VAL B 12 -0.311 5.566 -7.824 1.00 0.00 H new ATOM 0 HB VAL B 12 1.590 3.861 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL B 12 0.981 5.308 -4.298 1.00 0.00 H new ATOM 0 HG12 VAL B 12 1.817 6.207 -5.587 1.00 0.00 H new ATOM 0 HG13 VAL B 12 0.053 6.350 -5.403 1.00 0.00 H new ATOM 0 HG21 VAL B 12 -0.430 3.372 -4.843 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -1.408 4.320 -5.988 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.606 2.826 -6.528 1.00 0.00 H new ATOM 904 N LYS B 13 1.624 7.120 -8.115 1.00 0.00 N ATOM 905 CA LYS B 13 2.696 8.030 -8.485 1.00 0.00 C ATOM 906 C LYS B 13 3.406 8.601 -7.262 1.00 0.00 C ATOM 907 O LYS B 13 3.063 8.268 -6.131 1.00 0.00 O ATOM 908 CB LYS B 13 2.152 9.159 -9.364 1.00 0.00 C ATOM 909 CG LYS B 13 1.789 8.718 -10.778 1.00 0.00 C ATOM 910 CD LYS B 13 3.025 8.491 -11.641 1.00 0.00 C ATOM 911 CE LYS B 13 3.592 7.087 -11.472 1.00 0.00 C ATOM 912 NZ LYS B 13 4.922 6.942 -12.121 1.00 0.00 N ATOM 0 H LYS B 13 0.747 7.578 -7.868 1.00 0.00 H new ATOM 0 HA LYS B 13 3.432 7.459 -9.051 1.00 0.00 H new ATOM 0 HB2 LYS B 13 1.268 9.584 -8.888 1.00 0.00 H new ATOM 0 HB3 LYS B 13 2.896 9.953 -9.421 1.00 0.00 H new ATOM 0 HG2 LYS B 13 1.205 7.799 -10.732 1.00 0.00 H new ATOM 0 HG3 LYS B 13 1.157 9.475 -11.243 1.00 0.00 H new ATOM 0 HD2 LYS B 13 2.771 8.655 -12.688 1.00 0.00 H new ATOM 0 HD3 LYS B 13 3.789 9.224 -11.380 1.00 0.00 H new ATOM 0 HE2 LYS B 13 3.680 6.857 -10.410 1.00 0.00 H new ATOM 0 HE3 LYS B 13 2.899 6.362 -11.899 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 5.226 5.949 -12.071 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 4.856 7.234 -13.117 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 5.615 7.541 -11.629 1.00 0.00 H new ATOM 926 N LYS B 14 4.366 9.491 -7.541 1.00 0.00 N ATOM 927 CA LYS B 14 5.213 10.172 -6.553 1.00 0.00 C ATOM 928 C LYS B 14 5.217 9.538 -5.158 1.00 0.00 C ATOM 929 O LYS B 14 4.577 10.032 -4.231 1.00 0.00 O ATOM 930 CB LYS B 14 4.760 11.624 -6.444 1.00 0.00 C ATOM 931 CG LYS B 14 5.006 12.450 -7.694 1.00 0.00 C ATOM 932 CD LYS B 14 4.600 13.901 -7.484 1.00 0.00 C ATOM 933 CE LYS B 14 3.895 14.470 -8.706 1.00 0.00 C ATOM 934 NZ LYS B 14 2.420 14.274 -8.643 1.00 0.00 N ATOM 0 H LYS B 14 4.583 9.768 -8.499 1.00 0.00 H new ATOM 0 HA LYS B 14 6.237 10.084 -6.916 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.695 11.644 -6.213 1.00 0.00 H new ATOM 0 HB3 LYS B 14 5.277 12.092 -5.606 1.00 0.00 H new ATOM 0 HG2 LYS B 14 6.061 12.400 -7.964 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.443 12.029 -8.527 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.942 13.973 -6.618 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.485 14.498 -7.263 1.00 0.00 H new ATOM 0 HE2 LYS B 14 4.116 15.534 -8.789 1.00 0.00 H new ATOM 0 HE3 LYS B 14 4.286 13.993 -9.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 2.078 13.919 -9.559 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 2.193 13.585 -7.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 1.958 15.181 -8.429 1.00 0.00 H new ATOM 948 N VAL B 15 5.964 8.454 -5.018 1.00 0.00 N ATOM 949 CA VAL B 15 6.100 7.761 -3.746 1.00 0.00 C ATOM 950 C VAL B 15 7.563 7.774 -3.330 1.00 0.00 C ATOM 951 O VAL B 15 8.424 7.275 -4.052 1.00 0.00 O ATOM 952 CB VAL B 15 5.607 6.296 -3.815 1.00 0.00 C ATOM 953 CG1 VAL B 15 5.972 5.539 -2.544 1.00 0.00 C ATOM 954 CG2 VAL B 15 4.109 6.242 -4.042 1.00 0.00 C ATOM 0 H VAL B 15 6.492 8.030 -5.781 1.00 0.00 H new ATOM 0 HA VAL B 15 5.479 8.283 -3.017 1.00 0.00 H new ATOM 0 HB VAL B 15 6.104 5.817 -4.658 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.615 4.512 -2.617 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.055 5.538 -2.419 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.508 6.024 -1.685 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.785 5.202 -4.087 1.00 0.00 H new ATOM 0 HG22 VAL B 15 3.598 6.746 -3.221 1.00 0.00 H new ATOM 0 HG23 VAL B 15 3.865 6.739 -4.981 1.00 0.00 H new ATOM 964 N ARG B 16 7.850 8.350 -2.183 1.00 0.00 N ATOM 965 CA ARG B 16 9.212 8.425 -1.704 1.00 0.00 C ATOM 966 C ARG B 16 9.436 7.436 -0.577 1.00 0.00 C ATOM 967 O ARG B 16 8.700 7.424 0.401 1.00 0.00 O ATOM 968 CB ARG B 16 9.536 9.844 -1.233 1.00 0.00 C ATOM 969 CG ARG B 16 9.534 10.868 -2.358 1.00 0.00 C ATOM 970 CD ARG B 16 9.948 12.245 -1.867 1.00 0.00 C ATOM 971 NE ARG B 16 11.377 12.314 -1.563 1.00 0.00 N ATOM 972 CZ ARG B 16 11.967 13.352 -0.973 1.00 0.00 C ATOM 973 NH1 ARG B 16 11.259 14.426 -0.646 1.00 0.00 N ATOM 974 NH2 ARG B 16 13.270 13.321 -0.723 1.00 0.00 N ATOM 0 H ARG B 16 7.158 8.773 -1.565 1.00 0.00 H new ATOM 0 HA ARG B 16 9.879 8.169 -2.528 1.00 0.00 H new ATOM 0 HB2 ARG B 16 8.809 10.143 -0.478 1.00 0.00 H new ATOM 0 HB3 ARG B 16 10.514 9.845 -0.752 1.00 0.00 H new ATOM 0 HG2 ARG B 16 10.213 10.544 -3.146 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.538 10.923 -2.798 1.00 0.00 H new ATOM 0 HD2 ARG B 16 9.703 12.989 -2.625 1.00 0.00 H new ATOM 0 HD3 ARG B 16 9.375 12.499 -0.975 1.00 0.00 H new ATOM 0 HE ARG B 16 11.959 11.516 -1.819 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.259 14.458 -0.846 1.00 0.00 H new ATOM 0 HH12 ARG B 16 11.714 15.219 -0.194 1.00 0.00 H new ATOM 0 HH21 ARG B 16 13.820 12.502 -0.983 1.00 0.00 H new ATOM 0 HH22 ARG B 16 13.722 14.116 -0.271 1.00 0.00 H new ATOM 988 N GLN B 17 10.425 6.578 -0.723 1.00 0.00 N ATOM 989 CA GLN B 17 10.720 5.624 0.324 1.00 0.00 C ATOM 990 C GLN B 17 11.990 6.050 1.047 1.00 0.00 C ATOM 991 O GLN B 17 13.098 5.919 0.529 1.00 0.00 O ATOM 992 CB GLN B 17 10.807 4.188 -0.224 1.00 0.00 C ATOM 993 CG GLN B 17 11.955 3.917 -1.178 1.00 0.00 C ATOM 994 CD GLN B 17 12.797 2.736 -0.733 1.00 0.00 C ATOM 995 OE1 GLN B 17 12.177 1.789 -0.040 1.00 0.00 O flip ATOM 996 NE2 GLN B 17 13.992 2.673 -1.003 1.00 0.00 N flip ATOM 0 H GLN B 17 11.029 6.522 -1.543 1.00 0.00 H new ATOM 0 HA GLN B 17 9.902 5.616 1.044 1.00 0.00 H new ATOM 0 HB2 GLN B 17 10.889 3.501 0.619 1.00 0.00 H new ATOM 0 HB3 GLN B 17 9.872 3.956 -0.734 1.00 0.00 H new ATOM 0 HG2 GLN B 17 11.560 3.725 -2.176 1.00 0.00 H new ATOM 0 HG3 GLN B 17 12.584 4.804 -1.250 1.00 0.00 H new ATOM 0 HE21 GLN B 17 14.434 3.421 -1.538 1.00 0.00 H new ATOM 0 HE22 GLN B 17 14.544 1.873 -0.693 1.00 0.00 H new ATOM 1005 N LYS B 18 11.801 6.619 2.232 1.00 0.00 N ATOM 1006 CA LYS B 18 12.899 7.110 3.059 1.00 0.00 C ATOM 1007 C LYS B 18 13.654 8.216 2.319 1.00 0.00 C ATOM 1008 O LYS B 18 14.878 8.190 2.203 1.00 0.00 O ATOM 1009 CB LYS B 18 13.831 5.969 3.483 1.00 0.00 C ATOM 1010 CG LYS B 18 13.149 4.933 4.374 1.00 0.00 C ATOM 1011 CD LYS B 18 13.611 5.020 5.826 1.00 0.00 C ATOM 1012 CE LYS B 18 13.054 6.246 6.543 1.00 0.00 C ATOM 1013 NZ LYS B 18 13.644 6.413 7.903 1.00 0.00 N ATOM 0 H LYS B 18 10.880 6.754 2.648 1.00 0.00 H new ATOM 0 HA LYS B 18 12.486 7.533 3.975 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.217 5.474 2.592 1.00 0.00 H new ATOM 0 HB3 LYS B 18 14.688 6.386 4.012 1.00 0.00 H new ATOM 0 HG2 LYS B 18 12.069 5.075 4.330 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.356 3.934 3.989 1.00 0.00 H new ATOM 0 HD2 LYS B 18 13.301 4.120 6.357 1.00 0.00 H new ATOM 0 HD3 LYS B 18 14.700 5.049 5.856 1.00 0.00 H new ATOM 0 HE2 LYS B 18 13.256 7.137 5.948 1.00 0.00 H new ATOM 0 HE3 LYS B 18 11.971 6.157 6.626 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 13.968 7.394 8.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 12.925 6.195 8.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 14.451 5.766 8.013 1.00 0.00 H new ATOM 1027 N LYS B 19 12.871 9.171 1.805 1.00 0.00 N ATOM 1028 CA LYS B 19 13.367 10.343 1.078 1.00 0.00 C ATOM 1029 C LYS B 19 13.862 10.010 -0.333 1.00 0.00 C ATOM 1030 O LYS B 19 14.474 10.851 -0.990 1.00 0.00 O ATOM 1031 CB LYS B 19 14.460 11.075 1.873 1.00 0.00 C ATOM 1032 CG LYS B 19 13.911 12.059 2.900 1.00 0.00 C ATOM 1033 CD LYS B 19 13.400 11.349 4.144 1.00 0.00 C ATOM 1034 CE LYS B 19 12.334 12.161 4.865 1.00 0.00 C ATOM 1035 NZ LYS B 19 12.880 13.399 5.478 1.00 0.00 N ATOM 0 H LYS B 19 11.854 9.150 1.885 1.00 0.00 H new ATOM 0 HA LYS B 19 12.511 11.008 0.965 1.00 0.00 H new ATOM 0 HB2 LYS B 19 15.081 10.339 2.383 1.00 0.00 H new ATOM 0 HB3 LYS B 19 15.106 11.611 1.178 1.00 0.00 H new ATOM 0 HG2 LYS B 19 14.692 12.766 3.180 1.00 0.00 H new ATOM 0 HG3 LYS B 19 13.102 12.637 2.453 1.00 0.00 H new ATOM 0 HD2 LYS B 19 12.990 10.378 3.865 1.00 0.00 H new ATOM 0 HD3 LYS B 19 14.233 11.160 4.822 1.00 0.00 H new ATOM 0 HE2 LYS B 19 11.545 12.425 4.161 1.00 0.00 H new ATOM 0 HE3 LYS B 19 11.876 11.547 5.640 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 12.096 14.006 5.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 13.474 13.149 6.295 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 13.453 13.910 4.777 1.00 0.00 H new ATOM 1049 N GLN B 20 13.554 8.817 -0.822 1.00 0.00 N ATOM 1050 CA GLN B 20 13.978 8.421 -2.164 1.00 0.00 C ATOM 1051 C GLN B 20 12.807 8.538 -3.137 1.00 0.00 C ATOM 1052 O GLN B 20 11.742 7.986 -2.888 1.00 0.00 O ATOM 1053 CB GLN B 20 14.528 6.994 -2.153 1.00 0.00 C ATOM 1054 CG GLN B 20 15.161 6.581 -3.470 1.00 0.00 C ATOM 1055 CD GLN B 20 16.015 5.331 -3.352 1.00 0.00 C ATOM 1056 OE1 GLN B 20 15.665 4.453 -2.426 1.00 0.00 O flip ATOM 1057 NE2 GLN B 20 16.983 5.156 -4.089 1.00 0.00 N flip ATOM 0 H GLN B 20 13.018 8.111 -0.318 1.00 0.00 H new ATOM 0 HA GLN B 20 14.774 9.089 -2.493 1.00 0.00 H new ATOM 0 HB2 GLN B 20 15.269 6.904 -1.359 1.00 0.00 H new ATOM 0 HB3 GLN B 20 13.720 6.303 -1.915 1.00 0.00 H new ATOM 0 HG2 GLN B 20 14.376 6.410 -4.206 1.00 0.00 H new ATOM 0 HG3 GLN B 20 15.775 7.400 -3.844 1.00 0.00 H new ATOM 0 HE21 GLN B 20 17.222 5.856 -4.792 1.00 0.00 H new ATOM 0 HE22 GLN B 20 17.547 4.311 -3.998 1.00 0.00 H new ATOM 1066 N ASP B 21 13.011 9.256 -4.242 1.00 0.00 N ATOM 1067 CA ASP B 21 11.952 9.468 -5.233 1.00 0.00 C ATOM 1068 C ASP B 21 11.563 8.169 -5.925 1.00 0.00 C ATOM 1069 O ASP B 21 12.421 7.355 -6.267 1.00 0.00 O ATOM 1070 CB ASP B 21 12.375 10.514 -6.285 1.00 0.00 C ATOM 1071 CG ASP B 21 13.081 9.919 -7.505 1.00 0.00 C ATOM 1072 OD1 ASP B 21 12.388 9.465 -8.443 1.00 0.00 O ATOM 1073 OD2 ASP B 21 14.325 9.921 -7.541 1.00 0.00 O ATOM 0 H ASP B 21 13.899 9.701 -4.474 1.00 0.00 H new ATOM 0 HA ASP B 21 11.083 9.843 -4.693 1.00 0.00 H new ATOM 0 HB2 ASP B 21 11.491 11.057 -6.619 1.00 0.00 H new ATOM 0 HB3 ASP B 21 13.036 11.241 -5.814 1.00 0.00 H new ATOM 1078 N GLY B 22 10.264 7.953 -6.090 1.00 0.00 N ATOM 1079 CA GLY B 22 9.802 6.774 -6.767 1.00 0.00 C ATOM 1080 C GLY B 22 8.317 6.793 -7.034 1.00 0.00 C ATOM 1081 O GLY B 22 7.661 7.822 -6.901 1.00 0.00 O ATOM 0 H GLY B 22 9.527 8.579 -5.764 1.00 0.00 H new ATOM 0 HA2 GLY B 22 10.335 6.672 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY B 22 10.047 5.897 -6.167 1.00 0.00 H new ATOM 1085 N ALA B 23 7.816 5.651 -7.439 1.00 0.00 N ATOM 1086 CA ALA B 23 6.415 5.444 -7.720 1.00 0.00 C ATOM 1087 C ALA B 23 6.072 4.037 -7.276 1.00 0.00 C ATOM 1088 O ALA B 23 6.875 3.119 -7.455 1.00 0.00 O ATOM 1089 CB ALA B 23 6.127 5.646 -9.197 1.00 0.00 C ATOM 0 H ALA B 23 8.386 4.818 -7.586 1.00 0.00 H new ATOM 0 HA ALA B 23 5.801 6.167 -7.183 1.00 0.00 H new ATOM 0 HB1 ALA B 23 5.066 5.485 -9.386 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.397 6.662 -9.485 1.00 0.00 H new ATOM 0 HB3 ALA B 23 6.711 4.936 -9.782 1.00 0.00 H new ATOM 1095 N LEU B 24 4.901 3.854 -6.709 1.00 0.00 N ATOM 1096 CA LEU B 24 4.523 2.553 -6.196 1.00 0.00 C ATOM 1097 C LEU B 24 3.554 1.860 -7.160 1.00 0.00 C ATOM 1098 O LEU B 24 2.485 2.380 -7.463 1.00 0.00 O ATOM 1099 CB LEU B 24 3.903 2.735 -4.811 1.00 0.00 C ATOM 1100 CG LEU B 24 4.125 1.588 -3.821 1.00 0.00 C ATOM 1101 CD1 LEU B 24 3.019 1.554 -2.781 1.00 0.00 C ATOM 1102 CD2 LEU B 24 4.240 0.253 -4.530 1.00 0.00 C ATOM 0 H LEU B 24 4.197 4.583 -6.591 1.00 0.00 H new ATOM 0 HA LEU B 24 5.402 1.914 -6.109 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.303 3.649 -4.373 1.00 0.00 H new ATOM 0 HB3 LEU B 24 2.830 2.882 -4.931 1.00 0.00 H new ATOM 0 HG LEU B 24 5.071 1.771 -3.312 1.00 0.00 H new ATOM 0 HD11 LEU B 24 3.196 0.732 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU B 24 3.007 2.495 -2.232 1.00 0.00 H new ATOM 0 HD13 LEU B 24 2.058 1.410 -3.276 1.00 0.00 H new ATOM 0 HD21 LEU B 24 4.397 -0.537 -3.795 1.00 0.00 H new ATOM 0 HD22 LEU B 24 3.323 0.055 -5.085 1.00 0.00 H new ATOM 0 HD23 LEU B 24 5.083 0.279 -5.220 1.00 0.00 H new ATOM 1114 N TYR B 25 3.939 0.688 -7.645 1.00 0.00 N ATOM 1115 CA TYR B 25 3.112 -0.065 -8.575 1.00 0.00 C ATOM 1116 C TYR B 25 2.661 -1.388 -7.956 1.00 0.00 C ATOM 1117 O TYR B 25 3.474 -2.164 -7.454 1.00 0.00 O ATOM 1118 CB TYR B 25 3.884 -0.332 -9.871 1.00 0.00 C ATOM 1119 CG TYR B 25 4.434 0.917 -10.526 1.00 0.00 C ATOM 1120 CD1 TYR B 25 5.694 1.403 -10.196 1.00 0.00 C ATOM 1121 CD2 TYR B 25 3.696 1.609 -11.477 1.00 0.00 C ATOM 1122 CE1 TYR B 25 6.201 2.541 -10.793 1.00 0.00 C ATOM 1123 CE2 TYR B 25 4.196 2.748 -12.080 1.00 0.00 C ATOM 1124 CZ TYR B 25 5.448 3.210 -11.734 1.00 0.00 C ATOM 1125 OH TYR B 25 5.949 4.347 -12.332 1.00 0.00 O ATOM 0 H TYR B 25 4.823 0.237 -7.408 1.00 0.00 H new ATOM 0 HA TYR B 25 2.227 0.529 -8.801 1.00 0.00 H new ATOM 0 HB2 TYR B 25 4.709 -1.012 -9.657 1.00 0.00 H new ATOM 0 HB3 TYR B 25 3.226 -0.841 -10.576 1.00 0.00 H new ATOM 0 HD1 TYR B 25 6.287 0.881 -9.460 1.00 0.00 H new ATOM 0 HD2 TYR B 25 2.714 1.251 -11.750 1.00 0.00 H new ATOM 0 HE1 TYR B 25 7.182 2.904 -10.524 1.00 0.00 H new ATOM 0 HE2 TYR B 25 3.609 3.273 -12.819 1.00 0.00 H new ATOM 0 HH TYR B 25 5.585 4.427 -13.238 1.00 0.00 H new ATOM 1135 N LEU B 26 1.360 -1.627 -7.983 1.00 0.00 N ATOM 1136 CA LEU B 26 0.788 -2.850 -7.439 1.00 0.00 C ATOM 1137 C LEU B 26 0.482 -3.834 -8.548 1.00 0.00 C ATOM 1138 O LEU B 26 -0.483 -3.654 -9.281 1.00 0.00 O ATOM 1139 CB LEU B 26 -0.503 -2.544 -6.683 1.00 0.00 C ATOM 1140 CG LEU B 26 -0.317 -1.837 -5.353 1.00 0.00 C ATOM 1141 CD1 LEU B 26 -1.658 -1.483 -4.743 1.00 0.00 C ATOM 1142 CD2 LEU B 26 0.463 -2.713 -4.406 1.00 0.00 C ATOM 0 H LEU B 26 0.674 -0.985 -8.379 1.00 0.00 H new ATOM 0 HA LEU B 26 1.518 -3.286 -6.757 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -1.141 -1.929 -7.318 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -1.034 -3.480 -6.509 1.00 0.00 H new ATOM 0 HG LEU B 26 0.238 -0.916 -5.528 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.502 -0.977 -3.790 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.203 -0.824 -5.419 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -2.235 -2.393 -4.580 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.591 -2.197 -3.455 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -0.078 -3.645 -4.243 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.441 -2.932 -4.835 1.00 0.00 H new ATOM 1154 N MET B 27 1.294 -4.865 -8.673 1.00 0.00 N ATOM 1155 CA MET B 27 1.076 -5.868 -9.708 1.00 0.00 C ATOM 1156 C MET B 27 0.120 -6.947 -9.217 1.00 0.00 C ATOM 1157 O MET B 27 -0.394 -6.874 -8.101 1.00 0.00 O ATOM 1158 CB MET B 27 2.394 -6.502 -10.162 1.00 0.00 C ATOM 1159 CG MET B 27 3.235 -5.615 -11.061 1.00 0.00 C ATOM 1160 SD MET B 27 4.162 -4.375 -10.140 1.00 0.00 S ATOM 1161 CE MET B 27 5.613 -4.223 -11.175 1.00 0.00 C ATOM 0 H MET B 27 2.105 -5.034 -8.079 1.00 0.00 H new ATOM 0 HA MET B 27 0.631 -5.362 -10.565 1.00 0.00 H new ATOM 0 HB2 MET B 27 2.979 -6.766 -9.281 1.00 0.00 H new ATOM 0 HB3 MET B 27 2.175 -7.430 -10.689 1.00 0.00 H new ATOM 0 HG2 MET B 27 3.929 -6.234 -11.629 1.00 0.00 H new ATOM 0 HG3 MET B 27 2.587 -5.117 -11.783 1.00 0.00 H new ATOM 0 HE1 MET B 27 6.072 -3.247 -11.017 1.00 0.00 H new ATOM 0 HE2 MET B 27 6.327 -5.006 -10.918 1.00 0.00 H new ATOM 0 HE3 MET B 27 5.326 -4.323 -12.222 1.00 0.00 H new ATOM 1171 N ALA B 28 -0.123 -7.940 -10.055 1.00 0.00 N ATOM 1172 CA ALA B 28 -1.022 -9.029 -9.709 1.00 0.00 C ATOM 1173 C ALA B 28 -0.280 -10.159 -9.005 1.00 0.00 C ATOM 1174 O ALA B 28 -0.888 -11.137 -8.580 1.00 0.00 O ATOM 1175 CB ALA B 28 -1.713 -9.552 -10.960 1.00 0.00 C ATOM 0 H ALA B 28 0.291 -8.015 -10.984 1.00 0.00 H new ATOM 0 HA ALA B 28 -1.772 -8.642 -9.020 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -2.384 -10.367 -10.691 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.286 -8.748 -11.422 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -0.965 -9.916 -11.664 1.00 0.00 H new ATOM 1181 N GLU B 29 1.034 -10.024 -8.888 1.00 0.00 N ATOM 1182 CA GLU B 29 1.852 -11.052 -8.256 1.00 0.00 C ATOM 1183 C GLU B 29 2.586 -10.489 -7.046 1.00 0.00 C ATOM 1184 O GLU B 29 2.650 -11.107 -5.972 1.00 0.00 O ATOM 1185 CB GLU B 29 2.894 -11.574 -9.248 1.00 0.00 C ATOM 1186 CG GLU B 29 2.465 -11.490 -10.703 1.00 0.00 C ATOM 1187 CD GLU B 29 2.792 -10.136 -11.314 1.00 0.00 C ATOM 1188 OE1 GLU B 29 3.655 -9.423 -10.750 1.00 0.00 O ATOM 1189 OE2 GLU B 29 2.181 -9.771 -12.340 1.00 0.00 O ATOM 0 H GLU B 29 1.556 -9.214 -9.222 1.00 0.00 H new ATOM 0 HA GLU B 29 1.190 -11.859 -7.940 1.00 0.00 H new ATOM 0 HB2 GLU B 29 3.817 -11.008 -9.120 1.00 0.00 H new ATOM 0 HB3 GLU B 29 3.121 -12.613 -9.007 1.00 0.00 H new ATOM 0 HG2 GLU B 29 2.961 -12.275 -11.274 1.00 0.00 H new ATOM 0 HG3 GLU B 29 1.393 -11.672 -10.776 1.00 0.00 H new ATOM 1196 N ARG B 30 3.143 -9.306 -7.226 1.00 0.00 N ATOM 1197 CA ARG B 30 3.904 -8.670 -6.175 1.00 0.00 C ATOM 1198 C ARG B 30 3.815 -7.157 -6.266 1.00 0.00 C ATOM 1199 O ARG B 30 3.365 -6.607 -7.267 1.00 0.00 O ATOM 1200 CB ARG B 30 5.367 -9.111 -6.269 1.00 0.00 C ATOM 1201 CG ARG B 30 6.224 -8.265 -7.194 1.00 0.00 C ATOM 1202 CD ARG B 30 6.029 -8.610 -8.662 1.00 0.00 C ATOM 1203 NE ARG B 30 7.043 -7.959 -9.489 1.00 0.00 N ATOM 1204 CZ ARG B 30 7.042 -7.953 -10.823 1.00 0.00 C ATOM 1205 NH1 ARG B 30 6.048 -8.516 -11.501 1.00 0.00 N ATOM 1206 NH2 ARG B 30 8.036 -7.356 -11.476 1.00 0.00 N ATOM 0 H ARG B 30 3.081 -8.769 -8.091 1.00 0.00 H new ATOM 0 HA ARG B 30 3.485 -8.973 -5.215 1.00 0.00 H new ATOM 0 HB2 ARG B 30 5.804 -9.091 -5.271 1.00 0.00 H new ATOM 0 HB3 ARG B 30 5.400 -10.146 -6.610 1.00 0.00 H new ATOM 0 HG2 ARG B 30 5.987 -7.212 -7.039 1.00 0.00 H new ATOM 0 HG3 ARG B 30 7.273 -8.398 -6.931 1.00 0.00 H new ATOM 0 HD2 ARG B 30 6.083 -9.690 -8.796 1.00 0.00 H new ATOM 0 HD3 ARG B 30 5.036 -8.298 -8.984 1.00 0.00 H new ATOM 0 HE ARG B 30 7.805 -7.476 -9.013 1.00 0.00 H new ATOM 0 HH11 ARG B 30 5.276 -8.958 -11.002 1.00 0.00 H new ATOM 0 HH12 ARG B 30 6.057 -8.506 -12.521 1.00 0.00 H new ATOM 0 HH21 ARG B 30 8.791 -6.908 -10.957 1.00 0.00 H new ATOM 0 HH22 ARG B 30 8.043 -7.347 -12.496 1.00 0.00 H new ATOM 1220 N ILE B 31 4.248 -6.498 -5.210 1.00 0.00 N ATOM 1221 CA ILE B 31 4.260 -5.052 -5.166 1.00 0.00 C ATOM 1222 C ILE B 31 5.645 -4.575 -5.587 1.00 0.00 C ATOM 1223 O ILE B 31 6.655 -5.124 -5.141 1.00 0.00 O ATOM 1224 CB ILE B 31 3.908 -4.526 -3.752 1.00 0.00 C ATOM 1225 CG1 ILE B 31 4.036 -3.005 -3.692 1.00 0.00 C ATOM 1226 CG2 ILE B 31 4.788 -5.177 -2.695 1.00 0.00 C ATOM 1227 CD1 ILE B 31 3.591 -2.412 -2.372 1.00 0.00 C ATOM 0 H ILE B 31 4.599 -6.947 -4.364 1.00 0.00 H new ATOM 0 HA ILE B 31 3.504 -4.662 -5.847 1.00 0.00 H new ATOM 0 HB ILE B 31 2.872 -4.792 -3.544 1.00 0.00 H new ATOM 0 HG12 ILE B 31 5.075 -2.729 -3.873 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.444 -2.567 -4.496 1.00 0.00 H new ATOM 0 HG21 ILE B 31 4.521 -4.791 -1.711 1.00 0.00 H new ATOM 0 HG22 ILE B 31 4.640 -6.257 -2.713 1.00 0.00 H new ATOM 0 HG23 ILE B 31 5.834 -4.950 -2.902 1.00 0.00 H new ATOM 0 HD11 ILE B 31 3.710 -1.329 -2.401 1.00 0.00 H new ATOM 0 HD12 ILE B 31 2.543 -2.658 -2.197 1.00 0.00 H new ATOM 0 HD13 ILE B 31 4.199 -2.822 -1.566 1.00 0.00 H new ATOM 1239 N ALA B 32 5.711 -3.601 -6.472 1.00 0.00 N ATOM 1240 CA ALA B 32 6.996 -3.108 -6.929 1.00 0.00 C ATOM 1241 C ALA B 32 7.057 -1.595 -6.898 1.00 0.00 C ATOM 1242 O ALA B 32 6.084 -0.908 -7.196 1.00 0.00 O ATOM 1243 CB ALA B 32 7.298 -3.621 -8.324 1.00 0.00 C ATOM 0 H ALA B 32 4.901 -3.139 -6.885 1.00 0.00 H new ATOM 0 HA ALA B 32 7.755 -3.485 -6.243 1.00 0.00 H new ATOM 0 HB1 ALA B 32 8.266 -3.241 -8.650 1.00 0.00 H new ATOM 0 HB2 ALA B 32 7.321 -4.711 -8.314 1.00 0.00 H new ATOM 0 HB3 ALA B 32 6.524 -3.281 -9.012 1.00 0.00 H new ATOM 1249 N TRP B 33 8.211 -1.087 -6.536 1.00 0.00 N ATOM 1250 CA TRP B 33 8.430 0.336 -6.461 1.00 0.00 C ATOM 1251 C TRP B 33 9.629 0.704 -7.324 1.00 0.00 C ATOM 1252 O TRP B 33 10.645 0.001 -7.330 1.00 0.00 O ATOM 1253 CB TRP B 33 8.640 0.747 -5.001 1.00 0.00 C ATOM 1254 CG TRP B 33 8.996 2.189 -4.801 1.00 0.00 C ATOM 1255 CD1 TRP B 33 8.143 3.230 -4.553 1.00 0.00 C ATOM 1256 CD2 TRP B 33 10.310 2.744 -4.817 1.00 0.00 C ATOM 1257 NE1 TRP B 33 8.851 4.392 -4.410 1.00 0.00 N ATOM 1258 CE2 TRP B 33 10.187 4.121 -4.569 1.00 0.00 C ATOM 1259 CE3 TRP B 33 11.578 2.203 -5.018 1.00 0.00 C ATOM 1260 CZ2 TRP B 33 11.293 4.963 -4.514 1.00 0.00 C ATOM 1261 CZ3 TRP B 33 12.673 3.037 -4.969 1.00 0.00 C ATOM 1262 CH2 TRP B 33 12.526 4.406 -4.718 1.00 0.00 C ATOM 0 H TRP B 33 9.024 -1.649 -6.285 1.00 0.00 H new ATOM 0 HA TRP B 33 7.560 0.873 -6.838 1.00 0.00 H new ATOM 0 HB2 TRP B 33 7.729 0.531 -4.442 1.00 0.00 H new ATOM 0 HB3 TRP B 33 9.430 0.129 -4.574 1.00 0.00 H new ATOM 0 HD1 TRP B 33 7.069 3.147 -4.481 1.00 0.00 H new ATOM 0 HE1 TRP B 33 8.451 5.310 -4.217 1.00 0.00 H new ATOM 0 HE3 TRP B 33 11.700 1.147 -5.209 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 11.182 6.019 -4.317 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 13.660 2.628 -5.127 1.00 0.00 H new ATOM 0 HH2 TRP B 33 13.403 5.035 -4.685 1.00 0.00 H new ATOM 1273 N ALA B 34 9.491 1.781 -8.072 1.00 0.00 N ATOM 1274 CA ALA B 34 10.549 2.254 -8.944 1.00 0.00 C ATOM 1275 C ALA B 34 10.596 3.763 -8.911 1.00 0.00 C ATOM 1276 O ALA B 34 9.553 4.394 -8.836 1.00 0.00 O ATOM 1277 CB ALA B 34 10.315 1.780 -10.364 1.00 0.00 C ATOM 0 H ALA B 34 8.646 2.351 -8.093 1.00 0.00 H new ATOM 0 HA ALA B 34 11.500 1.852 -8.594 1.00 0.00 H new ATOM 0 HB1 ALA B 34 11.118 2.143 -11.006 1.00 0.00 H new ATOM 0 HB2 ALA B 34 10.298 0.690 -10.386 1.00 0.00 H new ATOM 0 HB3 ALA B 34 9.361 2.165 -10.723 1.00 0.00 H new ATOM 1283 N PRO B 35 11.797 4.357 -8.958 1.00 0.00 N ATOM 1284 CA PRO B 35 11.958 5.816 -8.935 1.00 0.00 C ATOM 1285 C PRO B 35 11.037 6.516 -9.948 1.00 0.00 C ATOM 1286 O PRO B 35 10.794 5.999 -11.042 1.00 0.00 O ATOM 1287 CB PRO B 35 13.433 6.010 -9.279 1.00 0.00 C ATOM 1288 CG PRO B 35 14.098 4.753 -8.833 1.00 0.00 C ATOM 1289 CD PRO B 35 13.090 3.656 -9.033 1.00 0.00 C ATOM 0 HA PRO B 35 11.684 6.255 -7.976 1.00 0.00 H new ATOM 0 HB2 PRO B 35 13.572 6.173 -10.348 1.00 0.00 H new ATOM 0 HB3 PRO B 35 13.847 6.879 -8.768 1.00 0.00 H new ATOM 0 HG2 PRO B 35 15.001 4.563 -9.413 1.00 0.00 H new ATOM 0 HG3 PRO B 35 14.398 4.821 -7.787 1.00 0.00 H new ATOM 0 HD2 PRO B 35 13.222 3.160 -9.995 1.00 0.00 H new ATOM 0 HD3 PRO B 35 13.175 2.888 -8.264 1.00 0.00 H new ATOM 1297 N GLU B 36 10.541 7.698 -9.584 1.00 0.00 N ATOM 1298 CA GLU B 36 9.614 8.443 -10.432 1.00 0.00 C ATOM 1299 C GLU B 36 10.279 8.875 -11.732 1.00 0.00 C ATOM 1300 O GLU B 36 11.342 9.503 -11.729 1.00 0.00 O ATOM 1301 CB GLU B 36 9.052 9.659 -9.687 1.00 0.00 C ATOM 1302 CG GLU B 36 7.890 10.340 -10.403 1.00 0.00 C ATOM 1303 CD GLU B 36 6.739 9.394 -10.709 1.00 0.00 C ATOM 1304 OE1 GLU B 36 6.880 8.554 -11.627 1.00 0.00 O ATOM 1305 OE2 GLU B 36 5.685 9.490 -10.044 1.00 0.00 O ATOM 0 H GLU B 36 10.767 8.161 -8.704 1.00 0.00 H new ATOM 0 HA GLU B 36 8.787 7.778 -10.682 1.00 0.00 H new ATOM 0 HB2 GLU B 36 8.722 9.345 -8.697 1.00 0.00 H new ATOM 0 HB3 GLU B 36 9.852 10.385 -9.541 1.00 0.00 H new ATOM 0 HG2 GLU B 36 7.523 11.161 -9.787 1.00 0.00 H new ATOM 0 HG3 GLU B 36 8.251 10.776 -11.334 1.00 0.00 H new ATOM 1312 N GLY B 37 9.638 8.532 -12.839 1.00 0.00 N ATOM 1313 CA GLY B 37 10.170 8.858 -14.145 1.00 0.00 C ATOM 1314 C GLY B 37 10.982 7.717 -14.720 1.00 0.00 C ATOM 1315 O GLY B 37 11.496 7.804 -15.833 1.00 0.00 O ATOM 0 H GLY B 37 8.751 8.029 -12.855 1.00 0.00 H new ATOM 0 HA2 GLY B 37 9.350 9.099 -14.822 1.00 0.00 H new ATOM 0 HA3 GLY B 37 10.795 9.748 -14.072 1.00 0.00 H new ATOM 1319 N LYS B 38 11.103 6.644 -13.948 1.00 0.00 N ATOM 1320 CA LYS B 38 11.857 5.471 -14.364 1.00 0.00 C ATOM 1321 C LYS B 38 10.901 4.293 -14.558 1.00 0.00 C ATOM 1322 O LYS B 38 9.909 4.169 -13.836 1.00 0.00 O ATOM 1323 CB LYS B 38 12.945 5.130 -13.328 1.00 0.00 C ATOM 1324 CG LYS B 38 13.981 6.238 -13.101 1.00 0.00 C ATOM 1325 CD LYS B 38 13.415 7.376 -12.257 1.00 0.00 C ATOM 1326 CE LYS B 38 14.494 8.266 -11.652 1.00 0.00 C ATOM 1327 NZ LYS B 38 13.918 9.247 -10.681 1.00 0.00 N ATOM 0 H LYS B 38 10.684 6.564 -13.022 1.00 0.00 H new ATOM 0 HA LYS B 38 12.354 5.682 -15.311 1.00 0.00 H new ATOM 0 HB2 LYS B 38 12.464 4.901 -12.377 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.463 4.226 -13.649 1.00 0.00 H new ATOM 0 HG2 LYS B 38 14.858 5.820 -12.607 1.00 0.00 H new ATOM 0 HG3 LYS B 38 14.313 6.629 -14.063 1.00 0.00 H new ATOM 0 HD2 LYS B 38 12.755 7.985 -12.875 1.00 0.00 H new ATOM 0 HD3 LYS B 38 12.806 6.958 -11.456 1.00 0.00 H new ATOM 0 HE2 LYS B 38 15.236 7.647 -11.148 1.00 0.00 H new ATOM 0 HE3 LYS B 38 15.013 8.802 -12.447 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.598 10.018 -10.522 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 13.035 9.638 -11.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 13.721 8.768 -9.779 1.00 0.00 H new ATOM 1341 N ASP B 39 11.196 3.437 -15.529 1.00 0.00 N ATOM 1342 CA ASP B 39 10.341 2.286 -15.831 1.00 0.00 C ATOM 1343 C ASP B 39 10.839 1.009 -15.173 1.00 0.00 C ATOM 1344 O ASP B 39 10.160 -0.017 -15.203 1.00 0.00 O ATOM 1345 CB ASP B 39 10.291 2.051 -17.344 1.00 0.00 C ATOM 1346 CG ASP B 39 11.418 1.142 -17.815 1.00 0.00 C ATOM 1347 OD1 ASP B 39 12.570 1.619 -17.889 1.00 0.00 O ATOM 1348 OD2 ASP B 39 11.158 -0.055 -18.080 1.00 0.00 O ATOM 0 H ASP B 39 12.021 3.515 -16.124 1.00 0.00 H new ATOM 0 HA ASP B 39 9.352 2.520 -15.438 1.00 0.00 H new ATOM 0 HB2 ASP B 39 9.332 1.608 -17.611 1.00 0.00 H new ATOM 0 HB3 ASP B 39 10.356 3.008 -17.862 1.00 0.00 H new ATOM 1353 N ARG B 40 11.989 1.070 -14.533 1.00 0.00 N ATOM 1354 CA ARG B 40 12.554 -0.128 -13.948 1.00 0.00 C ATOM 1355 C ARG B 40 12.405 -0.163 -12.444 1.00 0.00 C ATOM 1356 O ARG B 40 13.002 0.635 -11.721 1.00 0.00 O ATOM 1357 CB ARG B 40 14.026 -0.259 -14.335 1.00 0.00 C ATOM 1358 CG ARG B 40 14.331 -1.538 -15.092 1.00 0.00 C ATOM 1359 CD ARG B 40 13.231 -1.866 -16.087 1.00 0.00 C ATOM 1360 NE ARG B 40 12.441 -3.029 -15.670 1.00 0.00 N ATOM 1361 CZ ARG B 40 11.173 -3.250 -16.036 1.00 0.00 C ATOM 1362 NH1 ARG B 40 10.543 -2.402 -16.843 1.00 0.00 N ATOM 1363 NH2 ARG B 40 10.538 -4.331 -15.591 1.00 0.00 N ATOM 0 H ARG B 40 12.541 1.918 -14.406 1.00 0.00 H new ATOM 0 HA ARG B 40 11.994 -0.975 -14.346 1.00 0.00 H new ATOM 0 HB2 ARG B 40 14.312 0.596 -14.948 1.00 0.00 H new ATOM 0 HB3 ARG B 40 14.637 -0.223 -13.433 1.00 0.00 H new ATOM 0 HG2 ARG B 40 15.280 -1.435 -15.617 1.00 0.00 H new ATOM 0 HG3 ARG B 40 14.445 -2.362 -14.387 1.00 0.00 H new ATOM 0 HD2 ARG B 40 12.574 -1.003 -16.199 1.00 0.00 H new ATOM 0 HD3 ARG B 40 13.673 -2.059 -17.065 1.00 0.00 H new ATOM 0 HE ARG B 40 12.887 -3.715 -15.061 1.00 0.00 H new ATOM 0 HH11 ARG B 40 11.026 -1.573 -17.190 1.00 0.00 H new ATOM 0 HH12 ARG B 40 9.576 -2.580 -17.116 1.00 0.00 H new ATOM 0 HH21 ARG B 40 11.018 -4.986 -14.974 1.00 0.00 H new ATOM 0 HH22 ARG B 40 9.571 -4.504 -15.867 1.00 0.00 H new ATOM 1377 N PHE B 41 11.584 -1.102 -11.993 1.00 0.00 N ATOM 1378 CA PHE B 41 11.342 -1.304 -10.579 1.00 0.00 C ATOM 1379 C PHE B 41 12.588 -1.898 -9.957 1.00 0.00 C ATOM 1380 O PHE B 41 13.043 -2.967 -10.364 1.00 0.00 O ATOM 1381 CB PHE B 41 10.140 -2.232 -10.376 1.00 0.00 C ATOM 1382 CG PHE B 41 9.067 -2.045 -11.413 1.00 0.00 C ATOM 1383 CD1 PHE B 41 8.117 -1.046 -11.277 1.00 0.00 C ATOM 1384 CD2 PHE B 41 9.019 -2.860 -12.533 1.00 0.00 C ATOM 1385 CE1 PHE B 41 7.138 -0.867 -12.237 1.00 0.00 C ATOM 1386 CE2 PHE B 41 8.045 -2.683 -13.495 1.00 0.00 C ATOM 1387 CZ PHE B 41 7.103 -1.687 -13.347 1.00 0.00 C ATOM 0 H PHE B 41 11.070 -1.742 -12.599 1.00 0.00 H new ATOM 0 HA PHE B 41 11.114 -0.352 -10.099 1.00 0.00 H new ATOM 0 HB2 PHE B 41 10.480 -3.267 -10.397 1.00 0.00 H new ATOM 0 HB3 PHE B 41 9.716 -2.056 -9.387 1.00 0.00 H new ATOM 0 HD1 PHE B 41 8.141 -0.400 -10.412 1.00 0.00 H new ATOM 0 HD2 PHE B 41 9.753 -3.643 -12.655 1.00 0.00 H new ATOM 0 HE1 PHE B 41 6.401 -0.086 -12.118 1.00 0.00 H new ATOM 0 HE2 PHE B 41 8.021 -3.325 -14.363 1.00 0.00 H new ATOM 0 HZ PHE B 41 6.339 -1.549 -14.098 1.00 0.00 H new ATOM 1397 N THR B 42 13.140 -1.205 -8.985 1.00 0.00 N ATOM 1398 CA THR B 42 14.355 -1.652 -8.343 1.00 0.00 C ATOM 1399 C THR B 42 14.057 -2.412 -7.056 1.00 0.00 C ATOM 1400 O THR B 42 14.916 -3.107 -6.516 1.00 0.00 O ATOM 1401 CB THR B 42 15.275 -0.450 -8.076 1.00 0.00 C ATOM 1402 OG1 THR B 42 14.541 0.585 -7.405 1.00 0.00 O ATOM 1403 CG2 THR B 42 15.822 0.087 -9.395 1.00 0.00 C ATOM 0 H THR B 42 12.765 -0.328 -8.622 1.00 0.00 H new ATOM 0 HA THR B 42 14.866 -2.344 -9.013 1.00 0.00 H new ATOM 0 HB THR B 42 16.104 -0.771 -7.446 1.00 0.00 H new ATOM 0 HG1 THR B 42 15.132 1.348 -7.236 1.00 0.00 H new ATOM 0 HG21 THR B 42 16.473 0.939 -9.199 1.00 0.00 H new ATOM 0 HG22 THR B 42 16.390 -0.695 -9.899 1.00 0.00 H new ATOM 0 HG23 THR B 42 14.995 0.402 -10.031 1.00 0.00 H new ATOM 1411 N ILE B 43 12.830 -2.274 -6.569 1.00 0.00 N ATOM 1412 CA ILE B 43 12.405 -2.962 -5.359 1.00 0.00 C ATOM 1413 C ILE B 43 11.067 -3.651 -5.605 1.00 0.00 C ATOM 1414 O ILE B 43 10.104 -3.010 -6.026 1.00 0.00 O ATOM 1415 CB ILE B 43 12.278 -1.996 -4.160 1.00 0.00 C ATOM 1416 CG1 ILE B 43 13.504 -1.080 -4.072 1.00 0.00 C ATOM 1417 CG2 ILE B 43 12.119 -2.784 -2.871 1.00 0.00 C ATOM 1418 CD1 ILE B 43 13.453 -0.100 -2.921 1.00 0.00 C ATOM 0 H ILE B 43 12.111 -1.690 -6.996 1.00 0.00 H new ATOM 0 HA ILE B 43 13.168 -3.700 -5.111 1.00 0.00 H new ATOM 0 HB ILE B 43 11.394 -1.375 -4.308 1.00 0.00 H new ATOM 0 HG12 ILE B 43 14.399 -1.695 -3.974 1.00 0.00 H new ATOM 0 HG13 ILE B 43 13.599 -0.525 -5.005 1.00 0.00 H new ATOM 0 HG21 ILE B 43 12.030 -2.094 -2.032 1.00 0.00 H new ATOM 0 HG22 ILE B 43 11.222 -3.401 -2.930 1.00 0.00 H new ATOM 0 HG23 ILE B 43 12.990 -3.423 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE B 43 14.354 0.513 -2.925 1.00 0.00 H new ATOM 0 HD12 ILE B 43 12.578 0.541 -3.027 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.390 -0.647 -1.980 1.00 0.00 H new ATOM 1430 N SER B 44 11.011 -4.954 -5.370 1.00 0.00 N ATOM 1431 CA SER B 44 9.796 -5.715 -5.589 1.00 0.00 C ATOM 1432 C SER B 44 9.603 -6.748 -4.474 1.00 0.00 C ATOM 1433 O SER B 44 10.529 -7.486 -4.140 1.00 0.00 O ATOM 1434 CB SER B 44 9.893 -6.404 -6.947 1.00 0.00 C ATOM 1435 OG SER B 44 8.617 -6.565 -7.537 1.00 0.00 O ATOM 0 H SER B 44 11.797 -5.505 -5.026 1.00 0.00 H new ATOM 0 HA SER B 44 8.935 -5.047 -5.576 1.00 0.00 H new ATOM 0 HB2 SER B 44 10.530 -5.818 -7.609 1.00 0.00 H new ATOM 0 HB3 SER B 44 10.367 -7.379 -6.829 1.00 0.00 H new ATOM 0 HG SER B 44 7.929 -6.226 -6.927 1.00 0.00 H new ATOM 1441 N HIS B 45 8.401 -6.795 -3.898 1.00 0.00 N ATOM 1442 CA HIS B 45 8.095 -7.735 -2.818 1.00 0.00 C ATOM 1443 C HIS B 45 6.890 -8.585 -3.173 1.00 0.00 C ATOM 1444 O HIS B 45 5.811 -8.061 -3.452 1.00 0.00 O ATOM 1445 CB HIS B 45 7.812 -6.999 -1.498 1.00 0.00 C ATOM 1446 CG HIS B 45 8.786 -5.911 -1.163 1.00 0.00 C ATOM 1447 ND1 HIS B 45 9.863 -6.067 -0.319 1.00 0.00 N ATOM 1448 CD2 HIS B 45 8.818 -4.617 -1.573 1.00 0.00 C ATOM 1449 CE1 HIS B 45 10.500 -4.894 -0.244 1.00 0.00 C ATOM 1450 NE2 HIS B 45 9.904 -3.981 -0.988 1.00 0.00 N ATOM 0 H HIS B 45 7.622 -6.192 -4.162 1.00 0.00 H new ATOM 0 HA HIS B 45 8.970 -8.372 -2.689 1.00 0.00 H new ATOM 0 HB2 HIS B 45 6.811 -6.569 -1.545 1.00 0.00 H new ATOM 0 HB3 HIS B 45 7.808 -7.727 -0.686 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.111 -4.156 -2.247 1.00 0.00 H new ATOM 0 HE1 HIS B 45 11.386 -4.717 0.348 1.00 0.00 H new ATOM 0 HE2 HIS B 45 10.184 -3.008 -1.108 1.00 0.00 H new ATOM 1458 N MET B 46 7.077 -9.896 -3.169 1.00 0.00 N ATOM 1459 CA MET B 46 5.997 -10.821 -3.476 1.00 0.00 C ATOM 1460 C MET B 46 4.940 -10.755 -2.389 1.00 0.00 C ATOM 1461 O MET B 46 5.272 -10.666 -1.208 1.00 0.00 O ATOM 1462 CB MET B 46 6.527 -12.253 -3.595 1.00 0.00 C ATOM 1463 CG MET B 46 7.297 -12.517 -4.878 1.00 0.00 C ATOM 1464 SD MET B 46 6.254 -12.433 -6.348 1.00 0.00 S ATOM 1465 CE MET B 46 5.139 -13.805 -6.054 1.00 0.00 C ATOM 0 H MET B 46 7.968 -10.344 -2.956 1.00 0.00 H new ATOM 0 HA MET B 46 5.557 -10.534 -4.431 1.00 0.00 H new ATOM 0 HB2 MET B 46 7.175 -12.463 -2.744 1.00 0.00 H new ATOM 0 HB3 MET B 46 5.689 -12.947 -3.536 1.00 0.00 H new ATOM 0 HG2 MET B 46 8.104 -11.790 -4.968 1.00 0.00 H new ATOM 0 HG3 MET B 46 7.760 -13.502 -4.822 1.00 0.00 H new ATOM 0 HE1 MET B 46 4.695 -14.121 -6.998 1.00 0.00 H new ATOM 0 HE2 MET B 46 5.692 -14.636 -5.617 1.00 0.00 H new ATOM 0 HE3 MET B 46 4.351 -13.493 -5.369 1.00 0.00 H new ATOM 1475 N TYR B 47 3.669 -10.775 -2.780 1.00 0.00 N ATOM 1476 CA TYR B 47 2.586 -10.730 -1.797 1.00 0.00 C ATOM 1477 C TYR B 47 2.712 -11.922 -0.849 1.00 0.00 C ATOM 1478 O TYR B 47 2.372 -11.844 0.332 1.00 0.00 O ATOM 1479 CB TYR B 47 1.218 -10.720 -2.487 1.00 0.00 C ATOM 1480 CG TYR B 47 0.982 -9.496 -3.348 1.00 0.00 C ATOM 1481 CD1 TYR B 47 1.493 -8.260 -2.979 1.00 0.00 C ATOM 1482 CD2 TYR B 47 0.249 -9.573 -4.529 1.00 0.00 C ATOM 1483 CE1 TYR B 47 1.283 -7.140 -3.756 1.00 0.00 C ATOM 1484 CE2 TYR B 47 0.036 -8.454 -5.310 1.00 0.00 C ATOM 1485 CZ TYR B 47 0.556 -7.239 -4.917 1.00 0.00 C ATOM 1486 OH TYR B 47 0.356 -6.121 -5.690 1.00 0.00 O ATOM 0 H TYR B 47 3.365 -10.821 -3.752 1.00 0.00 H new ATOM 0 HA TYR B 47 2.667 -9.808 -1.222 1.00 0.00 H new ATOM 0 HB2 TYR B 47 1.126 -11.613 -3.106 1.00 0.00 H new ATOM 0 HB3 TYR B 47 0.437 -10.776 -1.728 1.00 0.00 H new ATOM 0 HD1 TYR B 47 2.065 -8.173 -2.067 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -0.160 -10.523 -4.840 1.00 0.00 H new ATOM 0 HE1 TYR B 47 1.690 -6.187 -3.452 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -0.535 -8.530 -6.224 1.00 0.00 H new ATOM 0 HH TYR B 47 -0.049 -6.382 -6.543 1.00 0.00 H new ATOM 1496 N ALA B 48 3.226 -13.020 -1.393 1.00 0.00 N ATOM 1497 CA ALA B 48 3.466 -14.246 -0.641 1.00 0.00 C ATOM 1498 C ALA B 48 4.581 -14.091 0.402 1.00 0.00 C ATOM 1499 O ALA B 48 4.864 -15.033 1.145 1.00 0.00 O ATOM 1500 CB ALA B 48 3.834 -15.366 -1.606 1.00 0.00 C ATOM 0 H ALA B 48 3.490 -13.084 -2.376 1.00 0.00 H new ATOM 0 HA ALA B 48 2.547 -14.482 -0.104 1.00 0.00 H new ATOM 0 HB1 ALA B 48 4.014 -16.284 -1.046 1.00 0.00 H new ATOM 0 HB2 ALA B 48 3.016 -15.524 -2.309 1.00 0.00 H new ATOM 0 HB3 ALA B 48 4.736 -15.092 -2.154 1.00 0.00 H new ATOM 1506 N ASP B 49 5.220 -12.924 0.449 1.00 0.00 N ATOM 1507 CA ASP B 49 6.302 -12.670 1.394 1.00 0.00 C ATOM 1508 C ASP B 49 5.941 -11.561 2.370 1.00 0.00 C ATOM 1509 O ASP B 49 6.628 -11.350 3.372 1.00 0.00 O ATOM 1510 CB ASP B 49 7.565 -12.286 0.656 1.00 0.00 C ATOM 1511 CG ASP B 49 8.261 -13.475 0.033 1.00 0.00 C ATOM 1512 OD1 ASP B 49 9.025 -14.157 0.749 1.00 0.00 O ATOM 1513 OD2 ASP B 49 8.024 -13.750 -1.159 1.00 0.00 O ATOM 0 H ASP B 49 5.004 -12.136 -0.161 1.00 0.00 H new ATOM 0 HA ASP B 49 6.466 -13.590 1.956 1.00 0.00 H new ATOM 0 HB2 ASP B 49 7.320 -11.564 -0.123 1.00 0.00 H new ATOM 0 HB3 ASP B 49 8.248 -11.791 1.346 1.00 0.00 H new ATOM 1518 N ILE B 50 4.864 -10.855 2.091 1.00 0.00 N ATOM 1519 CA ILE B 50 4.428 -9.793 2.975 1.00 0.00 C ATOM 1520 C ILE B 50 3.464 -10.365 3.993 1.00 0.00 C ATOM 1521 O ILE B 50 2.613 -11.191 3.655 1.00 0.00 O ATOM 1522 CB ILE B 50 3.759 -8.641 2.208 1.00 0.00 C ATOM 1523 CG1 ILE B 50 4.513 -8.374 0.907 1.00 0.00 C ATOM 1524 CG2 ILE B 50 3.714 -7.385 3.072 1.00 0.00 C ATOM 1525 CD1 ILE B 50 4.001 -7.177 0.150 1.00 0.00 C ATOM 0 H ILE B 50 4.279 -10.995 1.267 1.00 0.00 H new ATOM 0 HA ILE B 50 5.306 -9.381 3.473 1.00 0.00 H new ATOM 0 HB ILE B 50 2.735 -8.924 1.965 1.00 0.00 H new ATOM 0 HG12 ILE B 50 5.569 -8.227 1.132 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.443 -9.255 0.269 1.00 0.00 H new ATOM 0 HG21 ILE B 50 3.238 -6.578 2.516 1.00 0.00 H new ATOM 0 HG22 ILE B 50 3.143 -7.587 3.978 1.00 0.00 H new ATOM 0 HG23 ILE B 50 4.729 -7.091 3.340 1.00 0.00 H new ATOM 0 HD11 ILE B 50 4.583 -7.048 -0.763 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.953 -7.330 -0.107 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.096 -6.286 0.771 1.00 0.00 H new ATOM 1537 N LYS B 51 3.616 -9.974 5.243 1.00 0.00 N ATOM 1538 CA LYS B 51 2.747 -10.486 6.280 1.00 0.00 C ATOM 1539 C LYS B 51 1.827 -9.407 6.839 1.00 0.00 C ATOM 1540 O LYS B 51 0.700 -9.686 7.223 1.00 0.00 O ATOM 1541 CB LYS B 51 3.560 -11.069 7.427 1.00 0.00 C ATOM 1542 CG LYS B 51 2.811 -12.143 8.198 1.00 0.00 C ATOM 1543 CD LYS B 51 2.797 -11.854 9.687 1.00 0.00 C ATOM 1544 CE LYS B 51 1.783 -10.772 10.049 1.00 0.00 C ATOM 1545 NZ LYS B 51 0.384 -11.147 9.692 1.00 0.00 N ATOM 0 H LYS B 51 4.324 -9.312 5.561 1.00 0.00 H new ATOM 0 HA LYS B 51 2.139 -11.263 5.818 1.00 0.00 H new ATOM 0 HB2 LYS B 51 4.485 -11.490 7.033 1.00 0.00 H new ATOM 0 HB3 LYS B 51 3.841 -10.268 8.110 1.00 0.00 H new ATOM 0 HG2 LYS B 51 1.787 -12.209 7.830 1.00 0.00 H new ATOM 0 HG3 LYS B 51 3.277 -13.112 8.019 1.00 0.00 H new ATOM 0 HD2 LYS B 51 2.562 -12.768 10.232 1.00 0.00 H new ATOM 0 HD3 LYS B 51 3.791 -11.540 10.005 1.00 0.00 H new ATOM 0 HE2 LYS B 51 1.839 -10.572 11.119 1.00 0.00 H new ATOM 0 HE3 LYS B 51 2.048 -9.847 9.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -0.095 -10.330 9.262 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 0.398 -11.936 9.015 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -0.128 -11.436 10.550 1.00 0.00 H new ATOM 1559 N CYS B 52 2.306 -8.177 6.878 1.00 0.00 N ATOM 1560 CA CYS B 52 1.532 -7.092 7.459 1.00 0.00 C ATOM 1561 C CYS B 52 1.808 -5.785 6.738 1.00 0.00 C ATOM 1562 O CYS B 52 2.766 -5.682 5.970 1.00 0.00 O ATOM 1563 CB CYS B 52 1.898 -6.954 8.940 1.00 0.00 C ATOM 1564 SG CYS B 52 0.553 -6.398 10.005 1.00 0.00 S ATOM 0 H CYS B 52 3.220 -7.904 6.518 1.00 0.00 H new ATOM 0 HA CYS B 52 0.471 -7.320 7.356 1.00 0.00 H new ATOM 0 HB2 CYS B 52 2.255 -7.918 9.303 1.00 0.00 H new ATOM 0 HB3 CYS B 52 2.728 -6.253 9.031 1.00 0.00 H new ATOM 0 HG CYS B 52 -0.313 -7.357 10.148 1.00 0.00 H new ATOM 1570 N GLN B 53 0.969 -4.791 6.982 1.00 0.00 N ATOM 1571 CA GLN B 53 1.145 -3.483 6.352 1.00 0.00 C ATOM 1572 C GLN B 53 0.543 -2.381 7.198 1.00 0.00 C ATOM 1573 O GLN B 53 -0.609 -2.428 7.535 1.00 0.00 O ATOM 1574 CB GLN B 53 0.509 -3.481 4.972 1.00 0.00 C ATOM 1575 CG GLN B 53 -0.900 -4.028 4.974 1.00 0.00 C ATOM 1576 CD GLN B 53 -1.528 -3.966 3.615 1.00 0.00 C ATOM 1577 OE1 GLN B 53 -1.418 -4.898 2.833 1.00 0.00 O ATOM 1578 NE2 GLN B 53 -2.180 -2.859 3.323 1.00 0.00 N ATOM 0 H GLN B 53 0.165 -4.859 7.606 1.00 0.00 H new ATOM 0 HA GLN B 53 2.215 -3.294 6.259 1.00 0.00 H new ATOM 0 HB2 GLN B 53 0.498 -2.462 4.584 1.00 0.00 H new ATOM 0 HB3 GLN B 53 1.123 -4.074 4.294 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -0.887 -5.061 5.321 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -1.508 -3.462 5.680 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -2.244 -2.108 4.011 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -2.621 -2.753 2.409 1.00 0.00 H new ATOM 1587 N LYS B 54 1.307 -1.369 7.526 1.00 0.00 N ATOM 1588 CA LYS B 54 0.780 -0.303 8.350 1.00 0.00 C ATOM 1589 C LYS B 54 0.708 0.993 7.554 1.00 0.00 C ATOM 1590 O LYS B 54 1.354 1.125 6.523 1.00 0.00 O ATOM 1591 CB LYS B 54 1.621 -0.144 9.604 1.00 0.00 C ATOM 1592 CG LYS B 54 2.073 -1.458 10.226 1.00 0.00 C ATOM 1593 CD LYS B 54 2.799 -1.229 11.543 1.00 0.00 C ATOM 1594 CE LYS B 54 3.061 -2.539 12.275 1.00 0.00 C ATOM 1595 NZ LYS B 54 3.195 -2.340 13.745 1.00 0.00 N ATOM 0 H LYS B 54 2.280 -1.258 7.242 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.233 -0.558 8.660 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.501 0.453 9.364 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.048 0.416 10.343 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.208 -2.100 10.393 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.730 -1.983 9.533 1.00 0.00 H new ATOM 0 HD2 LYS B 54 3.745 -0.722 11.354 1.00 0.00 H new ATOM 0 HD3 LYS B 54 2.205 -0.570 12.177 1.00 0.00 H new ATOM 0 HE2 LYS B 54 2.246 -3.235 12.076 1.00 0.00 H new ATOM 0 HE3 LYS B 54 3.971 -2.996 11.887 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 2.967 -3.227 14.238 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 4.171 -2.060 13.970 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 2.540 -1.594 14.055 1.00 0.00 H new ATOM 1609 N ILE B 55 -0.078 1.946 8.032 1.00 0.00 N ATOM 1610 CA ILE B 55 -0.265 3.212 7.326 1.00 0.00 C ATOM 1611 C ILE B 55 -0.072 4.419 8.244 1.00 0.00 C ATOM 1612 O ILE B 55 -0.636 4.470 9.324 1.00 0.00 O ATOM 1613 CB ILE B 55 -1.691 3.255 6.746 1.00 0.00 C ATOM 1614 CG1 ILE B 55 -2.706 3.131 7.887 1.00 0.00 C ATOM 1615 CG2 ILE B 55 -1.880 2.133 5.740 1.00 0.00 C ATOM 1616 CD1 ILE B 55 -3.979 2.415 7.527 1.00 0.00 C ATOM 0 H ILE B 55 -0.598 1.870 8.906 1.00 0.00 H new ATOM 0 HA ILE B 55 0.485 3.266 6.537 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.847 4.204 6.232 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -2.234 2.607 8.718 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -2.956 4.131 8.241 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.892 2.173 5.336 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -1.161 2.247 4.929 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.723 1.173 6.232 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.634 2.377 8.398 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -4.480 2.948 6.719 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.747 1.400 7.203 1.00 0.00 H new ATOM 1628 N SER B 56 0.722 5.397 7.832 1.00 0.00 N ATOM 1629 CA SER B 56 0.917 6.570 8.662 1.00 0.00 C ATOM 1630 C SER B 56 -0.292 7.470 8.488 1.00 0.00 C ATOM 1631 O SER B 56 -0.566 7.951 7.374 1.00 0.00 O ATOM 1632 CB SER B 56 2.223 7.301 8.340 1.00 0.00 C ATOM 1633 OG SER B 56 2.179 7.921 7.076 1.00 0.00 O ATOM 0 H SER B 56 1.230 5.401 6.948 1.00 0.00 H new ATOM 0 HA SER B 56 1.008 6.266 9.705 1.00 0.00 H new ATOM 0 HB2 SER B 56 2.418 8.052 9.106 1.00 0.00 H new ATOM 0 HB3 SER B 56 3.052 6.594 8.369 1.00 0.00 H new ATOM 0 HG SER B 56 2.207 8.894 7.188 1.00 0.00 H new ATOM 1639 N PRO B 57 -1.040 7.645 9.592 1.00 0.00 N ATOM 1640 CA PRO B 57 -2.285 8.426 9.645 1.00 0.00 C ATOM 1641 C PRO B 57 -2.096 9.932 9.559 1.00 0.00 C ATOM 1642 O PRO B 57 -0.978 10.449 9.674 1.00 0.00 O ATOM 1643 CB PRO B 57 -2.867 8.063 11.013 1.00 0.00 C ATOM 1644 CG PRO B 57 -1.689 7.705 11.846 1.00 0.00 C ATOM 1645 CD PRO B 57 -0.701 7.076 10.912 1.00 0.00 C ATOM 0 HA PRO B 57 -2.916 8.188 8.789 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -3.416 8.900 11.444 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -3.565 7.230 10.937 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -1.266 8.588 12.325 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -1.969 7.014 12.642 1.00 0.00 H new ATOM 0 HD2 PRO B 57 0.324 7.313 11.197 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -0.788 5.990 10.912 1.00 0.00 H new ATOM 1653 N GLU B 58 -3.217 10.618 9.350 1.00 0.00 N ATOM 1654 CA GLU B 58 -3.246 12.067 9.260 1.00 0.00 C ATOM 1655 C GLU B 58 -2.710 12.692 10.537 1.00 0.00 C ATOM 1656 O GLU B 58 -2.743 12.085 11.610 1.00 0.00 O ATOM 1657 CB GLU B 58 -4.666 12.559 8.992 1.00 0.00 C ATOM 1658 CG GLU B 58 -5.288 11.940 7.755 1.00 0.00 C ATOM 1659 CD GLU B 58 -4.380 12.016 6.545 1.00 0.00 C ATOM 1660 OE1 GLU B 58 -4.225 13.120 5.986 1.00 0.00 O ATOM 1661 OE2 GLU B 58 -3.819 10.970 6.160 1.00 0.00 O ATOM 0 H GLU B 58 -4.131 10.179 9.239 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.609 12.369 8.429 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -5.291 12.334 9.856 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -4.653 13.643 8.881 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.530 10.897 7.958 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -6.227 12.447 7.532 1.00 0.00 H new ATOM 1668 N GLY B 59 -2.233 13.910 10.414 1.00 0.00 N ATOM 1669 CA GLY B 59 -1.642 14.593 11.539 1.00 0.00 C ATOM 1670 C GLY B 59 -0.157 14.660 11.328 1.00 0.00 C ATOM 1671 O GLY B 59 0.557 15.442 11.952 1.00 0.00 O ATOM 0 H GLY B 59 -2.243 14.446 9.546 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -2.057 15.596 11.634 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -1.870 14.065 12.465 1.00 0.00 H new ATOM 1675 N LYS B 60 0.294 13.806 10.423 1.00 0.00 N ATOM 1676 CA LYS B 60 1.686 13.742 10.041 1.00 0.00 C ATOM 1677 C LYS B 60 1.872 14.593 8.797 1.00 0.00 C ATOM 1678 O LYS B 60 0.898 14.944 8.136 1.00 0.00 O ATOM 1679 CB LYS B 60 2.104 12.293 9.761 1.00 0.00 C ATOM 1680 CG LYS B 60 2.508 11.510 11.002 1.00 0.00 C ATOM 1681 CD LYS B 60 2.548 10.015 10.720 1.00 0.00 C ATOM 1682 CE LYS B 60 3.552 9.291 11.608 1.00 0.00 C ATOM 1683 NZ LYS B 60 4.950 9.709 11.338 1.00 0.00 N ATOM 0 H LYS B 60 -0.301 13.138 9.934 1.00 0.00 H new ATOM 0 HA LYS B 60 2.311 14.116 10.852 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.278 11.776 9.272 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.938 12.296 9.059 1.00 0.00 H new ATOM 0 HG2 LYS B 60 3.487 11.845 11.344 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.803 11.712 11.808 1.00 0.00 H new ATOM 0 HD2 LYS B 60 1.556 9.591 10.875 1.00 0.00 H new ATOM 0 HD3 LYS B 60 2.805 9.851 9.674 1.00 0.00 H new ATOM 0 HE2 LYS B 60 3.313 9.484 12.654 1.00 0.00 H new ATOM 0 HE3 LYS B 60 3.461 8.216 11.453 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 5.605 8.992 11.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 5.091 9.808 10.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 5.135 10.621 11.802 1.00 0.00 H new ATOM 1697 N ALA B 61 3.105 14.930 8.474 1.00 0.00 N ATOM 1698 CA ALA B 61 3.367 15.744 7.299 1.00 0.00 C ATOM 1699 C ALA B 61 3.320 14.906 6.028 1.00 0.00 C ATOM 1700 O ALA B 61 3.421 15.437 4.924 1.00 0.00 O ATOM 1701 CB ALA B 61 4.715 16.440 7.428 1.00 0.00 C ATOM 0 H ALA B 61 3.935 14.657 9.001 1.00 0.00 H new ATOM 0 HA ALA B 61 2.586 16.501 7.231 1.00 0.00 H new ATOM 0 HB1 ALA B 61 4.898 17.046 6.541 1.00 0.00 H new ATOM 0 HB2 ALA B 61 4.711 17.080 8.310 1.00 0.00 H new ATOM 0 HB3 ALA B 61 5.502 15.693 7.526 1.00 0.00 H new ATOM 1707 N LYS B 62 3.161 13.593 6.185 1.00 0.00 N ATOM 1708 CA LYS B 62 3.120 12.694 5.039 1.00 0.00 C ATOM 1709 C LYS B 62 2.185 11.511 5.280 1.00 0.00 C ATOM 1710 O LYS B 62 2.220 10.885 6.345 1.00 0.00 O ATOM 1711 CB LYS B 62 4.515 12.137 4.728 1.00 0.00 C ATOM 1712 CG LYS B 62 5.665 13.113 4.930 1.00 0.00 C ATOM 1713 CD LYS B 62 6.667 12.573 5.935 1.00 0.00 C ATOM 1714 CE LYS B 62 8.097 12.877 5.525 1.00 0.00 C ATOM 1715 NZ LYS B 62 8.455 14.299 5.756 1.00 0.00 N ATOM 0 H LYS B 62 3.059 13.133 7.090 1.00 0.00 H new ATOM 0 HA LYS B 62 2.752 13.284 4.199 1.00 0.00 H new ATOM 0 HB2 LYS B 62 4.687 11.263 5.356 1.00 0.00 H new ATOM 0 HB3 LYS B 62 4.529 11.794 3.693 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.163 13.296 3.978 1.00 0.00 H new ATOM 0 HG3 LYS B 62 5.277 14.071 5.277 1.00 0.00 H new ATOM 0 HD2 LYS B 62 6.470 13.008 6.915 1.00 0.00 H new ATOM 0 HD3 LYS B 62 6.538 11.495 6.033 1.00 0.00 H new ATOM 0 HE2 LYS B 62 8.778 12.237 6.086 1.00 0.00 H new ATOM 0 HE3 LYS B 62 8.230 12.637 4.470 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 9.485 14.415 5.674 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 7.982 14.896 5.047 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 8.149 14.584 6.708 1.00 0.00 H new ATOM 1729 N ILE B 63 1.353 11.219 4.288 1.00 0.00 N ATOM 1730 CA ILE B 63 0.449 10.076 4.334 1.00 0.00 C ATOM 1731 C ILE B 63 1.223 8.896 3.755 1.00 0.00 C ATOM 1732 O ILE B 63 1.621 8.937 2.589 1.00 0.00 O ATOM 1733 CB ILE B 63 -0.836 10.335 3.514 1.00 0.00 C ATOM 1734 CG1 ILE B 63 -1.520 11.627 3.973 1.00 0.00 C ATOM 1735 CG2 ILE B 63 -1.795 9.167 3.641 1.00 0.00 C ATOM 1736 CD1 ILE B 63 -1.136 12.848 3.164 1.00 0.00 C ATOM 0 H ILE B 63 1.286 11.767 3.430 1.00 0.00 H new ATOM 0 HA ILE B 63 0.127 9.883 5.357 1.00 0.00 H new ATOM 0 HB ILE B 63 -0.552 10.443 2.467 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -2.600 11.493 3.919 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -1.273 11.805 5.020 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -2.693 9.368 3.057 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -1.316 8.261 3.270 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.066 9.031 4.688 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -1.662 13.721 3.551 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -0.061 13.010 3.238 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -1.409 12.693 2.120 1.00 0.00 H new ATOM 1748 N GLN B 64 1.461 7.850 4.543 1.00 0.00 N ATOM 1749 CA GLN B 64 2.314 6.756 4.056 1.00 0.00 C ATOM 1750 C GLN B 64 1.830 5.349 4.406 1.00 0.00 C ATOM 1751 O GLN B 64 0.872 5.163 5.151 1.00 0.00 O ATOM 1752 CB GLN B 64 3.728 6.937 4.601 1.00 0.00 C ATOM 1753 CG GLN B 64 4.213 8.374 4.629 1.00 0.00 C ATOM 1754 CD GLN B 64 5.506 8.521 5.391 1.00 0.00 C ATOM 1755 OE1 GLN B 64 5.717 9.505 6.098 1.00 0.00 O ATOM 1756 NE2 GLN B 64 6.387 7.548 5.247 1.00 0.00 N ATOM 0 H GLN B 64 1.094 7.732 5.487 1.00 0.00 H new ATOM 0 HA GLN B 64 2.279 6.825 2.969 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.768 6.534 5.613 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.415 6.347 3.995 1.00 0.00 H new ATOM 0 HG2 GLN B 64 4.352 8.729 3.608 1.00 0.00 H new ATOM 0 HG3 GLN B 64 3.450 9.005 5.085 1.00 0.00 H new ATOM 0 HE21 GLN B 64 6.172 6.749 4.651 1.00 0.00 H new ATOM 0 HE22 GLN B 64 7.283 7.595 5.732 1.00 0.00 H new ATOM 1765 N LEU B 65 2.524 4.367 3.819 1.00 0.00 N ATOM 1766 CA LEU B 65 2.256 2.945 4.011 1.00 0.00 C ATOM 1767 C LEU B 65 3.565 2.170 4.252 1.00 0.00 C ATOM 1768 O LEU B 65 4.482 2.247 3.436 1.00 0.00 O ATOM 1769 CB LEU B 65 1.601 2.405 2.749 1.00 0.00 C ATOM 1770 CG LEU B 65 1.260 0.917 2.774 1.00 0.00 C ATOM 1771 CD1 LEU B 65 -0.148 0.687 3.289 1.00 0.00 C ATOM 1772 CD2 LEU B 65 1.441 0.308 1.396 1.00 0.00 C ATOM 0 H LEU B 65 3.303 4.547 3.185 1.00 0.00 H new ATOM 0 HA LEU B 65 1.607 2.820 4.878 1.00 0.00 H new ATOM 0 HB2 LEU B 65 0.685 2.967 2.566 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.265 2.594 1.906 1.00 0.00 H new ATOM 0 HG LEU B 65 1.947 0.422 3.460 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.363 -0.382 3.296 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -0.234 1.081 4.302 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -0.860 1.196 2.640 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.194 -0.753 1.432 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.783 0.810 0.687 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.477 0.429 1.078 1.00 0.00 H new ATOM 1784 N GLN B 66 3.676 1.461 5.377 1.00 0.00 N ATOM 1785 CA GLN B 66 4.870 0.664 5.652 1.00 0.00 C ATOM 1786 C GLN B 66 4.535 -0.823 5.519 1.00 0.00 C ATOM 1787 O GLN B 66 3.521 -1.291 6.035 1.00 0.00 O ATOM 1788 CB GLN B 66 5.464 0.967 7.033 1.00 0.00 C ATOM 1789 CG GLN B 66 4.805 0.239 8.195 1.00 0.00 C ATOM 1790 CD GLN B 66 5.787 -0.112 9.298 1.00 0.00 C ATOM 1791 OE1 GLN B 66 5.560 -1.040 10.074 1.00 0.00 O ATOM 1792 NE2 GLN B 66 6.892 0.616 9.371 1.00 0.00 N ATOM 0 H GLN B 66 2.962 1.423 6.104 1.00 0.00 H new ATOM 0 HA GLN B 66 5.630 0.933 4.919 1.00 0.00 H new ATOM 0 HB2 GLN B 66 6.524 0.712 7.019 1.00 0.00 H new ATOM 0 HB3 GLN B 66 5.397 2.040 7.212 1.00 0.00 H new ATOM 0 HG2 GLN B 66 4.011 0.863 8.606 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.336 -0.674 7.828 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.046 1.378 8.710 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.589 0.415 10.088 1.00 0.00 H new ATOM 1801 N LEU B 67 5.370 -1.553 4.805 1.00 0.00 N ATOM 1802 CA LEU B 67 5.158 -2.978 4.602 1.00 0.00 C ATOM 1803 C LEU B 67 5.960 -3.793 5.602 1.00 0.00 C ATOM 1804 O LEU B 67 7.114 -3.490 5.871 1.00 0.00 O ATOM 1805 CB LEU B 67 5.565 -3.383 3.183 1.00 0.00 C ATOM 1806 CG LEU B 67 4.727 -2.777 2.060 1.00 0.00 C ATOM 1807 CD1 LEU B 67 5.269 -3.211 0.710 1.00 0.00 C ATOM 1808 CD2 LEU B 67 3.268 -3.182 2.205 1.00 0.00 C ATOM 0 H LEU B 67 6.206 -1.183 4.353 1.00 0.00 H new ATOM 0 HA LEU B 67 4.097 -3.179 4.748 1.00 0.00 H new ATOM 0 HB2 LEU B 67 6.606 -3.101 3.028 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.514 -4.469 3.105 1.00 0.00 H new ATOM 0 HG LEU B 67 4.788 -1.691 2.127 1.00 0.00 H new ATOM 0 HD11 LEU B 67 4.663 -2.773 -0.083 1.00 0.00 H new ATOM 0 HD12 LEU B 67 6.301 -2.875 0.607 1.00 0.00 H new ATOM 0 HD13 LEU B 67 5.233 -4.298 0.636 1.00 0.00 H new ATOM 0 HD21 LEU B 67 2.686 -2.741 1.396 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.186 -4.268 2.161 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.885 -2.828 3.162 1.00 0.00 H new ATOM 1820 N VAL B 68 5.331 -4.809 6.161 1.00 0.00 N ATOM 1821 CA VAL B 68 5.982 -5.695 7.112 1.00 0.00 C ATOM 1822 C VAL B 68 6.019 -7.100 6.530 1.00 0.00 C ATOM 1823 O VAL B 68 4.994 -7.781 6.456 1.00 0.00 O ATOM 1824 CB VAL B 68 5.239 -5.723 8.469 1.00 0.00 C ATOM 1825 CG1 VAL B 68 5.837 -6.771 9.401 1.00 0.00 C ATOM 1826 CG2 VAL B 68 5.258 -4.349 9.121 1.00 0.00 C ATOM 0 H VAL B 68 4.357 -5.045 5.971 1.00 0.00 H new ATOM 0 HA VAL B 68 6.991 -5.324 7.290 1.00 0.00 H new ATOM 0 HB VAL B 68 4.202 -5.997 8.278 1.00 0.00 H new ATOM 0 HG11 VAL B 68 5.295 -6.768 10.347 1.00 0.00 H new ATOM 0 HG12 VAL B 68 5.758 -7.756 8.940 1.00 0.00 H new ATOM 0 HG13 VAL B 68 6.886 -6.539 9.583 1.00 0.00 H new ATOM 0 HG21 VAL B 68 4.730 -4.391 10.074 1.00 0.00 H new ATOM 0 HG22 VAL B 68 6.290 -4.041 9.291 1.00 0.00 H new ATOM 0 HG23 VAL B 68 4.768 -3.629 8.466 1.00 0.00 H new ATOM 1836 N LEU B 69 7.184 -7.528 6.091 1.00 0.00 N ATOM 1837 CA LEU B 69 7.315 -8.847 5.505 1.00 0.00 C ATOM 1838 C LEU B 69 7.551 -9.877 6.598 1.00 0.00 C ATOM 1839 O LEU B 69 8.225 -9.594 7.587 1.00 0.00 O ATOM 1840 CB LEU B 69 8.445 -8.895 4.476 1.00 0.00 C ATOM 1841 CG LEU B 69 8.388 -7.826 3.380 1.00 0.00 C ATOM 1842 CD1 LEU B 69 9.003 -8.342 2.096 1.00 0.00 C ATOM 1843 CD2 LEU B 69 6.973 -7.358 3.111 1.00 0.00 C ATOM 0 H LEU B 69 8.048 -6.987 6.128 1.00 0.00 H new ATOM 0 HA LEU B 69 6.386 -9.080 4.985 1.00 0.00 H new ATOM 0 HB2 LEU B 69 9.395 -8.801 5.002 1.00 0.00 H new ATOM 0 HB3 LEU B 69 8.439 -9.877 4.002 1.00 0.00 H new ATOM 0 HG LEU B 69 8.962 -6.973 3.743 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.952 -7.567 1.331 1.00 0.00 H new ATOM 0 HD12 LEU B 69 10.045 -8.609 2.273 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.455 -9.222 1.758 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.983 -6.601 2.327 1.00 0.00 H new ATOM 0 HD22 LEU B 69 6.365 -8.204 2.791 1.00 0.00 H new ATOM 0 HD23 LEU B 69 6.551 -6.932 4.021 1.00 0.00 H new ATOM 1855 N HIS B 70 7.014 -11.078 6.415 1.00 0.00 N ATOM 1856 CA HIS B 70 7.170 -12.140 7.410 1.00 0.00 C ATOM 1857 C HIS B 70 8.558 -12.769 7.319 1.00 0.00 C ATOM 1858 O HIS B 70 8.850 -13.760 7.981 1.00 0.00 O ATOM 1859 CB HIS B 70 6.073 -13.210 7.268 1.00 0.00 C ATOM 1860 CG HIS B 70 5.747 -13.586 5.855 1.00 0.00 C ATOM 1861 ND1 HIS B 70 4.529 -13.368 5.251 1.00 0.00 N ATOM 1862 CD2 HIS B 70 6.516 -14.178 4.923 1.00 0.00 C ATOM 1863 CE1 HIS B 70 4.611 -13.831 3.997 1.00 0.00 C ATOM 1864 NE2 HIS B 70 5.794 -14.341 3.760 1.00 0.00 N ATOM 0 H HIS B 70 6.470 -11.343 5.594 1.00 0.00 H new ATOM 0 HA HIS B 70 7.064 -11.688 8.396 1.00 0.00 H new ATOM 0 HB2 HIS B 70 6.386 -14.105 7.805 1.00 0.00 H new ATOM 0 HB3 HIS B 70 5.166 -12.848 7.752 1.00 0.00 H new ATOM 0 HD1 HIS B 70 3.713 -12.933 5.681 1.00 0.00 H new ATOM 0 HD2 HIS B 70 7.543 -14.480 5.065 1.00 0.00 H new ATOM 0 HE1 HIS B 70 3.808 -13.789 3.276 1.00 0.00 H new ATOM 1872 N ALA B 71 9.404 -12.177 6.486 1.00 0.00 N ATOM 1873 CA ALA B 71 10.768 -12.644 6.307 1.00 0.00 C ATOM 1874 C ALA B 71 11.726 -11.803 7.143 1.00 0.00 C ATOM 1875 O ALA B 71 12.931 -12.040 7.154 1.00 0.00 O ATOM 1876 CB ALA B 71 11.155 -12.584 4.838 1.00 0.00 C ATOM 0 H ALA B 71 9.164 -11.364 5.919 1.00 0.00 H new ATOM 0 HA ALA B 71 10.831 -13.680 6.641 1.00 0.00 H new ATOM 0 HB1 ALA B 71 12.179 -12.936 4.717 1.00 0.00 H new ATOM 0 HB2 ALA B 71 10.483 -13.217 4.258 1.00 0.00 H new ATOM 0 HB3 ALA B 71 11.081 -11.556 4.484 1.00 0.00 H new ATOM 1882 N GLY B 72 11.172 -10.818 7.844 1.00 0.00 N ATOM 1883 CA GLY B 72 11.985 -9.944 8.667 1.00 0.00 C ATOM 1884 C GLY B 72 12.398 -8.689 7.926 1.00 0.00 C ATOM 1885 O GLY B 72 13.490 -8.165 8.138 1.00 0.00 O ATOM 0 H GLY B 72 10.173 -10.610 7.856 1.00 0.00 H new ATOM 0 HA2 GLY B 72 11.429 -9.669 9.563 1.00 0.00 H new ATOM 0 HA3 GLY B 72 12.875 -10.480 8.996 1.00 0.00 H new ATOM 1889 N ASP B 73 11.516 -8.208 7.059 1.00 0.00 N ATOM 1890 CA ASP B 73 11.785 -7.011 6.268 1.00 0.00 C ATOM 1891 C ASP B 73 10.636 -6.015 6.408 1.00 0.00 C ATOM 1892 O ASP B 73 9.505 -6.405 6.692 1.00 0.00 O ATOM 1893 CB ASP B 73 11.982 -7.385 4.792 1.00 0.00 C ATOM 1894 CG ASP B 73 12.077 -6.173 3.883 1.00 0.00 C ATOM 1895 OD1 ASP B 73 12.834 -5.236 4.215 1.00 0.00 O ATOM 1896 OD2 ASP B 73 11.390 -6.156 2.840 1.00 0.00 O ATOM 0 H ASP B 73 10.604 -8.630 6.884 1.00 0.00 H new ATOM 0 HA ASP B 73 12.699 -6.546 6.638 1.00 0.00 H new ATOM 0 HB2 ASP B 73 12.889 -7.980 4.691 1.00 0.00 H new ATOM 0 HB3 ASP B 73 11.152 -8.012 4.467 1.00 0.00 H new ATOM 1901 N THR B 74 10.935 -4.739 6.218 1.00 0.00 N ATOM 1902 CA THR B 74 9.937 -3.685 6.308 1.00 0.00 C ATOM 1903 C THR B 74 10.227 -2.611 5.263 1.00 0.00 C ATOM 1904 O THR B 74 11.356 -2.138 5.150 1.00 0.00 O ATOM 1905 CB THR B 74 9.907 -3.044 7.711 1.00 0.00 C ATOM 1906 OG1 THR B 74 11.243 -2.873 8.202 1.00 0.00 O ATOM 1907 CG2 THR B 74 9.108 -3.894 8.690 1.00 0.00 C ATOM 0 H THR B 74 11.874 -4.406 5.998 1.00 0.00 H new ATOM 0 HA THR B 74 8.961 -4.134 6.123 1.00 0.00 H new ATOM 0 HB THR B 74 9.421 -2.072 7.625 1.00 0.00 H new ATOM 0 HG1 THR B 74 11.215 -2.464 9.092 1.00 0.00 H new ATOM 0 HG21 THR B 74 9.106 -3.416 9.669 1.00 0.00 H new ATOM 0 HG22 THR B 74 8.083 -3.994 8.333 1.00 0.00 H new ATOM 0 HG23 THR B 74 9.563 -4.881 8.770 1.00 0.00 H new ATOM 1915 N THR B 75 9.211 -2.217 4.510 1.00 0.00 N ATOM 1916 CA THR B 75 9.391 -1.218 3.470 1.00 0.00 C ATOM 1917 C THR B 75 8.487 -0.005 3.686 1.00 0.00 C ATOM 1918 O THR B 75 7.266 -0.119 3.667 1.00 0.00 O ATOM 1919 CB THR B 75 9.091 -1.829 2.096 1.00 0.00 C ATOM 1920 OG1 THR B 75 9.391 -3.231 2.116 1.00 0.00 O ATOM 1921 CG2 THR B 75 9.912 -1.147 1.013 1.00 0.00 C ATOM 0 H THR B 75 8.259 -2.572 4.599 1.00 0.00 H new ATOM 0 HA THR B 75 10.428 -0.885 3.515 1.00 0.00 H new ATOM 0 HB THR B 75 8.034 -1.683 1.875 1.00 0.00 H new ATOM 0 HG1 THR B 75 8.800 -3.701 1.491 1.00 0.00 H new ATOM 0 HG21 THR B 75 9.684 -1.596 0.046 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.669 -0.085 0.986 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.973 -1.271 1.229 1.00 0.00 H new ATOM 1929 N ASN B 76 9.093 1.156 3.885 1.00 0.00 N ATOM 1930 CA ASN B 76 8.339 2.390 4.101 1.00 0.00 C ATOM 1931 C ASN B 76 8.057 3.095 2.780 1.00 0.00 C ATOM 1932 O ASN B 76 8.970 3.309 1.989 1.00 0.00 O ATOM 1933 CB ASN B 76 9.122 3.335 5.006 1.00 0.00 C ATOM 1934 CG ASN B 76 8.967 2.996 6.468 1.00 0.00 C ATOM 1935 OD1 ASN B 76 8.942 4.017 7.295 1.00 0.00 O flip ATOM 1936 ND2 ASN B 76 8.855 1.833 6.848 1.00 0.00 N flip ATOM 0 H ASN B 76 10.106 1.273 3.902 1.00 0.00 H new ATOM 0 HA ASN B 76 7.393 2.123 4.573 1.00 0.00 H new ATOM 0 HB2 ASN B 76 10.178 3.298 4.738 1.00 0.00 H new ATOM 0 HB3 ASN B 76 8.786 4.358 4.836 1.00 0.00 H new ATOM 0 HD21 ASN B 76 8.880 1.071 6.171 1.00 0.00 H new ATOM 0 HD22 ASN B 76 8.737 1.630 7.841 1.00 0.00 H new ATOM 1943 N PHE B 77 6.800 3.451 2.541 1.00 0.00 N ATOM 1944 CA PHE B 77 6.424 4.142 1.312 1.00 0.00 C ATOM 1945 C PHE B 77 5.638 5.417 1.611 1.00 0.00 C ATOM 1946 O PHE B 77 4.496 5.362 2.066 1.00 0.00 O ATOM 1947 CB PHE B 77 5.599 3.223 0.407 1.00 0.00 C ATOM 1948 CG PHE B 77 6.409 2.144 -0.253 1.00 0.00 C ATOM 1949 CD1 PHE B 77 7.620 2.443 -0.855 1.00 0.00 C ATOM 1950 CD2 PHE B 77 5.964 0.833 -0.269 1.00 0.00 C ATOM 1951 CE1 PHE B 77 8.371 1.458 -1.461 1.00 0.00 C ATOM 1952 CE2 PHE B 77 6.711 -0.158 -0.875 1.00 0.00 C ATOM 1953 CZ PHE B 77 7.918 0.155 -1.472 1.00 0.00 C ATOM 0 H PHE B 77 6.025 3.273 3.180 1.00 0.00 H new ATOM 0 HA PHE B 77 7.343 4.418 0.796 1.00 0.00 H new ATOM 0 HB2 PHE B 77 4.807 2.762 0.997 1.00 0.00 H new ATOM 0 HB3 PHE B 77 5.115 3.824 -0.362 1.00 0.00 H new ATOM 0 HD1 PHE B 77 7.981 3.461 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE B 77 5.023 0.583 0.197 1.00 0.00 H new ATOM 0 HE1 PHE B 77 9.313 1.706 -1.927 1.00 0.00 H new ATOM 0 HE2 PHE B 77 6.353 -1.177 -0.883 1.00 0.00 H new ATOM 0 HZ PHE B 77 8.505 -0.618 -1.946 1.00 0.00 H new ATOM 1963 N HIS B 78 6.267 6.559 1.367 1.00 0.00 N ATOM 1964 CA HIS B 78 5.651 7.861 1.584 1.00 0.00 C ATOM 1965 C HIS B 78 4.940 8.314 0.309 1.00 0.00 C ATOM 1966 O HIS B 78 5.561 8.448 -0.744 1.00 0.00 O ATOM 1967 CB HIS B 78 6.747 8.857 2.021 1.00 0.00 C ATOM 1968 CG HIS B 78 6.450 10.329 1.853 1.00 0.00 C ATOM 1969 ND1 HIS B 78 7.428 11.300 1.881 1.00 0.00 N ATOM 1970 CD2 HIS B 78 5.281 10.989 1.642 1.00 0.00 C ATOM 1971 CE1 HIS B 78 6.842 12.486 1.683 1.00 0.00 C ATOM 1972 NE2 HIS B 78 5.538 12.353 1.533 1.00 0.00 N ATOM 0 H HIS B 78 7.222 6.608 1.012 1.00 0.00 H new ATOM 0 HA HIS B 78 4.900 7.807 2.372 1.00 0.00 H new ATOM 0 HB2 HIS B 78 6.969 8.675 3.073 1.00 0.00 H new ATOM 0 HB3 HIS B 78 7.653 8.629 1.460 1.00 0.00 H new ATOM 0 HD1 HIS B 78 8.425 11.142 2.027 1.00 0.00 H new ATOM 0 HD2 HIS B 78 4.307 10.528 1.570 1.00 0.00 H new ATOM 0 HE1 HIS B 78 7.367 13.429 1.650 1.00 0.00 H new ATOM 1980 N PHE B 79 3.638 8.540 0.407 1.00 0.00 N ATOM 1981 CA PHE B 79 2.857 8.981 -0.738 1.00 0.00 C ATOM 1982 C PHE B 79 2.964 10.493 -0.891 1.00 0.00 C ATOM 1983 O PHE B 79 2.154 11.246 -0.354 1.00 0.00 O ATOM 1984 CB PHE B 79 1.392 8.560 -0.591 1.00 0.00 C ATOM 1985 CG PHE B 79 1.187 7.072 -0.636 1.00 0.00 C ATOM 1986 CD1 PHE B 79 1.380 6.295 0.496 1.00 0.00 C ATOM 1987 CD2 PHE B 79 0.802 6.450 -1.811 1.00 0.00 C ATOM 1988 CE1 PHE B 79 1.194 4.927 0.454 1.00 0.00 C ATOM 1989 CE2 PHE B 79 0.614 5.082 -1.858 1.00 0.00 C ATOM 1990 CZ PHE B 79 0.810 4.320 -0.723 1.00 0.00 C ATOM 0 H PHE B 79 3.101 8.425 1.267 1.00 0.00 H new ATOM 0 HA PHE B 79 3.257 8.507 -1.634 1.00 0.00 H new ATOM 0 HB2 PHE B 79 1.005 8.943 0.353 1.00 0.00 H new ATOM 0 HB3 PHE B 79 0.808 9.023 -1.386 1.00 0.00 H new ATOM 0 HD1 PHE B 79 1.679 6.765 1.421 1.00 0.00 H new ATOM 0 HD2 PHE B 79 0.647 7.041 -2.702 1.00 0.00 H new ATOM 0 HE1 PHE B 79 1.349 4.333 1.343 1.00 0.00 H new ATOM 0 HE2 PHE B 79 0.314 4.609 -2.781 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.663 3.251 -0.757 1.00 0.00 H new ATOM 2000 N SER B 80 3.982 10.927 -1.618 1.00 0.00 N ATOM 2001 CA SER B 80 4.225 12.344 -1.847 1.00 0.00 C ATOM 2002 C SER B 80 3.459 12.842 -3.072 1.00 0.00 C ATOM 2003 O SER B 80 3.714 13.934 -3.582 1.00 0.00 O ATOM 2004 CB SER B 80 5.725 12.579 -2.025 1.00 0.00 C ATOM 2005 OG SER B 80 6.331 11.486 -2.699 1.00 0.00 O ATOM 0 H SER B 80 4.661 10.310 -2.064 1.00 0.00 H new ATOM 0 HA SER B 80 3.869 12.905 -0.983 1.00 0.00 H new ATOM 0 HB2 SER B 80 5.889 13.497 -2.590 1.00 0.00 H new ATOM 0 HB3 SER B 80 6.194 12.716 -1.051 1.00 0.00 H new ATOM 0 HG SER B 80 5.698 11.108 -3.344 1.00 0.00 H new ATOM 2011 N ASN B 81 2.523 12.031 -3.540 1.00 0.00 N ATOM 2012 CA ASN B 81 1.718 12.381 -4.697 1.00 0.00 C ATOM 2013 C ASN B 81 0.599 13.313 -4.264 1.00 0.00 C ATOM 2014 O ASN B 81 -0.475 12.871 -3.880 1.00 0.00 O ATOM 2015 CB ASN B 81 1.144 11.118 -5.347 1.00 0.00 C ATOM 2016 CG ASN B 81 0.703 11.352 -6.777 1.00 0.00 C ATOM 2017 OD1 ASN B 81 1.269 12.186 -7.486 1.00 0.00 O ATOM 2018 ND2 ASN B 81 -0.297 10.612 -7.217 1.00 0.00 N ATOM 0 H ASN B 81 2.302 11.122 -3.133 1.00 0.00 H new ATOM 0 HA ASN B 81 2.342 12.887 -5.434 1.00 0.00 H new ATOM 0 HB2 ASN B 81 1.896 10.329 -5.326 1.00 0.00 H new ATOM 0 HB3 ASN B 81 0.295 10.765 -4.761 1.00 0.00 H new ATOM 0 HD21 ASN B 81 -0.628 10.720 -8.176 1.00 0.00 H new ATOM 0 HD22 ASN B 81 -0.739 9.932 -6.598 1.00 0.00 H new ATOM 2025 N GLU B 82 0.861 14.610 -4.340 1.00 0.00 N ATOM 2026 CA GLU B 82 -0.097 15.633 -3.918 1.00 0.00 C ATOM 2027 C GLU B 82 -1.468 15.486 -4.588 1.00 0.00 C ATOM 2028 O GLU B 82 -2.471 15.981 -4.074 1.00 0.00 O ATOM 2029 CB GLU B 82 0.475 17.033 -4.187 1.00 0.00 C ATOM 2030 CG GLU B 82 0.489 17.447 -5.658 1.00 0.00 C ATOM 2031 CD GLU B 82 1.319 16.527 -6.534 1.00 0.00 C ATOM 2032 OE1 GLU B 82 2.525 16.357 -6.261 1.00 0.00 O ATOM 2033 OE2 GLU B 82 0.771 15.964 -7.499 1.00 0.00 O ATOM 0 H GLU B 82 1.740 14.987 -4.694 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.254 15.494 -2.848 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -0.107 17.763 -3.624 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.494 17.074 -3.803 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -0.535 17.467 -6.032 1.00 0.00 H new ATOM 0 HG3 GLU B 82 0.878 18.462 -5.739 1.00 0.00 H new ATOM 2040 N SER B 83 -1.512 14.796 -5.716 1.00 0.00 N ATOM 2041 CA SER B 83 -2.751 14.610 -6.447 1.00 0.00 C ATOM 2042 C SER B 83 -3.713 13.649 -5.732 1.00 0.00 C ATOM 2043 O SER B 83 -4.863 14.006 -5.443 1.00 0.00 O ATOM 2044 CB SER B 83 -2.437 14.092 -7.850 1.00 0.00 C ATOM 2045 OG SER B 83 -1.043 14.154 -8.118 1.00 0.00 O ATOM 0 H SER B 83 -0.699 14.354 -6.145 1.00 0.00 H new ATOM 0 HA SER B 83 -3.252 15.576 -6.506 1.00 0.00 H new ATOM 0 HB2 SER B 83 -2.784 13.063 -7.947 1.00 0.00 H new ATOM 0 HB3 SER B 83 -2.979 14.682 -8.589 1.00 0.00 H new ATOM 0 HG SER B 83 -0.729 15.075 -8.005 1.00 0.00 H new ATOM 2051 N THR B 84 -3.254 12.441 -5.430 1.00 0.00 N ATOM 2052 CA THR B 84 -4.117 11.448 -4.805 1.00 0.00 C ATOM 2053 C THR B 84 -3.470 10.720 -3.618 1.00 0.00 C ATOM 2054 O THR B 84 -3.948 9.663 -3.233 1.00 0.00 O ATOM 2055 CB THR B 84 -4.548 10.413 -5.863 1.00 0.00 C ATOM 2056 OG1 THR B 84 -3.523 10.295 -6.855 1.00 0.00 O ATOM 2057 CG2 THR B 84 -5.850 10.814 -6.538 1.00 0.00 C ATOM 0 H THR B 84 -2.299 12.128 -5.606 1.00 0.00 H new ATOM 0 HA THR B 84 -4.974 11.990 -4.405 1.00 0.00 H new ATOM 0 HB THR B 84 -4.704 9.459 -5.359 1.00 0.00 H new ATOM 0 HG1 THR B 84 -2.651 10.213 -6.416 1.00 0.00 H new ATOM 0 HG21 THR B 84 -6.123 10.061 -7.278 1.00 0.00 H new ATOM 0 HG22 THR B 84 -6.639 10.891 -5.790 1.00 0.00 H new ATOM 0 HG23 THR B 84 -5.722 11.778 -7.031 1.00 0.00 H new ATOM 2065 N ALA B 85 -2.431 11.315 -3.027 1.00 0.00 N ATOM 2066 CA ALA B 85 -1.683 10.725 -1.894 1.00 0.00 C ATOM 2067 C ALA B 85 -2.538 9.890 -0.937 1.00 0.00 C ATOM 2068 O ALA B 85 -2.406 8.668 -0.883 1.00 0.00 O ATOM 2069 CB ALA B 85 -0.985 11.823 -1.105 1.00 0.00 C ATOM 0 H ALA B 85 -2.076 12.226 -3.317 1.00 0.00 H new ATOM 0 HA ALA B 85 -0.963 10.041 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -0.437 11.381 -0.273 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -0.290 12.354 -1.756 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -1.727 12.522 -0.720 1.00 0.00 H new ATOM 2075 N VAL B 86 -3.404 10.559 -0.181 1.00 0.00 N ATOM 2076 CA VAL B 86 -4.267 9.889 0.792 1.00 0.00 C ATOM 2077 C VAL B 86 -5.124 8.803 0.145 1.00 0.00 C ATOM 2078 O VAL B 86 -5.229 7.688 0.653 1.00 0.00 O ATOM 2079 CB VAL B 86 -5.203 10.896 1.493 1.00 0.00 C ATOM 2080 CG1 VAL B 86 -5.816 10.277 2.737 1.00 0.00 C ATOM 2081 CG2 VAL B 86 -4.463 12.179 1.840 1.00 0.00 C ATOM 0 H VAL B 86 -3.528 11.571 -0.223 1.00 0.00 H new ATOM 0 HA VAL B 86 -3.602 9.429 1.523 1.00 0.00 H new ATOM 0 HB VAL B 86 -6.007 11.149 0.802 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -6.473 11.002 3.218 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -6.392 9.394 2.458 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -5.024 9.990 3.429 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -5.146 12.871 2.333 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -3.633 11.951 2.508 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -4.079 12.636 0.928 1.00 0.00 H new ATOM 2091 N LYS B 87 -5.706 9.137 -0.995 1.00 0.00 N ATOM 2092 CA LYS B 87 -6.577 8.220 -1.721 1.00 0.00 C ATOM 2093 C LYS B 87 -5.815 6.973 -2.178 1.00 0.00 C ATOM 2094 O LYS B 87 -6.304 5.852 -2.037 1.00 0.00 O ATOM 2095 CB LYS B 87 -7.197 8.947 -2.918 1.00 0.00 C ATOM 2096 CG LYS B 87 -7.747 10.326 -2.566 1.00 0.00 C ATOM 2097 CD LYS B 87 -7.537 11.319 -3.699 1.00 0.00 C ATOM 2098 CE LYS B 87 -7.705 12.760 -3.235 1.00 0.00 C ATOM 2099 NZ LYS B 87 -7.365 13.739 -4.309 1.00 0.00 N ATOM 0 H LYS B 87 -5.591 10.046 -1.444 1.00 0.00 H new ATOM 0 HA LYS B 87 -7.370 7.888 -1.052 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -6.445 9.052 -3.700 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -8.001 8.336 -3.329 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -8.811 10.248 -2.343 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -7.258 10.694 -1.664 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -6.539 11.187 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -8.247 11.111 -4.499 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -8.734 12.919 -2.913 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -7.068 12.938 -2.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -7.637 14.696 -4.005 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -6.342 13.711 -4.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -7.880 13.493 -5.179 1.00 0.00 H new ATOM 2113 N GLU B 88 -4.618 7.177 -2.716 1.00 0.00 N ATOM 2114 CA GLU B 88 -3.784 6.076 -3.179 1.00 0.00 C ATOM 2115 C GLU B 88 -3.334 5.228 -1.998 1.00 0.00 C ATOM 2116 O GLU B 88 -3.351 4.003 -2.060 1.00 0.00 O ATOM 2117 CB GLU B 88 -2.561 6.610 -3.934 1.00 0.00 C ATOM 2118 CG GLU B 88 -2.862 7.067 -5.353 1.00 0.00 C ATOM 2119 CD GLU B 88 -1.773 7.956 -5.928 1.00 0.00 C ATOM 2120 OE1 GLU B 88 -1.645 9.110 -5.468 1.00 0.00 O ATOM 2121 OE2 GLU B 88 -1.059 7.522 -6.853 1.00 0.00 O ATOM 0 H GLU B 88 -4.202 8.100 -2.842 1.00 0.00 H new ATOM 0 HA GLU B 88 -4.372 5.459 -3.858 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -2.138 7.446 -3.376 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -1.799 5.831 -3.968 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -2.987 6.193 -5.993 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -3.809 7.607 -5.363 1.00 0.00 H new ATOM 2128 N ARG B 89 -2.958 5.901 -0.914 1.00 0.00 N ATOM 2129 CA ARG B 89 -2.497 5.240 0.304 1.00 0.00 C ATOM 2130 C ARG B 89 -3.484 4.176 0.781 1.00 0.00 C ATOM 2131 O ARG B 89 -3.097 3.037 1.055 1.00 0.00 O ATOM 2132 CB ARG B 89 -2.268 6.285 1.404 1.00 0.00 C ATOM 2133 CG ARG B 89 -2.006 5.703 2.787 1.00 0.00 C ATOM 2134 CD ARG B 89 -3.213 5.880 3.700 1.00 0.00 C ATOM 2135 NE ARG B 89 -2.825 6.211 5.072 1.00 0.00 N ATOM 2136 CZ ARG B 89 -3.645 6.126 6.126 1.00 0.00 C ATOM 2137 NH1 ARG B 89 -4.926 5.810 5.966 1.00 0.00 N ATOM 2138 NH2 ARG B 89 -3.189 6.397 7.339 1.00 0.00 N ATOM 0 H ARG B 89 -2.964 6.919 -0.855 1.00 0.00 H new ATOM 0 HA ARG B 89 -1.558 4.735 0.078 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -1.422 6.911 1.121 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -3.142 6.935 1.457 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -1.767 4.643 2.699 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -1.137 6.190 3.230 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -3.853 6.669 3.305 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -3.802 4.963 3.702 1.00 0.00 H new ATOM 0 HE ARG B 89 -1.869 6.526 5.235 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -5.294 5.629 5.032 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -5.541 5.748 6.777 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -2.215 6.670 7.468 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -3.812 6.333 8.144 1.00 0.00 H new ATOM 2152 N ASP B 90 -4.754 4.539 0.870 1.00 0.00 N ATOM 2153 CA ASP B 90 -5.770 3.605 1.334 1.00 0.00 C ATOM 2154 C ASP B 90 -6.166 2.597 0.270 1.00 0.00 C ATOM 2155 O ASP B 90 -6.543 1.474 0.600 1.00 0.00 O ATOM 2156 CB ASP B 90 -6.997 4.341 1.862 1.00 0.00 C ATOM 2157 CG ASP B 90 -6.880 4.608 3.346 1.00 0.00 C ATOM 2158 OD1 ASP B 90 -6.325 5.653 3.723 1.00 0.00 O ATOM 2159 OD2 ASP B 90 -7.313 3.744 4.137 1.00 0.00 O ATOM 0 H ASP B 90 -5.105 5.466 0.629 1.00 0.00 H new ATOM 0 HA ASP B 90 -5.322 3.044 2.154 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -7.116 5.284 1.329 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -7.891 3.749 1.666 1.00 0.00 H new ATOM 2164 N ALA B 91 -6.043 2.969 -0.998 1.00 0.00 N ATOM 2165 CA ALA B 91 -6.396 2.061 -2.079 1.00 0.00 C ATOM 2166 C ALA B 91 -5.357 0.963 -2.136 1.00 0.00 C ATOM 2167 O ALA B 91 -5.672 -0.212 -2.326 1.00 0.00 O ATOM 2168 CB ALA B 91 -6.488 2.793 -3.406 1.00 0.00 C ATOM 0 H ALA B 91 -5.705 3.883 -1.300 1.00 0.00 H new ATOM 0 HA ALA B 91 -7.379 1.631 -1.888 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -6.753 2.087 -4.193 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -7.251 3.569 -3.342 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -5.526 3.249 -3.637 1.00 0.00 H new ATOM 2174 N VAL B 92 -4.110 1.371 -1.952 1.00 0.00 N ATOM 2175 CA VAL B 92 -2.998 0.448 -1.927 1.00 0.00 C ATOM 2176 C VAL B 92 -3.140 -0.449 -0.710 1.00 0.00 C ATOM 2177 O VAL B 92 -2.963 -1.659 -0.793 1.00 0.00 O ATOM 2178 CB VAL B 92 -1.653 1.201 -1.866 1.00 0.00 C ATOM 2179 CG1 VAL B 92 -0.514 0.259 -1.549 1.00 0.00 C ATOM 2180 CG2 VAL B 92 -1.386 1.923 -3.170 1.00 0.00 C ATOM 0 H VAL B 92 -3.847 2.347 -1.817 1.00 0.00 H new ATOM 0 HA VAL B 92 -3.008 -0.146 -2.841 1.00 0.00 H new ATOM 0 HB VAL B 92 -1.720 1.937 -1.065 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.421 0.818 -1.513 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.692 -0.215 -0.583 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.449 -0.507 -2.322 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -0.433 2.448 -3.107 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -1.349 1.200 -3.985 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -2.184 2.641 -3.358 1.00 0.00 H new ATOM 2190 N LYS B 93 -3.486 0.174 0.412 1.00 0.00 N ATOM 2191 CA LYS B 93 -3.687 -0.532 1.668 1.00 0.00 C ATOM 2192 C LYS B 93 -4.675 -1.673 1.479 1.00 0.00 C ATOM 2193 O LYS B 93 -4.355 -2.835 1.720 1.00 0.00 O ATOM 2194 CB LYS B 93 -4.216 0.443 2.729 1.00 0.00 C ATOM 2195 CG LYS B 93 -4.343 -0.153 4.124 1.00 0.00 C ATOM 2196 CD LYS B 93 -5.751 -0.668 4.412 1.00 0.00 C ATOM 2197 CE LYS B 93 -6.703 0.451 4.820 1.00 0.00 C ATOM 2198 NZ LYS B 93 -7.251 1.186 3.648 1.00 0.00 N ATOM 0 H LYS B 93 -3.634 1.181 0.474 1.00 0.00 H new ATOM 0 HA LYS B 93 -2.734 -0.945 1.998 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -3.552 1.306 2.775 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -5.193 0.809 2.413 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -3.631 -0.971 4.233 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -4.077 0.602 4.864 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -6.141 -1.169 3.526 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -5.708 -1.413 5.206 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -7.526 0.031 5.399 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -6.179 1.150 5.471 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -8.213 1.516 3.864 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -6.644 2.003 3.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -7.279 0.553 2.823 1.00 0.00 H new ATOM 2212 N ASP B 94 -5.864 -1.318 1.034 1.00 0.00 N ATOM 2213 CA ASP B 94 -6.931 -2.286 0.802 1.00 0.00 C ATOM 2214 C ASP B 94 -6.510 -3.377 -0.170 1.00 0.00 C ATOM 2215 O ASP B 94 -6.517 -4.553 0.183 1.00 0.00 O ATOM 2216 CB ASP B 94 -8.185 -1.581 0.283 1.00 0.00 C ATOM 2217 CG ASP B 94 -9.114 -1.158 1.402 1.00 0.00 C ATOM 2218 OD1 ASP B 94 -8.763 -0.214 2.142 1.00 0.00 O ATOM 2219 OD2 ASP B 94 -10.189 -1.769 1.542 1.00 0.00 O ATOM 0 H ASP B 94 -6.123 -0.354 0.822 1.00 0.00 H new ATOM 0 HA ASP B 94 -7.150 -2.761 1.758 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -7.893 -0.704 -0.294 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -8.718 -2.246 -0.396 1.00 0.00 H new ATOM 2224 N LEU B 95 -6.122 -2.985 -1.381 1.00 0.00 N ATOM 2225 CA LEU B 95 -5.712 -3.946 -2.404 1.00 0.00 C ATOM 2226 C LEU B 95 -4.626 -4.882 -1.880 1.00 0.00 C ATOM 2227 O LEU B 95 -4.699 -6.097 -2.065 1.00 0.00 O ATOM 2228 CB LEU B 95 -5.224 -3.220 -3.661 1.00 0.00 C ATOM 2229 CG LEU B 95 -5.082 -4.100 -4.909 1.00 0.00 C ATOM 2230 CD1 LEU B 95 -6.411 -4.748 -5.266 1.00 0.00 C ATOM 2231 CD2 LEU B 95 -4.562 -3.281 -6.081 1.00 0.00 C ATOM 0 H LEU B 95 -6.083 -2.010 -1.679 1.00 0.00 H new ATOM 0 HA LEU B 95 -6.583 -4.548 -2.662 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -5.917 -2.409 -3.885 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -4.258 -2.764 -3.446 1.00 0.00 H new ATOM 0 HG LEU B 95 -4.363 -4.889 -4.689 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -6.287 -5.368 -6.154 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -6.748 -5.368 -4.435 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -7.152 -3.973 -5.465 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -4.467 -3.921 -6.958 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -5.259 -2.471 -6.296 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -3.587 -2.864 -5.829 1.00 0.00 H new ATOM 2243 N LEU B 96 -3.640 -4.316 -1.200 1.00 0.00 N ATOM 2244 CA LEU B 96 -2.544 -5.098 -0.649 1.00 0.00 C ATOM 2245 C LEU B 96 -3.017 -6.081 0.412 1.00 0.00 C ATOM 2246 O LEU B 96 -2.753 -7.279 0.307 1.00 0.00 O ATOM 2247 CB LEU B 96 -1.479 -4.184 -0.049 1.00 0.00 C ATOM 2248 CG LEU B 96 -0.369 -3.759 -1.003 1.00 0.00 C ATOM 2249 CD1 LEU B 96 0.540 -2.747 -0.333 1.00 0.00 C ATOM 2250 CD2 LEU B 96 0.431 -4.970 -1.448 1.00 0.00 C ATOM 0 H LEU B 96 -3.577 -3.315 -1.016 1.00 0.00 H new ATOM 0 HA LEU B 96 -2.118 -5.667 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -1.968 -3.288 0.335 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -1.028 -4.691 0.804 1.00 0.00 H new ATOM 0 HG LEU B 96 -0.820 -3.296 -1.880 1.00 0.00 H new ATOM 0 HD11 LEU B 96 1.329 -2.452 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.040 -1.869 -0.048 1.00 0.00 H new ATOM 0 HD13 LEU B 96 0.986 -3.191 0.557 1.00 0.00 H new ATOM 0 HD21 LEU B 96 1.221 -4.654 -2.129 1.00 0.00 H new ATOM 0 HD22 LEU B 96 0.874 -5.453 -0.577 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -0.227 -5.674 -1.957 1.00 0.00 H new ATOM 2262 N GLN B 97 -3.739 -5.590 1.416 1.00 0.00 N ATOM 2263 CA GLN B 97 -4.196 -6.454 2.497 1.00 0.00 C ATOM 2264 C GLN B 97 -5.211 -7.472 2.007 1.00 0.00 C ATOM 2265 O GLN B 97 -5.370 -8.523 2.612 1.00 0.00 O ATOM 2266 CB GLN B 97 -4.739 -5.646 3.688 1.00 0.00 C ATOM 2267 CG GLN B 97 -6.093 -4.994 3.478 1.00 0.00 C ATOM 2268 CD GLN B 97 -6.708 -4.525 4.785 1.00 0.00 C ATOM 2269 OE1 GLN B 97 -6.346 -5.176 5.885 1.00 0.00 O flip ATOM 2270 NE2 GLN B 97 -7.485 -3.576 4.812 1.00 0.00 N flip ATOM 0 H GLN B 97 -4.016 -4.612 1.502 1.00 0.00 H new ATOM 0 HA GLN B 97 -3.326 -7.005 2.854 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -4.805 -6.307 4.552 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -4.016 -4.868 3.936 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -5.986 -4.145 2.803 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -6.766 -5.703 2.995 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -7.740 -3.101 3.946 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.876 -3.262 5.700 1.00 0.00 H new ATOM 2279 N GLN B 98 -5.875 -7.174 0.903 1.00 0.00 N ATOM 2280 CA GLN B 98 -6.847 -8.094 0.338 1.00 0.00 C ATOM 2281 C GLN B 98 -6.137 -9.243 -0.371 1.00 0.00 C ATOM 2282 O GLN B 98 -6.589 -10.389 -0.336 1.00 0.00 O ATOM 2283 CB GLN B 98 -7.768 -7.366 -0.643 1.00 0.00 C ATOM 2284 CG GLN B 98 -8.907 -6.620 0.033 1.00 0.00 C ATOM 2285 CD GLN B 98 -9.501 -5.537 -0.847 1.00 0.00 C ATOM 2286 OE1 GLN B 98 -9.509 -5.649 -2.073 1.00 0.00 O ATOM 2287 NE2 GLN B 98 -9.998 -4.477 -0.227 1.00 0.00 N ATOM 0 H GLN B 98 -5.759 -6.305 0.382 1.00 0.00 H new ATOM 0 HA GLN B 98 -7.451 -8.497 1.151 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -7.178 -6.660 -1.227 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -8.184 -8.090 -1.344 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -9.688 -7.329 0.307 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -8.544 -6.172 0.958 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -9.972 -4.423 0.791 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -10.407 -3.715 -0.768 1.00 0.00 H new ATOM 2296 N LEU B 99 -5.014 -8.936 -1.007 1.00 0.00 N ATOM 2297 CA LEU B 99 -4.249 -9.941 -1.737 1.00 0.00 C ATOM 2298 C LEU B 99 -3.262 -10.673 -0.831 1.00 0.00 C ATOM 2299 O LEU B 99 -2.874 -11.807 -1.110 1.00 0.00 O ATOM 2300 CB LEU B 99 -3.506 -9.290 -2.901 1.00 0.00 C ATOM 2301 CG LEU B 99 -4.414 -8.610 -3.919 1.00 0.00 C ATOM 2302 CD1 LEU B 99 -3.632 -7.608 -4.755 1.00 0.00 C ATOM 2303 CD2 LEU B 99 -5.087 -9.643 -4.811 1.00 0.00 C ATOM 0 H LEU B 99 -4.612 -7.999 -1.033 1.00 0.00 H new ATOM 0 HA LEU B 99 -4.954 -10.678 -2.121 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -2.807 -8.553 -2.505 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -2.913 -10.050 -3.410 1.00 0.00 H new ATOM 0 HG LEU B 99 -5.189 -8.069 -3.376 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.300 -7.135 -5.475 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -3.203 -6.847 -4.103 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -2.832 -8.123 -5.287 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -5.731 -9.138 -5.531 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -4.327 -10.215 -5.343 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -5.686 -10.317 -4.199 1.00 0.00 H new ATOM 2315 N LEU B 100 -2.873 -10.019 0.257 1.00 0.00 N ATOM 2316 CA LEU B 100 -1.916 -10.575 1.218 1.00 0.00 C ATOM 2317 C LEU B 100 -2.206 -12.016 1.645 1.00 0.00 C ATOM 2318 O LEU B 100 -1.344 -12.886 1.487 1.00 0.00 O ATOM 2319 CB LEU B 100 -1.807 -9.681 2.451 1.00 0.00 C ATOM 2320 CG LEU B 100 -0.723 -8.627 2.349 1.00 0.00 C ATOM 2321 CD1 LEU B 100 -0.577 -7.867 3.656 1.00 0.00 C ATOM 2322 CD2 LEU B 100 0.579 -9.297 1.969 1.00 0.00 C ATOM 0 H LEU B 100 -3.210 -9.088 0.502 1.00 0.00 H new ATOM 0 HA LEU B 100 -0.965 -10.604 0.686 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -2.765 -9.188 2.617 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -1.614 -10.304 3.324 1.00 0.00 H new ATOM 0 HG LEU B 100 -0.997 -7.903 1.581 1.00 0.00 H new ATOM 0 HD11 LEU B 100 0.207 -7.117 3.555 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -1.519 -7.376 3.899 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -0.314 -8.562 4.454 1.00 0.00 H new ATOM 0 HD21 LEU B 100 1.366 -8.546 1.893 1.00 0.00 H new ATOM 0 HD22 LEU B 100 0.848 -10.029 2.731 1.00 0.00 H new ATOM 0 HD23 LEU B 100 0.463 -9.799 1.009 1.00 0.00 H new ATOM 2334 N PRO B 101 -3.397 -12.311 2.189 1.00 0.00 N ATOM 2335 CA PRO B 101 -3.714 -13.659 2.640 1.00 0.00 C ATOM 2336 C PRO B 101 -4.058 -14.595 1.484 1.00 0.00 C ATOM 2337 O PRO B 101 -4.155 -15.807 1.662 1.00 0.00 O ATOM 2338 CB PRO B 101 -4.900 -13.446 3.574 1.00 0.00 C ATOM 2339 CG PRO B 101 -5.565 -12.198 3.104 1.00 0.00 C ATOM 2340 CD PRO B 101 -4.519 -11.378 2.401 1.00 0.00 C ATOM 0 HA PRO B 101 -2.869 -14.145 3.128 1.00 0.00 H new ATOM 0 HB2 PRO B 101 -5.585 -14.293 3.536 1.00 0.00 H new ATOM 0 HB3 PRO B 101 -4.571 -13.348 4.609 1.00 0.00 H new ATOM 0 HG2 PRO B 101 -6.389 -12.431 2.430 1.00 0.00 H new ATOM 0 HG3 PRO B 101 -5.987 -11.646 3.944 1.00 0.00 H new ATOM 0 HD2 PRO B 101 -4.892 -10.985 1.455 1.00 0.00 H new ATOM 0 HD3 PRO B 101 -4.215 -10.522 3.004 1.00 0.00 H new ATOM 2348 N LYS B 102 -4.222 -14.028 0.296 1.00 0.00 N ATOM 2349 CA LYS B 102 -4.519 -14.819 -0.888 1.00 0.00 C ATOM 2350 C LYS B 102 -3.235 -15.460 -1.394 1.00 0.00 C ATOM 2351 O LYS B 102 -3.195 -16.642 -1.738 1.00 0.00 O ATOM 2352 CB LYS B 102 -5.124 -13.947 -1.993 1.00 0.00 C ATOM 2353 CG LYS B 102 -6.532 -13.456 -1.704 1.00 0.00 C ATOM 2354 CD LYS B 102 -7.108 -12.718 -2.903 1.00 0.00 C ATOM 2355 CE LYS B 102 -8.561 -12.337 -2.686 1.00 0.00 C ATOM 2356 NZ LYS B 102 -8.710 -11.211 -1.730 1.00 0.00 N ATOM 0 H LYS B 102 -4.154 -13.024 0.128 1.00 0.00 H new ATOM 0 HA LYS B 102 -5.245 -15.588 -0.622 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -4.477 -13.084 -2.154 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -5.134 -14.515 -2.923 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -7.171 -14.302 -1.451 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -6.520 -12.795 -0.837 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -6.521 -11.819 -3.093 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -7.026 -13.346 -3.790 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -9.009 -12.062 -3.641 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -9.110 -13.202 -2.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -9.099 -11.566 -0.833 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -7.781 -10.778 -1.556 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -9.355 -10.499 -2.130 1.00 0.00 H new ATOM 2370 N PHE B 103 -2.177 -14.657 -1.405 1.00 0.00 N ATOM 2371 CA PHE B 103 -0.866 -15.098 -1.861 1.00 0.00 C ATOM 2372 C PHE B 103 -0.075 -15.723 -0.726 1.00 0.00 C ATOM 2373 O PHE B 103 1.073 -16.110 -0.903 1.00 0.00 O ATOM 2374 CB PHE B 103 -0.100 -13.926 -2.468 1.00 0.00 C ATOM 2375 CG PHE B 103 -0.660 -13.499 -3.793 1.00 0.00 C ATOM 2376 CD1 PHE B 103 -1.706 -12.594 -3.856 1.00 0.00 C ATOM 2377 CD2 PHE B 103 -0.153 -14.017 -4.972 1.00 0.00 C ATOM 2378 CE1 PHE B 103 -2.236 -12.211 -5.069 1.00 0.00 C ATOM 2379 CE2 PHE B 103 -0.679 -13.635 -6.191 1.00 0.00 C ATOM 2380 CZ PHE B 103 -1.722 -12.733 -6.238 1.00 0.00 C ATOM 0 H PHE B 103 -2.205 -13.684 -1.099 1.00 0.00 H new ATOM 0 HA PHE B 103 -1.008 -15.860 -2.627 1.00 0.00 H new ATOM 0 HB2 PHE B 103 -0.125 -13.083 -1.778 1.00 0.00 H new ATOM 0 HB3 PHE B 103 0.946 -14.205 -2.592 1.00 0.00 H new ATOM 0 HD1 PHE B 103 -2.112 -12.183 -2.943 1.00 0.00 H new ATOM 0 HD2 PHE B 103 0.661 -14.726 -4.939 1.00 0.00 H new ATOM 0 HE1 PHE B 103 -3.052 -11.504 -5.104 1.00 0.00 H new ATOM 0 HE2 PHE B 103 -0.274 -14.042 -7.106 1.00 0.00 H new ATOM 0 HZ PHE B 103 -2.136 -12.436 -7.190 1.00 0.00 H new ATOM 2390 N LYS B 104 -0.696 -15.833 0.439 1.00 0.00 N ATOM 2391 CA LYS B 104 -0.036 -16.422 1.588 1.00 0.00 C ATOM 2392 C LYS B 104 0.217 -17.905 1.341 1.00 0.00 C ATOM 2393 O LYS B 104 -0.691 -18.723 1.448 1.00 0.00 O ATOM 2394 CB LYS B 104 -0.890 -16.238 2.843 1.00 0.00 C ATOM 2395 CG LYS B 104 -0.124 -16.445 4.140 1.00 0.00 C ATOM 2396 CD LYS B 104 0.231 -15.121 4.796 1.00 0.00 C ATOM 2397 CE LYS B 104 1.168 -14.293 3.929 1.00 0.00 C ATOM 2398 NZ LYS B 104 0.551 -13.006 3.511 1.00 0.00 N ATOM 0 H LYS B 104 -1.652 -15.523 0.611 1.00 0.00 H new ATOM 0 HA LYS B 104 0.919 -15.919 1.739 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -1.315 -15.234 2.839 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -1.725 -16.938 2.809 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -0.724 -17.043 4.826 1.00 0.00 H new ATOM 0 HG3 LYS B 104 0.787 -17.008 3.939 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -0.680 -14.555 4.989 1.00 0.00 H new ATOM 0 HD3 LYS B 104 0.700 -15.308 5.762 1.00 0.00 H new ATOM 0 HE2 LYS B 104 2.088 -14.092 4.479 1.00 0.00 H new ATOM 0 HE3 LYS B 104 1.444 -14.866 3.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 1.298 -12.302 3.340 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 0.005 -13.150 2.638 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -0.082 -12.664 4.262 1.00 0.00 H new ATOM 2412 N ARG B 105 1.455 -18.236 1.003 1.00 0.00 N ATOM 2413 CA ARG B 105 1.832 -19.614 0.731 1.00 0.00 C ATOM 2414 C ARG B 105 2.925 -20.057 1.695 1.00 0.00 C ATOM 2415 O ARG B 105 2.994 -19.554 2.820 1.00 0.00 O ATOM 2416 CB ARG B 105 2.307 -19.767 -0.721 1.00 0.00 C ATOM 2417 CG ARG B 105 1.236 -19.461 -1.759 1.00 0.00 C ATOM 2418 CD ARG B 105 0.038 -20.389 -1.624 1.00 0.00 C ATOM 2419 NE ARG B 105 -1.211 -19.642 -1.474 1.00 0.00 N ATOM 2420 CZ ARG B 105 -2.282 -20.104 -0.828 1.00 0.00 C ATOM 2421 NH1 ARG B 105 -2.291 -21.336 -0.338 1.00 0.00 N ATOM 2422 NH2 ARG B 105 -3.353 -19.329 -0.686 1.00 0.00 N ATOM 0 H ARG B 105 2.218 -17.565 0.911 1.00 0.00 H new ATOM 0 HA ARG B 105 0.957 -20.249 0.874 1.00 0.00 H new ATOM 0 HB2 ARG B 105 3.157 -19.105 -0.886 1.00 0.00 H new ATOM 0 HB3 ARG B 105 2.663 -20.786 -0.871 1.00 0.00 H new ATOM 0 HG2 ARG B 105 0.909 -18.427 -1.650 1.00 0.00 H new ATOM 0 HG3 ARG B 105 1.660 -19.558 -2.758 1.00 0.00 H new ATOM 0 HD2 ARG B 105 -0.025 -21.031 -2.502 1.00 0.00 H new ATOM 0 HD3 ARG B 105 0.178 -21.041 -0.762 1.00 0.00 H new ATOM 0 HE ARG B 105 -1.266 -18.712 -1.889 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -1.475 -21.937 -0.454 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -3.114 -21.683 0.155 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -3.354 -18.384 -1.071 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -4.174 -19.679 -0.192 1.00 0.00 H new ATOM 2436 N LYS B 106 3.761 -21.002 1.247 1.00 0.00 N ATOM 2437 CA LYS B 106 4.871 -21.549 2.041 1.00 0.00 C ATOM 2438 C LYS B 106 4.343 -22.568 3.044 1.00 0.00 C ATOM 2439 O LYS B 106 4.875 -23.670 3.162 1.00 0.00 O ATOM 2440 CB LYS B 106 5.669 -20.446 2.750 1.00 0.00 C ATOM 2441 CG LYS B 106 6.454 -19.558 1.797 1.00 0.00 C ATOM 2442 CD LYS B 106 6.673 -18.171 2.379 1.00 0.00 C ATOM 2443 CE LYS B 106 7.475 -17.291 1.433 1.00 0.00 C ATOM 2444 NZ LYS B 106 7.425 -15.863 1.832 1.00 0.00 N ATOM 0 H LYS B 106 3.686 -21.412 0.316 1.00 0.00 H new ATOM 0 HA LYS B 106 5.557 -22.047 1.356 1.00 0.00 H new ATOM 0 HB2 LYS B 106 4.983 -19.827 3.329 1.00 0.00 H new ATOM 0 HB3 LYS B 106 6.359 -20.905 3.458 1.00 0.00 H new ATOM 0 HG2 LYS B 106 7.418 -20.019 1.580 1.00 0.00 H new ATOM 0 HG3 LYS B 106 5.919 -19.476 0.851 1.00 0.00 H new ATOM 0 HD2 LYS B 106 5.709 -17.704 2.583 1.00 0.00 H new ATOM 0 HD3 LYS B 106 7.195 -18.253 3.332 1.00 0.00 H new ATOM 0 HE2 LYS B 106 8.512 -17.627 1.415 1.00 0.00 H new ATOM 0 HE3 LYS B 106 7.087 -17.399 0.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 8.343 -15.415 1.636 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 6.680 -15.378 1.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 7.216 -15.794 2.849 1.00 0.00 H new ATOM 2458 N ALA B 107 3.299 -22.189 3.762 1.00 0.00 N ATOM 2459 CA ALA B 107 2.665 -23.076 4.725 1.00 0.00 C ATOM 2460 C ALA B 107 1.332 -23.534 4.158 1.00 0.00 C ATOM 2461 O ALA B 107 0.500 -24.125 4.848 1.00 0.00 O ATOM 2462 CB ALA B 107 2.481 -22.377 6.065 1.00 0.00 C ATOM 0 H ALA B 107 2.869 -21.266 3.696 1.00 0.00 H new ATOM 0 HA ALA B 107 3.301 -23.944 4.900 1.00 0.00 H new ATOM 0 HB1 ALA B 107 2.005 -23.060 6.769 1.00 0.00 H new ATOM 0 HB2 ALA B 107 3.453 -22.074 6.454 1.00 0.00 H new ATOM 0 HB3 ALA B 107 1.853 -21.496 5.933 1.00 0.00 H new ATOM 2468 N ASN B 108 1.175 -23.257 2.876 1.00 0.00 N ATOM 2469 CA ASN B 108 -0.019 -23.586 2.118 1.00 0.00 C ATOM 2470 C ASN B 108 0.235 -23.220 0.663 1.00 0.00 C ATOM 2471 O ASN B 108 -0.659 -23.421 -0.180 1.00 0.00 O ATOM 2472 CB ASN B 108 -1.239 -22.819 2.648 1.00 0.00 C ATOM 2473 CG ASN B 108 -2.556 -23.388 2.146 1.00 0.00 C ATOM 2474 OD1 ASN B 108 -3.504 -22.648 1.869 1.00 0.00 O ATOM 2475 ND2 ASN B 108 -2.630 -24.704 2.030 1.00 0.00 N ATOM 2476 OXT ASN B 108 1.343 -22.711 0.381 1.00 0.00 O ATOM 0 H ASN B 108 1.890 -22.787 2.321 1.00 0.00 H new ATOM 0 HA ASN B 108 -0.233 -24.650 2.216 1.00 0.00 H new ATOM 0 HB2 ASN B 108 -1.231 -22.841 3.738 1.00 0.00 H new ATOM 0 HB3 ASN B 108 -1.163 -21.773 2.350 1.00 0.00 H new ATOM 0 HD21 ASN B 108 -3.492 -25.139 1.702 1.00 0.00 H new ATOM 0 HD22 ASN B 108 -1.825 -25.283 2.269 1.00 0.00 H new TER 2483 ASN B 108