USER MOD reduce.3.24.130724 H: found=0, std=0, add=1450, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1448 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 SER OG : rot -45:sc= 1.3 USER MOD Set 1.2: B 80 TYR OH : rot 130:sc= 0.967 USER MOD Set 2.1: B 79 TYR OH : rot 150:sc= 0 USER MOD Set 2.2: B 83 ASN : amide:sc= -0.611 K(o=-0.61,f=-2.3!) USER MOD Set 3.1: B 23 THR OG1 : rot 81:sc= 1.28 USER MOD Set 3.2: B 67 HIS : no HE2:sc= -0.456! C(o=0.82!,f=-3.8!) USER MOD Set 4.1: A 79 TYR OH : rot 100:sc= 0.06 USER MOD Set 4.2: A 83 ASN : amide:sc= -1.51 X(o=-1.5,f=-1.8!) USER MOD Set 5.1: A 80 TYR OH : rot 70:sc= 1.13 USER MOD Set 5.2: B 21 SER OG : rot -28:sc= 1.23 USER MOD Set 6.1: A 48 SER OG : rot -167:sc= 1.18 USER MOD Set 6.2: A 53 TYR OH : rot 30:sc= 1.01 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 161:sc= 1.41 (180deg=0.886) USER MOD Single : A 4 THR OG1 : rot 43:sc= 0.593 USER MOD Single : A 7 THR OG1 : rot 38:sc= 0.138 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -148:sc= -1.58 (180deg=-3.78!) USER MOD Single : A 23 THR OG1 : rot 76:sc= 1.28 USER MOD Single : A 26 THR OG1 : rot 73:sc= 1.34 USER MOD Single : A 28 TYR OH : rot 150:sc= -0.915 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 40 ASN : amide:sc= -0.056 X(o=-0.056,f=0) USER MOD Single : A 41 GLN : amide:sc= -0.396 X(o=-0.4,f=-0.11) USER MOD Single : A 45 TYR OH : rot 180:sc= 0.875 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 62 ASN : amide:sc= 0.621 K(o=0.62,f=-4.5!) USER MOD Single : A 67 HIS : no HE2:sc= 0.432 K(o=0.43,f=-5.5!) USER MOD Single : A 73 MET CE :methyl -133:sc= -2.07 (180deg=-3.75!) USER MOD Single : A 77 THR OG1 : rot 94:sc= 0.641 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HD1:sc= 0.776 K(o=0.78,f=-4.9!) USER MOD Single : A 89 LYS NZ :NH3+ 174:sc= 1.08 (180deg=1.02) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 171:sc= 0.841 (180deg=0.593) USER MOD Single : B 4 THR OG1 : rot 37:sc= 0.535 USER MOD Single : B 7 THR OG1 : rot -91:sc= 1.24 USER MOD Single : B 15 ASN : amide:sc= -0.0611 X(o=-0.061,f=-0.12) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ -169:sc= 0.376 (180deg=0.268) USER MOD Single : B 26 THR OG1 : rot 73:sc= 0.671 USER MOD Single : B 28 TYR OH : rot 120:sc= -1.63 USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 40 ASN : amide:sc= -0.0429 K(o=-0.043,f=-2.1!) USER MOD Single : B 41 GLN : amide:sc= 0.22 X(o=0.22,f=-0.2) USER MOD Single : B 45 TYR OH : rot -51:sc= 0.754 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : B 62 ASN :FLIP amide:sc= -0.044 F(o=-0.62!,f=-0.044) USER MOD Single : B 73 MET CE :methyl 138:sc= -1.82 (180deg=-2.31!) USER MOD Single : B 77 THR OG1 : rot 79:sc= 0.65 USER MOD Single : B 78 LYS NZ :NH3+ -178:sc= 1.3 (180deg=1.26) USER MOD Single : B 84 HIS : no HD1:sc= 0.993 K(o=0.99,f=-5.9!) USER MOD Single : B 89 LYS NZ :NH3+ -172:sc=-0.00642 (180deg=-0.0864) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.393 5.547 30.515 1.00 0.00 N ATOM 2 CA MET A 1 -14.180 5.201 29.775 1.00 52.33 C ATOM 3 C MET A 1 -12.964 5.694 30.511 1.00 42.25 C ATOM 4 O MET A 1 -13.079 6.385 31.523 1.00 55.33 O ATOM 5 CB MET A 1 -14.193 5.773 28.345 1.00 42.41 C ATOM 6 CG MET A 1 -15.210 5.151 27.400 1.00 32.44 C ATOM 7 SD MET A 1 -16.918 5.386 27.917 1.00 2.21 S ATOM 8 CE MET A 1 -17.763 4.537 26.585 1.00 23.10 C ATOM 0 H1 MET A 1 -16.213 5.502 29.877 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.526 4.875 31.298 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.304 6.510 30.897 1.00 0.00 H new ATOM 0 HA MET A 1 -14.146 4.114 29.697 1.00 52.33 H new ATOM 0 HB2 MET A 1 -14.385 6.844 28.403 1.00 42.41 H new ATOM 0 HB3 MET A 1 -13.199 5.650 27.914 1.00 42.41 H new ATOM 0 HG2 MET A 1 -15.078 5.579 26.406 1.00 32.44 H new ATOM 0 HG3 MET A 1 -15.009 4.083 27.316 1.00 32.44 H new ATOM 0 HE1 MET A 1 -18.840 4.586 26.748 1.00 23.10 H new ATOM 0 HE2 MET A 1 -17.517 5.014 25.636 1.00 23.10 H new ATOM 0 HE3 MET A 1 -17.447 3.494 26.560 1.00 23.10 H new ATOM 20 N GLY A 2 -11.809 5.356 30.008 1.00 34.32 N ATOM 21 CA GLY A 2 -10.584 5.765 30.618 1.00 41.11 C ATOM 22 C GLY A 2 -9.466 5.689 29.635 1.00 15.05 C ATOM 23 O GLY A 2 -8.762 4.675 29.567 1.00 74.44 O ATOM 0 H GLY A 2 -11.695 4.791 29.166 1.00 34.32 H new ATOM 0 HA2 GLY A 2 -10.679 6.784 30.993 1.00 41.11 H new ATOM 0 HA3 GLY A 2 -10.367 5.129 31.476 1.00 41.11 H new ATOM 27 N PHE A 3 -9.320 6.730 28.840 1.00 11.31 N ATOM 28 CA PHE A 3 -8.282 6.770 27.837 1.00 32.04 C ATOM 29 C PHE A 3 -6.959 7.087 28.480 1.00 11.32 C ATOM 30 O PHE A 3 -6.589 8.255 28.637 1.00 71.01 O ATOM 31 CB PHE A 3 -8.591 7.775 26.714 1.00 11.25 C ATOM 32 CG PHE A 3 -9.846 7.477 25.933 1.00 10.24 C ATOM 33 CD1 PHE A 3 -11.051 8.072 26.274 1.00 45.23 C ATOM 34 CD2 PHE A 3 -9.816 6.608 24.854 1.00 10.22 C ATOM 35 CE1 PHE A 3 -12.200 7.804 25.558 1.00 42.41 C ATOM 36 CE2 PHE A 3 -10.965 6.336 24.134 1.00 32.43 C ATOM 37 CZ PHE A 3 -12.157 6.936 24.487 1.00 71.01 C ATOM 0 H PHE A 3 -9.911 7.561 28.872 1.00 11.31 H new ATOM 0 HA PHE A 3 -8.234 5.784 27.375 1.00 32.04 H new ATOM 0 HB2 PHE A 3 -8.677 8.771 27.149 1.00 11.25 H new ATOM 0 HB3 PHE A 3 -7.747 7.800 26.025 1.00 11.25 H new ATOM 0 HD1 PHE A 3 -11.091 8.754 27.111 1.00 45.23 H new ATOM 0 HD2 PHE A 3 -8.885 6.138 24.572 1.00 10.22 H new ATOM 0 HE1 PHE A 3 -13.132 8.274 25.836 1.00 42.41 H new ATOM 0 HE2 PHE A 3 -10.930 5.655 23.297 1.00 32.43 H new ATOM 0 HZ PHE A 3 -13.055 6.726 23.925 1.00 71.01 H new ATOM 47 N THR A 4 -6.292 6.063 28.906 1.00 35.14 N ATOM 48 CA THR A 4 -5.028 6.179 29.545 1.00 13.00 C ATOM 49 C THR A 4 -3.924 5.900 28.552 1.00 23.32 C ATOM 50 O THR A 4 -3.680 4.746 28.181 1.00 65.13 O ATOM 51 CB THR A 4 -4.943 5.200 30.721 1.00 51.14 C ATOM 52 OG1 THR A 4 -5.302 3.898 30.254 1.00 72.30 O ATOM 53 CG2 THR A 4 -5.884 5.616 31.840 1.00 62.14 C ATOM 0 H THR A 4 -6.622 5.102 28.815 1.00 35.14 H new ATOM 0 HA THR A 4 -4.912 7.194 29.926 1.00 13.00 H new ATOM 0 HB THR A 4 -3.926 5.198 31.114 1.00 51.14 H new ATOM 0 HG1 THR A 4 -4.877 3.733 29.386 1.00 72.30 H new ATOM 0 HG21 THR A 4 -5.806 4.906 32.664 1.00 62.14 H new ATOM 0 HG22 THR A 4 -5.613 6.611 32.192 1.00 62.14 H new ATOM 0 HG23 THR A 4 -6.908 5.629 31.468 1.00 62.14 H new ATOM 61 N ASP A 5 -3.295 6.935 28.093 1.00 4.53 N ATOM 62 CA ASP A 5 -2.240 6.804 27.132 1.00 5.13 C ATOM 63 C ASP A 5 -1.174 7.813 27.380 1.00 34.14 C ATOM 64 O ASP A 5 -1.406 9.027 27.276 1.00 70.04 O ATOM 65 CB ASP A 5 -2.755 6.955 25.700 1.00 24.04 C ATOM 66 CG ASP A 5 -1.628 6.920 24.683 1.00 33.54 C ATOM 67 OD1 ASP A 5 -1.233 5.809 24.248 1.00 33.15 O ATOM 68 OD2 ASP A 5 -1.124 8.003 24.303 1.00 23.43 O ATOM 0 H ASP A 5 -3.496 7.895 28.372 1.00 4.53 H new ATOM 0 HA ASP A 5 -1.828 5.801 27.247 1.00 5.13 H new ATOM 0 HB2 ASP A 5 -3.464 6.156 25.483 1.00 24.04 H new ATOM 0 HB3 ASP A 5 -3.298 7.896 25.607 1.00 24.04 H new ATOM 73 N GLU A 6 -0.030 7.343 27.730 1.00 15.11 N ATOM 74 CA GLU A 6 1.084 8.195 27.888 1.00 42.44 C ATOM 75 C GLU A 6 2.219 7.696 27.039 1.00 40.44 C ATOM 76 O GLU A 6 2.977 6.794 27.442 1.00 43.43 O ATOM 77 CB GLU A 6 1.519 8.336 29.345 1.00 31.11 C ATOM 78 CG GLU A 6 2.711 9.266 29.515 1.00 3.34 C ATOM 79 CD GLU A 6 3.164 9.385 30.932 1.00 2.22 C ATOM 80 OE1 GLU A 6 2.692 10.306 31.641 1.00 51.23 O ATOM 81 OE2 GLU A 6 4.013 8.577 31.365 1.00 3.11 O ATOM 0 H GLU A 6 0.156 6.357 27.914 1.00 15.11 H new ATOM 0 HA GLU A 6 0.788 9.192 27.561 1.00 42.44 H new ATOM 0 HB2 GLU A 6 0.683 8.712 29.935 1.00 31.11 H new ATOM 0 HB3 GLU A 6 1.771 7.352 29.741 1.00 31.11 H new ATOM 0 HG2 GLU A 6 3.538 8.902 28.905 1.00 3.34 H new ATOM 0 HG3 GLU A 6 2.449 10.255 29.139 1.00 3.34 H new ATOM 88 N THR A 7 2.303 8.200 25.850 1.00 12.31 N ATOM 89 CA THR A 7 3.388 7.873 25.022 1.00 63.43 C ATOM 90 C THR A 7 4.544 8.782 25.387 1.00 43.24 C ATOM 91 O THR A 7 4.485 10.001 25.191 1.00 63.10 O ATOM 92 CB THR A 7 3.031 7.927 23.503 1.00 62.23 C ATOM 93 OG1 THR A 7 2.483 9.204 23.140 1.00 11.22 O ATOM 94 CG2 THR A 7 2.029 6.835 23.156 1.00 72.14 C ATOM 0 H THR A 7 1.623 8.841 25.441 1.00 12.31 H new ATOM 0 HA THR A 7 3.674 6.835 25.192 1.00 63.43 H new ATOM 0 HB THR A 7 3.953 7.771 22.943 1.00 62.23 H new ATOM 0 HG1 THR A 7 2.954 9.912 23.626 1.00 11.22 H new ATOM 0 HG21 THR A 7 1.790 6.885 22.094 1.00 72.14 H new ATOM 0 HG22 THR A 7 2.459 5.860 23.385 1.00 72.14 H new ATOM 0 HG23 THR A 7 1.120 6.977 23.740 1.00 72.14 H new ATOM 102 N VAL A 8 5.569 8.186 25.982 1.00 63.41 N ATOM 103 CA VAL A 8 6.735 8.909 26.472 1.00 65.12 C ATOM 104 C VAL A 8 7.444 9.637 25.338 1.00 14.44 C ATOM 105 O VAL A 8 8.123 10.652 25.565 1.00 15.34 O ATOM 106 CB VAL A 8 7.729 7.948 27.203 1.00 54.54 C ATOM 107 CG1 VAL A 8 8.276 6.876 26.267 1.00 24.05 C ATOM 108 CG2 VAL A 8 8.859 8.717 27.858 1.00 34.40 C ATOM 0 H VAL A 8 5.615 7.179 26.139 1.00 63.41 H new ATOM 0 HA VAL A 8 6.383 9.649 27.190 1.00 65.12 H new ATOM 0 HB VAL A 8 7.164 7.443 27.986 1.00 54.54 H new ATOM 0 HG11 VAL A 8 8.962 6.230 26.815 1.00 24.05 H new ATOM 0 HG12 VAL A 8 7.452 6.280 25.875 1.00 24.05 H new ATOM 0 HG13 VAL A 8 8.806 7.350 25.441 1.00 24.05 H new ATOM 0 HG21 VAL A 8 9.532 8.020 28.357 1.00 34.40 H new ATOM 0 HG22 VAL A 8 9.410 9.272 27.098 1.00 34.40 H new ATOM 0 HG23 VAL A 8 8.449 9.413 28.590 1.00 34.40 H new ATOM 118 N ARG A 9 7.227 9.133 24.118 1.00 23.35 N ATOM 119 CA ARG A 9 7.834 9.640 22.908 1.00 20.12 C ATOM 120 C ARG A 9 9.293 9.270 22.886 1.00 2.32 C ATOM 121 O ARG A 9 10.138 9.926 23.510 1.00 53.31 O ATOM 122 CB ARG A 9 7.622 11.154 22.725 1.00 43.50 C ATOM 123 CG ARG A 9 6.162 11.568 22.642 1.00 13.54 C ATOM 124 CD ARG A 9 6.034 13.070 22.536 1.00 62.23 C ATOM 125 NE ARG A 9 4.638 13.507 22.426 1.00 50.12 N ATOM 126 CZ ARG A 9 4.255 14.761 22.164 1.00 42.33 C ATOM 127 NH1 ARG A 9 5.157 15.736 22.075 1.00 2.32 N ATOM 128 NH2 ARG A 9 2.975 15.040 22.022 1.00 52.21 N ATOM 0 H ARG A 9 6.606 8.341 23.954 1.00 23.35 H new ATOM 0 HA ARG A 9 7.337 9.173 22.058 1.00 20.12 H new ATOM 0 HB2 ARG A 9 8.091 11.679 23.557 1.00 43.50 H new ATOM 0 HB3 ARG A 9 8.132 11.475 21.817 1.00 43.50 H new ATOM 0 HG2 ARG A 9 5.695 11.097 21.777 1.00 13.54 H new ATOM 0 HG3 ARG A 9 5.629 11.215 23.524 1.00 13.54 H new ATOM 0 HD2 ARG A 9 6.489 13.533 23.412 1.00 62.23 H new ATOM 0 HD3 ARG A 9 6.590 13.419 21.666 1.00 62.23 H new ATOM 0 HE ARG A 9 3.909 12.806 22.559 1.00 50.12 H new ATOM 0 HH11 ARG A 9 6.147 15.529 22.207 1.00 2.32 H new ATOM 0 HH12 ARG A 9 4.858 16.690 21.875 1.00 2.32 H new ATOM 0 HH21 ARG A 9 2.279 14.300 22.112 1.00 52.21 H new ATOM 0 HH22 ARG A 9 2.681 15.996 21.822 1.00 52.21 H new ATOM 142 N PHE A 10 9.576 8.177 22.235 1.00 34.01 N ATOM 143 CA PHE A 10 10.915 7.696 22.132 1.00 53.24 C ATOM 144 C PHE A 10 11.689 8.606 21.208 1.00 12.40 C ATOM 145 O PHE A 10 12.741 9.135 21.585 1.00 70.52 O ATOM 146 CB PHE A 10 10.930 6.250 21.605 1.00 21.35 C ATOM 147 CG PHE A 10 12.302 5.640 21.563 1.00 22.30 C ATOM 148 CD1 PHE A 10 12.769 4.900 22.630 1.00 51.32 C ATOM 149 CD2 PHE A 10 13.128 5.815 20.463 1.00 41.34 C ATOM 150 CE1 PHE A 10 14.028 4.349 22.606 1.00 1.12 C ATOM 151 CE2 PHE A 10 14.387 5.266 20.434 1.00 53.24 C ATOM 152 CZ PHE A 10 14.837 4.533 21.507 1.00 63.11 C ATOM 0 H PHE A 10 8.882 7.598 21.763 1.00 34.01 H new ATOM 0 HA PHE A 10 11.380 7.696 23.118 1.00 53.24 H new ATOM 0 HB2 PHE A 10 10.287 5.636 22.236 1.00 21.35 H new ATOM 0 HB3 PHE A 10 10.503 6.233 20.602 1.00 21.35 H new ATOM 0 HD1 PHE A 10 12.138 4.752 23.494 1.00 51.32 H new ATOM 0 HD2 PHE A 10 12.777 6.390 19.619 1.00 41.34 H new ATOM 0 HE1 PHE A 10 14.382 3.773 23.448 1.00 1.12 H new ATOM 0 HE2 PHE A 10 15.021 5.410 19.572 1.00 53.24 H new ATOM 0 HZ PHE A 10 15.827 4.101 21.488 1.00 63.11 H new ATOM 162 N ASP A 11 11.132 8.798 20.006 1.00 2.23 N ATOM 163 CA ASP A 11 11.740 9.616 18.957 1.00 51.10 C ATOM 164 C ASP A 11 13.124 9.163 18.611 1.00 63.23 C ATOM 165 O ASP A 11 14.125 9.620 19.187 1.00 43.11 O ATOM 166 CB ASP A 11 11.696 11.131 19.243 1.00 24.15 C ATOM 167 CG ASP A 11 10.306 11.706 19.136 1.00 73.20 C ATOM 168 OD1 ASP A 11 9.527 11.620 20.101 1.00 34.54 O ATOM 169 OD2 ASP A 11 9.959 12.251 18.064 1.00 12.04 O ATOM 0 H ASP A 11 10.239 8.385 19.735 1.00 2.23 H new ATOM 0 HA ASP A 11 11.112 9.459 18.080 1.00 51.10 H new ATOM 0 HB2 ASP A 11 12.086 11.319 20.243 1.00 24.15 H new ATOM 0 HB3 ASP A 11 12.353 11.647 18.543 1.00 24.15 H new ATOM 174 N PHE A 12 13.200 8.237 17.701 1.00 12.33 N ATOM 175 CA PHE A 12 14.462 7.734 17.283 1.00 34.23 C ATOM 176 C PHE A 12 15.056 8.656 16.265 1.00 61.21 C ATOM 177 O PHE A 12 14.353 9.179 15.393 1.00 32.12 O ATOM 178 CB PHE A 12 14.395 6.270 16.793 1.00 35.12 C ATOM 179 CG PHE A 12 13.418 5.973 15.684 1.00 64.30 C ATOM 180 CD1 PHE A 12 12.153 5.501 15.980 1.00 2.44 C ATOM 181 CD2 PHE A 12 13.770 6.145 14.356 1.00 75.32 C ATOM 182 CE1 PHE A 12 11.255 5.208 14.977 1.00 23.21 C ATOM 183 CE2 PHE A 12 12.878 5.856 13.351 1.00 74.01 C ATOM 184 CZ PHE A 12 11.617 5.385 13.661 1.00 61.31 C ATOM 0 H PHE A 12 12.395 7.817 17.236 1.00 12.33 H new ATOM 0 HA PHE A 12 15.121 7.706 18.151 1.00 34.23 H new ATOM 0 HB2 PHE A 12 15.390 5.977 16.458 1.00 35.12 H new ATOM 0 HB3 PHE A 12 14.146 5.637 17.645 1.00 35.12 H new ATOM 0 HD1 PHE A 12 11.865 5.360 17.011 1.00 2.44 H new ATOM 0 HD2 PHE A 12 14.756 6.510 14.107 1.00 75.32 H new ATOM 0 HE1 PHE A 12 10.270 4.840 15.223 1.00 23.21 H new ATOM 0 HE2 PHE A 12 13.163 5.997 12.319 1.00 74.01 H new ATOM 0 HZ PHE A 12 10.916 5.156 12.872 1.00 61.31 H new ATOM 194 N ASP A 13 16.320 8.894 16.396 1.00 23.10 N ATOM 195 CA ASP A 13 17.001 9.800 15.516 1.00 63.13 C ATOM 196 C ASP A 13 17.185 9.121 14.178 1.00 40.21 C ATOM 197 O ASP A 13 17.443 7.898 14.128 1.00 50.33 O ATOM 198 CB ASP A 13 18.342 10.204 16.122 1.00 12.21 C ATOM 199 CG ASP A 13 18.994 11.335 15.384 1.00 52.54 C ATOM 200 OD1 ASP A 13 19.879 11.090 14.549 1.00 55.24 O ATOM 201 OD2 ASP A 13 18.623 12.493 15.636 1.00 1.22 O ATOM 0 H ASP A 13 16.912 8.471 17.111 1.00 23.10 H new ATOM 0 HA ASP A 13 16.415 10.709 15.376 1.00 63.13 H new ATOM 0 HB2 ASP A 13 18.194 10.492 17.163 1.00 12.21 H new ATOM 0 HB3 ASP A 13 19.010 9.343 16.122 1.00 12.21 H new ATOM 206 N ASP A 14 17.025 9.865 13.103 1.00 55.43 N ATOM 207 CA ASP A 14 17.128 9.286 11.778 1.00 13.12 C ATOM 208 C ASP A 14 18.540 8.841 11.489 1.00 31.51 C ATOM 209 O ASP A 14 19.489 9.621 11.597 1.00 23.41 O ATOM 210 CB ASP A 14 16.606 10.220 10.673 1.00 23.50 C ATOM 211 CG ASP A 14 16.777 9.614 9.285 1.00 42.34 C ATOM 212 OD1 ASP A 14 15.989 8.705 8.911 1.00 52.51 O ATOM 213 OD2 ASP A 14 17.706 10.029 8.553 1.00 71.12 O ATOM 0 H ASP A 14 16.824 10.865 13.119 1.00 55.43 H new ATOM 0 HA ASP A 14 16.480 8.409 11.773 1.00 13.12 H new ATOM 0 HB2 ASP A 14 15.552 10.434 10.848 1.00 23.50 H new ATOM 0 HB3 ASP A 14 17.137 11.171 10.721 1.00 23.50 H new ATOM 218 N ASN A 15 18.669 7.594 11.149 1.00 12.42 N ATOM 219 CA ASN A 15 19.958 6.990 10.874 1.00 30.32 C ATOM 220 C ASN A 15 19.758 5.747 10.034 1.00 13.02 C ATOM 221 O ASN A 15 20.608 5.382 9.210 1.00 42.13 O ATOM 222 CB ASN A 15 20.663 6.620 12.192 1.00 72.22 C ATOM 223 CG ASN A 15 22.061 6.050 11.995 1.00 0.43 C ATOM 224 OD1 ASN A 15 22.239 4.841 11.852 1.00 63.21 O ATOM 225 ND2 ASN A 15 23.055 6.909 11.990 1.00 33.21 N ATOM 0 H ASN A 15 17.882 6.953 11.051 1.00 12.42 H new ATOM 0 HA ASN A 15 20.580 7.702 10.332 1.00 30.32 H new ATOM 0 HB2 ASN A 15 20.727 7.507 12.822 1.00 72.22 H new ATOM 0 HB3 ASN A 15 20.055 5.891 12.728 1.00 72.22 H new ATOM 0 HD21 ASN A 15 24.012 6.580 11.865 1.00 33.21 H new ATOM 0 HD22 ASN A 15 22.869 7.905 12.111 1.00 33.21 H new ATOM 232 N ARG A 16 18.611 5.114 10.223 1.00 55.24 N ATOM 233 CA ARG A 16 18.282 3.894 9.535 1.00 13.45 C ATOM 234 C ARG A 16 17.749 4.215 8.154 1.00 23.12 C ATOM 235 O ARG A 16 17.267 5.329 7.902 1.00 73.31 O ATOM 236 CB ARG A 16 17.233 3.096 10.326 1.00 4.34 C ATOM 237 CG ARG A 16 17.631 2.791 11.764 1.00 52.50 C ATOM 238 CD ARG A 16 18.916 1.985 11.843 1.00 45.31 C ATOM 239 NE ARG A 16 19.313 1.742 13.227 1.00 53.22 N ATOM 240 CZ ARG A 16 20.543 1.398 13.626 1.00 54.31 C ATOM 241 NH1 ARG A 16 21.526 1.241 12.734 1.00 34.20 N ATOM 242 NH2 ARG A 16 20.785 1.208 14.915 1.00 22.13 N ATOM 0 H ARG A 16 17.886 5.440 10.862 1.00 55.24 H new ATOM 0 HA ARG A 16 19.184 3.289 9.444 1.00 13.45 H new ATOM 0 HB2 ARG A 16 16.297 3.654 10.331 1.00 4.34 H new ATOM 0 HB3 ARG A 16 17.041 2.157 9.807 1.00 4.34 H new ATOM 0 HG2 ARG A 16 17.756 3.725 12.311 1.00 52.50 H new ATOM 0 HG3 ARG A 16 16.828 2.240 12.253 1.00 52.50 H new ATOM 0 HD2 ARG A 16 18.781 1.033 11.330 1.00 45.31 H new ATOM 0 HD3 ARG A 16 19.713 2.517 11.323 1.00 45.31 H new ATOM 0 HE ARG A 16 18.597 1.842 13.946 1.00 53.22 H new ATOM 0 HH11 ARG A 16 21.341 1.384 11.741 1.00 34.20 H new ATOM 0 HH12 ARG A 16 22.461 0.979 13.046 1.00 34.20 H new ATOM 0 HH21 ARG A 16 20.036 1.324 15.597 1.00 22.13 H new ATOM 0 HH22 ARG A 16 21.721 0.946 15.225 1.00 22.13 H new ATOM 256 N LYS A 17 17.850 3.265 7.274 1.00 31.05 N ATOM 257 CA LYS A 17 17.376 3.409 5.917 1.00 0.31 C ATOM 258 C LYS A 17 16.555 2.207 5.569 1.00 13.53 C ATOM 259 O LYS A 17 16.738 1.150 6.186 1.00 55.31 O ATOM 260 CB LYS A 17 18.544 3.551 4.954 1.00 11.13 C ATOM 261 CG LYS A 17 19.375 4.797 5.187 1.00 62.23 C ATOM 262 CD LYS A 17 20.544 4.867 4.241 1.00 25.35 C ATOM 263 CE LYS A 17 21.354 6.116 4.484 1.00 1.32 C ATOM 264 NZ LYS A 17 22.542 6.188 3.614 1.00 11.42 N ATOM 0 H LYS A 17 18.267 2.356 7.473 1.00 31.05 H new ATOM 0 HA LYS A 17 16.767 4.309 5.835 1.00 0.31 H new ATOM 0 HB2 LYS A 17 19.186 2.675 5.043 1.00 11.13 H new ATOM 0 HB3 LYS A 17 18.163 3.565 3.933 1.00 11.13 H new ATOM 0 HG2 LYS A 17 18.750 5.681 5.060 1.00 62.23 H new ATOM 0 HG3 LYS A 17 19.737 4.807 6.215 1.00 62.23 H new ATOM 0 HD2 LYS A 17 21.175 3.988 4.370 1.00 25.35 H new ATOM 0 HD3 LYS A 17 20.186 4.855 3.212 1.00 25.35 H new ATOM 0 HE2 LYS A 17 20.728 6.992 4.314 1.00 1.32 H new ATOM 0 HE3 LYS A 17 21.668 6.146 5.527 1.00 1.32 H new ATOM 0 HZ1 LYS A 17 23.068 7.062 3.816 1.00 11.42 H new ATOM 0 HZ2 LYS A 17 23.154 5.367 3.794 1.00 11.42 H new ATOM 0 HZ3 LYS A 17 22.243 6.186 2.618 1.00 11.42 H new ATOM 278 N LYS A 18 15.624 2.364 4.610 1.00 54.14 N ATOM 279 CA LYS A 18 14.723 1.273 4.190 1.00 32.45 C ATOM 280 C LYS A 18 13.821 0.888 5.393 1.00 20.42 C ATOM 281 O LYS A 18 13.266 -0.208 5.485 1.00 13.21 O ATOM 282 CB LYS A 18 15.568 0.076 3.674 1.00 11.04 C ATOM 283 CG LYS A 18 14.778 -1.099 3.114 1.00 73.51 C ATOM 284 CD LYS A 18 15.668 -2.254 2.613 1.00 15.32 C ATOM 285 CE LYS A 18 16.443 -3.010 3.726 1.00 44.41 C ATOM 286 NZ LYS A 18 17.482 -2.201 4.423 1.00 24.23 N ATOM 0 H LYS A 18 15.475 3.240 4.109 1.00 54.14 H new ATOM 0 HA LYS A 18 14.077 1.588 3.370 1.00 32.45 H new ATOM 0 HB2 LYS A 18 16.242 0.439 2.898 1.00 11.04 H new ATOM 0 HB3 LYS A 18 16.190 -0.286 4.493 1.00 11.04 H new ATOM 0 HG2 LYS A 18 14.107 -1.476 3.885 1.00 73.51 H new ATOM 0 HG3 LYS A 18 14.154 -0.749 2.292 1.00 73.51 H new ATOM 0 HD2 LYS A 18 15.044 -2.968 2.076 1.00 15.32 H new ATOM 0 HD3 LYS A 18 16.386 -1.856 1.896 1.00 15.32 H new ATOM 0 HE2 LYS A 18 15.728 -3.372 4.465 1.00 44.41 H new ATOM 0 HE3 LYS A 18 16.919 -3.886 3.287 1.00 44.41 H new ATOM 0 HZ1 LYS A 18 18.267 -2.819 4.713 1.00 24.23 H new ATOM 0 HZ2 LYS A 18 17.839 -1.466 3.779 1.00 24.23 H new ATOM 0 HZ3 LYS A 18 17.066 -1.752 5.264 1.00 24.23 H new ATOM 300 N ALA A 19 13.638 1.862 6.273 1.00 41.40 N ATOM 301 CA ALA A 19 12.899 1.704 7.515 1.00 63.44 C ATOM 302 C ALA A 19 11.460 1.326 7.279 1.00 4.13 C ATOM 303 O ALA A 19 10.874 0.588 8.071 1.00 31.12 O ATOM 304 CB ALA A 19 12.950 2.974 8.296 1.00 43.02 C ATOM 0 H ALA A 19 14.007 2.803 6.140 1.00 41.40 H new ATOM 0 HA ALA A 19 13.370 0.894 8.072 1.00 63.44 H new ATOM 0 HB1 ALA A 19 12.395 2.852 9.226 1.00 43.02 H new ATOM 0 HB2 ALA A 19 13.987 3.221 8.522 1.00 43.02 H new ATOM 0 HB3 ALA A 19 12.505 3.779 7.711 1.00 43.02 H new ATOM 310 N ILE A 20 10.889 1.819 6.182 1.00 12.03 N ATOM 311 CA ILE A 20 9.497 1.527 5.832 1.00 53.43 C ATOM 312 C ILE A 20 9.299 0.016 5.695 1.00 24.44 C ATOM 313 O ILE A 20 8.253 -0.529 6.065 1.00 4.00 O ATOM 314 CB ILE A 20 9.082 2.236 4.509 1.00 72.10 C ATOM 315 CG1 ILE A 20 9.224 3.756 4.651 1.00 23.33 C ATOM 316 CG2 ILE A 20 7.648 1.868 4.111 1.00 54.55 C ATOM 317 CD1 ILE A 20 8.867 4.530 3.398 1.00 62.32 C ATOM 0 H ILE A 20 11.369 2.425 5.517 1.00 12.03 H new ATOM 0 HA ILE A 20 8.863 1.908 6.633 1.00 53.43 H new ATOM 0 HB ILE A 20 9.749 1.893 3.718 1.00 72.10 H new ATOM 0 HG12 ILE A 20 8.587 4.095 5.468 1.00 23.33 H new ATOM 0 HG13 ILE A 20 10.252 3.990 4.929 1.00 23.33 H new ATOM 0 HG21 ILE A 20 7.386 2.378 3.184 1.00 54.55 H new ATOM 0 HG22 ILE A 20 7.576 0.790 3.966 1.00 54.55 H new ATOM 0 HG23 ILE A 20 6.961 2.174 4.900 1.00 54.55 H new ATOM 0 HD11 ILE A 20 8.994 5.597 3.581 1.00 62.32 H new ATOM 0 HD12 ILE A 20 9.520 4.222 2.582 1.00 62.32 H new ATOM 0 HD13 ILE A 20 7.830 4.329 3.129 1.00 62.32 H new ATOM 329 N SER A 21 10.333 -0.650 5.241 1.00 25.31 N ATOM 330 CA SER A 21 10.269 -2.075 5.009 1.00 5.30 C ATOM 331 C SER A 21 10.198 -2.826 6.335 1.00 15.35 C ATOM 332 O SER A 21 9.447 -3.793 6.479 1.00 43.33 O ATOM 333 CB SER A 21 11.460 -2.514 4.173 1.00 10.24 C ATOM 334 OG SER A 21 11.483 -1.789 2.946 1.00 25.42 O ATOM 0 H SER A 21 11.235 -0.226 5.023 1.00 25.31 H new ATOM 0 HA SER A 21 9.362 -2.313 4.452 1.00 5.30 H new ATOM 0 HB2 SER A 21 12.385 -2.344 4.724 1.00 10.24 H new ATOM 0 HB3 SER A 21 11.401 -3.584 3.973 1.00 10.24 H new ATOM 0 HG SER A 21 10.581 -1.764 2.564 1.00 25.42 H new ATOM 340 N GLU A 22 10.946 -2.345 7.314 1.00 51.21 N ATOM 341 CA GLU A 22 10.935 -2.932 8.633 1.00 61.13 C ATOM 342 C GLU A 22 9.656 -2.540 9.356 1.00 53.00 C ATOM 343 O GLU A 22 9.096 -3.327 10.125 1.00 64.30 O ATOM 344 CB GLU A 22 12.155 -2.485 9.436 1.00 42.33 C ATOM 345 CG GLU A 22 13.479 -2.850 8.791 1.00 1.42 C ATOM 346 CD GLU A 22 14.661 -2.478 9.644 1.00 45.24 C ATOM 347 OE1 GLU A 22 15.238 -1.388 9.448 1.00 13.14 O ATOM 348 OE2 GLU A 22 15.041 -3.279 10.517 1.00 34.43 O ATOM 0 H GLU A 22 11.570 -1.545 7.214 1.00 51.21 H new ATOM 0 HA GLU A 22 10.974 -4.017 8.534 1.00 61.13 H new ATOM 0 HB2 GLU A 22 12.113 -1.404 9.572 1.00 42.33 H new ATOM 0 HB3 GLU A 22 12.109 -2.933 10.429 1.00 42.33 H new ATOM 0 HG2 GLU A 22 13.500 -3.922 8.595 1.00 1.42 H new ATOM 0 HG3 GLU A 22 13.559 -2.348 7.827 1.00 1.42 H new ATOM 355 N THR A 23 9.187 -1.327 9.082 1.00 41.43 N ATOM 356 CA THR A 23 7.973 -0.803 9.676 1.00 34.42 C ATOM 357 C THR A 23 6.771 -1.687 9.325 1.00 13.34 C ATOM 358 O THR A 23 6.082 -2.177 10.214 1.00 1.12 O ATOM 359 CB THR A 23 7.708 0.648 9.191 1.00 14.33 C ATOM 360 OG1 THR A 23 8.804 1.496 9.558 1.00 71.24 O ATOM 361 CG2 THR A 23 6.422 1.209 9.782 1.00 1.55 C ATOM 0 H THR A 23 9.644 -0.681 8.438 1.00 41.43 H new ATOM 0 HA THR A 23 8.106 -0.799 10.758 1.00 34.42 H new ATOM 0 HB THR A 23 7.605 0.619 8.106 1.00 14.33 H new ATOM 0 HG1 THR A 23 9.562 1.327 8.961 1.00 71.24 H new ATOM 0 HG21 THR A 23 6.269 2.226 9.421 1.00 1.55 H new ATOM 0 HG22 THR A 23 5.580 0.586 9.480 1.00 1.55 H new ATOM 0 HG23 THR A 23 6.495 1.217 10.870 1.00 1.55 H new ATOM 369 N LEU A 24 6.564 -1.939 8.039 1.00 11.54 N ATOM 370 CA LEU A 24 5.440 -2.763 7.611 1.00 70.23 C ATOM 371 C LEU A 24 5.614 -4.210 7.985 1.00 23.22 C ATOM 372 O LEU A 24 4.638 -4.902 8.221 1.00 71.24 O ATOM 373 CB LEU A 24 5.067 -2.585 6.132 1.00 1.12 C ATOM 374 CG LEU A 24 4.296 -1.299 5.764 1.00 62.44 C ATOM 375 CD1 LEU A 24 5.089 -0.036 6.052 1.00 41.04 C ATOM 376 CD2 LEU A 24 3.859 -1.340 4.318 1.00 34.31 C ATOM 0 H LEU A 24 7.151 -1.590 7.282 1.00 11.54 H new ATOM 0 HA LEU A 24 4.583 -2.389 8.171 1.00 70.23 H new ATOM 0 HB2 LEU A 24 5.984 -2.613 5.544 1.00 1.12 H new ATOM 0 HB3 LEU A 24 4.466 -3.442 5.827 1.00 1.12 H new ATOM 0 HG LEU A 24 3.413 -1.265 6.402 1.00 62.44 H new ATOM 0 HD11 LEU A 24 4.498 0.836 5.774 1.00 41.04 H new ATOM 0 HD12 LEU A 24 5.326 0.010 7.115 1.00 41.04 H new ATOM 0 HD13 LEU A 24 6.013 -0.047 5.474 1.00 41.04 H new ATOM 0 HD21 LEU A 24 3.317 -0.426 4.076 1.00 34.31 H new ATOM 0 HD22 LEU A 24 4.735 -1.423 3.675 1.00 34.31 H new ATOM 0 HD23 LEU A 24 3.209 -2.200 4.159 1.00 34.31 H new ATOM 388 N GLU A 25 6.856 -4.661 8.054 1.00 74.53 N ATOM 389 CA GLU A 25 7.152 -6.007 8.516 1.00 32.12 C ATOM 390 C GLU A 25 6.632 -6.155 9.951 1.00 52.51 C ATOM 391 O GLU A 25 5.957 -7.128 10.295 1.00 62.30 O ATOM 392 CB GLU A 25 8.661 -6.233 8.498 1.00 52.23 C ATOM 393 CG GLU A 25 9.092 -7.614 8.928 1.00 40.11 C ATOM 394 CD GLU A 25 10.583 -7.739 9.022 1.00 4.31 C ATOM 395 OE1 GLU A 25 11.129 -7.555 10.116 1.00 42.34 O ATOM 396 OE2 GLU A 25 11.234 -8.024 8.002 1.00 14.25 O ATOM 0 H GLU A 25 7.677 -4.113 7.795 1.00 74.53 H new ATOM 0 HA GLU A 25 6.673 -6.739 7.865 1.00 32.12 H new ATOM 0 HB2 GLU A 25 9.031 -6.048 7.490 1.00 52.23 H new ATOM 0 HB3 GLU A 25 9.133 -5.499 9.151 1.00 52.23 H new ATOM 0 HG2 GLU A 25 8.648 -7.846 9.896 1.00 40.11 H new ATOM 0 HG3 GLU A 25 8.712 -8.349 8.218 1.00 40.11 H new ATOM 403 N THR A 26 6.927 -5.149 10.753 1.00 4.31 N ATOM 404 CA THR A 26 6.524 -5.103 12.131 1.00 52.40 C ATOM 405 C THR A 26 4.988 -4.979 12.244 1.00 50.12 C ATOM 406 O THR A 26 4.350 -5.732 12.979 1.00 75.42 O ATOM 407 CB THR A 26 7.204 -3.910 12.838 1.00 60.35 C ATOM 408 OG1 THR A 26 8.635 -4.017 12.698 1.00 72.21 O ATOM 409 CG2 THR A 26 6.863 -3.893 14.305 1.00 62.24 C ATOM 0 H THR A 26 7.461 -4.333 10.454 1.00 4.31 H new ATOM 0 HA THR A 26 6.833 -6.030 12.615 1.00 52.40 H new ATOM 0 HB THR A 26 6.845 -2.990 12.376 1.00 60.35 H new ATOM 0 HG1 THR A 26 8.891 -3.798 11.778 1.00 72.21 H new ATOM 0 HG21 THR A 26 7.353 -3.044 14.783 1.00 62.24 H new ATOM 0 HG22 THR A 26 5.783 -3.804 14.427 1.00 62.24 H new ATOM 0 HG23 THR A 26 7.206 -4.818 14.769 1.00 62.24 H new ATOM 417 N VAL A 27 4.411 -4.038 11.484 1.00 64.23 N ATOM 418 CA VAL A 27 2.961 -3.811 11.482 1.00 22.02 C ATOM 419 C VAL A 27 2.216 -5.080 11.071 1.00 0.53 C ATOM 420 O VAL A 27 1.213 -5.444 11.681 1.00 72.34 O ATOM 421 CB VAL A 27 2.550 -2.634 10.536 1.00 73.40 C ATOM 422 CG1 VAL A 27 1.040 -2.455 10.519 1.00 21.42 C ATOM 423 CG2 VAL A 27 3.211 -1.333 10.964 1.00 44.14 C ATOM 0 H VAL A 27 4.930 -3.420 10.860 1.00 64.23 H new ATOM 0 HA VAL A 27 2.683 -3.539 12.500 1.00 22.02 H new ATOM 0 HB VAL A 27 2.889 -2.888 9.532 1.00 73.40 H new ATOM 0 HG11 VAL A 27 0.779 -1.631 9.855 1.00 21.42 H new ATOM 0 HG12 VAL A 27 0.569 -3.371 10.163 1.00 21.42 H new ATOM 0 HG13 VAL A 27 0.688 -2.234 11.527 1.00 21.42 H new ATOM 0 HG21 VAL A 27 2.908 -0.532 10.290 1.00 44.14 H new ATOM 0 HG22 VAL A 27 2.905 -1.087 11.981 1.00 44.14 H new ATOM 0 HG23 VAL A 27 4.294 -1.447 10.929 1.00 44.14 H new ATOM 433 N TYR A 28 2.737 -5.762 10.062 1.00 14.22 N ATOM 434 CA TYR A 28 2.125 -6.981 9.569 1.00 64.30 C ATOM 435 C TYR A 28 2.046 -8.016 10.680 1.00 60.32 C ATOM 436 O TYR A 28 0.979 -8.579 10.944 1.00 15.44 O ATOM 437 CB TYR A 28 2.910 -7.546 8.362 1.00 11.25 C ATOM 438 CG TYR A 28 2.326 -8.823 7.787 1.00 62.53 C ATOM 439 CD1 TYR A 28 2.724 -10.067 8.262 1.00 14.00 C ATOM 440 CD2 TYR A 28 1.366 -8.784 6.784 1.00 44.14 C ATOM 441 CE1 TYR A 28 2.187 -11.226 7.761 1.00 52.41 C ATOM 442 CE2 TYR A 28 0.825 -9.948 6.272 1.00 64.54 C ATOM 443 CZ TYR A 28 1.242 -11.165 6.768 1.00 3.32 C ATOM 444 OH TYR A 28 0.695 -12.328 6.281 1.00 63.22 O ATOM 0 H TYR A 28 3.586 -5.488 9.568 1.00 14.22 H new ATOM 0 HA TYR A 28 1.115 -6.744 9.235 1.00 64.30 H new ATOM 0 HB2 TYR A 28 2.944 -6.789 7.578 1.00 11.25 H new ATOM 0 HB3 TYR A 28 3.939 -7.735 8.668 1.00 11.25 H new ATOM 0 HD1 TYR A 28 3.470 -10.123 9.041 1.00 14.00 H new ATOM 0 HD2 TYR A 28 1.038 -7.830 6.399 1.00 44.14 H new ATOM 0 HE1 TYR A 28 2.507 -12.183 8.147 1.00 52.41 H new ATOM 0 HE2 TYR A 28 0.082 -9.905 5.490 1.00 64.54 H new ATOM 0 HH TYR A 28 -0.222 -12.157 5.980 1.00 63.22 H new ATOM 454 N ARG A 29 3.167 -8.238 11.349 1.00 44.01 N ATOM 455 CA ARG A 29 3.232 -9.228 12.408 1.00 73.35 C ATOM 456 C ARG A 29 2.368 -8.844 13.593 1.00 2.43 C ATOM 457 O ARG A 29 1.782 -9.712 14.228 1.00 72.12 O ATOM 458 CB ARG A 29 4.666 -9.497 12.845 1.00 62.52 C ATOM 459 CG ARG A 29 5.539 -10.040 11.733 1.00 2.22 C ATOM 460 CD ARG A 29 6.930 -10.376 12.228 1.00 51.53 C ATOM 461 NE ARG A 29 6.915 -11.440 13.250 1.00 72.44 N ATOM 462 CZ ARG A 29 7.982 -12.170 13.603 1.00 4.52 C ATOM 463 NH1 ARG A 29 9.165 -11.954 13.030 1.00 5.14 N ATOM 464 NH2 ARG A 29 7.865 -13.111 14.528 1.00 74.31 N ATOM 0 H ARG A 29 4.043 -7.745 11.176 1.00 44.01 H new ATOM 0 HA ARG A 29 2.833 -10.154 11.994 1.00 73.35 H new ATOM 0 HB2 ARG A 29 5.103 -8.572 13.222 1.00 62.52 H new ATOM 0 HB3 ARG A 29 4.659 -10.207 13.672 1.00 62.52 H new ATOM 0 HG2 ARG A 29 5.077 -10.932 11.311 1.00 2.22 H new ATOM 0 HG3 ARG A 29 5.606 -9.305 10.931 1.00 2.22 H new ATOM 0 HD2 ARG A 29 7.547 -10.691 11.387 1.00 51.53 H new ATOM 0 HD3 ARG A 29 7.392 -9.481 12.644 1.00 51.53 H new ATOM 0 HE ARG A 29 6.031 -11.633 13.721 1.00 72.44 H new ATOM 0 HH11 ARG A 29 9.262 -11.230 12.318 1.00 5.14 H new ATOM 0 HH12 ARG A 29 9.973 -12.513 13.303 1.00 5.14 H new ATOM 0 HH21 ARG A 29 6.962 -13.280 14.972 1.00 74.31 H new ATOM 0 HH22 ARG A 29 8.677 -13.666 14.796 1.00 74.31 H new ATOM 478 N ALA A 30 2.263 -7.547 13.857 1.00 73.55 N ATOM 479 CA ALA A 30 1.455 -7.037 14.957 1.00 40.44 C ATOM 480 C ALA A 30 0.011 -7.526 14.857 1.00 74.51 C ATOM 481 O ALA A 30 -0.562 -8.011 15.840 1.00 55.02 O ATOM 482 CB ALA A 30 1.508 -5.515 15.007 1.00 61.12 C ATOM 0 H ALA A 30 2.734 -6.822 13.316 1.00 73.55 H new ATOM 0 HA ALA A 30 1.874 -7.425 15.885 1.00 40.44 H new ATOM 0 HB1 ALA A 30 0.898 -5.157 15.836 1.00 61.12 H new ATOM 0 HB2 ALA A 30 2.539 -5.191 15.149 1.00 61.12 H new ATOM 0 HB3 ALA A 30 1.125 -5.107 14.072 1.00 61.12 H new ATOM 488 N LEU A 31 -0.580 -7.425 13.673 1.00 32.31 N ATOM 489 CA LEU A 31 -1.942 -7.895 13.507 1.00 24.33 C ATOM 490 C LEU A 31 -2.040 -9.405 13.489 1.00 42.43 C ATOM 491 O LEU A 31 -3.057 -9.959 13.898 1.00 32.21 O ATOM 492 CB LEU A 31 -2.710 -7.262 12.346 1.00 4.31 C ATOM 493 CG LEU A 31 -3.007 -5.769 12.463 1.00 74.34 C ATOM 494 CD1 LEU A 31 -1.846 -4.906 12.063 1.00 44.50 C ATOM 495 CD2 LEU A 31 -4.230 -5.402 11.710 1.00 40.10 C ATOM 0 H LEU A 31 -0.149 -7.032 12.836 1.00 32.31 H new ATOM 0 HA LEU A 31 -2.450 -7.540 14.404 1.00 24.33 H new ATOM 0 HB2 LEU A 31 -2.142 -7.427 11.430 1.00 4.31 H new ATOM 0 HB3 LEU A 31 -3.656 -7.791 12.234 1.00 4.31 H new ATOM 0 HG LEU A 31 -3.185 -5.576 13.521 1.00 74.34 H new ATOM 0 HD11 LEU A 31 -2.120 -3.856 12.168 1.00 44.50 H new ATOM 0 HD12 LEU A 31 -0.992 -5.124 12.705 1.00 44.50 H new ATOM 0 HD13 LEU A 31 -1.582 -5.110 11.025 1.00 44.50 H new ATOM 0 HD21 LEU A 31 -4.414 -4.333 11.813 1.00 40.10 H new ATOM 0 HD22 LEU A 31 -4.096 -5.647 10.656 1.00 40.10 H new ATOM 0 HD23 LEU A 31 -5.081 -5.956 12.106 1.00 40.10 H new ATOM 507 N GLU A 32 -0.992 -10.068 13.025 1.00 1.00 N ATOM 508 CA GLU A 32 -0.929 -11.534 13.052 1.00 23.14 C ATOM 509 C GLU A 32 -1.012 -12.024 14.499 1.00 74.20 C ATOM 510 O GLU A 32 -1.711 -13.003 14.811 1.00 21.40 O ATOM 511 CB GLU A 32 0.379 -12.022 12.423 1.00 60.45 C ATOM 512 CG GLU A 32 0.528 -11.717 10.941 1.00 23.53 C ATOM 513 CD GLU A 32 -0.417 -12.514 10.074 1.00 42.35 C ATOM 514 OE1 GLU A 32 -0.065 -13.649 9.701 1.00 21.24 O ATOM 515 OE2 GLU A 32 -1.508 -12.028 9.737 1.00 31.24 O ATOM 0 H GLU A 32 -0.169 -9.620 12.623 1.00 1.00 H new ATOM 0 HA GLU A 32 -1.767 -11.932 12.480 1.00 23.14 H new ATOM 0 HB2 GLU A 32 1.214 -11.569 12.958 1.00 60.45 H new ATOM 0 HB3 GLU A 32 0.455 -13.100 12.567 1.00 60.45 H new ATOM 0 HG2 GLU A 32 0.354 -10.654 10.776 1.00 23.53 H new ATOM 0 HG3 GLU A 32 1.554 -11.923 10.635 1.00 23.53 H new ATOM 522 N GLU A 33 -0.312 -11.321 15.378 1.00 22.42 N ATOM 523 CA GLU A 33 -0.281 -11.638 16.797 1.00 61.50 C ATOM 524 C GLU A 33 -1.621 -11.308 17.459 1.00 74.45 C ATOM 525 O GLU A 33 -2.089 -12.024 18.349 1.00 43.12 O ATOM 526 CB GLU A 33 0.826 -10.842 17.497 1.00 23.10 C ATOM 527 CG GLU A 33 2.221 -11.045 16.926 1.00 21.21 C ATOM 528 CD GLU A 33 2.655 -12.479 16.930 1.00 20.44 C ATOM 529 OE1 GLU A 33 3.128 -12.962 17.973 1.00 32.11 O ATOM 530 OE2 GLU A 33 2.547 -13.145 15.897 1.00 2.44 O ATOM 0 H GLU A 33 0.253 -10.511 15.124 1.00 22.42 H new ATOM 0 HA GLU A 33 -0.085 -12.706 16.894 1.00 61.50 H new ATOM 0 HB2 GLU A 33 0.579 -9.782 17.445 1.00 23.10 H new ATOM 0 HB3 GLU A 33 0.838 -11.115 18.552 1.00 23.10 H new ATOM 0 HG2 GLU A 33 2.247 -10.667 15.904 1.00 21.21 H new ATOM 0 HG3 GLU A 33 2.933 -10.455 17.503 1.00 21.21 H new ATOM 537 N LYS A 34 -2.227 -10.230 17.022 1.00 63.55 N ATOM 538 CA LYS A 34 -3.488 -9.750 17.598 1.00 54.31 C ATOM 539 C LYS A 34 -4.720 -10.427 17.011 1.00 42.10 C ATOM 540 O LYS A 34 -5.826 -10.240 17.511 1.00 73.55 O ATOM 541 CB LYS A 34 -3.589 -8.235 17.457 1.00 54.11 C ATOM 542 CG LYS A 34 -2.607 -7.474 18.324 1.00 25.44 C ATOM 543 CD LYS A 34 -2.961 -7.570 19.810 1.00 52.30 C ATOM 544 CE LYS A 34 -4.228 -6.792 20.127 1.00 14.13 C ATOM 545 NZ LYS A 34 -4.605 -6.889 21.551 1.00 71.54 N ATOM 0 H LYS A 34 -1.872 -9.653 16.260 1.00 63.55 H new ATOM 0 HA LYS A 34 -3.469 -10.019 18.654 1.00 54.31 H new ATOM 0 HB2 LYS A 34 -3.424 -7.965 16.414 1.00 54.11 H new ATOM 0 HB3 LYS A 34 -4.602 -7.922 17.711 1.00 54.11 H new ATOM 0 HG2 LYS A 34 -1.603 -7.866 18.164 1.00 25.44 H new ATOM 0 HG3 LYS A 34 -2.592 -6.427 18.022 1.00 25.44 H new ATOM 0 HD2 LYS A 34 -3.095 -8.616 20.087 1.00 52.30 H new ATOM 0 HD3 LYS A 34 -2.136 -7.184 20.408 1.00 52.30 H new ATOM 0 HE2 LYS A 34 -4.084 -5.744 19.862 1.00 14.13 H new ATOM 0 HE3 LYS A 34 -5.045 -7.167 19.511 1.00 14.13 H new ATOM 0 HZ1 LYS A 34 -5.474 -6.343 21.718 1.00 71.54 H new ATOM 0 HZ2 LYS A 34 -4.769 -7.885 21.800 1.00 71.54 H new ATOM 0 HZ3 LYS A 34 -3.838 -6.507 22.140 1.00 71.54 H new ATOM 559 N GLY A 35 -4.538 -11.192 15.967 1.00 20.52 N ATOM 560 CA GLY A 35 -5.657 -11.892 15.371 1.00 61.43 C ATOM 561 C GLY A 35 -6.511 -10.987 14.498 1.00 12.33 C ATOM 562 O GLY A 35 -7.735 -11.102 14.470 1.00 24.13 O ATOM 0 H GLY A 35 -3.638 -11.349 15.512 1.00 20.52 H new ATOM 0 HA2 GLY A 35 -5.284 -12.723 14.772 1.00 61.43 H new ATOM 0 HA3 GLY A 35 -6.276 -12.320 16.160 1.00 61.43 H new ATOM 566 N TYR A 36 -5.875 -10.084 13.808 1.00 70.20 N ATOM 567 CA TYR A 36 -6.566 -9.206 12.888 1.00 42.33 C ATOM 568 C TYR A 36 -6.069 -9.453 11.490 1.00 32.20 C ATOM 569 O TYR A 36 -5.194 -10.295 11.276 1.00 12.42 O ATOM 570 CB TYR A 36 -6.377 -7.723 13.231 1.00 4.52 C ATOM 571 CG TYR A 36 -7.030 -7.238 14.499 1.00 22.13 C ATOM 572 CD1 TYR A 36 -6.303 -7.090 15.661 1.00 1.44 C ATOM 573 CD2 TYR A 36 -8.379 -6.906 14.521 1.00 12.24 C ATOM 574 CE1 TYR A 36 -6.894 -6.624 16.816 1.00 72.44 C ATOM 575 CE2 TYR A 36 -8.980 -6.442 15.671 1.00 62.15 C ATOM 576 CZ TYR A 36 -8.233 -6.303 16.816 1.00 23.31 C ATOM 577 OH TYR A 36 -8.822 -5.826 17.967 1.00 21.31 O ATOM 0 H TYR A 36 -4.868 -9.930 13.862 1.00 70.20 H new ATOM 0 HA TYR A 36 -7.630 -9.430 12.968 1.00 42.33 H new ATOM 0 HB2 TYR A 36 -5.308 -7.522 13.299 1.00 4.52 H new ATOM 0 HB3 TYR A 36 -6.760 -7.129 12.401 1.00 4.52 H new ATOM 0 HD1 TYR A 36 -5.253 -7.343 15.667 1.00 1.44 H new ATOM 0 HD2 TYR A 36 -8.967 -7.013 13.621 1.00 12.24 H new ATOM 0 HE1 TYR A 36 -6.309 -6.511 17.717 1.00 72.44 H new ATOM 0 HE2 TYR A 36 -10.030 -6.190 15.672 1.00 62.15 H new ATOM 0 HH TYR A 36 -9.771 -5.646 17.799 1.00 21.31 H new ATOM 587 N ASN A 37 -6.615 -8.726 10.552 1.00 64.51 N ATOM 588 CA ASN A 37 -6.216 -8.828 9.169 1.00 42.45 C ATOM 589 C ASN A 37 -5.296 -7.669 8.827 1.00 42.21 C ATOM 590 O ASN A 37 -5.762 -6.534 8.629 1.00 50.40 O ATOM 591 CB ASN A 37 -7.444 -8.837 8.246 1.00 41.12 C ATOM 592 CG ASN A 37 -8.339 -10.044 8.454 1.00 44.40 C ATOM 593 OD1 ASN A 37 -7.876 -11.130 8.826 1.00 42.33 O ATOM 594 ND2 ASN A 37 -9.608 -9.875 8.228 1.00 62.10 N ATOM 0 H ASN A 37 -7.352 -8.043 10.724 1.00 64.51 H new ATOM 0 HA ASN A 37 -5.683 -9.767 9.019 1.00 42.45 H new ATOM 0 HB2 ASN A 37 -8.024 -7.930 8.415 1.00 41.12 H new ATOM 0 HB3 ASN A 37 -7.111 -8.814 7.208 1.00 41.12 H new ATOM 0 HD21 ASN A 37 -10.257 -10.652 8.356 1.00 62.10 H new ATOM 0 HD22 ASN A 37 -9.955 -8.966 7.922 1.00 62.10 H new ATOM 601 N PRO A 38 -3.965 -7.925 8.786 1.00 54.02 N ATOM 602 CA PRO A 38 -2.962 -6.888 8.545 1.00 60.35 C ATOM 603 C PRO A 38 -3.188 -6.134 7.261 1.00 14.13 C ATOM 604 O PRO A 38 -3.090 -4.922 7.236 1.00 41.53 O ATOM 605 CB PRO A 38 -1.643 -7.658 8.450 1.00 1.33 C ATOM 606 CG PRO A 38 -1.889 -8.951 9.131 1.00 34.54 C ATOM 607 CD PRO A 38 -3.347 -9.252 8.977 1.00 41.11 C ATOM 0 HA PRO A 38 -2.990 -6.138 9.335 1.00 60.35 H new ATOM 0 HB2 PRO A 38 -1.352 -7.811 7.411 1.00 1.33 H new ATOM 0 HB3 PRO A 38 -0.833 -7.109 8.930 1.00 1.33 H new ATOM 0 HG2 PRO A 38 -1.283 -9.742 8.689 1.00 34.54 H new ATOM 0 HG3 PRO A 38 -1.616 -8.891 10.185 1.00 34.54 H new ATOM 0 HD2 PRO A 38 -3.532 -9.905 8.124 1.00 41.11 H new ATOM 0 HD3 PRO A 38 -3.746 -9.756 9.857 1.00 41.11 H new ATOM 615 N ILE A 39 -3.550 -6.843 6.218 1.00 14.25 N ATOM 616 CA ILE A 39 -3.702 -6.232 4.916 1.00 21.44 C ATOM 617 C ILE A 39 -4.881 -5.288 4.915 1.00 21.32 C ATOM 618 O ILE A 39 -4.762 -4.154 4.475 1.00 31.13 O ATOM 619 CB ILE A 39 -3.857 -7.296 3.798 1.00 3.14 C ATOM 620 CG1 ILE A 39 -2.671 -8.276 3.835 1.00 54.53 C ATOM 621 CG2 ILE A 39 -3.979 -6.641 2.419 1.00 74.33 C ATOM 622 CD1 ILE A 39 -1.312 -7.620 3.670 1.00 45.24 C ATOM 0 H ILE A 39 -3.745 -7.844 6.244 1.00 14.25 H new ATOM 0 HA ILE A 39 -2.794 -5.666 4.707 1.00 21.44 H new ATOM 0 HB ILE A 39 -4.778 -7.851 3.979 1.00 3.14 H new ATOM 0 HG12 ILE A 39 -2.689 -8.814 4.783 1.00 54.53 H new ATOM 0 HG13 ILE A 39 -2.802 -9.016 3.046 1.00 54.53 H new ATOM 0 HG21 ILE A 39 -4.086 -7.413 1.657 1.00 74.33 H new ATOM 0 HG22 ILE A 39 -4.853 -5.990 2.401 1.00 74.33 H new ATOM 0 HG23 ILE A 39 -3.084 -6.052 2.215 1.00 74.33 H new ATOM 0 HD11 ILE A 39 -0.533 -8.382 3.708 1.00 45.24 H new ATOM 0 HD12 ILE A 39 -1.270 -7.106 2.710 1.00 45.24 H new ATOM 0 HD13 ILE A 39 -1.155 -6.900 4.474 1.00 45.24 H new ATOM 634 N ASN A 40 -5.984 -5.740 5.491 1.00 23.40 N ATOM 635 CA ASN A 40 -7.198 -5.011 5.546 1.00 32.42 C ATOM 636 C ASN A 40 -7.030 -3.717 6.348 1.00 42.11 C ATOM 637 O ASN A 40 -7.558 -2.658 5.972 1.00 31.41 O ATOM 638 CB ASN A 40 -8.248 -5.932 6.162 1.00 42.25 C ATOM 639 CG ASN A 40 -9.541 -5.266 6.461 1.00 14.34 C ATOM 640 OD1 ASN A 40 -10.439 -5.204 5.633 1.00 5.10 O ATOM 641 ND2 ASN A 40 -9.663 -4.796 7.651 1.00 25.51 N ATOM 0 H ASN A 40 -6.039 -6.654 5.941 1.00 23.40 H new ATOM 0 HA ASN A 40 -7.511 -4.704 4.548 1.00 32.42 H new ATOM 0 HB2 ASN A 40 -8.429 -6.764 5.482 1.00 42.25 H new ATOM 0 HB3 ASN A 40 -7.848 -6.355 7.084 1.00 42.25 H new ATOM 0 HD21 ASN A 40 -10.535 -4.350 7.936 1.00 25.51 H new ATOM 0 HD22 ASN A 40 -8.888 -4.869 8.310 1.00 25.51 H new ATOM 648 N GLN A 41 -6.299 -3.791 7.450 1.00 12.41 N ATOM 649 CA GLN A 41 -6.078 -2.624 8.257 1.00 44.41 C ATOM 650 C GLN A 41 -5.064 -1.667 7.621 1.00 22.33 C ATOM 651 O GLN A 41 -5.226 -0.455 7.708 1.00 0.24 O ATOM 652 CB GLN A 41 -5.702 -3.002 9.674 1.00 0.24 C ATOM 653 CG GLN A 41 -6.773 -3.846 10.381 1.00 34.42 C ATOM 654 CD GLN A 41 -8.111 -3.156 10.534 1.00 63.41 C ATOM 655 OE1 GLN A 41 -9.147 -3.803 10.532 1.00 61.51 O ATOM 656 NE2 GLN A 41 -8.101 -1.865 10.718 1.00 5.31 N ATOM 0 H GLN A 41 -5.857 -4.643 7.795 1.00 12.41 H new ATOM 0 HA GLN A 41 -7.020 -2.078 8.308 1.00 44.41 H new ATOM 0 HB2 GLN A 41 -4.764 -3.557 9.658 1.00 0.24 H new ATOM 0 HB3 GLN A 41 -5.526 -2.094 10.250 1.00 0.24 H new ATOM 0 HG2 GLN A 41 -6.917 -4.771 9.823 1.00 34.42 H new ATOM 0 HG3 GLN A 41 -6.406 -4.124 11.369 1.00 34.42 H new ATOM 0 HE21 GLN A 41 -7.217 -1.356 10.714 1.00 5.31 H new ATOM 0 HE22 GLN A 41 -8.977 -1.364 10.866 1.00 5.31 H new ATOM 665 N ILE A 42 -4.023 -2.214 6.975 1.00 75.21 N ATOM 666 CA ILE A 42 -3.010 -1.375 6.324 1.00 33.14 C ATOM 667 C ILE A 42 -3.598 -0.632 5.130 1.00 74.32 C ATOM 668 O ILE A 42 -3.450 0.590 5.033 1.00 75.42 O ATOM 669 CB ILE A 42 -1.721 -2.160 5.903 1.00 45.33 C ATOM 670 CG1 ILE A 42 -1.008 -2.725 7.146 1.00 55.33 C ATOM 671 CG2 ILE A 42 -0.767 -1.256 5.105 1.00 32.22 C ATOM 672 CD1 ILE A 42 0.239 -3.540 6.838 1.00 32.21 C ATOM 0 H ILE A 42 -3.863 -3.218 6.891 1.00 75.21 H new ATOM 0 HA ILE A 42 -2.697 -0.651 7.076 1.00 33.14 H new ATOM 0 HB ILE A 42 -2.021 -2.990 5.263 1.00 45.33 H new ATOM 0 HG12 ILE A 42 -0.734 -1.897 7.800 1.00 55.33 H new ATOM 0 HG13 ILE A 42 -1.709 -3.350 7.699 1.00 55.33 H new ATOM 0 HG21 ILE A 42 0.121 -1.822 4.824 1.00 32.22 H new ATOM 0 HG22 ILE A 42 -1.270 -0.900 4.206 1.00 32.22 H new ATOM 0 HG23 ILE A 42 -0.474 -0.404 5.719 1.00 32.22 H new ATOM 0 HD11 ILE A 42 0.678 -3.899 7.769 1.00 32.21 H new ATOM 0 HD12 ILE A 42 -0.028 -4.390 6.211 1.00 32.21 H new ATOM 0 HD13 ILE A 42 0.962 -2.915 6.314 1.00 32.21 H new ATOM 684 N VAL A 43 -4.295 -1.352 4.237 1.00 44.14 N ATOM 685 CA VAL A 43 -4.917 -0.703 3.085 1.00 33.50 C ATOM 686 C VAL A 43 -5.887 0.389 3.561 1.00 53.20 C ATOM 687 O VAL A 43 -5.881 1.506 3.035 1.00 13.22 O ATOM 688 CB VAL A 43 -5.605 -1.713 2.078 1.00 34.22 C ATOM 689 CG1 VAL A 43 -6.672 -2.548 2.757 1.00 34.22 C ATOM 690 CG2 VAL A 43 -6.223 -0.972 0.900 1.00 73.41 C ATOM 0 H VAL A 43 -4.437 -2.361 4.292 1.00 44.14 H new ATOM 0 HA VAL A 43 -4.117 -0.239 2.507 1.00 33.50 H new ATOM 0 HB VAL A 43 -4.821 -2.379 1.718 1.00 34.22 H new ATOM 0 HG11 VAL A 43 -7.119 -3.227 2.031 1.00 34.22 H new ATOM 0 HG12 VAL A 43 -6.223 -3.125 3.565 1.00 34.22 H new ATOM 0 HG13 VAL A 43 -7.443 -1.893 3.163 1.00 34.22 H new ATOM 0 HG21 VAL A 43 -6.689 -1.688 0.223 1.00 73.41 H new ATOM 0 HG22 VAL A 43 -6.977 -0.274 1.264 1.00 73.41 H new ATOM 0 HG23 VAL A 43 -5.446 -0.423 0.368 1.00 73.41 H new ATOM 700 N GLY A 44 -6.656 0.082 4.612 1.00 33.53 N ATOM 701 CA GLY A 44 -7.558 1.044 5.178 1.00 54.13 C ATOM 702 C GLY A 44 -6.819 2.242 5.753 1.00 2.25 C ATOM 703 O GLY A 44 -7.252 3.365 5.599 1.00 64.32 O ATOM 0 H GLY A 44 -6.659 -0.827 5.074 1.00 33.53 H new ATOM 0 HA2 GLY A 44 -8.257 1.381 4.412 1.00 54.13 H new ATOM 0 HA3 GLY A 44 -8.149 0.571 5.962 1.00 54.13 H new ATOM 707 N TYR A 45 -5.686 1.997 6.393 1.00 21.22 N ATOM 708 CA TYR A 45 -4.903 3.065 6.994 1.00 24.14 C ATOM 709 C TYR A 45 -4.413 4.087 5.970 1.00 53.34 C ATOM 710 O TYR A 45 -4.632 5.290 6.142 1.00 15.31 O ATOM 711 CB TYR A 45 -3.718 2.524 7.827 1.00 61.42 C ATOM 712 CG TYR A 45 -2.817 3.628 8.361 1.00 30.34 C ATOM 713 CD1 TYR A 45 -1.544 3.817 7.856 1.00 72.52 C ATOM 714 CD2 TYR A 45 -3.261 4.501 9.332 1.00 32.32 C ATOM 715 CE1 TYR A 45 -0.742 4.843 8.304 1.00 73.15 C ATOM 716 CE2 TYR A 45 -2.461 5.526 9.793 1.00 41.52 C ATOM 717 CZ TYR A 45 -1.205 5.691 9.274 1.00 5.04 C ATOM 718 OH TYR A 45 -0.418 6.728 9.704 1.00 21.22 O ATOM 0 H TYR A 45 -5.288 1.065 6.510 1.00 21.22 H new ATOM 0 HA TYR A 45 -5.584 3.581 7.671 1.00 24.14 H new ATOM 0 HB2 TYR A 45 -4.104 1.941 8.663 1.00 61.42 H new ATOM 0 HB3 TYR A 45 -3.127 1.846 7.211 1.00 61.42 H new ATOM 0 HD1 TYR A 45 -1.171 3.147 7.095 1.00 72.52 H new ATOM 0 HD2 TYR A 45 -4.254 4.380 9.739 1.00 32.32 H new ATOM 0 HE1 TYR A 45 0.247 4.978 7.892 1.00 73.15 H new ATOM 0 HE2 TYR A 45 -2.824 6.195 10.559 1.00 41.52 H new ATOM 0 HH TYR A 45 -0.894 7.236 10.394 1.00 21.22 H new ATOM 728 N LEU A 46 -3.779 3.626 4.909 1.00 24.15 N ATOM 729 CA LEU A 46 -3.195 4.547 3.938 1.00 71.32 C ATOM 730 C LEU A 46 -4.216 5.346 3.154 1.00 51.10 C ATOM 731 O LEU A 46 -3.984 6.512 2.861 1.00 3.44 O ATOM 732 CB LEU A 46 -2.157 3.902 2.999 1.00 51.23 C ATOM 733 CG LEU A 46 -0.807 3.455 3.624 1.00 64.43 C ATOM 734 CD1 LEU A 46 -0.956 2.277 4.549 1.00 74.22 C ATOM 735 CD2 LEU A 46 0.222 3.175 2.552 1.00 13.13 C ATOM 0 H LEU A 46 -3.653 2.637 4.694 1.00 24.15 H new ATOM 0 HA LEU A 46 -2.652 5.255 4.564 1.00 71.32 H new ATOM 0 HB2 LEU A 46 -2.618 3.030 2.535 1.00 51.23 H new ATOM 0 HB3 LEU A 46 -1.940 4.611 2.200 1.00 51.23 H new ATOM 0 HG LEU A 46 -0.455 4.288 4.232 1.00 64.43 H new ATOM 0 HD11 LEU A 46 0.019 2.009 4.956 1.00 74.22 H new ATOM 0 HD12 LEU A 46 -1.631 2.538 5.364 1.00 74.22 H new ATOM 0 HD13 LEU A 46 -1.364 1.430 3.997 1.00 74.22 H new ATOM 0 HD21 LEU A 46 1.157 2.864 3.018 1.00 13.13 H new ATOM 0 HD22 LEU A 46 -0.140 2.381 1.899 1.00 13.13 H new ATOM 0 HD23 LEU A 46 0.391 4.078 1.966 1.00 13.13 H new ATOM 747 N LEU A 47 -5.339 4.755 2.832 1.00 24.05 N ATOM 748 CA LEU A 47 -6.327 5.466 2.040 1.00 71.45 C ATOM 749 C LEU A 47 -7.490 6.035 2.865 1.00 30.21 C ATOM 750 O LEU A 47 -8.496 6.479 2.316 1.00 74.41 O ATOM 751 CB LEU A 47 -6.756 4.647 0.800 1.00 74.14 C ATOM 752 CG LEU A 47 -7.223 3.201 1.012 1.00 3.41 C ATOM 753 CD1 LEU A 47 -8.572 3.106 1.701 1.00 41.10 C ATOM 754 CD2 LEU A 47 -7.201 2.436 -0.295 1.00 74.02 C ATOM 0 H LEU A 47 -5.595 3.804 3.096 1.00 24.05 H new ATOM 0 HA LEU A 47 -5.838 6.360 1.653 1.00 71.45 H new ATOM 0 HB2 LEU A 47 -7.563 5.188 0.306 1.00 74.14 H new ATOM 0 HB3 LEU A 47 -5.915 4.627 0.107 1.00 74.14 H new ATOM 0 HG LEU A 47 -6.513 2.734 1.694 1.00 3.41 H new ATOM 0 HD11 LEU A 47 -8.846 2.058 1.822 1.00 41.10 H new ATOM 0 HD12 LEU A 47 -8.515 3.581 2.680 1.00 41.10 H new ATOM 0 HD13 LEU A 47 -9.326 3.611 1.097 1.00 41.10 H new ATOM 0 HD21 LEU A 47 -7.535 1.413 -0.123 1.00 74.02 H new ATOM 0 HD22 LEU A 47 -7.865 2.920 -1.011 1.00 74.02 H new ATOM 0 HD23 LEU A 47 -6.186 2.424 -0.693 1.00 74.02 H new ATOM 766 N SER A 48 -7.333 6.047 4.180 1.00 61.50 N ATOM 767 CA SER A 48 -8.317 6.669 5.048 1.00 74.04 C ATOM 768 C SER A 48 -7.636 7.677 6.013 1.00 22.41 C ATOM 769 O SER A 48 -8.270 8.628 6.467 1.00 41.14 O ATOM 770 CB SER A 48 -9.129 5.598 5.797 1.00 12.34 C ATOM 771 OG SER A 48 -10.142 6.149 6.624 1.00 62.24 O ATOM 0 H SER A 48 -6.537 5.635 4.666 1.00 61.50 H new ATOM 0 HA SER A 48 -9.020 7.237 4.438 1.00 74.04 H new ATOM 0 HB2 SER A 48 -9.586 4.923 5.073 1.00 12.34 H new ATOM 0 HB3 SER A 48 -8.454 4.999 6.409 1.00 12.34 H new ATOM 0 HG SER A 48 -10.481 5.458 7.231 1.00 62.24 H new ATOM 777 N GLY A 49 -6.337 7.477 6.286 1.00 60.44 N ATOM 778 CA GLY A 49 -5.570 8.416 7.104 1.00 52.30 C ATOM 779 C GLY A 49 -5.965 8.472 8.580 1.00 61.45 C ATOM 780 O GLY A 49 -6.243 9.553 9.102 1.00 33.35 O ATOM 0 H GLY A 49 -5.802 6.676 5.952 1.00 60.44 H new ATOM 0 HA2 GLY A 49 -4.515 8.152 7.037 1.00 52.30 H new ATOM 0 HA3 GLY A 49 -5.677 9.414 6.678 1.00 52.30 H new ATOM 784 N ASP A 50 -5.971 7.334 9.258 1.00 61.14 N ATOM 785 CA ASP A 50 -6.287 7.313 10.699 1.00 31.41 C ATOM 786 C ASP A 50 -5.489 6.234 11.438 1.00 25.35 C ATOM 787 O ASP A 50 -5.602 5.059 11.127 1.00 4.33 O ATOM 788 CB ASP A 50 -7.787 7.138 10.947 1.00 50.10 C ATOM 789 CG ASP A 50 -8.122 7.025 12.418 1.00 71.21 C ATOM 790 OD1 ASP A 50 -8.266 8.066 13.103 1.00 22.25 O ATOM 791 OD2 ASP A 50 -8.254 5.912 12.899 1.00 41.04 O ATOM 0 H ASP A 50 -5.766 6.421 8.852 1.00 61.14 H new ATOM 0 HA ASP A 50 -5.992 8.283 11.100 1.00 31.41 H new ATOM 0 HB2 ASP A 50 -8.324 7.985 10.520 1.00 50.10 H new ATOM 0 HB3 ASP A 50 -8.136 6.245 10.429 1.00 50.10 H new ATOM 796 N PRO A 51 -4.651 6.634 12.418 1.00 42.23 N ATOM 797 CA PRO A 51 -3.804 5.705 13.203 1.00 61.43 C ATOM 798 C PRO A 51 -4.557 4.535 13.865 1.00 20.11 C ATOM 799 O PRO A 51 -3.969 3.474 14.092 1.00 0.05 O ATOM 800 CB PRO A 51 -3.186 6.586 14.285 1.00 10.54 C ATOM 801 CG PRO A 51 -3.266 7.978 13.765 1.00 20.45 C ATOM 802 CD PRO A 51 -4.432 8.037 12.815 1.00 70.11 C ATOM 0 HA PRO A 51 -3.089 5.220 12.539 1.00 61.43 H new ATOM 0 HB2 PRO A 51 -3.727 6.488 15.226 1.00 10.54 H new ATOM 0 HB3 PRO A 51 -2.153 6.300 14.480 1.00 10.54 H new ATOM 0 HG2 PRO A 51 -3.401 8.686 14.583 1.00 20.45 H new ATOM 0 HG3 PRO A 51 -2.342 8.251 13.256 1.00 20.45 H new ATOM 0 HD2 PRO A 51 -5.316 8.457 13.296 1.00 70.11 H new ATOM 0 HD3 PRO A 51 -4.210 8.665 11.952 1.00 70.11 H new ATOM 810 N ALA A 52 -5.848 4.710 14.143 1.00 55.43 N ATOM 811 CA ALA A 52 -6.650 3.690 14.837 1.00 45.13 C ATOM 812 C ALA A 52 -6.856 2.424 14.004 1.00 33.35 C ATOM 813 O ALA A 52 -7.376 1.423 14.505 1.00 12.50 O ATOM 814 CB ALA A 52 -7.964 4.243 15.362 1.00 62.04 C ATOM 0 H ALA A 52 -6.368 5.553 13.898 1.00 55.43 H new ATOM 0 HA ALA A 52 -6.062 3.393 15.705 1.00 45.13 H new ATOM 0 HB1 ALA A 52 -8.517 3.450 15.865 1.00 62.04 H new ATOM 0 HB2 ALA A 52 -7.763 5.050 16.067 1.00 62.04 H new ATOM 0 HB3 ALA A 52 -8.555 4.627 14.531 1.00 62.04 H new ATOM 820 N TYR A 53 -6.493 2.470 12.724 1.00 72.02 N ATOM 821 CA TYR A 53 -6.549 1.276 11.895 1.00 23.24 C ATOM 822 C TYR A 53 -5.558 0.224 12.365 1.00 73.24 C ATOM 823 O TYR A 53 -5.774 -0.970 12.164 1.00 72.33 O ATOM 824 CB TYR A 53 -6.321 1.594 10.419 1.00 61.42 C ATOM 825 CG TYR A 53 -7.510 2.233 9.792 1.00 61.00 C ATOM 826 CD1 TYR A 53 -8.582 1.462 9.422 1.00 2.53 C ATOM 827 CD2 TYR A 53 -7.581 3.591 9.589 1.00 73.23 C ATOM 828 CE1 TYR A 53 -9.694 2.016 8.872 1.00 30.33 C ATOM 829 CE2 TYR A 53 -8.691 4.164 9.031 1.00 33.32 C ATOM 830 CZ TYR A 53 -9.748 3.378 8.674 1.00 61.11 C ATOM 831 OH TYR A 53 -10.879 3.960 8.137 1.00 52.10 O ATOM 0 H TYR A 53 -6.162 3.309 12.247 1.00 72.02 H new ATOM 0 HA TYR A 53 -7.556 0.872 12.000 1.00 23.24 H new ATOM 0 HB2 TYR A 53 -5.460 2.256 10.320 1.00 61.42 H new ATOM 0 HB3 TYR A 53 -6.080 0.675 9.884 1.00 61.42 H new ATOM 0 HD1 TYR A 53 -8.542 0.393 9.571 1.00 2.53 H new ATOM 0 HD2 TYR A 53 -6.747 4.215 9.875 1.00 73.23 H new ATOM 0 HE1 TYR A 53 -10.530 1.392 8.592 1.00 30.33 H new ATOM 0 HE2 TYR A 53 -8.731 5.232 8.874 1.00 33.32 H new ATOM 0 HH TYR A 53 -11.667 3.433 8.385 1.00 52.10 H new ATOM 841 N ILE A 54 -4.488 0.662 13.008 1.00 72.41 N ATOM 842 CA ILE A 54 -3.491 -0.255 13.517 1.00 2.10 C ATOM 843 C ILE A 54 -3.647 -0.377 15.041 1.00 13.32 C ATOM 844 O ILE A 54 -3.506 0.618 15.765 1.00 14.14 O ATOM 845 CB ILE A 54 -2.045 0.209 13.163 1.00 74.41 C ATOM 846 CG1 ILE A 54 -1.899 0.413 11.638 1.00 42.45 C ATOM 847 CG2 ILE A 54 -1.006 -0.796 13.671 1.00 1.24 C ATOM 848 CD1 ILE A 54 -2.222 -0.814 10.796 1.00 11.10 C ATOM 0 H ILE A 54 -4.291 1.646 13.188 1.00 72.41 H new ATOM 0 HA ILE A 54 -3.647 -1.226 13.046 1.00 2.10 H new ATOM 0 HB ILE A 54 -1.865 1.162 13.660 1.00 74.41 H new ATOM 0 HG12 ILE A 54 -2.552 1.230 11.331 1.00 42.45 H new ATOM 0 HG13 ILE A 54 -0.877 0.725 11.423 1.00 42.45 H new ATOM 0 HG21 ILE A 54 -0.006 -0.448 13.411 1.00 1.24 H new ATOM 0 HG22 ILE A 54 -1.088 -0.888 14.754 1.00 1.24 H new ATOM 0 HG23 ILE A 54 -1.184 -1.768 13.210 1.00 1.24 H new ATOM 0 HD11 ILE A 54 -2.092 -0.575 9.740 1.00 11.10 H new ATOM 0 HD12 ILE A 54 -1.552 -1.629 11.069 1.00 11.10 H new ATOM 0 HD13 ILE A 54 -3.254 -1.117 10.975 1.00 11.10 H new ATOM 860 N PRO A 55 -3.956 -1.590 15.544 1.00 21.01 N ATOM 861 CA PRO A 55 -4.176 -1.827 16.980 1.00 61.34 C ATOM 862 C PRO A 55 -2.934 -1.530 17.831 1.00 13.04 C ATOM 863 O PRO A 55 -1.793 -1.878 17.461 1.00 24.33 O ATOM 864 CB PRO A 55 -4.529 -3.321 17.054 1.00 53.51 C ATOM 865 CG PRO A 55 -4.000 -3.905 15.791 1.00 41.33 C ATOM 866 CD PRO A 55 -4.118 -2.827 14.758 1.00 34.44 C ATOM 0 HA PRO A 55 -4.951 -1.171 17.376 1.00 61.34 H new ATOM 0 HB2 PRO A 55 -4.075 -3.791 17.927 1.00 53.51 H new ATOM 0 HB3 PRO A 55 -5.606 -3.469 17.136 1.00 53.51 H new ATOM 0 HG2 PRO A 55 -2.963 -4.219 15.910 1.00 41.33 H new ATOM 0 HG3 PRO A 55 -4.569 -4.788 15.501 1.00 41.33 H new ATOM 0 HD2 PRO A 55 -3.350 -2.920 13.990 1.00 34.44 H new ATOM 0 HD3 PRO A 55 -5.082 -2.859 14.251 1.00 34.44 H new ATOM 874 N ARG A 56 -3.154 -0.903 18.973 1.00 43.30 N ATOM 875 CA ARG A 56 -2.076 -0.544 19.881 1.00 14.12 C ATOM 876 C ARG A 56 -1.559 -1.741 20.690 1.00 40.13 C ATOM 877 O ARG A 56 -1.866 -1.923 21.871 1.00 33.50 O ATOM 878 CB ARG A 56 -2.455 0.661 20.765 1.00 41.33 C ATOM 879 CG ARG A 56 -3.744 0.469 21.563 1.00 11.22 C ATOM 880 CD ARG A 56 -4.141 1.730 22.301 1.00 34.21 C ATOM 881 NE ARG A 56 -5.429 1.574 22.994 1.00 44.20 N ATOM 882 CZ ARG A 56 -6.502 2.363 22.793 1.00 3.32 C ATOM 883 NH1 ARG A 56 -6.438 3.374 21.925 1.00 61.13 N ATOM 884 NH2 ARG A 56 -7.631 2.136 23.454 1.00 31.21 N ATOM 0 H ARG A 56 -4.081 -0.629 19.297 1.00 43.30 H new ATOM 0 HA ARG A 56 -1.235 -0.227 19.265 1.00 14.12 H new ATOM 0 HB2 ARG A 56 -1.638 0.861 21.458 1.00 41.33 H new ATOM 0 HB3 ARG A 56 -2.560 1.543 20.133 1.00 41.33 H new ATOM 0 HG2 ARG A 56 -4.548 0.174 20.889 1.00 11.22 H new ATOM 0 HG3 ARG A 56 -3.612 -0.344 22.277 1.00 11.22 H new ATOM 0 HD2 ARG A 56 -3.367 1.987 23.025 1.00 34.21 H new ATOM 0 HD3 ARG A 56 -4.205 2.559 21.596 1.00 34.21 H new ATOM 0 HE ARG A 56 -5.515 0.817 23.673 1.00 44.20 H new ATOM 0 HH11 ARG A 56 -5.575 3.551 21.411 1.00 61.13 H new ATOM 0 HH12 ARG A 56 -7.252 3.970 21.775 1.00 61.13 H new ATOM 0 HH21 ARG A 56 -7.687 1.362 24.116 1.00 31.21 H new ATOM 0 HH22 ARG A 56 -8.442 2.735 23.300 1.00 31.21 H new ATOM 898 N TYR A 57 -0.859 -2.585 20.000 1.00 5.20 N ATOM 899 CA TYR A 57 -0.212 -3.745 20.567 1.00 41.20 C ATOM 900 C TYR A 57 1.290 -3.550 20.656 1.00 34.34 C ATOM 901 O TYR A 57 1.920 -3.906 21.644 1.00 31.31 O ATOM 902 CB TYR A 57 -0.531 -4.954 19.688 1.00 60.25 C ATOM 903 CG TYR A 57 0.346 -6.174 19.913 1.00 42.43 C ATOM 904 CD1 TYR A 57 0.211 -6.986 21.031 1.00 4.43 C ATOM 905 CD2 TYR A 57 1.308 -6.509 18.976 1.00 75.31 C ATOM 906 CE1 TYR A 57 1.021 -8.095 21.201 1.00 74.41 C ATOM 907 CE2 TYR A 57 2.112 -7.602 19.136 1.00 3.51 C ATOM 908 CZ TYR A 57 1.974 -8.395 20.241 1.00 40.44 C ATOM 909 OH TYR A 57 2.800 -9.493 20.392 1.00 51.34 O ATOM 0 H TYR A 57 -0.712 -2.491 18.995 1.00 5.20 H new ATOM 0 HA TYR A 57 -0.583 -3.902 21.580 1.00 41.20 H new ATOM 0 HB2 TYR A 57 -1.570 -5.239 19.855 1.00 60.25 H new ATOM 0 HB3 TYR A 57 -0.446 -4.655 18.643 1.00 60.25 H new ATOM 0 HD1 TYR A 57 -0.534 -6.750 21.776 1.00 4.43 H new ATOM 0 HD2 TYR A 57 1.426 -5.892 18.098 1.00 75.31 H new ATOM 0 HE1 TYR A 57 0.911 -8.721 22.074 1.00 74.41 H new ATOM 0 HE2 TYR A 57 2.856 -7.839 18.390 1.00 3.51 H new ATOM 0 HH TYR A 57 3.407 -9.554 19.625 1.00 51.34 H new ATOM 919 N GLN A 58 1.845 -2.971 19.635 1.00 72.21 N ATOM 920 CA GLN A 58 3.264 -2.850 19.525 1.00 52.14 C ATOM 921 C GLN A 58 3.583 -1.447 19.067 1.00 31.31 C ATOM 922 O GLN A 58 2.682 -0.717 18.615 1.00 25.04 O ATOM 923 CB GLN A 58 3.741 -3.885 18.483 1.00 1.20 C ATOM 924 CG GLN A 58 5.242 -4.079 18.346 1.00 61.42 C ATOM 925 CD GLN A 58 5.564 -5.150 17.323 1.00 30.23 C ATOM 926 OE1 GLN A 58 4.818 -5.356 16.376 1.00 65.22 O ATOM 927 NE2 GLN A 58 6.659 -5.834 17.499 1.00 55.02 N ATOM 0 H GLN A 58 1.325 -2.569 18.855 1.00 72.21 H new ATOM 0 HA GLN A 58 3.764 -3.034 20.476 1.00 52.14 H new ATOM 0 HB2 GLN A 58 3.296 -4.848 18.733 1.00 1.20 H new ATOM 0 HB3 GLN A 58 3.346 -3.594 17.510 1.00 1.20 H new ATOM 0 HG2 GLN A 58 5.708 -3.139 18.051 1.00 61.42 H new ATOM 0 HG3 GLN A 58 5.665 -4.355 19.312 1.00 61.42 H new ATOM 0 HE21 GLN A 58 7.260 -5.638 18.299 1.00 55.02 H new ATOM 0 HE22 GLN A 58 6.915 -6.566 16.836 1.00 55.02 H new ATOM 936 N ASP A 59 4.852 -1.079 19.149 1.00 53.42 N ATOM 937 CA ASP A 59 5.367 0.224 18.705 1.00 65.23 C ATOM 938 C ASP A 59 5.092 0.464 17.216 1.00 32.12 C ATOM 939 O ASP A 59 5.232 1.578 16.726 1.00 23.14 O ATOM 940 CB ASP A 59 6.871 0.401 19.051 1.00 60.44 C ATOM 941 CG ASP A 59 7.786 -0.649 18.436 1.00 14.23 C ATOM 942 OD1 ASP A 59 7.809 -1.795 18.937 1.00 53.21 O ATOM 943 OD2 ASP A 59 8.513 -0.342 17.475 1.00 11.45 O ATOM 0 H ASP A 59 5.576 -1.686 19.534 1.00 53.42 H new ATOM 0 HA ASP A 59 4.823 0.989 19.259 1.00 65.23 H new ATOM 0 HB2 ASP A 59 7.194 1.387 18.718 1.00 60.44 H new ATOM 0 HB3 ASP A 59 6.987 0.377 20.135 1.00 60.44 H new ATOM 948 N ALA A 60 4.685 -0.605 16.521 1.00 71.31 N ATOM 949 CA ALA A 60 4.308 -0.585 15.109 1.00 32.11 C ATOM 950 C ALA A 60 3.315 0.539 14.793 1.00 11.22 C ATOM 951 O ALA A 60 3.479 1.245 13.800 1.00 63.44 O ATOM 952 CB ALA A 60 3.701 -1.925 14.731 1.00 25.05 C ATOM 0 H ALA A 60 4.608 -1.532 16.940 1.00 71.31 H new ATOM 0 HA ALA A 60 5.210 -0.399 14.525 1.00 32.11 H new ATOM 0 HB1 ALA A 60 3.419 -1.913 13.678 1.00 25.05 H new ATOM 0 HB2 ALA A 60 4.431 -2.716 14.902 1.00 25.05 H new ATOM 0 HB3 ALA A 60 2.817 -2.109 15.341 1.00 25.05 H new ATOM 958 N ARG A 61 2.297 0.714 15.657 1.00 60.51 N ATOM 959 CA ARG A 61 1.316 1.786 15.481 1.00 22.13 C ATOM 960 C ARG A 61 1.973 3.182 15.465 1.00 1.21 C ATOM 961 O ARG A 61 1.535 4.070 14.771 1.00 43.31 O ATOM 962 CB ARG A 61 0.115 1.642 16.476 1.00 1.11 C ATOM 963 CG ARG A 61 0.487 1.414 17.947 1.00 31.21 C ATOM 964 CD ARG A 61 1.138 2.607 18.576 1.00 44.11 C ATOM 965 NE ARG A 61 1.769 2.304 19.861 1.00 44.44 N ATOM 966 CZ ARG A 61 2.371 3.221 20.616 1.00 43.11 C ATOM 967 NH1 ARG A 61 2.215 4.514 20.336 1.00 75.12 N ATOM 968 NH2 ARG A 61 3.082 2.854 21.678 1.00 70.40 N ATOM 0 H ARG A 61 2.138 0.128 16.477 1.00 60.51 H new ATOM 0 HA ARG A 61 0.878 1.679 14.489 1.00 22.13 H new ATOM 0 HB2 ARG A 61 -0.495 2.543 16.411 1.00 1.11 H new ATOM 0 HB3 ARG A 61 -0.508 0.811 16.146 1.00 1.11 H new ATOM 0 HG2 ARG A 61 -0.412 1.159 18.508 1.00 31.21 H new ATOM 0 HG3 ARG A 61 1.160 0.560 18.018 1.00 31.21 H new ATOM 0 HD2 ARG A 61 1.889 3.006 17.894 1.00 44.11 H new ATOM 0 HD3 ARG A 61 0.391 3.388 18.720 1.00 44.11 H new ATOM 0 HE ARG A 61 1.747 1.341 20.196 1.00 44.44 H new ATOM 0 HH11 ARG A 61 1.636 4.798 19.546 1.00 75.12 H new ATOM 0 HH12 ARG A 61 2.674 5.220 20.912 1.00 75.12 H new ATOM 0 HH21 ARG A 61 3.168 1.866 21.917 1.00 70.40 H new ATOM 0 HH22 ARG A 61 3.541 3.560 22.253 1.00 70.40 H new ATOM 982 N ASN A 62 3.033 3.336 16.237 1.00 22.33 N ATOM 983 CA ASN A 62 3.822 4.566 16.267 1.00 32.43 C ATOM 984 C ASN A 62 4.718 4.660 15.040 1.00 60.33 C ATOM 985 O ASN A 62 4.816 5.709 14.418 1.00 52.12 O ATOM 986 CB ASN A 62 4.642 4.647 17.577 1.00 14.23 C ATOM 987 CG ASN A 62 5.758 5.696 17.555 1.00 53.24 C ATOM 988 OD1 ASN A 62 5.544 6.869 17.844 1.00 35.12 O ATOM 989 ND2 ASN A 62 6.969 5.257 17.264 1.00 54.13 N ATOM 0 H ASN A 62 3.377 2.611 16.866 1.00 22.33 H new ATOM 0 HA ASN A 62 3.144 5.419 16.244 1.00 32.43 H new ATOM 0 HB2 ASN A 62 3.966 4.869 18.403 1.00 14.23 H new ATOM 0 HB3 ASN A 62 5.081 3.670 17.779 1.00 14.23 H new ATOM 0 HD21 ASN A 62 7.761 5.900 17.275 1.00 54.13 H new ATOM 0 HD22 ASN A 62 7.112 4.275 17.028 1.00 54.13 H new ATOM 996 N LEU A 63 5.347 3.544 14.693 1.00 3.31 N ATOM 997 CA LEU A 63 6.268 3.465 13.550 1.00 30.42 C ATOM 998 C LEU A 63 5.576 3.884 12.256 1.00 52.11 C ATOM 999 O LEU A 63 6.087 4.717 11.506 1.00 22.15 O ATOM 1000 CB LEU A 63 6.806 2.031 13.394 1.00 41.34 C ATOM 1001 CG LEU A 63 7.571 1.441 14.583 1.00 64.13 C ATOM 1002 CD1 LEU A 63 7.980 0.000 14.295 1.00 3.13 C ATOM 1003 CD2 LEU A 63 8.794 2.286 14.910 1.00 50.31 C ATOM 0 H LEU A 63 5.237 2.662 15.193 1.00 3.31 H new ATOM 0 HA LEU A 63 7.095 4.148 13.744 1.00 30.42 H new ATOM 0 HB2 LEU A 63 5.963 1.375 13.175 1.00 41.34 H new ATOM 0 HB3 LEU A 63 7.462 2.008 12.524 1.00 41.34 H new ATOM 0 HG LEU A 63 6.910 1.446 15.450 1.00 64.13 H new ATOM 0 HD11 LEU A 63 8.522 -0.402 15.151 1.00 3.13 H new ATOM 0 HD12 LEU A 63 7.089 -0.602 14.114 1.00 3.13 H new ATOM 0 HD13 LEU A 63 8.621 -0.027 13.414 1.00 3.13 H new ATOM 0 HD21 LEU A 63 9.322 1.849 15.757 1.00 50.31 H new ATOM 0 HD22 LEU A 63 9.457 2.316 14.045 1.00 50.31 H new ATOM 0 HD23 LEU A 63 8.480 3.299 15.162 1.00 50.31 H new ATOM 1015 N ILE A 64 4.397 3.331 12.030 1.00 21.15 N ATOM 1016 CA ILE A 64 3.631 3.572 10.811 1.00 22.20 C ATOM 1017 C ILE A 64 3.112 5.019 10.786 1.00 61.04 C ATOM 1018 O ILE A 64 2.963 5.628 9.744 1.00 65.15 O ATOM 1019 CB ILE A 64 2.425 2.579 10.727 1.00 61.02 C ATOM 1020 CG1 ILE A 64 1.796 2.601 9.330 1.00 23.40 C ATOM 1021 CG2 ILE A 64 1.363 2.926 11.801 1.00 62.24 C ATOM 1022 CD1 ILE A 64 0.706 1.566 9.132 1.00 34.44 C ATOM 0 H ILE A 64 3.939 2.699 12.687 1.00 21.15 H new ATOM 0 HA ILE A 64 4.285 3.414 9.954 1.00 22.20 H new ATOM 0 HB ILE A 64 2.799 1.573 10.917 1.00 61.02 H new ATOM 0 HG12 ILE A 64 1.381 3.592 9.144 1.00 23.40 H new ATOM 0 HG13 ILE A 64 2.577 2.438 8.588 1.00 23.40 H new ATOM 0 HG21 ILE A 64 0.531 2.226 11.729 1.00 62.24 H new ATOM 0 HG22 ILE A 64 1.811 2.856 12.792 1.00 62.24 H new ATOM 0 HG23 ILE A 64 0.999 3.940 11.638 1.00 62.24 H new ATOM 0 HD11 ILE A 64 0.310 1.644 8.120 1.00 34.44 H new ATOM 0 HD12 ILE A 64 1.119 0.569 9.284 1.00 34.44 H new ATOM 0 HD13 ILE A 64 -0.096 1.740 9.850 1.00 34.44 H new ATOM 1034 N ARG A 65 2.907 5.550 11.964 1.00 23.11 N ATOM 1035 CA ARG A 65 2.332 6.848 12.162 1.00 34.21 C ATOM 1036 C ARG A 65 3.390 7.929 11.911 1.00 11.04 C ATOM 1037 O ARG A 65 3.074 9.067 11.553 1.00 31.24 O ATOM 1038 CB ARG A 65 1.764 6.860 13.604 1.00 63.23 C ATOM 1039 CG ARG A 65 0.958 8.063 14.055 1.00 61.03 C ATOM 1040 CD ARG A 65 1.811 9.286 14.297 1.00 72.52 C ATOM 1041 NE ARG A 65 1.020 10.431 14.760 1.00 65.45 N ATOM 1042 CZ ARG A 65 1.518 11.634 15.093 1.00 23.24 C ATOM 1043 NH1 ARG A 65 2.825 11.876 15.010 1.00 64.24 N ATOM 1044 NH2 ARG A 65 0.696 12.595 15.498 1.00 61.14 N ATOM 0 H ARG A 65 3.144 5.074 12.835 1.00 23.11 H new ATOM 0 HA ARG A 65 1.525 7.063 11.462 1.00 34.21 H new ATOM 0 HB2 ARG A 65 1.135 5.977 13.720 1.00 63.23 H new ATOM 0 HB3 ARG A 65 2.602 6.746 14.291 1.00 63.23 H new ATOM 0 HG2 ARG A 65 0.207 8.294 13.300 1.00 61.03 H new ATOM 0 HG3 ARG A 65 0.423 7.813 14.971 1.00 61.03 H new ATOM 0 HD2 ARG A 65 2.576 9.052 15.037 1.00 72.52 H new ATOM 0 HD3 ARG A 65 2.329 9.553 13.376 1.00 72.52 H new ATOM 0 HE ARG A 65 0.011 10.304 14.835 1.00 65.45 H new ATOM 0 HH11 ARG A 65 3.460 11.144 14.691 1.00 64.24 H new ATOM 0 HH12 ARG A 65 3.191 12.793 15.266 1.00 64.24 H new ATOM 0 HH21 ARG A 65 -0.307 12.418 15.555 1.00 61.14 H new ATOM 0 HH22 ARG A 65 1.067 13.510 15.752 1.00 61.14 H new ATOM 1058 N ARG A 66 4.644 7.552 12.063 1.00 22.15 N ATOM 1059 CA ARG A 66 5.739 8.477 11.859 1.00 21.33 C ATOM 1060 C ARG A 66 6.166 8.532 10.403 1.00 21.44 C ATOM 1061 O ARG A 66 7.151 9.176 10.056 1.00 33.42 O ATOM 1062 CB ARG A 66 6.922 8.161 12.764 1.00 33.01 C ATOM 1063 CG ARG A 66 6.608 8.315 14.235 1.00 3.21 C ATOM 1064 CD ARG A 66 7.847 8.176 15.078 1.00 31.13 C ATOM 1065 NE ARG A 66 7.575 8.425 16.498 1.00 72.54 N ATOM 1066 CZ ARG A 66 8.108 9.435 17.197 1.00 65.34 C ATOM 1067 NH1 ARG A 66 8.792 10.394 16.571 1.00 65.03 N ATOM 1068 NH2 ARG A 66 7.921 9.509 18.515 1.00 44.12 N ATOM 0 H ARG A 66 4.930 6.609 12.328 1.00 22.15 H new ATOM 0 HA ARG A 66 5.371 9.466 12.132 1.00 21.33 H new ATOM 0 HB2 ARG A 66 7.252 7.140 12.575 1.00 33.01 H new ATOM 0 HB3 ARG A 66 7.753 8.817 12.506 1.00 33.01 H new ATOM 0 HG2 ARG A 66 6.153 9.290 14.412 1.00 3.21 H new ATOM 0 HG3 ARG A 66 5.877 7.564 14.533 1.00 3.21 H new ATOM 0 HD2 ARG A 66 8.257 7.173 14.958 1.00 31.13 H new ATOM 0 HD3 ARG A 66 8.606 8.875 14.726 1.00 31.13 H new ATOM 0 HE ARG A 66 6.941 7.790 16.983 1.00 72.54 H new ATOM 0 HH11 ARG A 66 8.910 10.359 15.558 1.00 65.03 H new ATOM 0 HH12 ARG A 66 9.197 11.163 17.105 1.00 65.03 H new ATOM 0 HH21 ARG A 66 7.371 8.795 18.993 1.00 44.12 H new ATOM 0 HH22 ARG A 66 8.328 10.279 19.045 1.00 44.12 H new ATOM 1082 N HIS A 67 5.426 7.868 9.560 1.00 74.34 N ATOM 1083 CA HIS A 67 5.678 7.894 8.144 1.00 71.21 C ATOM 1084 C HIS A 67 4.434 8.304 7.411 1.00 41.32 C ATOM 1085 O HIS A 67 3.335 7.880 7.760 1.00 53.34 O ATOM 1086 CB HIS A 67 6.198 6.549 7.611 1.00 1.10 C ATOM 1087 CG HIS A 67 7.587 6.199 8.039 1.00 74.42 C ATOM 1088 ND1 HIS A 67 8.689 6.466 7.268 1.00 44.10 N ATOM 1089 CD2 HIS A 67 8.053 5.589 9.151 1.00 21.34 C ATOM 1090 CE1 HIS A 67 9.769 6.040 7.878 1.00 2.05 C ATOM 1091 NE2 HIS A 67 9.414 5.502 9.024 1.00 61.42 N ATOM 0 H HIS A 67 4.630 7.292 9.834 1.00 74.34 H new ATOM 0 HA HIS A 67 6.465 8.627 7.967 1.00 71.21 H new ATOM 0 HB2 HIS A 67 5.522 5.759 7.938 1.00 1.10 H new ATOM 0 HB3 HIS A 67 6.163 6.568 6.522 1.00 1.10 H new ATOM 0 HD1 HIS A 67 8.671 6.926 6.358 1.00 44.10 H new ATOM 0 HD2 HIS A 67 7.463 5.236 9.984 1.00 21.34 H new ATOM 0 HE1 HIS A 67 10.779 6.118 7.503 1.00 2.05 H new ATOM 1100 N GLU A 68 4.598 9.147 6.420 1.00 71.52 N ATOM 1101 CA GLU A 68 3.490 9.592 5.615 1.00 2.55 C ATOM 1102 C GLU A 68 2.911 8.443 4.831 1.00 14.12 C ATOM 1103 O GLU A 68 3.653 7.619 4.281 1.00 1.10 O ATOM 1104 CB GLU A 68 3.914 10.707 4.661 1.00 34.10 C ATOM 1105 CG GLU A 68 4.306 11.995 5.347 1.00 71.23 C ATOM 1106 CD GLU A 68 3.190 12.548 6.198 1.00 62.21 C ATOM 1107 OE1 GLU A 68 3.248 12.412 7.438 1.00 53.23 O ATOM 1108 OE2 GLU A 68 2.228 13.121 5.638 1.00 5.41 O ATOM 0 H GLU A 68 5.499 9.541 6.151 1.00 71.52 H new ATOM 0 HA GLU A 68 2.728 9.985 6.288 1.00 2.55 H new ATOM 0 HB2 GLU A 68 4.755 10.357 4.062 1.00 34.10 H new ATOM 0 HB3 GLU A 68 3.095 10.911 3.971 1.00 34.10 H new ATOM 0 HG2 GLU A 68 5.184 11.821 5.970 1.00 71.23 H new ATOM 0 HG3 GLU A 68 4.589 12.733 4.597 1.00 71.23 H new ATOM 1115 N ARG A 69 1.596 8.392 4.759 1.00 75.44 N ATOM 1116 CA ARG A 69 0.919 7.346 4.026 1.00 52.23 C ATOM 1117 C ARG A 69 1.211 7.467 2.544 1.00 62.01 C ATOM 1118 O ARG A 69 1.153 6.488 1.809 1.00 42.34 O ATOM 1119 CB ARG A 69 -0.592 7.315 4.333 1.00 74.33 C ATOM 1120 CG ARG A 69 -0.884 7.000 5.792 1.00 10.04 C ATOM 1121 CD ARG A 69 -1.561 8.146 6.539 1.00 40.40 C ATOM 1122 NE ARG A 69 -0.800 9.397 6.487 1.00 74.24 N ATOM 1123 CZ ARG A 69 -0.004 9.874 7.471 1.00 43.30 C ATOM 1124 NH1 ARG A 69 0.285 9.140 8.550 1.00 34.05 N ATOM 1125 NH2 ARG A 69 0.517 11.069 7.347 1.00 12.25 N ATOM 0 H ARG A 69 0.974 9.068 5.203 1.00 75.44 H new ATOM 0 HA ARG A 69 1.310 6.385 4.360 1.00 52.23 H new ATOM 0 HB2 ARG A 69 -1.031 8.280 4.078 1.00 74.33 H new ATOM 0 HB3 ARG A 69 -1.073 6.569 3.700 1.00 74.33 H new ATOM 0 HG2 ARG A 69 -1.520 6.117 5.844 1.00 10.04 H new ATOM 0 HG3 ARG A 69 0.050 6.750 6.295 1.00 10.04 H new ATOM 0 HD2 ARG A 69 -2.551 8.313 6.115 1.00 40.40 H new ATOM 0 HD3 ARG A 69 -1.704 7.858 7.581 1.00 40.40 H new ATOM 0 HE ARG A 69 -0.877 9.955 5.637 1.00 74.24 H new ATOM 0 HH11 ARG A 69 -0.097 8.199 8.644 1.00 34.05 H new ATOM 0 HH12 ARG A 69 0.888 9.521 9.279 1.00 34.05 H new ATOM 0 HH21 ARG A 69 0.321 11.627 6.516 1.00 12.25 H new ATOM 0 HH22 ARG A 69 1.119 11.442 8.081 1.00 12.25 H new ATOM 1139 N ASP A 70 1.553 8.677 2.127 1.00 61.03 N ATOM 1140 CA ASP A 70 1.992 8.937 0.760 1.00 1.02 C ATOM 1141 C ASP A 70 3.341 8.261 0.542 1.00 12.35 C ATOM 1142 O ASP A 70 3.509 7.464 -0.374 1.00 1.24 O ATOM 1143 CB ASP A 70 2.144 10.455 0.513 1.00 43.15 C ATOM 1144 CG ASP A 70 0.860 11.230 0.685 1.00 23.22 C ATOM 1145 OD1 ASP A 70 0.540 11.621 1.823 1.00 42.13 O ATOM 1146 OD2 ASP A 70 0.147 11.455 -0.302 1.00 72.04 O ATOM 0 H ASP A 70 1.535 9.505 2.723 1.00 61.03 H new ATOM 0 HA ASP A 70 1.247 8.543 0.068 1.00 1.02 H new ATOM 0 HB2 ASP A 70 2.892 10.852 1.199 1.00 43.15 H new ATOM 0 HB3 ASP A 70 2.521 10.614 -0.497 1.00 43.15 H new ATOM 1151 N GLU A 71 4.276 8.564 1.445 1.00 52.52 N ATOM 1152 CA GLU A 71 5.647 8.045 1.408 1.00 14.34 C ATOM 1153 C GLU A 71 5.661 6.513 1.389 1.00 20.01 C ATOM 1154 O GLU A 71 6.347 5.891 0.558 1.00 64.35 O ATOM 1155 CB GLU A 71 6.418 8.538 2.638 1.00 63.33 C ATOM 1156 CG GLU A 71 7.860 8.073 2.692 1.00 52.00 C ATOM 1157 CD GLU A 71 8.549 8.442 3.979 1.00 50.02 C ATOM 1158 OE1 GLU A 71 9.075 9.560 4.091 1.00 63.35 O ATOM 1159 OE2 GLU A 71 8.602 7.606 4.903 1.00 62.30 O ATOM 0 H GLU A 71 4.101 9.186 2.234 1.00 52.52 H new ATOM 0 HA GLU A 71 6.120 8.408 0.496 1.00 14.34 H new ATOM 0 HB2 GLU A 71 6.398 9.628 2.653 1.00 63.33 H new ATOM 0 HB3 GLU A 71 5.904 8.197 3.537 1.00 63.33 H new ATOM 0 HG2 GLU A 71 7.892 6.991 2.566 1.00 52.00 H new ATOM 0 HG3 GLU A 71 8.408 8.507 1.856 1.00 52.00 H new ATOM 1166 N ILE A 72 4.906 5.916 2.311 1.00 41.15 N ATOM 1167 CA ILE A 72 4.821 4.464 2.433 1.00 13.03 C ATOM 1168 C ILE A 72 4.268 3.849 1.152 1.00 22.24 C ATOM 1169 O ILE A 72 4.787 2.847 0.657 1.00 21.21 O ATOM 1170 CB ILE A 72 3.919 4.042 3.628 1.00 0.52 C ATOM 1171 CG1 ILE A 72 4.473 4.586 4.952 1.00 74.01 C ATOM 1172 CG2 ILE A 72 3.767 2.520 3.692 1.00 43.02 C ATOM 1173 CD1 ILE A 72 3.614 4.252 6.161 1.00 73.40 C ATOM 0 H ILE A 72 4.339 6.424 2.990 1.00 41.15 H new ATOM 0 HA ILE A 72 5.832 4.098 2.611 1.00 13.03 H new ATOM 0 HB ILE A 72 2.931 4.474 3.468 1.00 0.52 H new ATOM 0 HG12 ILE A 72 5.475 4.185 5.108 1.00 74.01 H new ATOM 0 HG13 ILE A 72 4.571 5.669 4.876 1.00 74.01 H new ATOM 0 HG21 ILE A 72 3.132 2.253 4.537 1.00 43.02 H new ATOM 0 HG22 ILE A 72 3.313 2.161 2.769 1.00 43.02 H new ATOM 0 HG23 ILE A 72 4.748 2.061 3.817 1.00 43.02 H new ATOM 0 HD11 ILE A 72 4.070 4.670 7.058 1.00 73.40 H new ATOM 0 HD12 ILE A 72 2.619 4.676 6.029 1.00 73.40 H new ATOM 0 HD13 ILE A 72 3.536 3.170 6.264 1.00 73.40 H new ATOM 1185 N MET A 73 3.239 4.473 0.611 1.00 13.44 N ATOM 1186 CA MET A 73 2.578 3.970 -0.574 1.00 5.34 C ATOM 1187 C MET A 73 3.549 3.996 -1.768 1.00 73.13 C ATOM 1188 O MET A 73 3.589 3.049 -2.564 1.00 15.55 O ATOM 1189 CB MET A 73 1.296 4.787 -0.836 1.00 41.33 C ATOM 1190 CG MET A 73 0.326 4.211 -1.868 1.00 42.02 C ATOM 1191 SD MET A 73 0.980 4.129 -3.530 1.00 15.42 S ATOM 1192 CE MET A 73 -0.421 3.493 -4.385 1.00 71.21 C ATOM 0 H MET A 73 2.841 5.337 0.979 1.00 13.44 H new ATOM 0 HA MET A 73 2.280 2.932 -0.427 1.00 5.34 H new ATOM 0 HB2 MET A 73 0.764 4.901 0.108 1.00 41.33 H new ATOM 0 HB3 MET A 73 1.587 5.786 -1.160 1.00 41.33 H new ATOM 0 HG2 MET A 73 0.035 3.208 -1.555 1.00 42.02 H new ATOM 0 HG3 MET A 73 -0.579 4.818 -1.876 1.00 42.02 H new ATOM 0 HE1 MET A 73 -0.110 2.674 -5.034 1.00 71.21 H new ATOM 0 HE2 MET A 73 -1.152 3.128 -3.664 1.00 71.21 H new ATOM 0 HE3 MET A 73 -0.869 4.283 -4.988 1.00 71.21 H new ATOM 1202 N GLU A 74 4.357 5.058 -1.869 1.00 34.13 N ATOM 1203 CA GLU A 74 5.371 5.148 -2.928 1.00 14.23 C ATOM 1204 C GLU A 74 6.310 3.959 -2.838 1.00 64.12 C ATOM 1205 O GLU A 74 6.639 3.337 -3.839 1.00 61.41 O ATOM 1206 CB GLU A 74 6.209 6.411 -2.797 1.00 74.12 C ATOM 1207 CG GLU A 74 5.453 7.709 -2.881 1.00 22.21 C ATOM 1208 CD GLU A 74 6.380 8.887 -2.773 1.00 23.12 C ATOM 1209 OE1 GLU A 74 6.823 9.209 -1.644 1.00 10.40 O ATOM 1210 OE2 GLU A 74 6.685 9.507 -3.802 1.00 4.21 O ATOM 0 H GLU A 74 4.330 5.859 -1.238 1.00 34.13 H new ATOM 0 HA GLU A 74 4.843 5.164 -3.882 1.00 14.23 H new ATOM 0 HB2 GLU A 74 6.734 6.379 -1.842 1.00 74.12 H new ATOM 0 HB3 GLU A 74 6.969 6.403 -3.579 1.00 74.12 H new ATOM 0 HG2 GLU A 74 4.910 7.756 -3.825 1.00 22.21 H new ATOM 0 HG3 GLU A 74 4.711 7.753 -2.084 1.00 22.21 H new ATOM 1217 N GLU A 75 6.717 3.647 -1.617 1.00 44.14 N ATOM 1218 CA GLU A 75 7.620 2.545 -1.344 1.00 33.43 C ATOM 1219 C GLU A 75 6.968 1.218 -1.768 1.00 73.33 C ATOM 1220 O GLU A 75 7.624 0.353 -2.366 1.00 41.12 O ATOM 1221 CB GLU A 75 7.967 2.538 0.147 1.00 33.34 C ATOM 1222 CG GLU A 75 9.014 1.525 0.562 1.00 12.43 C ATOM 1223 CD GLU A 75 10.331 1.730 -0.142 1.00 61.53 C ATOM 1224 OE1 GLU A 75 10.897 2.839 -0.050 1.00 73.12 O ATOM 1225 OE2 GLU A 75 10.829 0.784 -0.758 1.00 2.32 O ATOM 0 H GLU A 75 6.426 4.157 -0.783 1.00 44.14 H new ATOM 0 HA GLU A 75 8.540 2.666 -1.916 1.00 33.43 H new ATOM 0 HB2 GLU A 75 8.316 3.532 0.427 1.00 33.34 H new ATOM 0 HB3 GLU A 75 7.056 2.348 0.715 1.00 33.34 H new ATOM 0 HG2 GLU A 75 9.168 1.588 1.639 1.00 12.43 H new ATOM 0 HG3 GLU A 75 8.646 0.521 0.351 1.00 12.43 H new ATOM 1232 N LEU A 76 5.668 1.088 -1.480 1.00 34.35 N ATOM 1233 CA LEU A 76 4.895 -0.093 -1.868 1.00 23.32 C ATOM 1234 C LEU A 76 4.902 -0.244 -3.376 1.00 60.15 C ATOM 1235 O LEU A 76 5.216 -1.317 -3.903 1.00 10.12 O ATOM 1236 CB LEU A 76 3.433 0.017 -1.398 1.00 43.33 C ATOM 1237 CG LEU A 76 3.184 0.117 0.104 1.00 53.23 C ATOM 1238 CD1 LEU A 76 1.697 0.249 0.381 1.00 0.15 C ATOM 1239 CD2 LEU A 76 3.735 -1.097 0.810 1.00 43.14 C ATOM 0 H LEU A 76 5.128 1.792 -0.976 1.00 34.35 H new ATOM 0 HA LEU A 76 5.359 -0.959 -1.396 1.00 23.32 H new ATOM 0 HB2 LEU A 76 2.992 0.894 -1.872 1.00 43.33 H new ATOM 0 HB3 LEU A 76 2.893 -0.853 -1.772 1.00 43.33 H new ATOM 0 HG LEU A 76 3.694 1.003 0.482 1.00 53.23 H new ATOM 0 HD11 LEU A 76 1.532 0.320 1.456 1.00 0.15 H new ATOM 0 HD12 LEU A 76 1.315 1.147 -0.104 1.00 0.15 H new ATOM 0 HD13 LEU A 76 1.175 -0.625 -0.010 1.00 0.15 H new ATOM 0 HD21 LEU A 76 3.550 -1.011 1.881 1.00 43.14 H new ATOM 0 HD22 LEU A 76 3.246 -1.993 0.428 1.00 43.14 H new ATOM 0 HD23 LEU A 76 4.808 -1.166 0.632 1.00 43.14 H new ATOM 1251 N THR A 77 4.589 0.842 -4.063 1.00 65.44 N ATOM 1252 CA THR A 77 4.534 0.842 -5.494 1.00 24.55 C ATOM 1253 C THR A 77 5.919 0.555 -6.108 1.00 14.33 C ATOM 1254 O THR A 77 6.030 -0.230 -7.048 1.00 52.30 O ATOM 1255 CB THR A 77 3.964 2.178 -6.010 1.00 54.52 C ATOM 1256 OG1 THR A 77 2.694 2.404 -5.381 1.00 73.14 O ATOM 1257 CG2 THR A 77 3.751 2.135 -7.516 1.00 31.42 C ATOM 0 H THR A 77 4.368 1.741 -3.635 1.00 65.44 H new ATOM 0 HA THR A 77 3.866 0.040 -5.808 1.00 24.55 H new ATOM 0 HB THR A 77 4.671 2.974 -5.776 1.00 54.52 H new ATOM 0 HG1 THR A 77 2.820 2.951 -4.578 1.00 73.14 H new ATOM 0 HG21 THR A 77 3.348 3.090 -7.854 1.00 31.42 H new ATOM 0 HG22 THR A 77 4.703 1.946 -8.013 1.00 31.42 H new ATOM 0 HG23 THR A 77 3.049 1.338 -7.762 1.00 31.42 H new ATOM 1265 N LYS A 78 6.976 1.153 -5.548 1.00 60.53 N ATOM 1266 CA LYS A 78 8.317 0.928 -6.075 1.00 42.41 C ATOM 1267 C LYS A 78 8.725 -0.518 -5.959 1.00 13.23 C ATOM 1268 O LYS A 78 9.235 -1.105 -6.899 1.00 53.13 O ATOM 1269 CB LYS A 78 9.388 1.802 -5.417 1.00 31.41 C ATOM 1270 CG LYS A 78 9.210 3.291 -5.609 1.00 2.30 C ATOM 1271 CD LYS A 78 10.430 4.071 -5.122 1.00 20.41 C ATOM 1272 CE LYS A 78 10.765 3.752 -3.680 1.00 41.13 C ATOM 1273 NZ LYS A 78 11.947 4.493 -3.203 1.00 64.52 N ATOM 0 H LYS A 78 6.928 1.783 -4.747 1.00 60.53 H new ATOM 0 HA LYS A 78 8.256 1.212 -7.126 1.00 42.41 H new ATOM 0 HB2 LYS A 78 9.402 1.589 -4.348 1.00 31.41 H new ATOM 0 HB3 LYS A 78 10.362 1.515 -5.812 1.00 31.41 H new ATOM 0 HG2 LYS A 78 9.039 3.504 -6.664 1.00 2.30 H new ATOM 0 HG3 LYS A 78 8.324 3.625 -5.068 1.00 2.30 H new ATOM 0 HD2 LYS A 78 11.287 3.837 -5.754 1.00 20.41 H new ATOM 0 HD3 LYS A 78 10.242 5.140 -5.223 1.00 20.41 H new ATOM 0 HE2 LYS A 78 9.909 3.992 -3.049 1.00 41.13 H new ATOM 0 HE3 LYS A 78 10.945 2.682 -3.579 1.00 41.13 H new ATOM 0 HZ1 LYS A 78 12.137 4.242 -2.212 1.00 64.52 H new ATOM 0 HZ2 LYS A 78 12.771 4.245 -3.787 1.00 64.52 H new ATOM 0 HZ3 LYS A 78 11.768 5.515 -3.273 1.00 64.52 H new ATOM 1287 N TYR A 79 8.480 -1.087 -4.820 1.00 42.03 N ATOM 1288 CA TYR A 79 8.881 -2.450 -4.554 1.00 73.35 C ATOM 1289 C TYR A 79 8.124 -3.431 -5.444 1.00 42.33 C ATOM 1290 O TYR A 79 8.694 -4.425 -5.926 1.00 14.24 O ATOM 1291 CB TYR A 79 8.666 -2.767 -3.087 1.00 13.10 C ATOM 1292 CG TYR A 79 9.151 -4.120 -2.665 1.00 50.03 C ATOM 1293 CD1 TYR A 79 10.448 -4.294 -2.231 1.00 70.51 C ATOM 1294 CD2 TYR A 79 8.311 -5.222 -2.693 1.00 14.14 C ATOM 1295 CE1 TYR A 79 10.901 -5.524 -1.836 1.00 12.34 C ATOM 1296 CE2 TYR A 79 8.756 -6.459 -2.299 1.00 54.11 C ATOM 1297 CZ TYR A 79 10.053 -6.603 -1.869 1.00 52.01 C ATOM 1298 OH TYR A 79 10.509 -7.828 -1.479 1.00 41.42 O ATOM 0 H TYR A 79 7.999 -0.630 -4.046 1.00 42.03 H new ATOM 0 HA TYR A 79 9.941 -2.555 -4.786 1.00 73.35 H new ATOM 0 HB2 TYR A 79 9.172 -2.011 -2.487 1.00 13.10 H new ATOM 0 HB3 TYR A 79 7.602 -2.691 -2.864 1.00 13.10 H new ATOM 0 HD1 TYR A 79 11.117 -3.447 -2.202 1.00 70.51 H new ATOM 0 HD2 TYR A 79 7.291 -5.106 -3.030 1.00 14.14 H new ATOM 0 HE1 TYR A 79 11.920 -5.645 -1.500 1.00 12.34 H new ATOM 0 HE2 TYR A 79 8.093 -7.311 -2.327 1.00 54.11 H new ATOM 0 HH TYR A 79 10.217 -8.009 -0.561 1.00 41.42 H new ATOM 1308 N TYR A 80 6.862 -3.128 -5.674 1.00 13.12 N ATOM 1309 CA TYR A 80 5.987 -3.951 -6.477 1.00 41.04 C ATOM 1310 C TYR A 80 6.577 -4.124 -7.881 1.00 52.22 C ATOM 1311 O TYR A 80 6.695 -5.239 -8.385 1.00 55.23 O ATOM 1312 CB TYR A 80 4.607 -3.291 -6.534 1.00 72.20 C ATOM 1313 CG TYR A 80 3.504 -4.124 -7.143 1.00 24.25 C ATOM 1314 CD1 TYR A 80 2.840 -5.070 -6.379 1.00 63.11 C ATOM 1315 CD2 TYR A 80 3.099 -3.945 -8.457 1.00 75.33 C ATOM 1316 CE1 TYR A 80 1.810 -5.817 -6.900 1.00 5.31 C ATOM 1317 CE2 TYR A 80 2.069 -4.692 -8.989 1.00 34.31 C ATOM 1318 CZ TYR A 80 1.427 -5.627 -8.201 1.00 55.14 C ATOM 1319 OH TYR A 80 0.393 -6.369 -8.717 1.00 60.50 O ATOM 0 H TYR A 80 6.412 -2.292 -5.302 1.00 13.12 H new ATOM 0 HA TYR A 80 5.888 -4.942 -6.033 1.00 41.04 H new ATOM 0 HB2 TYR A 80 4.313 -3.019 -5.520 1.00 72.20 H new ATOM 0 HB3 TYR A 80 4.692 -2.364 -7.101 1.00 72.20 H new ATOM 0 HD1 TYR A 80 3.138 -5.224 -5.352 1.00 63.11 H new ATOM 0 HD2 TYR A 80 3.597 -3.210 -9.072 1.00 75.33 H new ATOM 0 HE1 TYR A 80 1.306 -6.549 -6.287 1.00 5.31 H new ATOM 0 HE2 TYR A 80 1.766 -4.547 -10.015 1.00 34.31 H new ATOM 0 HH TYR A 80 -0.450 -6.084 -8.307 1.00 60.50 H new ATOM 1329 N LEU A 81 6.945 -3.017 -8.504 1.00 74.43 N ATOM 1330 CA LEU A 81 7.564 -3.053 -9.804 1.00 63.54 C ATOM 1331 C LEU A 81 9.013 -3.537 -9.759 1.00 62.22 C ATOM 1332 O LEU A 81 9.490 -4.153 -10.719 1.00 71.11 O ATOM 1333 CB LEU A 81 7.464 -1.703 -10.524 1.00 45.24 C ATOM 1334 CG LEU A 81 6.074 -1.254 -11.014 1.00 25.33 C ATOM 1335 CD1 LEU A 81 5.456 -2.271 -11.957 1.00 33.30 C ATOM 1336 CD2 LEU A 81 5.124 -0.915 -9.881 1.00 31.20 C ATOM 0 H LEU A 81 6.822 -2.080 -8.121 1.00 74.43 H new ATOM 0 HA LEU A 81 7.000 -3.786 -10.380 1.00 63.54 H new ATOM 0 HB2 LEU A 81 7.847 -0.935 -9.852 1.00 45.24 H new ATOM 0 HB3 LEU A 81 8.130 -1.733 -11.386 1.00 45.24 H new ATOM 0 HG LEU A 81 6.238 -0.331 -11.570 1.00 25.33 H new ATOM 0 HD11 LEU A 81 4.477 -1.919 -12.281 1.00 33.30 H new ATOM 0 HD12 LEU A 81 6.101 -2.400 -12.826 1.00 33.30 H new ATOM 0 HD13 LEU A 81 5.346 -3.225 -11.442 1.00 33.30 H new ATOM 0 HD21 LEU A 81 4.163 -0.606 -10.292 1.00 31.20 H new ATOM 0 HD22 LEU A 81 4.983 -1.792 -9.249 1.00 31.20 H new ATOM 0 HD23 LEU A 81 5.542 -0.103 -9.286 1.00 31.20 H new ATOM 1348 N ALA A 82 9.703 -3.288 -8.651 1.00 31.22 N ATOM 1349 CA ALA A 82 11.116 -3.628 -8.556 1.00 11.35 C ATOM 1350 C ALA A 82 11.348 -5.119 -8.591 1.00 55.32 C ATOM 1351 O ALA A 82 12.171 -5.606 -9.367 1.00 64.13 O ATOM 1352 CB ALA A 82 11.753 -3.014 -7.329 1.00 53.24 C ATOM 0 H ALA A 82 9.311 -2.856 -7.814 1.00 31.22 H new ATOM 0 HA ALA A 82 11.598 -3.203 -9.437 1.00 11.35 H new ATOM 0 HB1 ALA A 82 12.807 -3.289 -7.290 1.00 53.24 H new ATOM 0 HB2 ALA A 82 11.662 -1.929 -7.376 1.00 53.24 H new ATOM 0 HB3 ALA A 82 11.249 -3.382 -6.435 1.00 53.24 H new ATOM 1358 N ASN A 83 10.598 -5.862 -7.797 1.00 65.52 N ATOM 1359 CA ASN A 83 10.750 -7.312 -7.782 1.00 13.10 C ATOM 1360 C ASN A 83 10.087 -7.927 -8.985 1.00 73.05 C ATOM 1361 O ASN A 83 10.237 -9.117 -9.261 1.00 63.22 O ATOM 1362 CB ASN A 83 10.211 -7.942 -6.501 1.00 61.03 C ATOM 1363 CG ASN A 83 10.907 -7.458 -5.249 1.00 55.43 C ATOM 1364 OD1 ASN A 83 11.331 -6.310 -5.149 1.00 74.41 O ATOM 1365 ND2 ASN A 83 11.080 -8.329 -4.313 1.00 12.25 N ATOM 0 H ASN A 83 9.888 -5.497 -7.163 1.00 65.52 H new ATOM 0 HA ASN A 83 11.820 -7.518 -7.818 1.00 13.10 H new ATOM 0 HB2 ASN A 83 9.146 -7.727 -6.421 1.00 61.03 H new ATOM 0 HB3 ASN A 83 10.313 -9.025 -6.568 1.00 61.03 H new ATOM 0 HD21 ASN A 83 11.580 -8.071 -3.462 1.00 12.25 H new ATOM 0 HD22 ASN A 83 10.717 -9.276 -4.424 1.00 12.25 H new ATOM 1372 N HIS A 84 9.367 -7.104 -9.712 1.00 11.22 N ATOM 1373 CA HIS A 84 8.711 -7.511 -10.934 1.00 51.04 C ATOM 1374 C HIS A 84 9.717 -7.385 -12.103 1.00 12.41 C ATOM 1375 O HIS A 84 9.393 -7.630 -13.257 1.00 13.31 O ATOM 1376 CB HIS A 84 7.433 -6.656 -11.145 1.00 53.42 C ATOM 1377 CG HIS A 84 6.590 -7.000 -12.346 1.00 33.54 C ATOM 1378 ND1 HIS A 84 5.611 -7.973 -12.340 1.00 50.11 N ATOM 1379 CD2 HIS A 84 6.575 -6.470 -13.586 1.00 71.31 C ATOM 1380 CE1 HIS A 84 5.041 -8.019 -13.527 1.00 23.12 C ATOM 1381 NE2 HIS A 84 5.610 -7.118 -14.294 1.00 51.41 N ATOM 0 H HIS A 84 9.219 -6.124 -9.470 1.00 11.22 H new ATOM 0 HA HIS A 84 8.392 -8.552 -10.882 1.00 51.04 H new ATOM 0 HB2 HIS A 84 6.811 -6.744 -10.254 1.00 53.42 H new ATOM 0 HB3 HIS A 84 7.730 -5.610 -11.224 1.00 53.42 H new ATOM 0 HD2 HIS A 84 7.212 -5.677 -13.950 1.00 71.31 H new ATOM 0 HE1 HIS A 84 4.242 -8.684 -13.819 1.00 23.12 H new ATOM 0 HE2 HIS A 84 5.367 -6.933 -15.267 1.00 51.41 H new ATOM 1390 N GLY A 85 10.946 -6.998 -11.768 1.00 12.44 N ATOM 1391 CA GLY A 85 12.008 -6.952 -12.747 1.00 40.01 C ATOM 1392 C GLY A 85 12.345 -5.563 -13.227 1.00 61.14 C ATOM 1393 O GLY A 85 13.229 -5.396 -14.069 1.00 0.42 O ATOM 0 H GLY A 85 11.222 -6.715 -10.828 1.00 12.44 H new ATOM 0 HA2 GLY A 85 12.903 -7.403 -12.318 1.00 40.01 H new ATOM 0 HA3 GLY A 85 11.723 -7.562 -13.604 1.00 40.01 H new ATOM 1397 N ILE A 86 11.680 -4.569 -12.699 1.00 22.13 N ATOM 1398 CA ILE A 86 11.916 -3.211 -13.130 1.00 5.12 C ATOM 1399 C ILE A 86 12.806 -2.474 -12.146 1.00 62.01 C ATOM 1400 O ILE A 86 12.571 -2.512 -10.940 1.00 25.40 O ATOM 1401 CB ILE A 86 10.588 -2.437 -13.328 1.00 64.01 C ATOM 1402 CG1 ILE A 86 9.754 -3.098 -14.437 1.00 0.43 C ATOM 1403 CG2 ILE A 86 10.849 -0.960 -13.639 1.00 40.41 C ATOM 1404 CD1 ILE A 86 8.440 -2.407 -14.713 1.00 45.35 C ATOM 0 H ILE A 86 10.972 -4.671 -11.972 1.00 22.13 H new ATOM 0 HA ILE A 86 12.426 -3.263 -14.092 1.00 5.12 H new ATOM 0 HB ILE A 86 10.022 -2.478 -12.397 1.00 64.01 H new ATOM 0 HG12 ILE A 86 10.341 -3.119 -15.355 1.00 0.43 H new ATOM 0 HG13 ILE A 86 9.557 -4.134 -14.161 1.00 0.43 H new ATOM 0 HG21 ILE A 86 9.899 -0.443 -13.773 1.00 40.41 H new ATOM 0 HG22 ILE A 86 11.396 -0.505 -12.813 1.00 40.41 H new ATOM 0 HG23 ILE A 86 11.438 -0.879 -14.553 1.00 40.41 H new ATOM 0 HD11 ILE A 86 7.912 -2.934 -15.508 1.00 45.35 H new ATOM 0 HD12 ILE A 86 7.831 -2.409 -13.809 1.00 45.35 H new ATOM 0 HD13 ILE A 86 8.628 -1.379 -15.022 1.00 45.35 H new ATOM 1416 N ASP A 87 13.832 -1.831 -12.646 1.00 24.02 N ATOM 1417 CA ASP A 87 14.675 -1.020 -11.796 1.00 64.33 C ATOM 1418 C ASP A 87 14.135 0.388 -11.810 1.00 63.21 C ATOM 1419 O ASP A 87 14.021 1.027 -12.865 1.00 23.30 O ATOM 1420 CB ASP A 87 16.169 -1.050 -12.216 1.00 41.34 C ATOM 1421 CG ASP A 87 16.456 -0.410 -13.557 1.00 34.11 C ATOM 1422 OD1 ASP A 87 16.245 -1.057 -14.590 1.00 61.05 O ATOM 1423 OD2 ASP A 87 16.924 0.760 -13.590 1.00 30.34 O ATOM 0 H ASP A 87 14.104 -1.851 -13.629 1.00 24.02 H new ATOM 0 HA ASP A 87 14.650 -1.431 -10.787 1.00 64.33 H new ATOM 0 HB2 ASP A 87 16.759 -0.543 -11.452 1.00 41.34 H new ATOM 0 HB3 ASP A 87 16.505 -2.086 -12.243 1.00 41.34 H new ATOM 1428 N ILE A 88 13.767 0.856 -10.664 1.00 11.23 N ATOM 1429 CA ILE A 88 13.189 2.159 -10.547 1.00 70.21 C ATOM 1430 C ILE A 88 14.262 3.183 -10.323 1.00 24.33 C ATOM 1431 O ILE A 88 15.180 2.984 -9.513 1.00 64.44 O ATOM 1432 CB ILE A 88 12.100 2.179 -9.460 1.00 51.42 C ATOM 1433 CG1 ILE A 88 11.003 1.204 -9.880 1.00 61.42 C ATOM 1434 CG2 ILE A 88 11.538 3.583 -9.210 1.00 13.30 C ATOM 1435 CD1 ILE A 88 9.847 1.151 -8.959 1.00 61.22 C ATOM 0 H ILE A 88 13.857 0.350 -9.783 1.00 11.23 H new ATOM 0 HA ILE A 88 12.692 2.419 -11.481 1.00 70.21 H new ATOM 0 HB ILE A 88 12.538 1.872 -8.510 1.00 51.42 H new ATOM 0 HG12 ILE A 88 10.649 1.481 -10.873 1.00 61.42 H new ATOM 0 HG13 ILE A 88 11.433 0.206 -9.962 1.00 61.42 H new ATOM 0 HG21 ILE A 88 10.774 3.536 -8.434 1.00 13.30 H new ATOM 0 HG22 ILE A 88 12.342 4.245 -8.888 1.00 13.30 H new ATOM 0 HG23 ILE A 88 11.098 3.968 -10.130 1.00 13.30 H new ATOM 0 HD11 ILE A 88 9.116 0.434 -9.333 1.00 61.22 H new ATOM 0 HD12 ILE A 88 10.184 0.843 -7.969 1.00 61.22 H new ATOM 0 HD13 ILE A 88 9.388 2.137 -8.895 1.00 61.22 H new ATOM 1447 N LYS A 89 14.151 4.255 -11.044 1.00 11.20 N ATOM 1448 CA LYS A 89 15.166 5.291 -11.081 1.00 31.41 C ATOM 1449 C LYS A 89 14.955 6.294 -9.952 1.00 30.23 C ATOM 1450 O LYS A 89 13.818 6.488 -9.490 1.00 40.11 O ATOM 1451 CB LYS A 89 15.172 6.030 -12.458 1.00 64.23 C ATOM 1452 CG LYS A 89 15.460 5.166 -13.723 1.00 41.30 C ATOM 1453 CD LYS A 89 14.359 4.137 -14.011 1.00 44.32 C ATOM 1454 CE LYS A 89 14.624 3.338 -15.284 1.00 11.40 C ATOM 1455 NZ LYS A 89 15.895 2.577 -15.236 1.00 32.41 N ATOM 0 H LYS A 89 13.344 4.449 -11.637 1.00 11.20 H new ATOM 0 HA LYS A 89 16.134 4.808 -10.947 1.00 31.41 H new ATOM 0 HB2 LYS A 89 14.202 6.510 -12.589 1.00 64.23 H new ATOM 0 HB3 LYS A 89 15.917 6.824 -12.413 1.00 64.23 H new ATOM 0 HG2 LYS A 89 15.571 5.822 -14.586 1.00 41.30 H new ATOM 0 HG3 LYS A 89 16.410 4.647 -13.593 1.00 41.30 H new ATOM 0 HD2 LYS A 89 14.276 3.452 -13.167 1.00 44.32 H new ATOM 0 HD3 LYS A 89 13.401 4.650 -14.101 1.00 44.32 H new ATOM 0 HE2 LYS A 89 13.799 2.646 -15.450 1.00 11.40 H new ATOM 0 HE3 LYS A 89 14.646 4.018 -16.135 1.00 11.40 H new ATOM 0 HZ1 LYS A 89 15.972 1.976 -16.082 1.00 32.41 H new ATOM 0 HZ2 LYS A 89 16.696 3.240 -15.208 1.00 32.41 H new ATOM 0 HZ3 LYS A 89 15.910 1.980 -14.385 1.00 32.41 H new TER 1469 LYS A 89 ATOM 1470 N MET B 1 -19.997 0.427 18.695 1.00 31.41 N ATOM 1471 CA MET B 1 -21.457 0.422 18.727 1.00 1.43 C ATOM 1472 C MET B 1 -22.011 0.338 17.331 1.00 14.02 C ATOM 1473 O MET B 1 -23.219 0.449 17.098 1.00 31.31 O ATOM 1474 CB MET B 1 -22.021 1.632 19.495 1.00 63.11 C ATOM 1475 CG MET B 1 -21.750 1.590 21.000 1.00 3.21 C ATOM 1476 SD MET B 1 -19.990 1.593 21.416 1.00 73.32 S ATOM 1477 CE MET B 1 -20.072 1.333 23.183 1.00 43.31 C ATOM 0 H1 MET B 1 -19.630 0.638 19.645 1.00 31.41 H new ATOM 0 H2 MET B 1 -19.653 -0.506 18.390 1.00 31.41 H new ATOM 0 H3 MET B 1 -19.667 1.153 18.027 1.00 31.41 H new ATOM 0 HA MET B 1 -21.778 -0.465 19.273 1.00 1.43 H new ATOM 0 HB2 MET B 1 -21.590 2.545 19.083 1.00 63.11 H new ATOM 0 HB3 MET B 1 -23.097 1.685 19.331 1.00 63.11 H new ATOM 0 HG2 MET B 1 -22.228 2.449 21.471 1.00 3.21 H new ATOM 0 HG3 MET B 1 -22.213 0.697 21.420 1.00 3.21 H new ATOM 0 HE1 MET B 1 -19.063 1.310 23.595 1.00 43.31 H new ATOM 0 HE2 MET B 1 -20.633 2.145 23.645 1.00 43.31 H new ATOM 0 HE3 MET B 1 -20.570 0.385 23.389 1.00 43.31 H new ATOM 1487 N GLY B 2 -21.124 0.113 16.421 1.00 72.51 N ATOM 1488 CA GLY B 2 -21.469 -0.063 15.046 1.00 61.14 C ATOM 1489 C GLY B 2 -20.839 -1.321 14.550 1.00 34.12 C ATOM 1490 O GLY B 2 -20.110 -1.318 13.547 1.00 64.12 O ATOM 0 H GLY B 2 -20.124 0.045 16.612 1.00 72.51 H new ATOM 0 HA2 GLY B 2 -22.552 -0.113 14.932 1.00 61.14 H new ATOM 0 HA3 GLY B 2 -21.125 0.788 14.459 1.00 61.14 H new ATOM 1494 N PHE B 3 -21.104 -2.398 15.269 1.00 31.34 N ATOM 1495 CA PHE B 3 -20.509 -3.688 15.003 1.00 13.23 C ATOM 1496 C PHE B 3 -21.145 -4.307 13.785 1.00 62.12 C ATOM 1497 O PHE B 3 -22.186 -4.963 13.870 1.00 2.42 O ATOM 1498 CB PHE B 3 -20.658 -4.624 16.211 1.00 42.32 C ATOM 1499 CG PHE B 3 -20.097 -4.075 17.497 1.00 64.20 C ATOM 1500 CD1 PHE B 3 -20.928 -3.465 18.426 1.00 31.11 C ATOM 1501 CD2 PHE B 3 -18.749 -4.171 17.778 1.00 64.43 C ATOM 1502 CE1 PHE B 3 -20.419 -2.961 19.607 1.00 71.30 C ATOM 1503 CE2 PHE B 3 -18.234 -3.668 18.957 1.00 74.43 C ATOM 1504 CZ PHE B 3 -19.070 -3.065 19.873 1.00 3.43 C ATOM 0 H PHE B 3 -21.746 -2.397 16.062 1.00 31.34 H new ATOM 0 HA PHE B 3 -19.445 -3.542 14.817 1.00 13.23 H new ATOM 0 HB2 PHE B 3 -21.715 -4.845 16.355 1.00 42.32 H new ATOM 0 HB3 PHE B 3 -20.162 -5.569 15.987 1.00 42.32 H new ATOM 0 HD1 PHE B 3 -21.986 -3.383 18.223 1.00 31.11 H new ATOM 0 HD2 PHE B 3 -18.089 -4.645 17.067 1.00 64.43 H new ATOM 0 HE1 PHE B 3 -21.076 -2.486 20.321 1.00 71.30 H new ATOM 0 HE2 PHE B 3 -17.176 -3.747 19.161 1.00 74.43 H new ATOM 0 HZ PHE B 3 -18.669 -2.675 20.797 1.00 3.43 H new ATOM 1514 N THR B 4 -20.553 -4.059 12.656 1.00 54.25 N ATOM 1515 CA THR B 4 -21.065 -4.530 11.411 1.00 22.41 C ATOM 1516 C THR B 4 -19.945 -5.052 10.544 1.00 13.33 C ATOM 1517 O THR B 4 -19.009 -4.306 10.204 1.00 74.30 O ATOM 1518 CB THR B 4 -21.783 -3.387 10.645 1.00 41.51 C ATOM 1519 OG1 THR B 4 -20.896 -2.255 10.530 1.00 22.15 O ATOM 1520 CG2 THR B 4 -23.076 -2.960 11.334 1.00 73.30 C ATOM 0 H THR B 4 -19.692 -3.518 12.576 1.00 54.25 H new ATOM 0 HA THR B 4 -21.773 -5.330 11.627 1.00 22.41 H new ATOM 0 HB THR B 4 -22.046 -3.762 9.656 1.00 41.51 H new ATOM 0 HG1 THR B 4 -19.980 -2.571 10.386 1.00 22.15 H new ATOM 0 HG21 THR B 4 -23.545 -2.158 10.763 1.00 73.30 H new ATOM 0 HG22 THR B 4 -23.756 -3.810 11.391 1.00 73.30 H new ATOM 0 HG23 THR B 4 -22.852 -2.606 12.340 1.00 73.30 H new ATOM 1528 N ASP B 5 -20.007 -6.309 10.208 1.00 43.20 N ATOM 1529 CA ASP B 5 -19.070 -6.868 9.260 1.00 11.30 C ATOM 1530 C ASP B 5 -19.430 -6.340 7.912 1.00 44.40 C ATOM 1531 O ASP B 5 -20.588 -6.439 7.499 1.00 44.42 O ATOM 1532 CB ASP B 5 -19.155 -8.393 9.235 1.00 64.13 C ATOM 1533 CG ASP B 5 -18.311 -9.010 8.124 1.00 71.13 C ATOM 1534 OD1 ASP B 5 -17.111 -9.262 8.346 1.00 21.21 O ATOM 1535 OD2 ASP B 5 -18.854 -9.272 7.016 1.00 34.02 O ATOM 0 H ASP B 5 -20.693 -6.970 10.572 1.00 43.20 H new ATOM 0 HA ASP B 5 -18.055 -6.591 9.544 1.00 11.30 H new ATOM 0 HB2 ASP B 5 -18.827 -8.787 10.197 1.00 64.13 H new ATOM 0 HB3 ASP B 5 -20.195 -8.693 9.105 1.00 64.13 H new ATOM 1540 N GLU B 6 -18.511 -5.750 7.231 1.00 41.41 N ATOM 1541 CA GLU B 6 -18.832 -5.249 5.947 1.00 21.20 C ATOM 1542 C GLU B 6 -18.048 -5.958 4.876 1.00 61.53 C ATOM 1543 O GLU B 6 -17.007 -5.496 4.430 1.00 40.30 O ATOM 1544 CB GLU B 6 -18.698 -3.725 5.838 1.00 3.11 C ATOM 1545 CG GLU B 6 -19.259 -3.171 4.532 1.00 71.22 C ATOM 1546 CD GLU B 6 -19.094 -1.684 4.396 1.00 22.21 C ATOM 1547 OE1 GLU B 6 -19.813 -0.923 5.079 1.00 64.54 O ATOM 1548 OE2 GLU B 6 -18.272 -1.249 3.572 1.00 31.54 O ATOM 0 H GLU B 6 -17.549 -5.605 7.536 1.00 41.41 H new ATOM 0 HA GLU B 6 -19.889 -5.462 5.789 1.00 21.20 H new ATOM 0 HB2 GLU B 6 -19.216 -3.259 6.676 1.00 3.11 H new ATOM 0 HB3 GLU B 6 -17.646 -3.451 5.921 1.00 3.11 H new ATOM 0 HG2 GLU B 6 -18.763 -3.662 3.695 1.00 71.22 H new ATOM 0 HG3 GLU B 6 -20.318 -3.419 4.466 1.00 71.22 H new ATOM 1555 N THR B 7 -18.492 -7.127 4.556 1.00 55.50 N ATOM 1556 CA THR B 7 -17.990 -7.823 3.440 1.00 62.11 C ATOM 1557 C THR B 7 -18.979 -7.632 2.321 1.00 71.35 C ATOM 1558 O THR B 7 -20.003 -8.323 2.231 1.00 74.41 O ATOM 1559 CB THR B 7 -17.689 -9.315 3.742 1.00 53.33 C ATOM 1560 OG1 THR B 7 -18.785 -9.919 4.460 1.00 62.14 O ATOM 1561 CG2 THR B 7 -16.407 -9.449 4.552 1.00 34.45 C ATOM 0 H THR B 7 -19.219 -7.622 5.072 1.00 55.50 H new ATOM 0 HA THR B 7 -17.019 -7.420 3.151 1.00 62.11 H new ATOM 0 HB THR B 7 -17.562 -9.833 2.791 1.00 53.33 H new ATOM 0 HG1 THR B 7 -18.633 -9.830 5.424 1.00 62.14 H new ATOM 0 HG21 THR B 7 -16.213 -10.502 4.754 1.00 34.45 H new ATOM 0 HG22 THR B 7 -15.575 -9.028 3.988 1.00 34.45 H new ATOM 0 HG23 THR B 7 -16.515 -8.913 5.495 1.00 34.45 H new ATOM 1569 N VAL B 8 -18.704 -6.624 1.522 1.00 12.11 N ATOM 1570 CA VAL B 8 -19.591 -6.180 0.485 1.00 52.45 C ATOM 1571 C VAL B 8 -19.843 -7.274 -0.560 1.00 22.22 C ATOM 1572 O VAL B 8 -20.963 -7.405 -1.064 1.00 21.42 O ATOM 1573 CB VAL B 8 -19.072 -4.854 -0.171 1.00 23.23 C ATOM 1574 CG1 VAL B 8 -17.721 -5.020 -0.852 1.00 44.02 C ATOM 1575 CG2 VAL B 8 -20.097 -4.257 -1.106 1.00 65.23 C ATOM 0 H VAL B 8 -17.840 -6.085 1.581 1.00 12.11 H new ATOM 0 HA VAL B 8 -20.554 -5.963 0.948 1.00 52.45 H new ATOM 0 HB VAL B 8 -18.918 -4.149 0.646 1.00 23.23 H new ATOM 0 HG11 VAL B 8 -17.414 -4.069 -1.287 1.00 44.02 H new ATOM 0 HG12 VAL B 8 -16.981 -5.339 -0.119 1.00 44.02 H new ATOM 0 HG13 VAL B 8 -17.800 -5.771 -1.638 1.00 44.02 H new ATOM 0 HG21 VAL B 8 -19.701 -3.339 -1.541 1.00 65.23 H new ATOM 0 HG22 VAL B 8 -20.322 -4.968 -1.901 1.00 65.23 H new ATOM 0 HG23 VAL B 8 -21.008 -4.032 -0.551 1.00 65.23 H new ATOM 1585 N ARG B 9 -18.797 -8.074 -0.850 1.00 64.24 N ATOM 1586 CA ARG B 9 -18.872 -9.181 -1.819 1.00 21.23 C ATOM 1587 C ARG B 9 -19.337 -8.659 -3.176 1.00 32.13 C ATOM 1588 O ARG B 9 -20.027 -9.345 -3.929 1.00 35.15 O ATOM 1589 CB ARG B 9 -19.804 -10.295 -1.308 1.00 41.42 C ATOM 1590 CG ARG B 9 -19.401 -10.855 0.047 1.00 44.13 C ATOM 1591 CD ARG B 9 -20.281 -12.018 0.450 1.00 32.54 C ATOM 1592 NE ARG B 9 -19.985 -12.481 1.811 1.00 41.05 N ATOM 1593 CZ ARG B 9 -19.792 -13.758 2.178 1.00 12.42 C ATOM 1594 NH1 ARG B 9 -19.681 -14.722 1.261 1.00 44.13 N ATOM 1595 NH2 ARG B 9 -19.666 -14.058 3.467 1.00 22.11 N ATOM 0 H ARG B 9 -17.879 -7.969 -0.419 1.00 64.24 H new ATOM 0 HA ARG B 9 -17.877 -9.610 -1.936 1.00 21.23 H new ATOM 0 HB2 ARG B 9 -20.820 -9.905 -1.243 1.00 41.42 H new ATOM 0 HB3 ARG B 9 -19.820 -11.106 -2.036 1.00 41.42 H new ATOM 0 HG2 ARG B 9 -18.361 -11.179 0.013 1.00 44.13 H new ATOM 0 HG3 ARG B 9 -19.466 -10.070 0.800 1.00 44.13 H new ATOM 0 HD2 ARG B 9 -21.328 -11.720 0.387 1.00 32.54 H new ATOM 0 HD3 ARG B 9 -20.141 -12.840 -0.252 1.00 32.54 H new ATOM 0 HE ARG B 9 -19.920 -11.771 2.541 1.00 41.05 H new ATOM 0 HH11 ARG B 9 -19.743 -14.492 0.269 1.00 44.13 H new ATOM 0 HH12 ARG B 9 -19.535 -15.688 1.552 1.00 44.13 H new ATOM 0 HH21 ARG B 9 -19.716 -13.320 4.170 1.00 22.11 H new ATOM 0 HH22 ARG B 9 -19.519 -15.026 3.753 1.00 22.11 H new ATOM 1609 N PHE B 10 -18.856 -7.471 -3.504 1.00 14.12 N ATOM 1610 CA PHE B 10 -19.204 -6.749 -4.728 1.00 51.25 C ATOM 1611 C PHE B 10 -18.290 -7.221 -5.866 1.00 22.31 C ATOM 1612 O PHE B 10 -18.252 -6.629 -6.946 1.00 33.44 O ATOM 1613 CB PHE B 10 -19.032 -5.229 -4.464 1.00 5.33 C ATOM 1614 CG PHE B 10 -19.416 -4.306 -5.593 1.00 31.11 C ATOM 1615 CD1 PHE B 10 -20.746 -4.068 -5.887 1.00 31.04 C ATOM 1616 CD2 PHE B 10 -18.443 -3.664 -6.345 1.00 41.24 C ATOM 1617 CE1 PHE B 10 -21.099 -3.214 -6.907 1.00 63.12 C ATOM 1618 CE2 PHE B 10 -18.789 -2.811 -7.366 1.00 53.04 C ATOM 1619 CZ PHE B 10 -20.118 -2.585 -7.648 1.00 23.23 C ATOM 0 H PHE B 10 -18.195 -6.965 -2.915 1.00 14.12 H new ATOM 0 HA PHE B 10 -20.237 -6.944 -5.018 1.00 51.25 H new ATOM 0 HB2 PHE B 10 -19.626 -4.965 -3.589 1.00 5.33 H new ATOM 0 HB3 PHE B 10 -17.989 -5.042 -4.209 1.00 5.33 H new ATOM 0 HD1 PHE B 10 -21.516 -4.558 -5.310 1.00 31.04 H new ATOM 0 HD2 PHE B 10 -17.400 -3.837 -6.125 1.00 41.24 H new ATOM 0 HE1 PHE B 10 -22.141 -3.036 -7.127 1.00 63.12 H new ATOM 0 HE2 PHE B 10 -18.021 -2.320 -7.945 1.00 53.04 H new ATOM 0 HZ PHE B 10 -20.393 -1.915 -8.449 1.00 23.23 H new ATOM 1629 N ASP B 11 -17.585 -8.314 -5.591 1.00 12.33 N ATOM 1630 CA ASP B 11 -16.634 -8.943 -6.498 1.00 2.30 C ATOM 1631 C ASP B 11 -17.192 -9.058 -7.899 1.00 54.43 C ATOM 1632 O ASP B 11 -18.135 -9.822 -8.151 1.00 24.32 O ATOM 1633 CB ASP B 11 -16.249 -10.347 -5.997 1.00 42.40 C ATOM 1634 CG ASP B 11 -15.606 -10.358 -4.631 1.00 22.12 C ATOM 1635 OD1 ASP B 11 -16.336 -10.366 -3.618 1.00 4.52 O ATOM 1636 OD2 ASP B 11 -14.360 -10.382 -4.549 1.00 3.44 O ATOM 0 H ASP B 11 -17.664 -8.802 -4.699 1.00 12.33 H new ATOM 0 HA ASP B 11 -15.750 -8.306 -6.523 1.00 2.30 H new ATOM 0 HB2 ASP B 11 -17.143 -10.970 -5.971 1.00 42.40 H new ATOM 0 HB3 ASP B 11 -15.564 -10.802 -6.713 1.00 42.40 H new ATOM 1641 N PHE B 12 -16.650 -8.281 -8.789 1.00 42.00 N ATOM 1642 CA PHE B 12 -17.053 -8.319 -10.168 1.00 30.32 C ATOM 1643 C PHE B 12 -16.318 -9.437 -10.855 1.00 62.51 C ATOM 1644 O PHE B 12 -15.205 -9.789 -10.449 1.00 72.11 O ATOM 1645 CB PHE B 12 -16.815 -6.955 -10.867 1.00 74.55 C ATOM 1646 CG PHE B 12 -15.401 -6.419 -10.775 1.00 21.53 C ATOM 1647 CD1 PHE B 12 -15.055 -5.505 -9.789 1.00 25.22 C ATOM 1648 CD2 PHE B 12 -14.424 -6.823 -11.673 1.00 53.51 C ATOM 1649 CE1 PHE B 12 -13.770 -5.008 -9.702 1.00 0.33 C ATOM 1650 CE2 PHE B 12 -13.138 -6.330 -11.589 1.00 62.01 C ATOM 1651 CZ PHE B 12 -12.810 -5.422 -10.602 1.00 64.10 C ATOM 0 H PHE B 12 -15.917 -7.603 -8.582 1.00 42.00 H new ATOM 0 HA PHE B 12 -18.125 -8.508 -10.229 1.00 30.32 H new ATOM 0 HB2 PHE B 12 -17.081 -7.053 -11.919 1.00 74.55 H new ATOM 0 HB3 PHE B 12 -17.494 -6.220 -10.434 1.00 74.55 H new ATOM 0 HD1 PHE B 12 -15.801 -5.178 -9.080 1.00 25.22 H new ATOM 0 HD2 PHE B 12 -14.673 -7.533 -12.448 1.00 53.51 H new ATOM 0 HE1 PHE B 12 -13.517 -4.296 -8.930 1.00 0.33 H new ATOM 0 HE2 PHE B 12 -12.388 -6.654 -12.295 1.00 62.01 H new ATOM 0 HZ PHE B 12 -11.803 -5.036 -10.535 1.00 64.10 H new ATOM 1661 N ASP B 13 -16.910 -10.014 -11.861 1.00 2.20 N ATOM 1662 CA ASP B 13 -16.273 -11.125 -12.523 1.00 63.24 C ATOM 1663 C ASP B 13 -15.136 -10.668 -13.397 1.00 51.00 C ATOM 1664 O ASP B 13 -15.310 -9.868 -14.317 1.00 44.51 O ATOM 1665 CB ASP B 13 -17.251 -11.993 -13.314 1.00 71.43 C ATOM 1666 CG ASP B 13 -16.559 -13.191 -13.957 1.00 64.53 C ATOM 1667 OD1 ASP B 13 -16.367 -13.199 -15.195 1.00 32.14 O ATOM 1668 OD2 ASP B 13 -16.182 -14.142 -13.219 1.00 71.32 O ATOM 0 H ASP B 13 -17.818 -9.743 -12.239 1.00 2.20 H new ATOM 0 HA ASP B 13 -15.868 -11.753 -11.730 1.00 63.24 H new ATOM 0 HB2 ASP B 13 -18.042 -12.344 -12.652 1.00 71.43 H new ATOM 0 HB3 ASP B 13 -17.727 -11.391 -14.088 1.00 71.43 H new ATOM 1673 N ASP B 14 -13.985 -11.144 -13.072 1.00 74.21 N ATOM 1674 CA ASP B 14 -12.789 -10.894 -13.817 1.00 42.32 C ATOM 1675 C ASP B 14 -12.136 -12.228 -14.013 1.00 14.25 C ATOM 1676 O ASP B 14 -12.113 -13.038 -13.090 1.00 45.43 O ATOM 1677 CB ASP B 14 -11.867 -9.938 -13.059 1.00 2.12 C ATOM 1678 CG ASP B 14 -10.571 -9.677 -13.785 1.00 51.53 C ATOM 1679 OD1 ASP B 14 -10.514 -8.759 -14.630 1.00 43.32 O ATOM 1680 OD2 ASP B 14 -9.589 -10.369 -13.510 1.00 61.41 O ATOM 0 H ASP B 14 -13.840 -11.738 -12.255 1.00 74.21 H new ATOM 0 HA ASP B 14 -13.008 -10.419 -14.773 1.00 42.32 H new ATOM 0 HB2 ASP B 14 -12.385 -8.992 -12.898 1.00 2.12 H new ATOM 0 HB3 ASP B 14 -11.650 -10.354 -12.075 1.00 2.12 H new ATOM 1685 N ASN B 15 -11.636 -12.480 -15.182 1.00 14.31 N ATOM 1686 CA ASN B 15 -11.115 -13.801 -15.508 1.00 20.44 C ATOM 1687 C ASN B 15 -9.596 -13.874 -15.312 1.00 14.43 C ATOM 1688 O ASN B 15 -8.998 -14.945 -15.375 1.00 13.43 O ATOM 1689 CB ASN B 15 -11.507 -14.143 -16.964 1.00 74.22 C ATOM 1690 CG ASN B 15 -11.103 -15.537 -17.418 1.00 62.32 C ATOM 1691 OD1 ASN B 15 -10.016 -15.738 -17.947 1.00 24.42 O ATOM 1692 ND2 ASN B 15 -11.975 -16.494 -17.239 1.00 64.10 N ATOM 0 H ASN B 15 -11.571 -11.798 -15.938 1.00 14.31 H new ATOM 0 HA ASN B 15 -11.551 -14.534 -14.830 1.00 20.44 H new ATOM 0 HB2 ASN B 15 -12.587 -14.040 -17.069 1.00 74.22 H new ATOM 0 HB3 ASN B 15 -11.050 -13.412 -17.631 1.00 74.22 H new ATOM 0 HD21 ASN B 15 -11.760 -17.443 -17.543 1.00 64.10 H new ATOM 0 HD22 ASN B 15 -12.871 -16.291 -16.795 1.00 64.10 H new ATOM 1699 N ARG B 16 -8.983 -12.755 -15.018 1.00 3.21 N ATOM 1700 CA ARG B 16 -7.536 -12.704 -14.954 1.00 54.55 C ATOM 1701 C ARG B 16 -7.054 -12.751 -13.515 1.00 11.11 C ATOM 1702 O ARG B 16 -7.809 -12.457 -12.587 1.00 25.32 O ATOM 1703 CB ARG B 16 -7.027 -11.416 -15.604 1.00 73.30 C ATOM 1704 CG ARG B 16 -7.539 -11.165 -17.013 1.00 12.24 C ATOM 1705 CD ARG B 16 -7.151 -12.267 -17.982 1.00 40.21 C ATOM 1706 NE ARG B 16 -5.707 -12.393 -18.153 1.00 4.34 N ATOM 1707 CZ ARG B 16 -5.130 -13.158 -19.079 1.00 73.01 C ATOM 1708 NH1 ARG B 16 -5.878 -13.844 -19.950 1.00 73.33 N ATOM 1709 NH2 ARG B 16 -3.814 -13.228 -19.143 1.00 55.32 N ATOM 0 H ARG B 16 -9.454 -11.872 -14.820 1.00 3.21 H new ATOM 0 HA ARG B 16 -7.147 -13.571 -15.489 1.00 54.55 H new ATOM 0 HB2 ARG B 16 -7.310 -10.572 -14.975 1.00 73.30 H new ATOM 0 HB3 ARG B 16 -5.938 -11.444 -15.629 1.00 73.30 H new ATOM 0 HG2 ARG B 16 -8.625 -11.073 -16.990 1.00 12.24 H new ATOM 0 HG3 ARG B 16 -7.146 -10.214 -17.374 1.00 12.24 H new ATOM 0 HD2 ARG B 16 -7.553 -13.215 -17.625 1.00 40.21 H new ATOM 0 HD3 ARG B 16 -7.610 -12.070 -18.951 1.00 40.21 H new ATOM 0 HE ARG B 16 -5.103 -11.863 -17.525 1.00 4.34 H new ATOM 0 HH11 ARG B 16 -6.895 -13.783 -19.907 1.00 73.33 H new ATOM 0 HH12 ARG B 16 -5.431 -14.428 -20.657 1.00 73.33 H new ATOM 0 HH21 ARG B 16 -3.242 -12.698 -18.485 1.00 55.32 H new ATOM 0 HH22 ARG B 16 -3.368 -13.812 -19.850 1.00 55.32 H new ATOM 1723 N LYS B 17 -5.818 -13.148 -13.343 1.00 64.10 N ATOM 1724 CA LYS B 17 -5.133 -13.125 -12.069 1.00 54.23 C ATOM 1725 C LYS B 17 -3.710 -12.720 -12.310 1.00 55.34 C ATOM 1726 O LYS B 17 -3.151 -13.061 -13.353 1.00 63.31 O ATOM 1727 CB LYS B 17 -5.198 -14.462 -11.321 1.00 61.13 C ATOM 1728 CG LYS B 17 -6.590 -14.838 -10.858 1.00 61.50 C ATOM 1729 CD LYS B 17 -6.560 -16.060 -9.982 1.00 73.03 C ATOM 1730 CE LYS B 17 -7.935 -16.378 -9.436 1.00 14.12 C ATOM 1731 NZ LYS B 17 -7.897 -17.508 -8.489 1.00 73.43 N ATOM 0 H LYS B 17 -5.242 -13.507 -14.105 1.00 64.10 H new ATOM 0 HA LYS B 17 -5.638 -12.406 -11.424 1.00 54.23 H new ATOM 0 HB2 LYS B 17 -4.816 -15.250 -11.971 1.00 61.13 H new ATOM 0 HB3 LYS B 17 -4.538 -14.415 -10.455 1.00 61.13 H new ATOM 0 HG2 LYS B 17 -7.031 -14.005 -10.310 1.00 61.50 H new ATOM 0 HG3 LYS B 17 -7.226 -15.023 -11.723 1.00 61.50 H new ATOM 0 HD2 LYS B 17 -6.187 -16.910 -10.553 1.00 73.03 H new ATOM 0 HD3 LYS B 17 -5.866 -15.902 -9.156 1.00 73.03 H new ATOM 0 HE2 LYS B 17 -8.341 -15.498 -8.937 1.00 14.12 H new ATOM 0 HE3 LYS B 17 -8.608 -16.616 -10.260 1.00 14.12 H new ATOM 0 HZ1 LYS B 17 -8.857 -17.697 -8.136 1.00 73.43 H new ATOM 0 HZ2 LYS B 17 -7.533 -18.354 -8.972 1.00 73.43 H new ATOM 0 HZ3 LYS B 17 -7.275 -17.271 -7.690 1.00 73.43 H new ATOM 1745 N LYS B 18 -3.140 -11.947 -11.370 1.00 30.12 N ATOM 1746 CA LYS B 18 -1.778 -11.378 -11.491 1.00 52.23 C ATOM 1747 C LYS B 18 -1.770 -10.274 -12.575 1.00 51.10 C ATOM 1748 O LYS B 18 -0.738 -9.696 -12.926 1.00 51.01 O ATOM 1749 CB LYS B 18 -0.737 -12.493 -11.761 1.00 13.01 C ATOM 1750 CG LYS B 18 0.703 -12.038 -11.876 1.00 30.42 C ATOM 1751 CD LYS B 18 1.617 -13.220 -12.087 1.00 43.53 C ATOM 1752 CE LYS B 18 3.048 -12.788 -12.274 1.00 44.33 C ATOM 1753 NZ LYS B 18 3.242 -11.994 -13.508 1.00 14.44 N ATOM 0 H LYS B 18 -3.609 -11.696 -10.500 1.00 30.12 H new ATOM 0 HA LYS B 18 -1.490 -10.914 -10.548 1.00 52.23 H new ATOM 0 HB2 LYS B 18 -0.803 -13.227 -10.958 1.00 13.01 H new ATOM 0 HB3 LYS B 18 -1.011 -13.004 -12.684 1.00 13.01 H new ATOM 0 HG2 LYS B 18 0.804 -11.340 -12.707 1.00 30.42 H new ATOM 0 HG3 LYS B 18 0.994 -11.503 -10.972 1.00 30.42 H new ATOM 0 HD2 LYS B 18 1.548 -13.891 -11.231 1.00 43.53 H new ATOM 0 HD3 LYS B 18 1.289 -13.783 -12.961 1.00 43.53 H new ATOM 0 HE2 LYS B 18 3.362 -12.198 -11.413 1.00 44.33 H new ATOM 0 HE3 LYS B 18 3.689 -13.669 -12.308 1.00 44.33 H new ATOM 0 HZ1 LYS B 18 4.259 -11.880 -13.691 1.00 14.44 H new ATOM 0 HZ2 LYS B 18 2.799 -12.486 -14.310 1.00 14.44 H new ATOM 0 HZ3 LYS B 18 2.804 -11.058 -13.391 1.00 14.44 H new ATOM 1767 N ALA B 19 -2.963 -9.940 -13.030 1.00 4.35 N ATOM 1768 CA ALA B 19 -3.170 -8.959 -14.065 1.00 22.03 C ATOM 1769 C ALA B 19 -2.786 -7.594 -13.586 1.00 64.14 C ATOM 1770 O ALA B 19 -2.297 -6.788 -14.349 1.00 3.04 O ATOM 1771 CB ALA B 19 -4.602 -8.942 -14.468 1.00 23.34 C ATOM 0 H ALA B 19 -3.828 -10.354 -12.681 1.00 4.35 H new ATOM 0 HA ALA B 19 -2.546 -9.228 -14.917 1.00 22.03 H new ATOM 0 HB1 ALA B 19 -4.751 -8.198 -15.251 1.00 23.34 H new ATOM 0 HB2 ALA B 19 -4.886 -9.925 -14.843 1.00 23.34 H new ATOM 0 HB3 ALA B 19 -5.220 -8.690 -13.606 1.00 23.34 H new ATOM 1777 N ILE B 20 -2.997 -7.344 -12.303 1.00 24.10 N ATOM 1778 CA ILE B 20 -2.652 -6.068 -11.694 1.00 73.01 C ATOM 1779 C ILE B 20 -1.153 -5.846 -11.805 1.00 20.44 C ATOM 1780 O ILE B 20 -0.687 -4.727 -12.025 1.00 2.33 O ATOM 1781 CB ILE B 20 -3.083 -6.030 -10.202 1.00 63.41 C ATOM 1782 CG1 ILE B 20 -4.598 -6.201 -10.092 1.00 40.15 C ATOM 1783 CG2 ILE B 20 -2.639 -4.733 -9.530 1.00 12.34 C ATOM 1784 CD1 ILE B 20 -5.107 -6.281 -8.677 1.00 71.34 C ATOM 0 H ILE B 20 -3.410 -8.016 -11.657 1.00 24.10 H new ATOM 0 HA ILE B 20 -3.182 -5.275 -12.221 1.00 73.01 H new ATOM 0 HB ILE B 20 -2.594 -6.855 -9.684 1.00 63.41 H new ATOM 0 HG12 ILE B 20 -5.085 -5.365 -10.595 1.00 40.15 H new ATOM 0 HG13 ILE B 20 -4.890 -7.107 -10.623 1.00 40.15 H new ATOM 0 HG21 ILE B 20 -2.955 -4.737 -8.487 1.00 12.34 H new ATOM 0 HG22 ILE B 20 -1.553 -4.651 -9.579 1.00 12.34 H new ATOM 0 HG23 ILE B 20 -3.091 -3.884 -10.043 1.00 12.34 H new ATOM 0 HD11 ILE B 20 -6.190 -6.402 -8.686 1.00 71.34 H new ATOM 0 HD12 ILE B 20 -4.651 -7.134 -8.174 1.00 71.34 H new ATOM 0 HD13 ILE B 20 -4.849 -5.365 -8.145 1.00 71.34 H new ATOM 1796 N SER B 21 -0.420 -6.926 -11.745 1.00 71.31 N ATOM 1797 CA SER B 21 1.017 -6.868 -11.799 1.00 24.24 C ATOM 1798 C SER B 21 1.463 -6.507 -13.205 1.00 41.14 C ATOM 1799 O SER B 21 2.424 -5.755 -13.406 1.00 22.01 O ATOM 1800 CB SER B 21 1.593 -8.208 -11.375 1.00 20.23 C ATOM 1801 OG SER B 21 1.100 -8.569 -10.090 1.00 55.24 O ATOM 0 H SER B 21 -0.801 -7.868 -11.658 1.00 71.31 H new ATOM 0 HA SER B 21 1.382 -6.101 -11.116 1.00 24.24 H new ATOM 0 HB2 SER B 21 1.326 -8.974 -12.103 1.00 20.23 H new ATOM 0 HB3 SER B 21 2.681 -8.154 -11.353 1.00 20.23 H new ATOM 0 HG SER B 21 0.891 -7.759 -9.580 1.00 55.24 H new ATOM 1807 N GLU B 22 0.733 -7.020 -14.164 1.00 13.35 N ATOM 1808 CA GLU B 22 1.000 -6.773 -15.552 1.00 60.44 C ATOM 1809 C GLU B 22 0.536 -5.351 -15.901 1.00 64.21 C ATOM 1810 O GLU B 22 1.172 -4.644 -16.685 1.00 64.23 O ATOM 1811 CB GLU B 22 0.247 -7.796 -16.398 1.00 60.05 C ATOM 1812 CG GLU B 22 0.439 -9.250 -15.949 1.00 52.04 C ATOM 1813 CD GLU B 22 1.884 -9.698 -15.906 1.00 11.30 C ATOM 1814 OE1 GLU B 22 2.430 -10.075 -16.966 1.00 53.01 O ATOM 1815 OE2 GLU B 22 2.491 -9.716 -14.812 1.00 55.55 O ATOM 0 H GLU B 22 -0.070 -7.626 -13.997 1.00 13.35 H new ATOM 0 HA GLU B 22 2.067 -6.864 -15.754 1.00 60.44 H new ATOM 0 HB2 GLU B 22 -0.816 -7.558 -16.374 1.00 60.05 H new ATOM 0 HB3 GLU B 22 0.571 -7.702 -17.434 1.00 60.05 H new ATOM 0 HG2 GLU B 22 0.002 -9.374 -14.958 1.00 52.04 H new ATOM 0 HG3 GLU B 22 -0.113 -9.903 -16.625 1.00 52.04 H new ATOM 1822 N THR B 23 -0.569 -4.947 -15.283 1.00 73.11 N ATOM 1823 CA THR B 23 -1.160 -3.636 -15.474 1.00 63.23 C ATOM 1824 C THR B 23 -0.205 -2.531 -15.030 1.00 15.34 C ATOM 1825 O THR B 23 0.066 -1.608 -15.792 1.00 4.35 O ATOM 1826 CB THR B 23 -2.505 -3.519 -14.712 1.00 11.43 C ATOM 1827 OG1 THR B 23 -3.414 -4.524 -15.190 1.00 15.14 O ATOM 1828 CG2 THR B 23 -3.135 -2.146 -14.905 1.00 35.23 C ATOM 0 H THR B 23 -1.084 -5.534 -14.626 1.00 73.11 H new ATOM 0 HA THR B 23 -1.353 -3.514 -16.540 1.00 63.23 H new ATOM 0 HB THR B 23 -2.305 -3.661 -13.650 1.00 11.43 H new ATOM 0 HG1 THR B 23 -3.208 -5.381 -14.762 1.00 15.14 H new ATOM 0 HG21 THR B 23 -4.076 -2.097 -14.358 1.00 35.23 H new ATOM 0 HG22 THR B 23 -2.457 -1.379 -14.530 1.00 35.23 H new ATOM 0 HG23 THR B 23 -3.323 -1.978 -15.965 1.00 35.23 H new ATOM 1836 N LEU B 24 0.323 -2.634 -13.817 1.00 13.51 N ATOM 1837 CA LEU B 24 1.266 -1.635 -13.332 1.00 5.45 C ATOM 1838 C LEU B 24 2.550 -1.629 -14.126 1.00 31.31 C ATOM 1839 O LEU B 24 3.188 -0.597 -14.251 1.00 33.32 O ATOM 1840 CB LEU B 24 1.510 -1.681 -11.814 1.00 71.10 C ATOM 1841 CG LEU B 24 0.411 -1.058 -10.915 1.00 41.14 C ATOM 1842 CD1 LEU B 24 -0.930 -1.752 -11.061 1.00 61.04 C ATOM 1843 CD2 LEU B 24 0.854 -1.041 -9.465 1.00 64.23 C ATOM 0 H LEU B 24 0.119 -3.387 -13.160 1.00 13.51 H new ATOM 0 HA LEU B 24 0.778 -0.676 -13.505 1.00 5.45 H new ATOM 0 HB2 LEU B 24 1.640 -2.723 -11.521 1.00 71.10 H new ATOM 0 HB3 LEU B 24 2.451 -1.172 -11.605 1.00 71.10 H new ATOM 0 HG LEU B 24 0.269 -0.032 -11.254 1.00 41.14 H new ATOM 0 HD11 LEU B 24 -1.660 -1.274 -10.408 1.00 61.04 H new ATOM 0 HD12 LEU B 24 -1.266 -1.681 -12.095 1.00 61.04 H new ATOM 0 HD13 LEU B 24 -0.829 -2.801 -10.784 1.00 61.04 H new ATOM 0 HD21 LEU B 24 0.069 -0.600 -8.850 1.00 64.23 H new ATOM 0 HD22 LEU B 24 1.047 -2.061 -9.131 1.00 64.23 H new ATOM 0 HD23 LEU B 24 1.765 -0.450 -9.370 1.00 64.23 H new ATOM 1855 N GLU B 25 2.924 -2.785 -14.672 1.00 21.14 N ATOM 1856 CA GLU B 25 4.068 -2.863 -15.564 1.00 10.43 C ATOM 1857 C GLU B 25 3.798 -1.968 -16.777 1.00 43.51 C ATOM 1858 O GLU B 25 4.647 -1.168 -17.180 1.00 50.34 O ATOM 1859 CB GLU B 25 4.275 -4.301 -16.034 1.00 15.12 C ATOM 1860 CG GLU B 25 5.462 -4.487 -16.961 1.00 13.04 C ATOM 1861 CD GLU B 25 5.527 -5.876 -17.528 1.00 61.32 C ATOM 1862 OE1 GLU B 25 5.054 -6.083 -18.652 1.00 72.42 O ATOM 1863 OE2 GLU B 25 6.018 -6.789 -16.848 1.00 51.42 O ATOM 0 H GLU B 25 2.451 -3.674 -14.510 1.00 21.14 H new ATOM 0 HA GLU B 25 4.964 -2.534 -15.038 1.00 10.43 H new ATOM 0 HB2 GLU B 25 4.406 -4.941 -15.162 1.00 15.12 H new ATOM 0 HB3 GLU B 25 3.373 -4.638 -16.545 1.00 15.12 H new ATOM 0 HG2 GLU B 25 5.401 -3.766 -17.776 1.00 13.04 H new ATOM 0 HG3 GLU B 25 6.382 -4.275 -16.417 1.00 13.04 H new ATOM 1870 N THR B 26 2.590 -2.099 -17.327 1.00 43.35 N ATOM 1871 CA THR B 26 2.165 -1.316 -18.464 1.00 32.11 C ATOM 1872 C THR B 26 2.159 0.183 -18.101 1.00 22.01 C ATOM 1873 O THR B 26 2.711 1.009 -18.823 1.00 74.21 O ATOM 1874 CB THR B 26 0.743 -1.731 -18.906 1.00 74.14 C ATOM 1875 OG1 THR B 26 0.690 -3.153 -19.118 1.00 51.34 O ATOM 1876 CG2 THR B 26 0.372 -1.031 -20.193 1.00 33.40 C ATOM 0 H THR B 26 1.886 -2.755 -16.989 1.00 43.35 H new ATOM 0 HA THR B 26 2.864 -1.495 -19.281 1.00 32.11 H new ATOM 0 HB THR B 26 0.041 -1.448 -18.121 1.00 74.14 H new ATOM 0 HG1 THR B 26 0.716 -3.614 -18.253 1.00 51.34 H new ATOM 0 HG21 THR B 26 -0.632 -1.331 -20.494 1.00 33.40 H new ATOM 0 HG22 THR B 26 0.398 0.048 -20.041 1.00 33.40 H new ATOM 0 HG23 THR B 26 1.082 -1.304 -20.974 1.00 33.40 H new ATOM 1884 N VAL B 27 1.552 0.505 -16.958 1.00 32.22 N ATOM 1885 CA VAL B 27 1.452 1.887 -16.484 1.00 12.52 C ATOM 1886 C VAL B 27 2.841 2.492 -16.270 1.00 40.34 C ATOM 1887 O VAL B 27 3.083 3.648 -16.617 1.00 31.24 O ATOM 1888 CB VAL B 27 0.621 1.992 -15.163 1.00 31.11 C ATOM 1889 CG1 VAL B 27 0.511 3.437 -14.700 1.00 11.33 C ATOM 1890 CG2 VAL B 27 -0.773 1.400 -15.340 1.00 74.32 C ATOM 0 H VAL B 27 1.118 -0.179 -16.338 1.00 32.22 H new ATOM 0 HA VAL B 27 0.931 2.451 -17.258 1.00 12.52 H new ATOM 0 HB VAL B 27 1.149 1.418 -14.401 1.00 31.11 H new ATOM 0 HG11 VAL B 27 -0.072 3.481 -13.780 1.00 11.33 H new ATOM 0 HG12 VAL B 27 1.508 3.838 -14.518 1.00 11.33 H new ATOM 0 HG13 VAL B 27 0.017 4.029 -15.470 1.00 11.33 H new ATOM 0 HG21 VAL B 27 -1.327 1.487 -14.405 1.00 74.32 H new ATOM 0 HG22 VAL B 27 -1.301 1.940 -16.126 1.00 74.32 H new ATOM 0 HG23 VAL B 27 -0.690 0.349 -15.615 1.00 74.32 H new ATOM 1900 N TYR B 28 3.751 1.697 -15.737 1.00 42.32 N ATOM 1901 CA TYR B 28 5.099 2.159 -15.461 1.00 72.34 C ATOM 1902 C TYR B 28 5.778 2.557 -16.779 1.00 0.15 C ATOM 1903 O TYR B 28 6.340 3.648 -16.901 1.00 71.11 O ATOM 1904 CB TYR B 28 5.907 1.065 -14.727 1.00 24.24 C ATOM 1905 CG TYR B 28 7.232 1.543 -14.171 1.00 52.04 C ATOM 1906 CD1 TYR B 28 8.337 1.692 -14.983 1.00 42.10 C ATOM 1907 CD2 TYR B 28 7.367 1.858 -12.819 1.00 0.35 C ATOM 1908 CE1 TYR B 28 9.541 2.145 -14.473 1.00 62.10 C ATOM 1909 CE2 TYR B 28 8.572 2.306 -12.304 1.00 14.33 C ATOM 1910 CZ TYR B 28 9.651 2.449 -13.140 1.00 12.03 C ATOM 1911 OH TYR B 28 10.846 2.907 -12.640 1.00 4.02 O ATOM 0 H TYR B 28 3.580 0.723 -15.486 1.00 42.32 H new ATOM 0 HA TYR B 28 5.058 3.031 -14.808 1.00 72.34 H new ATOM 0 HB2 TYR B 28 5.304 0.670 -13.910 1.00 24.24 H new ATOM 0 HB3 TYR B 28 6.090 0.240 -15.416 1.00 24.24 H new ATOM 0 HD1 TYR B 28 8.261 1.451 -16.033 1.00 42.10 H new ATOM 0 HD2 TYR B 28 6.517 1.751 -12.162 1.00 0.35 H new ATOM 0 HE1 TYR B 28 10.394 2.259 -15.125 1.00 62.10 H new ATOM 0 HE2 TYR B 28 8.662 2.541 -11.254 1.00 14.33 H new ATOM 0 HH TYR B 28 10.719 3.799 -12.254 1.00 4.02 H new ATOM 1921 N ARG B 29 5.674 1.674 -17.759 1.00 51.23 N ATOM 1922 CA ARG B 29 6.219 1.893 -19.102 1.00 42.45 C ATOM 1923 C ARG B 29 5.625 3.146 -19.743 1.00 15.43 C ATOM 1924 O ARG B 29 6.336 3.920 -20.388 1.00 1.14 O ATOM 1925 CB ARG B 29 5.921 0.661 -19.970 1.00 32.12 C ATOM 1926 CG ARG B 29 6.703 -0.597 -19.581 1.00 73.44 C ATOM 1927 CD ARG B 29 8.113 -0.612 -20.176 1.00 32.23 C ATOM 1928 NE ARG B 29 8.935 0.551 -19.832 1.00 51.33 N ATOM 1929 CZ ARG B 29 9.724 1.205 -20.708 1.00 52.13 C ATOM 1930 NH1 ARG B 29 9.732 0.874 -21.991 1.00 74.24 N ATOM 1931 NH2 ARG B 29 10.479 2.190 -20.292 1.00 25.12 N ATOM 0 H ARG B 29 5.206 0.774 -17.650 1.00 51.23 H new ATOM 0 HA ARG B 29 7.296 2.041 -19.025 1.00 42.45 H new ATOM 0 HB2 ARG B 29 4.855 0.442 -19.913 1.00 32.12 H new ATOM 0 HB3 ARG B 29 6.142 0.903 -21.010 1.00 32.12 H new ATOM 0 HG2 ARG B 29 6.769 -0.660 -18.495 1.00 73.44 H new ATOM 0 HG3 ARG B 29 6.159 -1.479 -19.919 1.00 73.44 H new ATOM 0 HD2 ARG B 29 8.625 -1.514 -19.840 1.00 32.23 H new ATOM 0 HD3 ARG B 29 8.034 -0.676 -21.261 1.00 32.23 H new ATOM 0 HE ARG B 29 8.909 0.887 -18.869 1.00 51.33 H new ATOM 0 HH11 ARG B 29 9.137 0.117 -22.326 1.00 74.24 H new ATOM 0 HH12 ARG B 29 10.334 1.377 -22.644 1.00 74.24 H new ATOM 0 HH21 ARG B 29 10.469 2.460 -19.308 1.00 25.12 H new ATOM 0 HH22 ARG B 29 11.077 2.687 -20.951 1.00 25.12 H new ATOM 1945 N ALA B 30 4.331 3.348 -19.525 1.00 64.02 N ATOM 1946 CA ALA B 30 3.601 4.476 -20.094 1.00 15.13 C ATOM 1947 C ALA B 30 4.188 5.818 -19.659 1.00 74.25 C ATOM 1948 O ALA B 30 4.377 6.718 -20.485 1.00 11.31 O ATOM 1949 CB ALA B 30 2.121 4.397 -19.739 1.00 3.21 C ATOM 0 H ALA B 30 3.757 2.734 -18.948 1.00 64.02 H new ATOM 0 HA ALA B 30 3.704 4.412 -21.177 1.00 15.13 H new ATOM 0 HB1 ALA B 30 1.597 5.248 -20.174 1.00 3.21 H new ATOM 0 HB2 ALA B 30 1.701 3.472 -20.134 1.00 3.21 H new ATOM 0 HB3 ALA B 30 2.005 4.415 -18.655 1.00 3.21 H new ATOM 1955 N LEU B 31 4.486 5.964 -18.373 1.00 60.23 N ATOM 1956 CA LEU B 31 5.045 7.218 -17.905 1.00 51.41 C ATOM 1957 C LEU B 31 6.480 7.426 -18.314 1.00 72.44 C ATOM 1958 O LEU B 31 6.904 8.567 -18.485 1.00 0.30 O ATOM 1959 CB LEU B 31 4.844 7.519 -16.418 1.00 32.22 C ATOM 1960 CG LEU B 31 3.419 7.821 -15.965 1.00 41.41 C ATOM 1961 CD1 LEU B 31 2.588 6.577 -15.763 1.00 43.33 C ATOM 1962 CD2 LEU B 31 3.405 8.710 -14.755 1.00 14.32 C ATOM 0 H LEU B 31 4.354 5.250 -17.657 1.00 60.23 H new ATOM 0 HA LEU B 31 4.438 7.955 -18.431 1.00 51.41 H new ATOM 0 HB2 LEU B 31 5.209 6.666 -15.846 1.00 32.22 H new ATOM 0 HB3 LEU B 31 5.472 8.371 -16.156 1.00 32.22 H new ATOM 0 HG LEU B 31 2.944 8.367 -16.780 1.00 41.41 H new ATOM 0 HD11 LEU B 31 1.585 6.858 -15.441 1.00 43.33 H new ATOM 0 HD12 LEU B 31 2.527 6.024 -16.700 1.00 43.33 H new ATOM 0 HD13 LEU B 31 3.051 5.950 -15.001 1.00 43.33 H new ATOM 0 HD21 LEU B 31 2.374 8.905 -14.459 1.00 14.32 H new ATOM 0 HD22 LEU B 31 3.931 8.219 -13.936 1.00 14.32 H new ATOM 0 HD23 LEU B 31 3.900 9.652 -14.990 1.00 14.32 H new ATOM 1974 N GLU B 32 7.235 6.349 -18.474 1.00 13.45 N ATOM 1975 CA GLU B 32 8.622 6.482 -18.911 1.00 13.02 C ATOM 1976 C GLU B 32 8.677 7.022 -20.333 1.00 25.55 C ATOM 1977 O GLU B 32 9.507 7.876 -20.656 1.00 5.53 O ATOM 1978 CB GLU B 32 9.377 5.170 -18.817 1.00 40.12 C ATOM 1979 CG GLU B 32 9.485 4.612 -17.416 1.00 11.10 C ATOM 1980 CD GLU B 32 10.307 3.359 -17.383 1.00 31.41 C ATOM 1981 OE1 GLU B 32 9.780 2.287 -17.717 1.00 4.45 O ATOM 1982 OE2 GLU B 32 11.498 3.427 -17.049 1.00 63.21 O ATOM 0 H GLU B 32 6.922 5.392 -18.313 1.00 13.45 H new ATOM 0 HA GLU B 32 9.110 7.188 -18.239 1.00 13.02 H new ATOM 0 HB2 GLU B 32 8.883 4.434 -19.451 1.00 40.12 H new ATOM 0 HB3 GLU B 32 10.381 5.313 -19.217 1.00 40.12 H new ATOM 0 HG2 GLU B 32 9.932 5.359 -16.760 1.00 11.10 H new ATOM 0 HG3 GLU B 32 8.488 4.404 -17.029 1.00 11.10 H new ATOM 1989 N GLU B 33 7.765 6.546 -21.168 1.00 12.33 N ATOM 1990 CA GLU B 33 7.650 7.014 -22.547 1.00 41.43 C ATOM 1991 C GLU B 33 7.252 8.487 -22.586 1.00 70.11 C ATOM 1992 O GLU B 33 7.621 9.219 -23.502 1.00 43.01 O ATOM 1993 CB GLU B 33 6.617 6.176 -23.304 1.00 44.20 C ATOM 1994 CG GLU B 33 7.002 4.716 -23.478 1.00 13.41 C ATOM 1995 CD GLU B 33 8.213 4.539 -24.359 1.00 41.15 C ATOM 1996 OE1 GLU B 33 8.042 4.416 -25.578 1.00 43.42 O ATOM 1997 OE2 GLU B 33 9.359 4.520 -23.850 1.00 12.14 O ATOM 0 H GLU B 33 7.086 5.829 -20.914 1.00 12.33 H new ATOM 0 HA GLU B 33 8.622 6.904 -23.028 1.00 41.43 H new ATOM 0 HB2 GLU B 33 5.666 6.228 -22.774 1.00 44.20 H new ATOM 0 HB3 GLU B 33 6.459 6.618 -24.288 1.00 44.20 H new ATOM 0 HG2 GLU B 33 7.201 4.277 -22.500 1.00 13.41 H new ATOM 0 HG3 GLU B 33 6.162 4.171 -23.907 1.00 13.41 H new ATOM 2004 N LYS B 34 6.522 8.913 -21.574 1.00 54.33 N ATOM 2005 CA LYS B 34 6.048 10.288 -21.476 1.00 24.44 C ATOM 2006 C LYS B 34 6.996 11.179 -20.667 1.00 12.21 C ATOM 2007 O LYS B 34 6.743 12.371 -20.495 1.00 20.13 O ATOM 2008 CB LYS B 34 4.629 10.316 -20.900 1.00 71.41 C ATOM 2009 CG LYS B 34 3.587 9.688 -21.817 1.00 5.12 C ATOM 2010 CD LYS B 34 3.378 10.517 -23.084 1.00 42.20 C ATOM 2011 CE LYS B 34 2.640 11.816 -22.789 1.00 24.32 C ATOM 2012 NZ LYS B 34 2.576 12.705 -23.977 1.00 24.11 N ATOM 0 H LYS B 34 6.238 8.319 -20.795 1.00 54.33 H new ATOM 0 HA LYS B 34 6.027 10.702 -22.484 1.00 24.44 H new ATOM 0 HB2 LYS B 34 4.623 9.792 -19.944 1.00 71.41 H new ATOM 0 HB3 LYS B 34 4.348 11.350 -20.698 1.00 71.41 H new ATOM 0 HG2 LYS B 34 3.901 8.680 -22.089 1.00 5.12 H new ATOM 0 HG3 LYS B 34 2.641 9.594 -21.283 1.00 5.12 H new ATOM 0 HD2 LYS B 34 4.344 10.741 -23.536 1.00 42.20 H new ATOM 0 HD3 LYS B 34 2.813 9.934 -23.812 1.00 42.20 H new ATOM 0 HE2 LYS B 34 1.629 11.589 -22.452 1.00 24.32 H new ATOM 0 HE3 LYS B 34 3.139 12.338 -21.972 1.00 24.32 H new ATOM 0 HZ1 LYS B 34 2.065 13.577 -23.731 1.00 24.11 H new ATOM 0 HZ2 LYS B 34 3.540 12.944 -24.284 1.00 24.11 H new ATOM 0 HZ3 LYS B 34 2.077 12.218 -24.749 1.00 24.11 H new ATOM 2026 N GLY B 35 8.068 10.597 -20.173 1.00 1.43 N ATOM 2027 CA GLY B 35 9.070 11.359 -19.457 1.00 22.11 C ATOM 2028 C GLY B 35 8.632 11.814 -18.077 1.00 45.30 C ATOM 2029 O GLY B 35 9.071 12.857 -17.600 1.00 64.24 O ATOM 0 H GLY B 35 8.268 9.600 -20.254 1.00 1.43 H new ATOM 0 HA2 GLY B 35 9.971 10.753 -19.359 1.00 22.11 H new ATOM 0 HA3 GLY B 35 9.337 12.234 -20.049 1.00 22.11 H new ATOM 2033 N TYR B 36 7.775 11.052 -17.439 1.00 70.41 N ATOM 2034 CA TYR B 36 7.344 11.373 -16.086 1.00 23.54 C ATOM 2035 C TYR B 36 7.892 10.335 -15.137 1.00 44.24 C ATOM 2036 O TYR B 36 8.609 9.413 -15.563 1.00 1.43 O ATOM 2037 CB TYR B 36 5.811 11.390 -15.957 1.00 21.52 C ATOM 2038 CG TYR B 36 5.087 12.372 -16.842 1.00 44.22 C ATOM 2039 CD1 TYR B 36 4.244 11.927 -17.845 1.00 43.42 C ATOM 2040 CD2 TYR B 36 5.239 13.739 -16.673 1.00 4.14 C ATOM 2041 CE1 TYR B 36 3.571 12.815 -18.656 1.00 63.22 C ATOM 2042 CE2 TYR B 36 4.569 14.634 -17.482 1.00 4.24 C ATOM 2043 CZ TYR B 36 3.737 14.164 -18.471 1.00 31.12 C ATOM 2044 OH TYR B 36 3.063 15.051 -19.276 1.00 71.42 O ATOM 0 H TYR B 36 7.359 10.206 -17.828 1.00 70.41 H new ATOM 0 HA TYR B 36 7.718 12.368 -15.846 1.00 23.54 H new ATOM 0 HB2 TYR B 36 5.436 10.390 -16.174 1.00 21.52 H new ATOM 0 HB3 TYR B 36 5.555 11.608 -14.920 1.00 21.52 H new ATOM 0 HD1 TYR B 36 4.111 10.866 -17.995 1.00 43.42 H new ATOM 0 HD2 TYR B 36 5.892 14.110 -15.896 1.00 4.14 H new ATOM 0 HE1 TYR B 36 2.916 12.451 -19.434 1.00 63.22 H new ATOM 0 HE2 TYR B 36 4.697 15.697 -17.339 1.00 4.24 H new ATOM 0 HH TYR B 36 3.289 15.968 -19.014 1.00 71.42 H new ATOM 2054 N ASN B 37 7.574 10.473 -13.867 1.00 2.04 N ATOM 2055 CA ASN B 37 7.949 9.486 -12.876 1.00 75.14 C ATOM 2056 C ASN B 37 6.739 8.644 -12.537 1.00 30.54 C ATOM 2057 O ASN B 37 5.815 9.118 -11.851 1.00 72.12 O ATOM 2058 CB ASN B 37 8.530 10.121 -11.603 1.00 71.21 C ATOM 2059 CG ASN B 37 9.829 10.861 -11.840 1.00 21.43 C ATOM 2060 OD1 ASN B 37 10.597 10.531 -12.742 1.00 13.33 O ATOM 2061 ND2 ASN B 37 10.091 11.849 -11.029 1.00 35.14 N ATOM 0 H ASN B 37 7.052 11.266 -13.494 1.00 2.04 H new ATOM 0 HA ASN B 37 8.736 8.864 -13.302 1.00 75.14 H new ATOM 0 HB2 ASN B 37 7.798 10.812 -11.184 1.00 71.21 H new ATOM 0 HB3 ASN B 37 8.695 9.341 -10.860 1.00 71.21 H new ATOM 0 HD21 ASN B 37 10.958 12.377 -11.132 1.00 35.14 H new ATOM 0 HD22 ASN B 37 9.429 12.093 -10.292 1.00 35.14 H new ATOM 2068 N PRO B 38 6.707 7.391 -13.050 1.00 45.13 N ATOM 2069 CA PRO B 38 5.585 6.456 -12.868 1.00 61.33 C ATOM 2070 C PRO B 38 5.068 6.358 -11.439 1.00 61.13 C ATOM 2071 O PRO B 38 3.863 6.363 -11.213 1.00 73.43 O ATOM 2072 CB PRO B 38 6.198 5.124 -13.267 1.00 10.23 C ATOM 2073 CG PRO B 38 7.218 5.469 -14.289 1.00 31.22 C ATOM 2074 CD PRO B 38 7.781 6.795 -13.884 1.00 33.24 C ATOM 0 HA PRO B 38 4.719 6.776 -13.447 1.00 61.33 H new ATOM 0 HB2 PRO B 38 6.649 4.623 -12.410 1.00 10.23 H new ATOM 0 HB3 PRO B 38 5.445 4.447 -13.671 1.00 10.23 H new ATOM 0 HG2 PRO B 38 8.000 4.710 -14.331 1.00 31.22 H new ATOM 0 HG3 PRO B 38 6.772 5.522 -15.282 1.00 31.22 H new ATOM 0 HD2 PRO B 38 8.708 6.682 -13.323 1.00 33.24 H new ATOM 0 HD3 PRO B 38 8.007 7.416 -14.751 1.00 33.24 H new ATOM 2082 N ILE B 39 5.974 6.333 -10.484 1.00 34.14 N ATOM 2083 CA ILE B 39 5.610 6.140 -9.092 1.00 31.42 C ATOM 2084 C ILE B 39 4.788 7.310 -8.564 1.00 72.22 C ATOM 2085 O ILE B 39 3.766 7.107 -7.912 1.00 71.22 O ATOM 2086 CB ILE B 39 6.869 5.916 -8.212 1.00 62.12 C ATOM 2087 CG1 ILE B 39 7.656 4.694 -8.726 1.00 4.11 C ATOM 2088 CG2 ILE B 39 6.496 5.741 -6.736 1.00 12.10 C ATOM 2089 CD1 ILE B 39 6.883 3.391 -8.705 1.00 72.04 C ATOM 0 H ILE B 39 6.975 6.445 -10.646 1.00 34.14 H new ATOM 0 HA ILE B 39 4.991 5.244 -9.038 1.00 31.42 H new ATOM 0 HB ILE B 39 7.501 6.801 -8.285 1.00 62.12 H new ATOM 0 HG12 ILE B 39 7.982 4.892 -9.747 1.00 4.11 H new ATOM 0 HG13 ILE B 39 8.556 4.577 -8.122 1.00 4.11 H new ATOM 0 HG21 ILE B 39 7.401 5.586 -6.148 1.00 12.10 H new ATOM 0 HG22 ILE B 39 5.982 6.635 -6.382 1.00 12.10 H new ATOM 0 HG23 ILE B 39 5.840 4.878 -6.626 1.00 12.10 H new ATOM 0 HD11 ILE B 39 7.515 2.587 -9.083 1.00 72.04 H new ATOM 0 HD12 ILE B 39 6.580 3.164 -7.683 1.00 72.04 H new ATOM 0 HD13 ILE B 39 5.997 3.483 -9.334 1.00 72.04 H new ATOM 2101 N ASN B 40 5.212 8.518 -8.906 1.00 53.10 N ATOM 2102 CA ASN B 40 4.566 9.754 -8.440 1.00 63.33 C ATOM 2103 C ASN B 40 3.101 9.806 -8.837 1.00 13.42 C ATOM 2104 O ASN B 40 2.241 10.183 -8.041 1.00 32.10 O ATOM 2105 CB ASN B 40 5.276 11.009 -8.993 1.00 20.10 C ATOM 2106 CG ASN B 40 6.703 11.192 -8.499 1.00 33.31 C ATOM 2107 OD1 ASN B 40 7.417 10.227 -8.208 1.00 35.53 O ATOM 2108 ND2 ASN B 40 7.133 12.423 -8.418 1.00 72.24 N ATOM 0 H ASN B 40 6.014 8.678 -9.515 1.00 53.10 H new ATOM 0 HA ASN B 40 4.642 9.747 -7.353 1.00 63.33 H new ATOM 0 HB2 ASN B 40 5.285 10.956 -10.082 1.00 20.10 H new ATOM 0 HB3 ASN B 40 4.694 11.890 -8.721 1.00 20.10 H new ATOM 0 HD21 ASN B 40 8.086 12.611 -8.106 1.00 72.24 H new ATOM 0 HD22 ASN B 40 6.516 13.196 -8.666 1.00 72.24 H new ATOM 2115 N GLN B 41 2.819 9.461 -10.067 1.00 73.42 N ATOM 2116 CA GLN B 41 1.463 9.489 -10.554 1.00 42.41 C ATOM 2117 C GLN B 41 0.612 8.316 -10.041 1.00 72.34 C ATOM 2118 O GLN B 41 -0.567 8.495 -9.729 1.00 24.54 O ATOM 2119 CB GLN B 41 1.438 9.633 -12.061 1.00 4.23 C ATOM 2120 CG GLN B 41 2.117 10.931 -12.527 1.00 30.00 C ATOM 2121 CD GLN B 41 1.419 12.191 -12.027 1.00 33.54 C ATOM 2122 OE1 GLN B 41 2.056 13.215 -11.774 1.00 35.10 O ATOM 2123 NE2 GLN B 41 0.119 12.153 -11.938 1.00 3.21 N ATOM 0 H GLN B 41 3.512 9.157 -10.751 1.00 73.42 H new ATOM 0 HA GLN B 41 0.985 10.375 -10.137 1.00 42.41 H new ATOM 0 HB2 GLN B 41 1.939 8.778 -12.515 1.00 4.23 H new ATOM 0 HB3 GLN B 41 0.405 9.619 -12.409 1.00 4.23 H new ATOM 0 HG2 GLN B 41 3.151 10.936 -12.182 1.00 30.00 H new ATOM 0 HG3 GLN B 41 2.144 10.947 -13.617 1.00 30.00 H new ATOM 0 HE21 GLN B 41 -0.382 11.291 -12.154 1.00 3.21 H new ATOM 0 HE22 GLN B 41 -0.397 12.985 -11.653 1.00 3.21 H new ATOM 2132 N ILE B 42 1.216 7.122 -9.935 1.00 74.55 N ATOM 2133 CA ILE B 42 0.483 5.940 -9.457 1.00 43.14 C ATOM 2134 C ILE B 42 0.059 6.105 -8.004 1.00 73.41 C ATOM 2135 O ILE B 42 -1.104 5.855 -7.670 1.00 42.21 O ATOM 2136 CB ILE B 42 1.280 4.601 -9.629 1.00 64.11 C ATOM 2137 CG1 ILE B 42 1.574 4.336 -11.115 1.00 72.11 C ATOM 2138 CG2 ILE B 42 0.493 3.423 -9.026 1.00 60.42 C ATOM 2139 CD1 ILE B 42 2.399 3.084 -11.373 1.00 53.25 C ATOM 0 H ILE B 42 2.194 6.951 -10.170 1.00 74.55 H new ATOM 0 HA ILE B 42 -0.402 5.870 -10.089 1.00 43.14 H new ATOM 0 HB ILE B 42 2.227 4.696 -9.098 1.00 64.11 H new ATOM 0 HG12 ILE B 42 0.629 4.252 -11.652 1.00 72.11 H new ATOM 0 HG13 ILE B 42 2.100 5.196 -11.529 1.00 72.11 H new ATOM 0 HG21 ILE B 42 1.061 2.502 -9.155 1.00 60.42 H new ATOM 0 HG22 ILE B 42 0.327 3.602 -7.964 1.00 60.42 H new ATOM 0 HG23 ILE B 42 -0.468 3.330 -9.532 1.00 60.42 H new ATOM 0 HD11 ILE B 42 2.562 2.970 -12.445 1.00 53.25 H new ATOM 0 HD12 ILE B 42 3.361 3.171 -10.867 1.00 53.25 H new ATOM 0 HD13 ILE B 42 1.867 2.213 -10.992 1.00 53.25 H new ATOM 2151 N VAL B 43 0.990 6.555 -7.143 1.00 30.12 N ATOM 2152 CA VAL B 43 0.677 6.745 -5.722 1.00 42.15 C ATOM 2153 C VAL B 43 -0.537 7.664 -5.539 1.00 44.23 C ATOM 2154 O VAL B 43 -1.430 7.372 -4.737 1.00 23.45 O ATOM 2155 CB VAL B 43 1.921 7.229 -4.863 1.00 53.53 C ATOM 2156 CG1 VAL B 43 2.523 8.505 -5.409 1.00 32.23 C ATOM 2157 CG2 VAL B 43 1.529 7.450 -3.411 1.00 61.44 C ATOM 0 H VAL B 43 1.948 6.789 -7.404 1.00 30.12 H new ATOM 0 HA VAL B 43 0.416 5.761 -5.331 1.00 42.15 H new ATOM 0 HB VAL B 43 2.667 6.437 -4.925 1.00 53.53 H new ATOM 0 HG11 VAL B 43 3.371 8.800 -4.791 1.00 32.23 H new ATOM 0 HG12 VAL B 43 2.859 8.340 -6.432 1.00 32.23 H new ATOM 0 HG13 VAL B 43 1.773 9.296 -5.397 1.00 32.23 H new ATOM 0 HG21 VAL B 43 2.400 7.781 -2.845 1.00 61.44 H new ATOM 0 HG22 VAL B 43 0.750 8.211 -3.356 1.00 61.44 H new ATOM 0 HG23 VAL B 43 1.155 6.517 -2.989 1.00 61.44 H new ATOM 2167 N GLY B 44 -0.599 8.722 -6.343 1.00 52.20 N ATOM 2168 CA GLY B 44 -1.696 9.646 -6.272 1.00 70.11 C ATOM 2169 C GLY B 44 -3.012 9.014 -6.653 1.00 73.41 C ATOM 2170 O GLY B 44 -4.023 9.251 -6.006 1.00 54.25 O ATOM 0 H GLY B 44 0.104 8.949 -7.047 1.00 52.20 H new ATOM 0 HA2 GLY B 44 -1.767 10.043 -5.259 1.00 70.11 H new ATOM 0 HA3 GLY B 44 -1.498 10.491 -6.932 1.00 70.11 H new ATOM 2174 N TYR B 45 -3.000 8.189 -7.692 1.00 61.20 N ATOM 2175 CA TYR B 45 -4.215 7.544 -8.167 1.00 33.15 C ATOM 2176 C TYR B 45 -4.918 6.728 -7.087 1.00 35.02 C ATOM 2177 O TYR B 45 -6.108 6.932 -6.831 1.00 14.02 O ATOM 2178 CB TYR B 45 -3.966 6.671 -9.418 1.00 72.43 C ATOM 2179 CG TYR B 45 -5.172 5.809 -9.783 1.00 5.51 C ATOM 2180 CD1 TYR B 45 -5.131 4.428 -9.646 1.00 40.20 C ATOM 2181 CD2 TYR B 45 -6.353 6.378 -10.214 1.00 42.42 C ATOM 2182 CE1 TYR B 45 -6.227 3.646 -9.929 1.00 70.32 C ATOM 2183 CE2 TYR B 45 -7.454 5.602 -10.505 1.00 52.23 C ATOM 2184 CZ TYR B 45 -7.384 4.237 -10.360 1.00 2.23 C ATOM 2185 OH TYR B 45 -8.482 3.459 -10.641 1.00 20.31 O ATOM 0 H TYR B 45 -2.161 7.951 -8.222 1.00 61.20 H new ATOM 0 HA TYR B 45 -4.880 8.361 -8.447 1.00 33.15 H new ATOM 0 HB2 TYR B 45 -3.716 7.315 -10.261 1.00 72.43 H new ATOM 0 HB3 TYR B 45 -3.104 6.027 -9.241 1.00 72.43 H new ATOM 0 HD1 TYR B 45 -4.219 3.957 -9.310 1.00 40.20 H new ATOM 0 HD2 TYR B 45 -6.416 7.450 -10.325 1.00 42.42 H new ATOM 0 HE1 TYR B 45 -6.175 2.574 -9.812 1.00 70.32 H new ATOM 0 HE2 TYR B 45 -8.368 6.065 -10.846 1.00 52.23 H new ATOM 0 HH TYR B 45 -8.223 2.734 -11.247 1.00 20.31 H new ATOM 2195 N LEU B 46 -4.197 5.836 -6.451 1.00 64.33 N ATOM 2196 CA LEU B 46 -4.819 4.919 -5.504 1.00 12.54 C ATOM 2197 C LEU B 46 -5.335 5.585 -4.245 1.00 72.32 C ATOM 2198 O LEU B 46 -6.417 5.265 -3.782 1.00 54.32 O ATOM 2199 CB LEU B 46 -3.938 3.719 -5.147 1.00 64.33 C ATOM 2200 CG LEU B 46 -3.635 2.695 -6.266 1.00 54.54 C ATOM 2201 CD1 LEU B 46 -2.707 3.241 -7.322 1.00 34.11 C ATOM 2202 CD2 LEU B 46 -3.098 1.416 -5.682 1.00 32.11 C ATOM 0 H LEU B 46 -3.190 5.719 -6.564 1.00 64.33 H new ATOM 0 HA LEU B 46 -5.687 4.545 -6.048 1.00 12.54 H new ATOM 0 HB2 LEU B 46 -2.987 4.100 -4.773 1.00 64.33 H new ATOM 0 HB3 LEU B 46 -4.414 3.186 -4.324 1.00 64.33 H new ATOM 0 HG LEU B 46 -4.580 2.483 -6.767 1.00 54.54 H new ATOM 0 HD11 LEU B 46 -2.530 2.479 -8.081 1.00 34.11 H new ATOM 0 HD12 LEU B 46 -3.160 4.117 -7.786 1.00 34.11 H new ATOM 0 HD13 LEU B 46 -1.759 3.523 -6.863 1.00 34.11 H new ATOM 0 HD21 LEU B 46 -2.891 0.708 -6.485 1.00 32.11 H new ATOM 0 HD22 LEU B 46 -2.178 1.624 -5.135 1.00 32.11 H new ATOM 0 HD23 LEU B 46 -3.835 0.988 -5.003 1.00 32.11 H new ATOM 2214 N LEU B 47 -4.592 6.507 -3.701 1.00 24.20 N ATOM 2215 CA LEU B 47 -5.002 7.107 -2.446 1.00 41.21 C ATOM 2216 C LEU B 47 -5.871 8.357 -2.603 1.00 10.31 C ATOM 2217 O LEU B 47 -6.365 8.904 -1.611 1.00 2.24 O ATOM 2218 CB LEU B 47 -3.808 7.277 -1.481 1.00 71.00 C ATOM 2219 CG LEU B 47 -2.556 7.988 -2.015 1.00 24.03 C ATOM 2220 CD1 LEU B 47 -2.776 9.470 -2.266 1.00 23.20 C ATOM 2221 CD2 LEU B 47 -1.374 7.738 -1.107 1.00 3.42 C ATOM 0 H LEU B 47 -3.717 6.859 -4.090 1.00 24.20 H new ATOM 0 HA LEU B 47 -5.678 6.396 -1.971 1.00 41.21 H new ATOM 0 HB2 LEU B 47 -4.158 7.826 -0.607 1.00 71.00 H new ATOM 0 HB3 LEU B 47 -3.511 6.286 -1.137 1.00 71.00 H new ATOM 0 HG LEU B 47 -2.334 7.556 -2.991 1.00 24.03 H new ATOM 0 HD11 LEU B 47 -1.855 9.916 -2.642 1.00 23.20 H new ATOM 0 HD12 LEU B 47 -3.569 9.601 -3.002 1.00 23.20 H new ATOM 0 HD13 LEU B 47 -3.061 9.958 -1.334 1.00 23.20 H new ATOM 0 HD21 LEU B 47 -0.497 8.250 -1.502 1.00 3.42 H new ATOM 0 HD22 LEU B 47 -1.596 8.116 -0.109 1.00 3.42 H new ATOM 0 HD23 LEU B 47 -1.176 6.667 -1.054 1.00 3.42 H new ATOM 2233 N SER B 48 -6.059 8.802 -3.835 1.00 71.13 N ATOM 2234 CA SER B 48 -6.928 9.929 -4.088 1.00 40.41 C ATOM 2235 C SER B 48 -8.207 9.471 -4.802 1.00 44.23 C ATOM 2236 O SER B 48 -9.241 10.138 -4.722 1.00 44.13 O ATOM 2237 CB SER B 48 -6.198 11.009 -4.907 1.00 72.24 C ATOM 2238 OG SER B 48 -6.996 12.175 -5.085 1.00 41.35 O ATOM 0 H SER B 48 -5.624 8.401 -4.666 1.00 71.13 H new ATOM 0 HA SER B 48 -7.210 10.367 -3.131 1.00 40.41 H new ATOM 0 HB2 SER B 48 -5.269 11.279 -4.404 1.00 72.24 H new ATOM 0 HB3 SER B 48 -5.927 10.603 -5.882 1.00 72.24 H new ATOM 0 HG SER B 48 -6.497 12.836 -5.608 1.00 41.35 H new ATOM 2244 N GLY B 49 -8.137 8.333 -5.508 1.00 72.45 N ATOM 2245 CA GLY B 49 -9.301 7.819 -6.186 1.00 73.42 C ATOM 2246 C GLY B 49 -9.614 8.600 -7.437 1.00 51.11 C ATOM 2247 O GLY B 49 -10.766 8.655 -7.879 1.00 5.20 O ATOM 0 H GLY B 49 -7.293 7.770 -5.614 1.00 72.45 H new ATOM 0 HA2 GLY B 49 -9.139 6.772 -6.443 1.00 73.42 H new ATOM 0 HA3 GLY B 49 -10.158 7.853 -5.513 1.00 73.42 H new ATOM 2251 N ASP B 50 -8.597 9.194 -8.019 1.00 42.31 N ATOM 2252 CA ASP B 50 -8.784 10.014 -9.194 1.00 62.13 C ATOM 2253 C ASP B 50 -8.005 9.455 -10.382 1.00 31.42 C ATOM 2254 O ASP B 50 -6.771 9.473 -10.393 1.00 52.00 O ATOM 2255 CB ASP B 50 -8.383 11.454 -8.908 1.00 32.12 C ATOM 2256 CG ASP B 50 -8.613 12.355 -10.086 1.00 63.20 C ATOM 2257 OD1 ASP B 50 -9.784 12.689 -10.371 1.00 32.34 O ATOM 2258 OD2 ASP B 50 -7.641 12.768 -10.729 1.00 54.43 O ATOM 0 H ASP B 50 -7.631 9.125 -7.698 1.00 42.31 H new ATOM 0 HA ASP B 50 -9.842 9.999 -9.455 1.00 62.13 H new ATOM 0 HB2 ASP B 50 -8.951 11.824 -8.054 1.00 32.12 H new ATOM 0 HB3 ASP B 50 -7.330 11.487 -8.629 1.00 32.12 H new ATOM 2263 N PRO B 51 -8.724 8.922 -11.394 1.00 63.50 N ATOM 2264 CA PRO B 51 -8.122 8.307 -12.601 1.00 44.55 C ATOM 2265 C PRO B 51 -7.221 9.247 -13.394 1.00 30.12 C ATOM 2266 O PRO B 51 -6.307 8.794 -14.100 1.00 13.03 O ATOM 2267 CB PRO B 51 -9.337 7.910 -13.447 1.00 43.34 C ATOM 2268 CG PRO B 51 -10.447 7.792 -12.470 1.00 31.45 C ATOM 2269 CD PRO B 51 -10.199 8.855 -11.445 1.00 74.44 C ATOM 0 HA PRO B 51 -7.470 7.478 -12.324 1.00 44.55 H new ATOM 0 HB2 PRO B 51 -9.555 8.661 -14.206 1.00 43.34 H new ATOM 0 HB3 PRO B 51 -9.166 6.969 -13.970 1.00 43.34 H new ATOM 0 HG2 PRO B 51 -11.413 7.934 -12.955 1.00 31.45 H new ATOM 0 HG3 PRO B 51 -10.462 6.803 -12.012 1.00 31.45 H new ATOM 0 HD2 PRO B 51 -10.637 9.809 -11.737 1.00 74.44 H new ATOM 0 HD3 PRO B 51 -10.626 8.591 -10.477 1.00 74.44 H new ATOM 2277 N ALA B 52 -7.460 10.547 -13.262 1.00 23.25 N ATOM 2278 CA ALA B 52 -6.735 11.563 -14.022 1.00 13.54 C ATOM 2279 C ALA B 52 -5.236 11.604 -13.699 1.00 52.33 C ATOM 2280 O ALA B 52 -4.464 12.243 -14.418 1.00 71.44 O ATOM 2281 CB ALA B 52 -7.364 12.926 -13.837 1.00 60.43 C ATOM 0 H ALA B 52 -8.161 10.928 -12.626 1.00 23.25 H new ATOM 0 HA ALA B 52 -6.815 11.277 -15.071 1.00 13.54 H new ATOM 0 HB1 ALA B 52 -6.807 13.665 -14.412 1.00 60.43 H new ATOM 0 HB2 ALA B 52 -8.397 12.900 -14.184 1.00 60.43 H new ATOM 0 HB3 ALA B 52 -7.342 13.196 -12.781 1.00 60.43 H new ATOM 2287 N TYR B 53 -4.824 10.927 -12.627 1.00 24.05 N ATOM 2288 CA TYR B 53 -3.418 10.860 -12.258 1.00 15.24 C ATOM 2289 C TYR B 53 -2.559 10.102 -13.257 1.00 24.23 C ATOM 2290 O TYR B 53 -1.356 10.293 -13.291 1.00 61.42 O ATOM 2291 CB TYR B 53 -3.206 10.315 -10.850 1.00 53.23 C ATOM 2292 CG TYR B 53 -3.480 11.334 -9.791 1.00 42.12 C ATOM 2293 CD1 TYR B 53 -2.601 12.381 -9.614 1.00 3.13 C ATOM 2294 CD2 TYR B 53 -4.591 11.264 -8.974 1.00 44.33 C ATOM 2295 CE1 TYR B 53 -2.812 13.332 -8.663 1.00 73.03 C ATOM 2296 CE2 TYR B 53 -4.815 12.218 -8.006 1.00 70.42 C ATOM 2297 CZ TYR B 53 -3.920 13.255 -7.856 1.00 31.21 C ATOM 2298 OH TYR B 53 -4.137 14.222 -6.897 1.00 23.30 O ATOM 0 H TYR B 53 -5.448 10.418 -12.001 1.00 24.05 H new ATOM 0 HA TYR B 53 -3.083 11.897 -12.274 1.00 15.24 H new ATOM 0 HB2 TYR B 53 -3.856 9.453 -10.696 1.00 53.23 H new ATOM 0 HB3 TYR B 53 -2.179 9.962 -10.752 1.00 53.23 H new ATOM 0 HD1 TYR B 53 -1.726 12.448 -10.243 1.00 3.13 H new ATOM 0 HD2 TYR B 53 -5.292 10.452 -9.095 1.00 44.33 H new ATOM 0 HE1 TYR B 53 -2.110 14.144 -8.544 1.00 73.03 H new ATOM 0 HE2 TYR B 53 -5.685 12.154 -7.370 1.00 70.42 H new ATOM 0 HH TYR B 53 -4.965 14.022 -6.412 1.00 23.30 H new ATOM 2308 N ILE B 54 -3.149 9.259 -14.060 1.00 60.53 N ATOM 2309 CA ILE B 54 -2.365 8.547 -15.052 1.00 44.14 C ATOM 2310 C ILE B 54 -2.481 9.261 -16.402 1.00 2.12 C ATOM 2311 O ILE B 54 -3.600 9.537 -16.868 1.00 34.41 O ATOM 2312 CB ILE B 54 -2.796 7.052 -15.184 1.00 12.03 C ATOM 2313 CG1 ILE B 54 -2.725 6.355 -13.813 1.00 73.20 C ATOM 2314 CG2 ILE B 54 -1.914 6.315 -16.200 1.00 22.01 C ATOM 2315 CD1 ILE B 54 -1.353 6.392 -13.150 1.00 43.22 C ATOM 0 H ILE B 54 -4.147 9.046 -14.055 1.00 60.53 H new ATOM 0 HA ILE B 54 -1.326 8.548 -14.723 1.00 44.14 H new ATOM 0 HB ILE B 54 -3.825 7.024 -15.543 1.00 12.03 H new ATOM 0 HG12 ILE B 54 -3.449 6.822 -13.145 1.00 73.20 H new ATOM 0 HG13 ILE B 54 -3.027 5.315 -13.933 1.00 73.20 H new ATOM 0 HG21 ILE B 54 -2.234 5.276 -16.274 1.00 22.01 H new ATOM 0 HG22 ILE B 54 -2.005 6.793 -17.175 1.00 22.01 H new ATOM 0 HG23 ILE B 54 -0.875 6.352 -15.874 1.00 22.01 H new ATOM 0 HD11 ILE B 54 -1.399 5.877 -12.190 1.00 43.22 H new ATOM 0 HD12 ILE B 54 -0.625 5.897 -13.793 1.00 43.22 H new ATOM 0 HD13 ILE B 54 -1.053 7.428 -12.992 1.00 43.22 H new ATOM 2327 N PRO B 55 -1.340 9.618 -17.026 1.00 72.13 N ATOM 2328 CA PRO B 55 -1.323 10.285 -18.331 1.00 4.23 C ATOM 2329 C PRO B 55 -1.942 9.411 -19.416 1.00 1.44 C ATOM 2330 O PRO B 55 -1.827 8.172 -19.392 1.00 13.24 O ATOM 2331 CB PRO B 55 0.167 10.520 -18.618 1.00 30.21 C ATOM 2332 CG PRO B 55 0.888 9.586 -17.717 1.00 21.43 C ATOM 2333 CD PRO B 55 0.021 9.418 -16.502 1.00 65.44 C ATOM 0 HA PRO B 55 -1.905 11.207 -18.322 1.00 4.23 H new ATOM 0 HB2 PRO B 55 0.403 10.320 -19.663 1.00 30.21 H new ATOM 0 HB3 PRO B 55 0.448 11.554 -18.420 1.00 30.21 H new ATOM 0 HG2 PRO B 55 1.060 8.628 -18.207 1.00 21.43 H new ATOM 0 HG3 PRO B 55 1.865 9.985 -17.445 1.00 21.43 H new ATOM 0 HD2 PRO B 55 0.139 8.430 -16.057 1.00 65.44 H new ATOM 0 HD3 PRO B 55 0.266 10.147 -15.729 1.00 65.44 H new ATOM 2341 N ARG B 56 -2.558 10.036 -20.374 1.00 54.51 N ATOM 2342 CA ARG B 56 -3.254 9.312 -21.401 1.00 22.04 C ATOM 2343 C ARG B 56 -2.414 9.142 -22.650 1.00 34.24 C ATOM 2344 O ARG B 56 -2.585 9.835 -23.650 1.00 74.43 O ATOM 2345 CB ARG B 56 -4.697 9.832 -21.715 1.00 34.22 C ATOM 2346 CG ARG B 56 -4.814 11.294 -22.191 1.00 35.33 C ATOM 2347 CD ARG B 56 -4.562 12.303 -21.082 1.00 71.21 C ATOM 2348 NE ARG B 56 -4.550 13.669 -21.587 1.00 62.42 N ATOM 2349 CZ ARG B 56 -4.339 14.759 -20.842 1.00 53.43 C ATOM 2350 NH1 ARG B 56 -4.182 14.653 -19.522 1.00 13.51 N ATOM 2351 NH2 ARG B 56 -4.292 15.957 -21.417 1.00 5.22 N ATOM 0 H ARG B 56 -2.594 11.051 -20.468 1.00 54.51 H new ATOM 0 HA ARG B 56 -3.415 8.321 -20.976 1.00 22.04 H new ATOM 0 HB2 ARG B 56 -5.132 9.189 -22.480 1.00 34.22 H new ATOM 0 HB3 ARG B 56 -5.304 9.716 -20.817 1.00 34.22 H new ATOM 0 HG2 ARG B 56 -4.102 11.465 -22.999 1.00 35.33 H new ATOM 0 HG3 ARG B 56 -5.810 11.457 -22.604 1.00 35.33 H new ATOM 0 HD2 ARG B 56 -5.334 12.204 -20.318 1.00 71.21 H new ATOM 0 HD3 ARG B 56 -3.608 12.085 -20.601 1.00 71.21 H new ATOM 0 HE ARG B 56 -4.715 13.804 -22.584 1.00 62.42 H new ATOM 0 HH11 ARG B 56 -4.223 13.737 -19.076 1.00 13.51 H new ATOM 0 HH12 ARG B 56 -4.021 15.488 -18.959 1.00 13.51 H new ATOM 0 HH21 ARG B 56 -4.417 16.044 -22.426 1.00 5.22 H new ATOM 0 HH22 ARG B 56 -4.131 16.789 -20.849 1.00 5.22 H new ATOM 2365 N TYR B 57 -1.444 8.290 -22.542 1.00 71.20 N ATOM 2366 CA TYR B 57 -0.617 7.937 -23.658 1.00 50.35 C ATOM 2367 C TYR B 57 -0.989 6.571 -24.187 1.00 4.22 C ATOM 2368 O TYR B 57 -1.245 6.399 -25.378 1.00 70.53 O ATOM 2369 CB TYR B 57 0.855 7.952 -23.253 1.00 32.20 C ATOM 2370 CG TYR B 57 1.787 7.443 -24.333 1.00 35.00 C ATOM 2371 CD1 TYR B 57 2.029 8.186 -25.472 1.00 34.22 C ATOM 2372 CD2 TYR B 57 2.419 6.212 -24.206 1.00 63.21 C ATOM 2373 CE1 TYR B 57 2.868 7.725 -26.459 1.00 32.02 C ATOM 2374 CE2 TYR B 57 3.261 5.743 -25.185 1.00 53.05 C ATOM 2375 CZ TYR B 57 3.482 6.502 -26.313 1.00 71.33 C ATOM 2376 OH TYR B 57 4.329 6.039 -27.300 1.00 33.00 O ATOM 0 H TYR B 57 -1.200 7.815 -21.673 1.00 71.20 H new ATOM 0 HA TYR B 57 -0.777 8.673 -24.446 1.00 50.35 H new ATOM 0 HB2 TYR B 57 1.140 8.970 -22.989 1.00 32.20 H new ATOM 0 HB3 TYR B 57 0.983 7.343 -22.358 1.00 32.20 H new ATOM 0 HD1 TYR B 57 1.550 9.147 -25.590 1.00 34.22 H new ATOM 0 HD2 TYR B 57 2.245 5.614 -23.323 1.00 63.21 H new ATOM 0 HE1 TYR B 57 3.044 8.319 -27.344 1.00 32.02 H new ATOM 0 HE2 TYR B 57 3.747 4.785 -25.071 1.00 53.05 H new ATOM 0 HH TYR B 57 4.682 5.161 -27.043 1.00 33.00 H new ATOM 2386 N GLN B 58 -1.029 5.620 -23.299 1.00 61.42 N ATOM 2387 CA GLN B 58 -1.251 4.267 -23.661 1.00 64.45 C ATOM 2388 C GLN B 58 -2.522 3.795 -22.978 1.00 52.45 C ATOM 2389 O GLN B 58 -3.040 4.474 -22.076 1.00 5.31 O ATOM 2390 CB GLN B 58 -0.052 3.436 -23.171 1.00 3.42 C ATOM 2391 CG GLN B 58 0.046 2.032 -23.729 1.00 22.12 C ATOM 2392 CD GLN B 58 1.229 1.280 -23.165 1.00 70.10 C ATOM 2393 OE1 GLN B 58 1.639 1.506 -22.033 1.00 74.23 O ATOM 2394 NE2 GLN B 58 1.790 0.401 -23.945 1.00 43.41 N ATOM 0 H GLN B 58 -0.906 5.772 -22.298 1.00 61.42 H new ATOM 0 HA GLN B 58 -1.355 4.158 -24.741 1.00 64.45 H new ATOM 0 HB2 GLN B 58 0.864 3.971 -23.421 1.00 3.42 H new ATOM 0 HB3 GLN B 58 -0.097 3.373 -22.084 1.00 3.42 H new ATOM 0 HG2 GLN B 58 -0.871 1.487 -23.503 1.00 22.12 H new ATOM 0 HG3 GLN B 58 0.130 2.078 -24.815 1.00 22.12 H new ATOM 0 HE21 GLN B 58 1.420 0.240 -24.882 1.00 43.41 H new ATOM 0 HE22 GLN B 58 2.600 -0.127 -23.619 1.00 43.41 H new ATOM 2403 N ASP B 59 -2.997 2.628 -23.374 1.00 23.22 N ATOM 2404 CA ASP B 59 -4.179 1.976 -22.789 1.00 5.45 C ATOM 2405 C ASP B 59 -4.039 1.727 -21.291 1.00 34.31 C ATOM 2406 O ASP B 59 -5.014 1.411 -20.624 1.00 54.51 O ATOM 2407 CB ASP B 59 -4.574 0.689 -23.544 1.00 33.42 C ATOM 2408 CG ASP B 59 -3.444 -0.308 -23.712 1.00 65.52 C ATOM 2409 OD1 ASP B 59 -2.691 -0.194 -24.716 1.00 10.51 O ATOM 2410 OD2 ASP B 59 -3.299 -1.218 -22.887 1.00 31.35 O ATOM 0 H ASP B 59 -2.571 2.087 -24.126 1.00 23.22 H new ATOM 0 HA ASP B 59 -4.998 2.685 -22.911 1.00 5.45 H new ATOM 0 HB2 ASP B 59 -5.393 0.206 -23.011 1.00 33.42 H new ATOM 0 HB3 ASP B 59 -4.952 0.961 -24.529 1.00 33.42 H new ATOM 2415 N ALA B 60 -2.822 1.891 -20.779 1.00 20.05 N ATOM 2416 CA ALA B 60 -2.498 1.740 -19.362 1.00 73.45 C ATOM 2417 C ALA B 60 -3.470 2.520 -18.469 1.00 45.10 C ATOM 2418 O ALA B 60 -3.928 2.005 -17.449 1.00 34.03 O ATOM 2419 CB ALA B 60 -1.087 2.228 -19.115 1.00 43.33 C ATOM 0 H ALA B 60 -2.014 2.138 -21.351 1.00 20.05 H new ATOM 0 HA ALA B 60 -2.585 0.683 -19.109 1.00 73.45 H new ATOM 0 HB1 ALA B 60 -0.843 2.116 -18.059 1.00 43.33 H new ATOM 0 HB2 ALA B 60 -0.389 1.641 -19.712 1.00 43.33 H new ATOM 0 HB3 ALA B 60 -1.011 3.278 -19.396 1.00 43.33 H new ATOM 2425 N ARG B 61 -3.794 3.758 -18.873 1.00 44.04 N ATOM 2426 CA ARG B 61 -4.743 4.590 -18.134 1.00 24.04 C ATOM 2427 C ARG B 61 -6.128 3.942 -18.048 1.00 42.44 C ATOM 2428 O ARG B 61 -6.817 4.074 -17.058 1.00 21.21 O ATOM 2429 CB ARG B 61 -4.779 6.060 -18.688 1.00 73.20 C ATOM 2430 CG ARG B 61 -5.011 6.219 -20.209 1.00 15.23 C ATOM 2431 CD ARG B 61 -6.414 5.849 -20.659 1.00 55.40 C ATOM 2432 NE ARG B 61 -6.516 5.777 -22.118 1.00 4.00 N ATOM 2433 CZ ARG B 61 -7.622 5.426 -22.792 1.00 34.21 C ATOM 2434 NH1 ARG B 61 -8.768 5.235 -22.147 1.00 14.31 N ATOM 2435 NH2 ARG B 61 -7.582 5.288 -24.111 1.00 3.01 N ATOM 0 H ARG B 61 -3.410 4.201 -19.708 1.00 44.04 H new ATOM 0 HA ARG B 61 -4.386 4.662 -17.107 1.00 24.04 H new ATOM 0 HB2 ARG B 61 -5.566 6.603 -18.164 1.00 73.20 H new ATOM 0 HB3 ARG B 61 -3.835 6.543 -18.434 1.00 73.20 H new ATOM 0 HG2 ARG B 61 -4.810 7.252 -20.491 1.00 15.23 H new ATOM 0 HG3 ARG B 61 -4.293 5.597 -20.743 1.00 15.23 H new ATOM 0 HD2 ARG B 61 -6.692 4.888 -20.227 1.00 55.40 H new ATOM 0 HD3 ARG B 61 -7.123 6.586 -20.281 1.00 55.40 H new ATOM 0 HE ARG B 61 -5.685 6.011 -22.662 1.00 4.00 H new ATOM 0 HH11 ARG B 61 -8.810 5.355 -21.135 1.00 14.31 H new ATOM 0 HH12 ARG B 61 -9.606 4.968 -22.664 1.00 14.31 H new ATOM 0 HH21 ARG B 61 -6.710 5.449 -24.614 1.00 3.01 H new ATOM 0 HH22 ARG B 61 -8.424 5.021 -24.622 1.00 3.01 H new ATOM 2449 N ASN B 62 -6.510 3.238 -19.090 1.00 54.52 N ATOM 2450 CA ASN B 62 -7.800 2.572 -19.140 1.00 1.40 C ATOM 2451 C ASN B 62 -7.721 1.301 -18.293 1.00 33.32 C ATOM 2452 O ASN B 62 -8.647 0.979 -17.551 1.00 71.23 O ATOM 2453 CB ASN B 62 -8.147 2.215 -20.600 1.00 14.55 C ATOM 2454 CG ASN B 62 -9.612 1.820 -20.857 1.00 30.10 C ATOM 2455 OD1 ASN B 62 -10.314 1.322 -19.865 1.00 32.21 O flip ATOM 2456 ND2 ASN B 62 -10.108 2.002 -21.966 1.00 10.40 N flip ATOM 0 H ASN B 62 -5.940 3.109 -19.926 1.00 54.52 H new ATOM 0 HA ASN B 62 -8.578 3.229 -18.750 1.00 1.40 H new ATOM 0 HB2 ASN B 62 -7.903 3.069 -21.232 1.00 14.55 H new ATOM 0 HB3 ASN B 62 -7.506 1.392 -20.916 1.00 14.55 H new ATOM 0 HD21 ASN B 62 -9.542 2.390 -22.720 1.00 10.40 H new ATOM 0 HD22 ASN B 62 -11.086 1.765 -22.132 1.00 10.40 H new ATOM 2463 N LEU B 63 -6.594 0.595 -18.417 1.00 4.42 N ATOM 2464 CA LEU B 63 -6.358 -0.675 -17.718 1.00 2.32 C ATOM 2465 C LEU B 63 -6.451 -0.494 -16.222 1.00 63.11 C ATOM 2466 O LEU B 63 -7.183 -1.206 -15.542 1.00 2.24 O ATOM 2467 CB LEU B 63 -4.954 -1.213 -18.041 1.00 74.15 C ATOM 2468 CG LEU B 63 -4.620 -1.452 -19.507 1.00 30.21 C ATOM 2469 CD1 LEU B 63 -3.199 -1.966 -19.651 1.00 64.34 C ATOM 2470 CD2 LEU B 63 -5.593 -2.420 -20.127 1.00 74.44 C ATOM 0 H LEU B 63 -5.815 0.888 -19.007 1.00 4.42 H new ATOM 0 HA LEU B 63 -7.121 -1.376 -18.055 1.00 2.32 H new ATOM 0 HB2 LEU B 63 -4.223 -0.512 -17.638 1.00 74.15 H new ATOM 0 HB3 LEU B 63 -4.822 -2.154 -17.507 1.00 74.15 H new ATOM 0 HG LEU B 63 -4.702 -0.501 -20.033 1.00 30.21 H new ATOM 0 HD11 LEU B 63 -2.977 -2.131 -20.705 1.00 64.34 H new ATOM 0 HD12 LEU B 63 -2.504 -1.232 -19.245 1.00 64.34 H new ATOM 0 HD13 LEU B 63 -3.095 -2.905 -19.107 1.00 64.34 H new ATOM 0 HD21 LEU B 63 -5.334 -2.575 -21.174 1.00 74.44 H new ATOM 0 HD22 LEU B 63 -5.547 -3.371 -19.597 1.00 74.44 H new ATOM 0 HD23 LEU B 63 -6.603 -2.015 -20.059 1.00 74.44 H new ATOM 2482 N ILE B 64 -5.743 0.503 -15.723 1.00 20.14 N ATOM 2483 CA ILE B 64 -5.664 0.771 -14.291 1.00 63.42 C ATOM 2484 C ILE B 64 -7.028 1.221 -13.765 1.00 14.24 C ATOM 2485 O ILE B 64 -7.389 0.969 -12.628 1.00 43.24 O ATOM 2486 CB ILE B 64 -4.601 1.878 -14.006 1.00 52.14 C ATOM 2487 CG1 ILE B 64 -4.314 1.985 -12.501 1.00 42.44 C ATOM 2488 CG2 ILE B 64 -5.088 3.234 -14.558 1.00 32.52 C ATOM 2489 CD1 ILE B 64 -3.206 2.965 -12.151 1.00 71.54 C ATOM 0 H ILE B 64 -5.205 1.153 -16.296 1.00 20.14 H new ATOM 0 HA ILE B 64 -5.368 -0.146 -13.782 1.00 63.42 H new ATOM 0 HB ILE B 64 -3.674 1.604 -14.509 1.00 52.14 H new ATOM 0 HG12 ILE B 64 -5.227 2.287 -11.988 1.00 42.44 H new ATOM 0 HG13 ILE B 64 -4.046 0.999 -12.122 1.00 42.44 H new ATOM 0 HG21 ILE B 64 -4.340 4.000 -14.354 1.00 32.52 H new ATOM 0 HG22 ILE B 64 -5.242 3.155 -15.634 1.00 32.52 H new ATOM 0 HG23 ILE B 64 -6.027 3.507 -14.076 1.00 32.52 H new ATOM 0 HD11 ILE B 64 -3.064 2.983 -11.070 1.00 71.54 H new ATOM 0 HD12 ILE B 64 -2.279 2.654 -12.634 1.00 71.54 H new ATOM 0 HD13 ILE B 64 -3.479 3.962 -12.498 1.00 71.54 H new ATOM 2501 N ARG B 65 -7.786 1.831 -14.648 1.00 63.44 N ATOM 2502 CA ARG B 65 -9.048 2.428 -14.334 1.00 31.21 C ATOM 2503 C ARG B 65 -10.108 1.320 -14.175 1.00 41.35 C ATOM 2504 O ARG B 65 -11.097 1.487 -13.462 1.00 43.32 O ATOM 2505 CB ARG B 65 -9.365 3.432 -15.476 1.00 61.24 C ATOM 2506 CG ARG B 65 -10.487 4.434 -15.256 1.00 35.53 C ATOM 2507 CD ARG B 65 -11.843 3.794 -15.241 1.00 62.12 C ATOM 2508 NE ARG B 65 -12.923 4.766 -15.011 1.00 51.20 N ATOM 2509 CZ ARG B 65 -14.180 4.448 -14.649 1.00 61.42 C ATOM 2510 NH1 ARG B 65 -14.530 3.177 -14.469 1.00 45.11 N ATOM 2511 NH2 ARG B 65 -15.073 5.407 -14.448 1.00 64.12 N ATOM 0 H ARG B 65 -7.527 1.924 -15.630 1.00 63.44 H new ATOM 0 HA ARG B 65 -9.037 2.971 -13.389 1.00 31.21 H new ATOM 0 HB2 ARG B 65 -8.455 3.992 -15.690 1.00 61.24 H new ATOM 0 HB3 ARG B 65 -9.603 2.856 -16.370 1.00 61.24 H new ATOM 0 HG2 ARG B 65 -10.325 4.953 -14.311 1.00 35.53 H new ATOM 0 HG3 ARG B 65 -10.455 5.187 -16.043 1.00 35.53 H new ATOM 0 HD2 ARG B 65 -12.012 3.286 -16.191 1.00 62.12 H new ATOM 0 HD3 ARG B 65 -11.873 3.032 -14.462 1.00 62.12 H new ATOM 0 HE ARG B 65 -12.703 5.754 -15.135 1.00 51.20 H new ATOM 0 HH11 ARG B 65 -13.844 2.435 -14.605 1.00 45.11 H new ATOM 0 HH12 ARG B 65 -15.485 2.945 -14.195 1.00 45.11 H new ATOM 0 HH21 ARG B 65 -14.807 6.384 -14.568 1.00 64.12 H new ATOM 0 HH22 ARG B 65 -16.026 5.167 -14.174 1.00 64.12 H new ATOM 2525 N ARG B 66 -9.855 0.177 -14.805 1.00 63.11 N ATOM 2526 CA ARG B 66 -10.757 -0.972 -14.732 1.00 72.11 C ATOM 2527 C ARG B 66 -10.590 -1.703 -13.400 1.00 42.52 C ATOM 2528 O ARG B 66 -11.416 -2.539 -13.022 1.00 50.33 O ATOM 2529 CB ARG B 66 -10.490 -1.945 -15.890 1.00 45.24 C ATOM 2530 CG ARG B 66 -10.758 -1.380 -17.276 1.00 40.44 C ATOM 2531 CD ARG B 66 -10.374 -2.382 -18.351 1.00 1.21 C ATOM 2532 NE ARG B 66 -10.613 -1.876 -19.711 1.00 3.11 N ATOM 2533 CZ ARG B 66 -9.911 -2.243 -20.803 1.00 24.15 C ATOM 2534 NH1 ARG B 66 -8.925 -3.131 -20.704 1.00 62.22 N ATOM 2535 NH2 ARG B 66 -10.206 -1.724 -21.985 1.00 33.01 N ATOM 0 H ARG B 66 -9.025 0.019 -15.377 1.00 63.11 H new ATOM 0 HA ARG B 66 -11.779 -0.601 -14.809 1.00 72.11 H new ATOM 0 HB2 ARG B 66 -9.450 -2.269 -15.841 1.00 45.24 H new ATOM 0 HB3 ARG B 66 -11.108 -2.832 -15.750 1.00 45.24 H new ATOM 0 HG2 ARG B 66 -11.813 -1.124 -17.371 1.00 40.44 H new ATOM 0 HG3 ARG B 66 -10.193 -0.458 -17.413 1.00 40.44 H new ATOM 0 HD2 ARG B 66 -9.320 -2.638 -18.243 1.00 1.21 H new ATOM 0 HD3 ARG B 66 -10.942 -3.301 -18.205 1.00 1.21 H new ATOM 0 HE ARG B 66 -11.364 -1.198 -19.838 1.00 3.11 H new ATOM 0 HH11 ARG B 66 -8.695 -3.539 -19.798 1.00 62.22 H new ATOM 0 HH12 ARG B 66 -8.399 -3.403 -21.534 1.00 62.22 H new ATOM 0 HH21 ARG B 66 -10.964 -1.047 -22.070 1.00 33.01 H new ATOM 0 HH22 ARG B 66 -9.675 -2.001 -22.811 1.00 33.01 H new ATOM 2549 N HIS B 67 -9.530 -1.387 -12.698 1.00 34.34 N ATOM 2550 CA HIS B 67 -9.252 -2.004 -11.418 1.00 64.43 C ATOM 2551 C HIS B 67 -9.562 -1.023 -10.327 1.00 45.44 C ATOM 2552 O HIS B 67 -9.300 0.167 -10.480 1.00 43.24 O ATOM 2553 CB HIS B 67 -7.782 -2.428 -11.304 1.00 42.34 C ATOM 2554 CG HIS B 67 -7.341 -3.485 -12.267 1.00 33.22 C ATOM 2555 ND1 HIS B 67 -7.298 -4.809 -11.944 1.00 54.24 N ATOM 2556 CD2 HIS B 67 -6.888 -3.401 -13.532 1.00 33.43 C ATOM 2557 CE1 HIS B 67 -6.836 -5.497 -12.963 1.00 32.41 C ATOM 2558 NE2 HIS B 67 -6.584 -4.666 -13.943 1.00 25.34 N ATOM 0 H HIS B 67 -8.837 -0.699 -12.993 1.00 34.34 H new ATOM 0 HA HIS B 67 -9.872 -2.896 -11.327 1.00 64.43 H new ATOM 0 HB2 HIS B 67 -7.156 -1.547 -11.446 1.00 42.34 H new ATOM 0 HB3 HIS B 67 -7.603 -2.787 -10.290 1.00 42.34 H new ATOM 0 HD1 HIS B 67 -7.581 -5.205 -11.048 1.00 54.24 H new ATOM 0 HD2 HIS B 67 -6.784 -2.498 -14.115 1.00 33.43 H new ATOM 0 HE1 HIS B 67 -6.689 -6.567 -12.988 1.00 32.41 H new ATOM 2567 N GLU B 68 -10.126 -1.495 -9.238 1.00 71.33 N ATOM 2568 CA GLU B 68 -10.420 -0.613 -8.131 1.00 34.20 C ATOM 2569 C GLU B 68 -9.143 -0.274 -7.392 1.00 14.32 C ATOM 2570 O GLU B 68 -8.232 -1.111 -7.315 1.00 41.41 O ATOM 2571 CB GLU B 68 -11.484 -1.194 -7.191 1.00 20.14 C ATOM 2572 CG GLU B 68 -12.836 -1.440 -7.866 1.00 14.52 C ATOM 2573 CD GLU B 68 -13.405 -0.189 -8.524 1.00 44.12 C ATOM 2574 OE1 GLU B 68 -13.195 -0.001 -9.734 1.00 23.15 O ATOM 2575 OE2 GLU B 68 -14.050 0.630 -7.843 1.00 54.40 O ATOM 0 H GLU B 68 -10.387 -2.471 -9.095 1.00 71.33 H new ATOM 0 HA GLU B 68 -10.845 0.306 -8.534 1.00 34.20 H new ATOM 0 HB2 GLU B 68 -11.117 -2.134 -6.779 1.00 20.14 H new ATOM 0 HB3 GLU B 68 -11.626 -0.513 -6.352 1.00 20.14 H new ATOM 0 HG2 GLU B 68 -12.725 -2.221 -8.618 1.00 14.52 H new ATOM 0 HG3 GLU B 68 -13.545 -1.809 -7.125 1.00 14.52 H new ATOM 2582 N ARG B 69 -9.066 0.946 -6.859 1.00 2.33 N ATOM 2583 CA ARG B 69 -7.873 1.415 -6.172 1.00 50.24 C ATOM 2584 C ARG B 69 -7.546 0.485 -5.016 1.00 13.44 C ATOM 2585 O ARG B 69 -6.386 0.156 -4.779 1.00 3.50 O ATOM 2586 CB ARG B 69 -8.004 2.865 -5.615 1.00 33.23 C ATOM 2587 CG ARG B 69 -8.232 4.055 -6.598 1.00 11.42 C ATOM 2588 CD ARG B 69 -9.653 4.161 -7.195 1.00 71.52 C ATOM 2589 NE ARG B 69 -9.926 3.236 -8.301 1.00 63.52 N ATOM 2590 CZ ARG B 69 -11.105 2.637 -8.542 1.00 72.24 C ATOM 2591 NH1 ARG B 69 -12.102 2.714 -7.660 1.00 31.51 N ATOM 2592 NH2 ARG B 69 -11.256 1.921 -9.639 1.00 73.35 N ATOM 0 H ARG B 69 -9.824 1.628 -6.893 1.00 2.33 H new ATOM 0 HA ARG B 69 -7.078 1.420 -6.917 1.00 50.24 H new ATOM 0 HB2 ARG B 69 -8.831 2.867 -4.905 1.00 33.23 H new ATOM 0 HB3 ARG B 69 -7.097 3.079 -5.050 1.00 33.23 H new ATOM 0 HG2 ARG B 69 -8.006 4.984 -6.075 1.00 11.42 H new ATOM 0 HG3 ARG B 69 -7.518 3.969 -7.417 1.00 11.42 H new ATOM 0 HD2 ARG B 69 -10.379 3.982 -6.402 1.00 71.52 H new ATOM 0 HD3 ARG B 69 -9.809 5.181 -7.546 1.00 71.52 H new ATOM 0 HE ARG B 69 -9.158 3.031 -8.940 1.00 63.52 H new ATOM 0 HH11 ARG B 69 -11.975 3.232 -6.791 1.00 31.51 H new ATOM 0 HH12 ARG B 69 -12.992 2.255 -7.855 1.00 31.51 H new ATOM 0 HH21 ARG B 69 -10.482 1.825 -10.296 1.00 73.35 H new ATOM 0 HH22 ARG B 69 -12.147 1.463 -9.830 1.00 73.35 H new ATOM 2606 N ASP B 70 -8.596 0.049 -4.327 1.00 22.21 N ATOM 2607 CA ASP B 70 -8.483 -0.851 -3.170 1.00 32.24 C ATOM 2608 C ASP B 70 -7.852 -2.165 -3.595 1.00 3.31 C ATOM 2609 O ASP B 70 -6.915 -2.653 -2.966 1.00 41.23 O ATOM 2610 CB ASP B 70 -9.869 -1.152 -2.575 1.00 51.25 C ATOM 2611 CG ASP B 70 -10.665 0.079 -2.232 1.00 65.23 C ATOM 2612 OD1 ASP B 70 -11.640 0.385 -2.962 1.00 54.45 O ATOM 2613 OD2 ASP B 70 -10.334 0.773 -1.261 1.00 45.10 O ATOM 0 H ASP B 70 -9.557 0.308 -4.552 1.00 22.21 H new ATOM 0 HA ASP B 70 -7.864 -0.357 -2.421 1.00 32.24 H new ATOM 0 HB2 ASP B 70 -10.436 -1.753 -3.286 1.00 51.25 H new ATOM 0 HB3 ASP B 70 -9.744 -1.755 -1.675 1.00 51.25 H new ATOM 2618 N GLU B 71 -8.363 -2.701 -4.701 1.00 12.12 N ATOM 2619 CA GLU B 71 -7.934 -3.978 -5.264 1.00 21.30 C ATOM 2620 C GLU B 71 -6.431 -3.976 -5.533 1.00 11.34 C ATOM 2621 O GLU B 71 -5.714 -4.933 -5.193 1.00 15.54 O ATOM 2622 CB GLU B 71 -8.689 -4.230 -6.573 1.00 53.01 C ATOM 2623 CG GLU B 71 -8.355 -5.545 -7.246 1.00 70.11 C ATOM 2624 CD GLU B 71 -9.026 -5.704 -8.590 1.00 2.33 C ATOM 2625 OE1 GLU B 71 -10.171 -6.180 -8.637 1.00 34.43 O ATOM 2626 OE2 GLU B 71 -8.411 -5.348 -9.621 1.00 31.22 O ATOM 0 H GLU B 71 -9.102 -2.250 -5.241 1.00 12.12 H new ATOM 0 HA GLU B 71 -8.154 -4.769 -4.547 1.00 21.30 H new ATOM 0 HB2 GLU B 71 -9.760 -4.201 -6.372 1.00 53.01 H new ATOM 0 HB3 GLU B 71 -8.472 -3.416 -7.265 1.00 53.01 H new ATOM 0 HG2 GLU B 71 -7.275 -5.618 -7.374 1.00 70.11 H new ATOM 0 HG3 GLU B 71 -8.655 -6.367 -6.596 1.00 70.11 H new ATOM 2633 N ILE B 72 -5.962 -2.900 -6.133 1.00 33.31 N ATOM 2634 CA ILE B 72 -4.561 -2.763 -6.463 1.00 73.20 C ATOM 2635 C ILE B 72 -3.744 -2.547 -5.193 1.00 62.04 C ATOM 2636 O ILE B 72 -2.692 -3.152 -5.014 1.00 4.05 O ATOM 2637 CB ILE B 72 -4.316 -1.571 -7.429 1.00 5.34 C ATOM 2638 CG1 ILE B 72 -5.154 -1.721 -8.705 1.00 71.32 C ATOM 2639 CG2 ILE B 72 -2.829 -1.467 -7.784 1.00 73.04 C ATOM 2640 CD1 ILE B 72 -5.004 -0.560 -9.675 1.00 31.54 C ATOM 0 H ILE B 72 -6.538 -2.103 -6.403 1.00 33.31 H new ATOM 0 HA ILE B 72 -4.250 -3.682 -6.959 1.00 73.20 H new ATOM 0 HB ILE B 72 -4.622 -0.656 -6.922 1.00 5.34 H new ATOM 0 HG12 ILE B 72 -4.869 -2.644 -9.210 1.00 71.32 H new ATOM 0 HG13 ILE B 72 -6.204 -1.820 -8.430 1.00 71.32 H new ATOM 0 HG21 ILE B 72 -2.675 -0.627 -8.461 1.00 73.04 H new ATOM 0 HG22 ILE B 72 -2.248 -1.312 -6.875 1.00 73.04 H new ATOM 0 HG23 ILE B 72 -2.505 -2.388 -8.269 1.00 73.04 H new ATOM 0 HD11 ILE B 72 -5.626 -0.737 -10.553 1.00 31.54 H new ATOM 0 HD12 ILE B 72 -5.317 0.364 -9.188 1.00 31.54 H new ATOM 0 HD13 ILE B 72 -3.961 -0.473 -9.980 1.00 31.54 H new ATOM 2652 N MET B 73 -4.255 -1.704 -4.308 1.00 31.12 N ATOM 2653 CA MET B 73 -3.556 -1.329 -3.088 1.00 51.44 C ATOM 2654 C MET B 73 -3.317 -2.564 -2.198 1.00 72.03 C ATOM 2655 O MET B 73 -2.209 -2.758 -1.679 1.00 45.34 O ATOM 2656 CB MET B 73 -4.347 -0.231 -2.345 1.00 43.43 C ATOM 2657 CG MET B 73 -3.562 0.557 -1.291 1.00 0.33 C ATOM 2658 SD MET B 73 -2.962 -0.420 0.088 1.00 41.52 S ATOM 2659 CE MET B 73 -2.131 0.833 1.027 1.00 53.43 C ATOM 0 H MET B 73 -5.167 -1.260 -4.416 1.00 31.12 H new ATOM 0 HA MET B 73 -2.578 -0.923 -3.345 1.00 51.44 H new ATOM 0 HB2 MET B 73 -4.736 0.472 -3.082 1.00 43.43 H new ATOM 0 HB3 MET B 73 -5.207 -0.694 -1.860 1.00 43.43 H new ATOM 0 HG2 MET B 73 -2.711 1.036 -1.775 1.00 0.33 H new ATOM 0 HG3 MET B 73 -4.199 1.353 -0.904 1.00 0.33 H new ATOM 0 HE1 MET B 73 -2.347 0.697 2.087 1.00 53.43 H new ATOM 0 HE2 MET B 73 -1.056 0.757 0.864 1.00 53.43 H new ATOM 0 HE3 MET B 73 -2.478 1.816 0.709 1.00 53.43 H new ATOM 2669 N GLU B 74 -4.335 -3.413 -2.044 1.00 63.42 N ATOM 2670 CA GLU B 74 -4.168 -4.636 -1.254 1.00 20.33 C ATOM 2671 C GLU B 74 -3.142 -5.547 -1.890 1.00 74.04 C ATOM 2672 O GLU B 74 -2.365 -6.206 -1.194 1.00 30.30 O ATOM 2673 CB GLU B 74 -5.469 -5.407 -1.086 1.00 23.04 C ATOM 2674 CG GLU B 74 -6.561 -4.660 -0.375 1.00 43.01 C ATOM 2675 CD GLU B 74 -7.739 -5.547 -0.108 1.00 44.43 C ATOM 2676 OE1 GLU B 74 -8.534 -5.798 -1.034 1.00 15.44 O ATOM 2677 OE2 GLU B 74 -7.876 -6.029 1.027 1.00 1.21 O ATOM 0 H GLU B 74 -5.264 -3.282 -2.445 1.00 63.42 H new ATOM 0 HA GLU B 74 -3.831 -4.317 -0.268 1.00 20.33 H new ATOM 0 HB2 GLU B 74 -5.831 -5.699 -2.072 1.00 23.04 H new ATOM 0 HB3 GLU B 74 -5.261 -6.326 -0.538 1.00 23.04 H new ATOM 0 HG2 GLU B 74 -6.181 -4.263 0.566 1.00 43.01 H new ATOM 0 HG3 GLU B 74 -6.874 -3.807 -0.977 1.00 43.01 H new ATOM 2684 N GLU B 75 -3.128 -5.568 -3.214 1.00 14.13 N ATOM 2685 CA GLU B 75 -2.199 -6.394 -3.954 1.00 34.31 C ATOM 2686 C GLU B 75 -0.780 -5.880 -3.696 1.00 2.34 C ATOM 2687 O GLU B 75 0.146 -6.661 -3.487 1.00 74.43 O ATOM 2688 CB GLU B 75 -2.522 -6.336 -5.450 1.00 70.21 C ATOM 2689 CG GLU B 75 -1.843 -7.410 -6.283 1.00 52.15 C ATOM 2690 CD GLU B 75 -2.308 -8.799 -5.894 1.00 73.40 C ATOM 2691 OE1 GLU B 75 -3.450 -9.165 -6.247 1.00 3.23 O ATOM 2692 OE2 GLU B 75 -1.551 -9.536 -5.248 1.00 63.20 O ATOM 0 H GLU B 75 -3.757 -5.016 -3.798 1.00 14.13 H new ATOM 0 HA GLU B 75 -2.280 -7.431 -3.628 1.00 34.31 H new ATOM 0 HB2 GLU B 75 -3.601 -6.421 -5.579 1.00 70.21 H new ATOM 0 HB3 GLU B 75 -2.231 -5.358 -5.834 1.00 70.21 H new ATOM 0 HG2 GLU B 75 -2.053 -7.238 -7.339 1.00 52.15 H new ATOM 0 HG3 GLU B 75 -0.763 -7.339 -6.157 1.00 52.15 H new ATOM 2699 N LEU B 76 -0.640 -4.544 -3.682 1.00 4.34 N ATOM 2700 CA LEU B 76 0.638 -3.892 -3.398 1.00 44.00 C ATOM 2701 C LEU B 76 1.104 -4.269 -2.008 1.00 52.05 C ATOM 2702 O LEU B 76 2.251 -4.688 -1.821 1.00 54.24 O ATOM 2703 CB LEU B 76 0.515 -2.355 -3.459 1.00 13.41 C ATOM 2704 CG LEU B 76 0.044 -1.725 -4.769 1.00 51.34 C ATOM 2705 CD1 LEU B 76 -0.004 -0.218 -4.632 1.00 22.22 C ATOM 2706 CD2 LEU B 76 0.945 -2.110 -5.915 1.00 62.50 C ATOM 0 H LEU B 76 -1.405 -3.895 -3.866 1.00 4.34 H new ATOM 0 HA LEU B 76 1.350 -4.224 -4.153 1.00 44.00 H new ATOM 0 HB2 LEU B 76 -0.172 -2.043 -2.672 1.00 13.41 H new ATOM 0 HB3 LEU B 76 1.490 -1.932 -3.216 1.00 13.41 H new ATOM 0 HG LEU B 76 -0.957 -2.100 -4.984 1.00 51.34 H new ATOM 0 HD11 LEU B 76 -0.341 0.222 -5.571 1.00 22.22 H new ATOM 0 HD12 LEU B 76 -0.696 0.053 -3.835 1.00 22.22 H new ATOM 0 HD13 LEU B 76 0.991 0.157 -4.392 1.00 22.22 H new ATOM 0 HD21 LEU B 76 0.584 -1.647 -6.833 1.00 62.50 H new ATOM 0 HD22 LEU B 76 1.960 -1.768 -5.711 1.00 62.50 H new ATOM 0 HD23 LEU B 76 0.943 -3.194 -6.031 1.00 62.50 H new ATOM 2718 N THR B 77 0.199 -4.133 -1.037 1.00 24.12 N ATOM 2719 CA THR B 77 0.505 -4.430 0.329 1.00 55.21 C ATOM 2720 C THR B 77 0.936 -5.898 0.509 1.00 5.02 C ATOM 2721 O THR B 77 1.950 -6.171 1.147 1.00 71.34 O ATOM 2722 CB THR B 77 -0.696 -4.089 1.238 1.00 45.12 C ATOM 2723 OG1 THR B 77 -1.057 -2.715 1.028 1.00 44.32 O ATOM 2724 CG2 THR B 77 -0.338 -4.277 2.707 1.00 71.21 C ATOM 0 H THR B 77 -0.757 -3.814 -1.193 1.00 24.12 H new ATOM 0 HA THR B 77 1.350 -3.808 0.625 1.00 55.21 H new ATOM 0 HB THR B 77 -1.523 -4.754 0.989 1.00 45.12 H new ATOM 0 HG1 THR B 77 -1.583 -2.637 0.205 1.00 44.32 H new ATOM 0 HG21 THR B 77 -1.201 -4.030 3.326 1.00 71.21 H new ATOM 0 HG22 THR B 77 -0.050 -5.314 2.882 1.00 71.21 H new ATOM 0 HG23 THR B 77 0.494 -3.621 2.966 1.00 71.21 H new ATOM 2732 N LYS B 78 0.197 -6.835 -0.086 1.00 33.51 N ATOM 2733 CA LYS B 78 0.547 -8.246 0.058 1.00 53.21 C ATOM 2734 C LYS B 78 1.861 -8.569 -0.602 1.00 25.24 C ATOM 2735 O LYS B 78 2.703 -9.219 -0.013 1.00 3.32 O ATOM 2736 CB LYS B 78 -0.531 -9.191 -0.471 1.00 40.41 C ATOM 2737 CG LYS B 78 -1.850 -9.083 0.247 1.00 54.22 C ATOM 2738 CD LYS B 78 -2.831 -10.185 -0.169 1.00 31.12 C ATOM 2739 CE LYS B 78 -3.090 -10.217 -1.670 1.00 64.31 C ATOM 2740 NZ LYS B 78 -4.031 -11.305 -2.033 1.00 71.12 N ATOM 0 H LYS B 78 -0.627 -6.649 -0.658 1.00 33.51 H new ATOM 0 HA LYS B 78 0.635 -8.408 1.132 1.00 53.21 H new ATOM 0 HB2 LYS B 78 -0.689 -8.988 -1.530 1.00 40.41 H new ATOM 0 HB3 LYS B 78 -0.170 -10.217 -0.393 1.00 40.41 H new ATOM 0 HG2 LYS B 78 -1.681 -9.137 1.322 1.00 54.22 H new ATOM 0 HG3 LYS B 78 -2.294 -8.109 0.043 1.00 54.22 H new ATOM 0 HD2 LYS B 78 -2.438 -11.151 0.147 1.00 31.12 H new ATOM 0 HD3 LYS B 78 -3.776 -10.039 0.354 1.00 31.12 H new ATOM 0 HE2 LYS B 78 -3.498 -9.259 -1.991 1.00 64.31 H new ATOM 0 HE3 LYS B 78 -2.148 -10.356 -2.201 1.00 64.31 H new ATOM 0 HZ1 LYS B 78 -4.161 -11.322 -3.065 1.00 71.12 H new ATOM 0 HZ2 LYS B 78 -3.645 -12.218 -1.717 1.00 71.12 H new ATOM 0 HZ3 LYS B 78 -4.948 -11.139 -1.572 1.00 71.12 H new ATOM 2754 N TYR B 79 2.034 -8.091 -1.807 1.00 11.14 N ATOM 2755 CA TYR B 79 3.226 -8.386 -2.593 1.00 25.22 C ATOM 2756 C TYR B 79 4.486 -7.846 -1.919 1.00 73.03 C ATOM 2757 O TYR B 79 5.554 -8.479 -1.973 1.00 64.04 O ATOM 2758 CB TYR B 79 3.069 -7.816 -4.000 1.00 65.33 C ATOM 2759 CG TYR B 79 4.178 -8.159 -4.968 1.00 42.34 C ATOM 2760 CD1 TYR B 79 4.092 -9.292 -5.755 1.00 61.45 C ATOM 2761 CD2 TYR B 79 5.293 -7.343 -5.110 1.00 40.41 C ATOM 2762 CE1 TYR B 79 5.080 -9.608 -6.657 1.00 12.12 C ATOM 2763 CE2 TYR B 79 6.291 -7.653 -6.010 1.00 53.31 C ATOM 2764 CZ TYR B 79 6.177 -8.788 -6.782 1.00 63.11 C ATOM 2765 OH TYR B 79 7.161 -9.108 -7.689 1.00 63.23 O ATOM 0 H TYR B 79 1.361 -7.487 -2.279 1.00 11.14 H new ATOM 0 HA TYR B 79 3.337 -9.468 -2.661 1.00 25.22 H new ATOM 0 HB2 TYR B 79 2.126 -8.172 -4.414 1.00 65.33 H new ATOM 0 HB3 TYR B 79 2.996 -6.731 -3.928 1.00 65.33 H new ATOM 0 HD1 TYR B 79 3.234 -9.940 -5.660 1.00 61.45 H new ATOM 0 HD2 TYR B 79 5.380 -6.452 -4.506 1.00 40.41 H new ATOM 0 HE1 TYR B 79 4.995 -10.497 -7.265 1.00 12.12 H new ATOM 0 HE2 TYR B 79 7.154 -7.012 -6.109 1.00 53.31 H new ATOM 0 HH TYR B 79 7.584 -8.287 -8.016 1.00 63.23 H new ATOM 2775 N TYR B 80 4.345 -6.696 -1.273 1.00 71.24 N ATOM 2776 CA TYR B 80 5.439 -6.048 -0.577 1.00 52.13 C ATOM 2777 C TYR B 80 6.018 -6.999 0.472 1.00 1.22 C ATOM 2778 O TYR B 80 7.223 -7.236 0.512 1.00 12.51 O ATOM 2779 CB TYR B 80 4.934 -4.760 0.082 1.00 34.35 C ATOM 2780 CG TYR B 80 6.009 -3.870 0.673 1.00 30.21 C ATOM 2781 CD1 TYR B 80 6.686 -2.972 -0.132 1.00 64.01 C ATOM 2782 CD2 TYR B 80 6.331 -3.907 2.027 1.00 3.11 C ATOM 2783 CE1 TYR B 80 7.651 -2.136 0.378 1.00 13.33 C ATOM 2784 CE2 TYR B 80 7.304 -3.070 2.547 1.00 74.21 C ATOM 2785 CZ TYR B 80 7.958 -2.186 1.712 1.00 70.32 C ATOM 2786 OH TYR B 80 8.922 -1.344 2.218 1.00 21.23 O ATOM 0 H TYR B 80 3.463 -6.187 -1.219 1.00 71.24 H new ATOM 0 HA TYR B 80 6.227 -5.793 -1.286 1.00 52.13 H new ATOM 0 HB2 TYR B 80 4.378 -4.186 -0.659 1.00 34.35 H new ATOM 0 HB3 TYR B 80 4.232 -5.027 0.872 1.00 34.35 H new ATOM 0 HD1 TYR B 80 6.451 -2.926 -1.185 1.00 64.01 H new ATOM 0 HD2 TYR B 80 5.816 -4.597 2.679 1.00 3.11 H new ATOM 0 HE1 TYR B 80 8.165 -1.442 -0.271 1.00 13.33 H new ATOM 0 HE2 TYR B 80 7.549 -3.108 3.598 1.00 74.21 H new ATOM 0 HH TYR B 80 8.573 -0.886 3.011 1.00 21.23 H new ATOM 2796 N LEU B 81 5.154 -7.532 1.318 1.00 71.14 N ATOM 2797 CA LEU B 81 5.565 -8.480 2.312 1.00 61.25 C ATOM 2798 C LEU B 81 5.868 -9.862 1.713 1.00 41.10 C ATOM 2799 O LEU B 81 6.706 -10.598 2.242 1.00 12.11 O ATOM 2800 CB LEU B 81 4.542 -8.597 3.447 1.00 23.51 C ATOM 2801 CG LEU B 81 4.332 -7.378 4.374 1.00 21.04 C ATOM 2802 CD1 LEU B 81 5.626 -6.903 5.012 1.00 62.00 C ATOM 2803 CD2 LEU B 81 3.595 -6.238 3.705 1.00 11.00 C ATOM 0 H LEU B 81 4.157 -7.315 1.328 1.00 71.14 H new ATOM 0 HA LEU B 81 6.494 -8.094 2.732 1.00 61.25 H new ATOM 0 HB2 LEU B 81 3.579 -8.846 3.002 1.00 23.51 H new ATOM 0 HB3 LEU B 81 4.833 -9.442 4.071 1.00 23.51 H new ATOM 0 HG LEU B 81 3.686 -7.736 5.176 1.00 21.04 H new ATOM 0 HD11 LEU B 81 5.422 -6.045 5.653 1.00 62.00 H new ATOM 0 HD12 LEU B 81 6.054 -7.708 5.609 1.00 62.00 H new ATOM 0 HD13 LEU B 81 6.331 -6.614 4.233 1.00 62.00 H new ATOM 0 HD21 LEU B 81 3.481 -5.415 4.410 1.00 11.00 H new ATOM 0 HD22 LEU B 81 4.161 -5.897 2.838 1.00 11.00 H new ATOM 0 HD23 LEU B 81 2.611 -6.580 3.384 1.00 11.00 H new ATOM 2815 N ALA B 82 5.214 -10.197 0.603 1.00 53.34 N ATOM 2816 CA ALA B 82 5.342 -11.527 0.020 1.00 32.12 C ATOM 2817 C ALA B 82 6.732 -11.811 -0.493 1.00 72.25 C ATOM 2818 O ALA B 82 7.325 -12.843 -0.163 1.00 34.02 O ATOM 2819 CB ALA B 82 4.315 -11.760 -1.067 1.00 25.24 C ATOM 0 H ALA B 82 4.594 -9.568 0.093 1.00 53.34 H new ATOM 0 HA ALA B 82 5.151 -12.230 0.831 1.00 32.12 H new ATOM 0 HB1 ALA B 82 4.441 -12.762 -1.478 1.00 25.24 H new ATOM 0 HB2 ALA B 82 3.313 -11.663 -0.648 1.00 25.24 H new ATOM 0 HB3 ALA B 82 4.450 -11.023 -1.859 1.00 25.24 H new ATOM 2825 N ASN B 83 7.287 -10.903 -1.255 1.00 12.23 N ATOM 2826 CA ASN B 83 8.630 -11.102 -1.769 1.00 11.25 C ATOM 2827 C ASN B 83 9.660 -10.735 -0.722 1.00 63.44 C ATOM 2828 O ASN B 83 10.872 -10.884 -0.922 1.00 74.10 O ATOM 2829 CB ASN B 83 8.849 -10.337 -3.062 1.00 10.12 C ATOM 2830 CG ASN B 83 7.944 -10.798 -4.192 1.00 2.44 C ATOM 2831 OD1 ASN B 83 6.812 -11.240 -3.980 1.00 24.54 O ATOM 2832 ND2 ASN B 83 8.430 -10.730 -5.383 1.00 43.32 N ATOM 0 H ASN B 83 6.842 -10.028 -1.534 1.00 12.23 H new ATOM 0 HA ASN B 83 8.750 -12.160 -2.001 1.00 11.25 H new ATOM 0 HB2 ASN B 83 8.681 -9.275 -2.881 1.00 10.12 H new ATOM 0 HB3 ASN B 83 9.889 -10.447 -3.370 1.00 10.12 H new ATOM 0 HD21 ASN B 83 7.876 -11.046 -6.179 1.00 43.32 H new ATOM 0 HD22 ASN B 83 9.369 -10.360 -5.530 1.00 43.32 H new ATOM 2839 N HIS B 84 9.162 -10.280 0.408 1.00 32.34 N ATOM 2840 CA HIS B 84 9.968 -9.944 1.558 1.00 72.12 C ATOM 2841 C HIS B 84 10.149 -11.224 2.409 1.00 73.54 C ATOM 2842 O HIS B 84 10.799 -11.217 3.445 1.00 2.03 O ATOM 2843 CB HIS B 84 9.256 -8.816 2.347 1.00 42.21 C ATOM 2844 CG HIS B 84 9.990 -8.229 3.521 1.00 34.32 C ATOM 2845 ND1 HIS B 84 10.780 -7.116 3.425 1.00 55.14 N ATOM 2846 CD2 HIS B 84 10.004 -8.577 4.825 1.00 62.32 C ATOM 2847 CE1 HIS B 84 11.247 -6.802 4.608 1.00 63.23 C ATOM 2848 NE2 HIS B 84 10.788 -7.674 5.472 1.00 74.42 N ATOM 0 H HIS B 84 8.164 -10.131 0.554 1.00 32.34 H new ATOM 0 HA HIS B 84 10.955 -9.580 1.270 1.00 72.12 H new ATOM 0 HB2 HIS B 84 9.030 -8.008 1.651 1.00 42.21 H new ATOM 0 HB3 HIS B 84 8.302 -9.204 2.705 1.00 42.21 H new ATOM 0 HD2 HIS B 84 9.489 -9.415 5.271 1.00 62.32 H new ATOM 0 HE1 HIS B 84 11.897 -5.969 4.832 1.00 63.23 H new ATOM 0 HE2 HIS B 84 10.987 -7.675 6.472 1.00 74.42 H new ATOM 2857 N GLY B 85 9.555 -12.319 1.939 1.00 1.21 N ATOM 2858 CA GLY B 85 9.701 -13.600 2.600 1.00 62.51 C ATOM 2859 C GLY B 85 8.483 -14.009 3.400 1.00 13.22 C ATOM 2860 O GLY B 85 8.498 -15.038 4.076 1.00 3.20 O ATOM 0 H GLY B 85 8.970 -12.338 1.104 1.00 1.21 H new ATOM 0 HA2 GLY B 85 9.908 -14.365 1.851 1.00 62.51 H new ATOM 0 HA3 GLY B 85 10.565 -13.561 3.263 1.00 62.51 H new ATOM 2864 N ILE B 86 7.439 -13.217 3.339 1.00 11.43 N ATOM 2865 CA ILE B 86 6.213 -13.514 4.057 1.00 1.25 C ATOM 2866 C ILE B 86 5.183 -14.097 3.092 1.00 73.32 C ATOM 2867 O ILE B 86 5.099 -13.670 1.956 1.00 45.35 O ATOM 2868 CB ILE B 86 5.656 -12.236 4.748 1.00 63.32 C ATOM 2869 CG1 ILE B 86 6.663 -11.722 5.799 1.00 33.44 C ATOM 2870 CG2 ILE B 86 4.289 -12.491 5.371 1.00 3.30 C ATOM 2871 CD1 ILE B 86 6.228 -10.468 6.528 1.00 44.43 C ATOM 0 H ILE B 86 7.410 -12.354 2.796 1.00 11.43 H new ATOM 0 HA ILE B 86 6.427 -14.248 4.834 1.00 1.25 H new ATOM 0 HB ILE B 86 5.523 -11.465 3.989 1.00 63.32 H new ATOM 0 HG12 ILE B 86 6.838 -12.510 6.531 1.00 33.44 H new ATOM 0 HG13 ILE B 86 7.616 -11.528 5.306 1.00 33.44 H new ATOM 0 HG21 ILE B 86 3.929 -11.578 5.845 1.00 3.30 H new ATOM 0 HG22 ILE B 86 3.587 -12.798 4.595 1.00 3.30 H new ATOM 0 HG23 ILE B 86 4.371 -13.280 6.119 1.00 3.30 H new ATOM 0 HD11 ILE B 86 6.996 -10.180 7.246 1.00 44.43 H new ATOM 0 HD12 ILE B 86 6.082 -9.661 5.809 1.00 44.43 H new ATOM 0 HD13 ILE B 86 5.293 -10.659 7.054 1.00 44.43 H new ATOM 2883 N ASP B 87 4.438 -15.079 3.516 1.00 2.45 N ATOM 2884 CA ASP B 87 3.411 -15.642 2.659 1.00 73.34 C ATOM 2885 C ASP B 87 2.041 -15.128 3.074 1.00 51.23 C ATOM 2886 O ASP B 87 1.601 -15.353 4.203 1.00 43.03 O ATOM 2887 CB ASP B 87 3.443 -17.164 2.683 1.00 13.12 C ATOM 2888 CG ASP B 87 2.406 -17.768 1.771 1.00 2.35 C ATOM 2889 OD1 ASP B 87 1.367 -18.262 2.262 1.00 71.21 O ATOM 2890 OD2 ASP B 87 2.607 -17.748 0.542 1.00 65.12 O ATOM 0 H ASP B 87 4.514 -15.508 4.438 1.00 2.45 H new ATOM 0 HA ASP B 87 3.611 -15.323 1.636 1.00 73.34 H new ATOM 0 HB2 ASP B 87 4.433 -17.510 2.385 1.00 13.12 H new ATOM 0 HB3 ASP B 87 3.277 -17.514 3.702 1.00 13.12 H new ATOM 2895 N ILE B 88 1.370 -14.447 2.168 1.00 11.45 N ATOM 2896 CA ILE B 88 0.065 -13.857 2.453 1.00 21.11 C ATOM 2897 C ILE B 88 -0.964 -14.454 1.493 1.00 15.10 C ATOM 2898 O ILE B 88 -0.615 -14.842 0.372 1.00 22.52 O ATOM 2899 CB ILE B 88 0.083 -12.311 2.276 1.00 34.32 C ATOM 2900 CG1 ILE B 88 1.228 -11.692 3.060 1.00 3.32 C ATOM 2901 CG2 ILE B 88 -1.232 -11.713 2.771 1.00 3.10 C ATOM 2902 CD1 ILE B 88 1.361 -10.212 2.836 1.00 55.21 C ATOM 0 H ILE B 88 1.705 -14.284 1.218 1.00 11.45 H new ATOM 0 HA ILE B 88 -0.192 -14.077 3.489 1.00 21.11 H new ATOM 0 HB ILE B 88 0.215 -12.095 1.216 1.00 34.32 H new ATOM 0 HG12 ILE B 88 1.077 -11.881 4.123 1.00 3.32 H new ATOM 0 HG13 ILE B 88 2.160 -12.182 2.778 1.00 3.32 H new ATOM 0 HG21 ILE B 88 -1.210 -10.631 2.643 1.00 3.10 H new ATOM 0 HG22 ILE B 88 -2.060 -12.130 2.197 1.00 3.10 H new ATOM 0 HG23 ILE B 88 -1.366 -11.951 3.826 1.00 3.10 H new ATOM 0 HD11 ILE B 88 2.196 -9.829 3.423 1.00 55.21 H new ATOM 0 HD12 ILE B 88 1.542 -10.019 1.779 1.00 55.21 H new ATOM 0 HD13 ILE B 88 0.442 -9.713 3.144 1.00 55.21 H new ATOM 2914 N LYS B 89 -2.200 -14.555 1.923 1.00 14.31 N ATOM 2915 CA LYS B 89 -3.244 -15.145 1.111 1.00 22.03 C ATOM 2916 C LYS B 89 -4.027 -14.060 0.357 1.00 62.13 C ATOM 2917 O LYS B 89 -5.116 -13.660 0.822 1.00 39.17 O ATOM 2918 CB LYS B 89 -4.199 -16.021 1.971 1.00 42.33 C ATOM 2919 CG LYS B 89 -3.569 -17.286 2.606 1.00 3.23 C ATOM 2920 CD LYS B 89 -2.458 -16.968 3.606 1.00 74.34 C ATOM 2921 CE LYS B 89 -1.820 -18.223 4.162 1.00 32.13 C ATOM 2922 NZ LYS B 89 -2.770 -19.039 4.949 1.00 51.53 N ATOM 2923 OXT LYS B 89 -3.535 -13.582 -0.693 1.00 39.17 O ATOM 0 H LYS B 89 -2.511 -14.233 2.840 1.00 14.31 H new ATOM 0 HA LYS B 89 -2.769 -15.795 0.376 1.00 22.03 H new ATOM 0 HB2 LYS B 89 -4.608 -15.402 2.770 1.00 42.33 H new ATOM 0 HB3 LYS B 89 -5.037 -16.330 1.347 1.00 42.33 H new ATOM 0 HG2 LYS B 89 -4.348 -17.859 3.109 1.00 3.23 H new ATOM 0 HG3 LYS B 89 -3.167 -17.920 1.816 1.00 3.23 H new ATOM 0 HD2 LYS B 89 -1.696 -16.359 3.120 1.00 74.34 H new ATOM 0 HD3 LYS B 89 -2.866 -16.375 4.425 1.00 74.34 H new ATOM 0 HE2 LYS B 89 -1.426 -18.821 3.340 1.00 32.13 H new ATOM 0 HE3 LYS B 89 -0.973 -17.948 4.791 1.00 32.13 H new ATOM 0 HZ1 LYS B 89 -2.257 -19.812 5.419 1.00 51.53 H new ATOM 0 HZ2 LYS B 89 -3.229 -18.442 5.666 1.00 51.53 H new ATOM 0 HZ3 LYS B 89 -3.493 -19.438 4.316 1.00 51.53 H new TER 2937 LYS B 89