USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1118 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 135 ASN : amide:sc= -0.186 X(o=-0.14,f=0.21) USER MOD Set 1.2: A 136 THR OG1 : rot 180:sc= 0.0455 USER MOD Set 2.1: A 92 THR OG1 : rot 97:sc= 0.443 USER MOD Set 2.2: A 116 MET CE :methyl -175:sc= -0.012 (180deg=-0.0558) USER MOD Set 2.3: A 120 LYS NZ :NH3+ -178:sc= -0.347 (180deg=-0.368) USER MOD Set 3.1: A 81 MET CE :methyl 146:sc= -3.15! (180deg=-3.78!) USER MOD Set 3.2: A 130 THR OG1 : rot -83:sc= 1.24 USER MOD Set 4.1: A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 3 HIS : no HE2:sc= -0.184 K(o=-0.18,f=-1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0803 X(o=-0.08,f=-0.31) USER MOD Single : A 5 HIS : no HE2:sc= 0.715 K(o=0.71,f=-2.7!) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.174 X(o=-0.17,f=-0.009) USER MOD Single : A 8 HIS : no HD1:sc= -0.454 K(o=-0.45,f=-1.6) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 HIS : no HD1:sc= -0.0739 X(o=-0.074,f=-0.23) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.531 K(o=-0.53,f=-2.1) USER MOD Single : A 51 TYR OH : rot 30:sc= -0.51 USER MOD Single : A 55 ASN : amide:sc= -3.16 K(o=-3.2,f=-6.4!) USER MOD Single : A 60 CYS SG : rot 105:sc= 0.375 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot -65:sc= 0.612 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.00224 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -53:sc= 0.936 USER MOD Single : A 85 LYS NZ :NH3+ -133:sc= -0.0185 (180deg=-0.335) USER MOD Single : A 86 SER OG : rot 180:sc= -0.0034 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 157:sc= -0.0826 (180deg=-0.547) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot -60:sc= -0.577 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot -69:sc= 1.01 USER MOD Single : A 125 SER OG : rot 83:sc= 1.19 USER MOD Single : A 126 SER OG : rot 83:sc= 0.248 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 HIS : no HD1:sc= -0.173 X(o=-0.17,f=-0.54) USER MOD Single : A 138 HIS : no HD1:sc= -0.209 X(o=-0.21,f=-0.013) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.038 -0.374 -1.381 1.00 1.42 N ATOM 2 CA MET A 1 -0.003 -1.817 -1.176 1.00 71.01 C ATOM 3 C MET A 1 1.260 -2.422 -1.781 1.00 52.43 C ATOM 4 O MET A 1 1.312 -2.705 -2.978 1.00 34.14 O ATOM 5 CB MET A 1 -1.241 -2.471 -1.792 1.00 54.01 C ATOM 6 CG MET A 1 -1.698 -3.721 -1.057 1.00 10.41 C ATOM 7 SD MET A 1 -2.000 -5.109 -2.168 1.00 3.35 S ATOM 8 CE MET A 1 -3.778 -5.273 -2.029 1.00 22.13 C ATOM 0 H1 MET A 1 -0.906 0.015 -0.961 1.00 1.42 H new ATOM 0 H2 MET A 1 0.791 0.061 -0.928 1.00 1.42 H new ATOM 0 H3 MET A 1 -0.024 -0.168 -2.400 1.00 1.42 H new ATOM 0 HA MET A 1 0.003 -2.006 -0.103 1.00 71.01 H new ATOM 0 HB2 MET A 1 -2.056 -1.748 -1.803 1.00 54.01 H new ATOM 0 HB3 MET A 1 -1.028 -2.727 -2.830 1.00 54.01 H new ATOM 0 HG2 MET A 1 -0.942 -4.004 -0.325 1.00 10.41 H new ATOM 0 HG3 MET A 1 -2.610 -3.499 -0.503 1.00 10.41 H new ATOM 0 HE1 MET A 1 -4.118 -6.094 -2.661 1.00 22.13 H new ATOM 0 HE2 MET A 1 -4.044 -5.479 -0.992 1.00 22.13 H new ATOM 0 HE3 MET A 1 -4.255 -4.347 -2.349 1.00 22.13 H new ATOM 18 N ALA A 2 2.276 -2.616 -0.947 1.00 51.00 N ATOM 19 CA ALA A 2 3.538 -3.188 -1.400 1.00 74.21 C ATOM 20 C ALA A 2 4.220 -2.278 -2.416 1.00 74.32 C ATOM 21 O ALA A 2 4.250 -2.577 -3.610 1.00 71.55 O ATOM 22 CB ALA A 2 3.307 -4.569 -1.996 1.00 41.02 C ATOM 0 H ALA A 2 2.250 -2.385 0.046 1.00 51.00 H new ATOM 0 HA ALA A 2 4.197 -3.282 -0.537 1.00 74.21 H new ATOM 0 HB1 ALA A 2 4.258 -4.985 -2.330 1.00 41.02 H new ATOM 0 HB2 ALA A 2 2.871 -5.223 -1.241 1.00 41.02 H new ATOM 0 HB3 ALA A 2 2.627 -4.490 -2.844 1.00 41.02 H new ATOM 28 N HIS A 3 4.765 -1.166 -1.935 1.00 44.21 N ATOM 29 CA HIS A 3 5.447 -0.212 -2.802 1.00 43.25 C ATOM 30 C HIS A 3 6.789 0.203 -2.205 1.00 55.13 C ATOM 31 O HIS A 3 6.882 0.510 -1.016 1.00 40.03 O ATOM 32 CB HIS A 3 4.572 1.022 -3.027 1.00 21.24 C ATOM 33 CG HIS A 3 3.304 0.730 -3.769 1.00 24.11 C ATOM 34 ND1 HIS A 3 3.216 -0.224 -4.761 1.00 14.21 N ATOM 35 CD2 HIS A 3 2.069 1.271 -3.658 1.00 12.41 C ATOM 36 CE1 HIS A 3 1.981 -0.255 -5.229 1.00 72.12 C ATOM 37 NE2 HIS A 3 1.265 0.642 -4.576 1.00 54.42 N ATOM 0 H HIS A 3 4.748 -0.903 -0.950 1.00 44.21 H new ATOM 0 HA HIS A 3 5.630 -0.697 -3.761 1.00 43.25 H new ATOM 0 HB2 HIS A 3 4.325 1.463 -2.061 1.00 21.24 H new ATOM 0 HB3 HIS A 3 5.144 1.767 -3.580 1.00 21.24 H new ATOM 0 HD1 HIS A 3 3.984 -0.813 -5.083 1.00 14.21 H new ATOM 0 HD2 HIS A 3 1.771 2.052 -2.974 1.00 12.41 H new ATOM 0 HE1 HIS A 3 1.619 -0.904 -6.013 1.00 72.12 H new ATOM 45 N HIS A 4 7.825 0.209 -3.038 1.00 10.54 N ATOM 46 CA HIS A 4 9.161 0.586 -2.591 1.00 45.44 C ATOM 47 C HIS A 4 9.960 1.209 -3.733 1.00 31.02 C ATOM 48 O HIS A 4 10.791 0.547 -4.356 1.00 12.40 O ATOM 49 CB HIS A 4 9.902 -0.633 -2.042 1.00 34.32 C ATOM 50 CG HIS A 4 11.069 -0.284 -1.171 1.00 14.53 C ATOM 51 ND1 HIS A 4 11.356 1.007 -0.780 1.00 43.45 N ATOM 52 CD2 HIS A 4 12.022 -1.065 -0.612 1.00 62.12 C ATOM 53 CE1 HIS A 4 12.437 1.005 -0.021 1.00 63.11 C ATOM 54 NE2 HIS A 4 12.861 -0.241 0.097 1.00 53.41 N ATOM 0 H HIS A 4 7.765 -0.043 -4.025 1.00 10.54 H new ATOM 0 HA HIS A 4 9.056 1.326 -1.797 1.00 45.44 H new ATOM 0 HB2 HIS A 4 9.204 -1.245 -1.471 1.00 34.32 H new ATOM 0 HB3 HIS A 4 10.251 -1.241 -2.876 1.00 34.32 H new ATOM 0 HD2 HIS A 4 12.107 -2.138 -0.706 1.00 62.12 H new ATOM 0 HE1 HIS A 4 12.896 1.874 0.427 1.00 63.11 H new ATOM 0 HE2 HIS A 4 13.678 -0.542 0.628 1.00 53.41 H new ATOM 62 N HIS A 5 9.702 2.485 -4.002 1.00 73.23 N ATOM 63 CA HIS A 5 10.396 3.197 -5.069 1.00 63.42 C ATOM 64 C HIS A 5 10.561 4.673 -4.720 1.00 62.40 C ATOM 65 O HIS A 5 10.092 5.131 -3.677 1.00 65.43 O ATOM 66 CB HIS A 5 9.633 3.054 -6.387 1.00 5.33 C ATOM 67 CG HIS A 5 10.524 2.936 -7.585 1.00 3.31 C ATOM 68 ND1 HIS A 5 10.686 3.950 -8.505 1.00 51.23 N ATOM 69 CD2 HIS A 5 11.306 1.916 -8.010 1.00 54.01 C ATOM 70 CE1 HIS A 5 11.527 3.558 -9.446 1.00 13.12 C ATOM 71 NE2 HIS A 5 11.918 2.327 -9.168 1.00 52.44 N ATOM 0 H HIS A 5 9.018 3.047 -3.496 1.00 73.23 H new ATOM 0 HA HIS A 5 11.386 2.756 -5.182 1.00 63.42 H new ATOM 0 HB2 HIS A 5 8.992 2.174 -6.333 1.00 5.33 H new ATOM 0 HB3 HIS A 5 8.979 3.917 -6.514 1.00 5.33 H new ATOM 0 HD1 HIS A 5 10.228 4.861 -8.466 1.00 51.23 H new ATOM 0 HD2 HIS A 5 11.426 0.957 -7.528 1.00 54.01 H new ATOM 0 HE1 HIS A 5 11.841 4.144 -10.297 1.00 13.12 H new ATOM 79 N HIS A 6 11.231 5.412 -5.598 1.00 52.43 N ATOM 80 CA HIS A 6 11.457 6.837 -5.382 1.00 44.15 C ATOM 81 C HIS A 6 10.795 7.665 -6.480 1.00 22.12 C ATOM 82 O HIS A 6 10.091 8.636 -6.200 1.00 25.11 O ATOM 83 CB HIS A 6 12.956 7.135 -5.337 1.00 3.43 C ATOM 84 CG HIS A 6 13.676 6.421 -4.234 1.00 52.13 C ATOM 85 ND1 HIS A 6 13.917 6.989 -3.001 1.00 42.43 N ATOM 86 CD2 HIS A 6 14.206 5.177 -4.184 1.00 30.23 C ATOM 87 CE1 HIS A 6 14.566 6.126 -2.241 1.00 3.14 C ATOM 88 NE2 HIS A 6 14.754 5.018 -2.934 1.00 75.14 N ATOM 0 H HIS A 6 11.627 5.049 -6.465 1.00 52.43 H new ATOM 0 HA HIS A 6 11.010 7.110 -4.426 1.00 44.15 H new ATOM 0 HB2 HIS A 6 13.402 6.856 -6.291 1.00 3.43 H new ATOM 0 HB3 HIS A 6 13.101 8.209 -5.219 1.00 3.43 H new ATOM 0 HD2 HIS A 6 14.200 4.445 -4.978 1.00 30.23 H new ATOM 0 HE1 HIS A 6 14.888 6.297 -1.225 1.00 3.14 H new ATOM 0 HE2 HIS A 6 15.229 4.181 -2.597 1.00 75.14 H new ATOM 96 N HIS A 7 11.026 7.275 -7.729 1.00 71.25 N ATOM 97 CA HIS A 7 10.452 7.981 -8.869 1.00 53.31 C ATOM 98 C HIS A 7 9.261 7.216 -9.439 1.00 64.32 C ATOM 99 O HIS A 7 8.885 6.161 -8.926 1.00 41.34 O ATOM 100 CB HIS A 7 11.509 8.186 -9.955 1.00 32.43 C ATOM 101 CG HIS A 7 11.503 9.562 -10.545 1.00 12.11 C ATOM 102 ND1 HIS A 7 11.609 9.801 -11.899 1.00 22.12 N ATOM 103 CD2 HIS A 7 11.401 10.777 -9.957 1.00 54.10 C ATOM 104 CE1 HIS A 7 11.574 11.103 -12.118 1.00 45.21 C ATOM 105 NE2 HIS A 7 11.448 11.718 -10.956 1.00 51.10 N ATOM 0 H HIS A 7 11.607 6.474 -7.978 1.00 71.25 H new ATOM 0 HA HIS A 7 10.104 8.955 -8.524 1.00 53.31 H new ATOM 0 HB2 HIS A 7 12.494 7.984 -9.534 1.00 32.43 H new ATOM 0 HB3 HIS A 7 11.347 7.458 -10.750 1.00 32.43 H new ATOM 0 HD2 HIS A 7 11.301 10.970 -8.899 1.00 54.10 H new ATOM 0 HE1 HIS A 7 11.638 11.583 -13.083 1.00 45.21 H new ATOM 0 HE2 HIS A 7 11.394 12.728 -10.822 1.00 51.10 H new ATOM 113 N HIS A 8 8.672 7.754 -10.502 1.00 62.34 N ATOM 114 CA HIS A 8 7.524 7.121 -11.142 1.00 41.11 C ATOM 115 C HIS A 8 7.878 6.649 -12.549 1.00 52.32 C ATOM 116 O HIS A 8 8.028 7.457 -13.465 1.00 63.15 O ATOM 117 CB HIS A 8 6.345 8.093 -11.199 1.00 3.32 C ATOM 118 CG HIS A 8 6.539 9.319 -10.360 1.00 40.13 C ATOM 119 ND1 HIS A 8 6.378 9.327 -8.991 1.00 13.31 N ATOM 120 CD2 HIS A 8 6.884 10.582 -10.705 1.00 24.34 C ATOM 121 CE1 HIS A 8 6.614 10.542 -8.529 1.00 52.44 C ATOM 122 NE2 HIS A 8 6.924 11.323 -9.549 1.00 72.41 N ATOM 0 H HIS A 8 8.970 8.626 -10.938 1.00 62.34 H new ATOM 0 HA HIS A 8 7.241 6.253 -10.547 1.00 41.11 H new ATOM 0 HB2 HIS A 8 6.182 8.393 -12.234 1.00 3.32 H new ATOM 0 HB3 HIS A 8 5.443 7.577 -10.871 1.00 3.32 H new ATOM 0 HD2 HIS A 8 7.089 10.940 -11.703 1.00 24.34 H new ATOM 0 HE1 HIS A 8 6.562 10.845 -7.494 1.00 52.44 H new ATOM 0 HE2 HIS A 8 7.155 12.315 -9.488 1.00 72.41 H new ATOM 130 N ALA A 9 8.010 5.337 -12.712 1.00 71.04 N ATOM 131 CA ALA A 9 8.345 4.758 -14.008 1.00 12.15 C ATOM 132 C ALA A 9 8.174 3.243 -13.992 1.00 64.21 C ATOM 133 O ALA A 9 7.570 2.668 -14.897 1.00 23.31 O ATOM 134 CB ALA A 9 9.768 5.127 -14.398 1.00 41.25 C ATOM 0 H ALA A 9 7.890 4.655 -11.963 1.00 71.04 H new ATOM 0 HA ALA A 9 7.659 5.167 -14.750 1.00 12.15 H new ATOM 0 HB1 ALA A 9 10.005 4.688 -15.367 1.00 41.25 H new ATOM 0 HB2 ALA A 9 9.859 6.212 -14.458 1.00 41.25 H new ATOM 0 HB3 ALA A 9 10.461 4.746 -13.648 1.00 41.25 H new ATOM 140 N MET A 10 8.711 2.602 -12.959 1.00 45.10 N ATOM 141 CA MET A 10 8.618 1.153 -12.827 1.00 31.24 C ATOM 142 C MET A 10 7.256 0.744 -12.274 1.00 3.23 C ATOM 143 O MET A 10 6.632 -0.196 -12.766 1.00 1.02 O ATOM 144 CB MET A 10 9.730 0.630 -11.915 1.00 35.21 C ATOM 145 CG MET A 10 11.122 1.059 -12.347 1.00 63.20 C ATOM 146 SD MET A 10 11.668 0.232 -13.854 1.00 34.13 S ATOM 147 CE MET A 10 11.712 1.609 -14.998 1.00 65.13 C ATOM 0 H MET A 10 9.215 3.063 -12.201 1.00 45.10 H new ATOM 0 HA MET A 10 8.735 0.714 -13.818 1.00 31.24 H new ATOM 0 HB2 MET A 10 9.550 0.980 -10.899 1.00 35.21 H new ATOM 0 HB3 MET A 10 9.686 -0.459 -11.890 1.00 35.21 H new ATOM 0 HG2 MET A 10 11.133 2.137 -12.505 1.00 63.20 H new ATOM 0 HG3 MET A 10 11.829 0.847 -11.545 1.00 63.20 H new ATOM 0 HE1 MET A 10 12.033 1.257 -15.979 1.00 65.13 H new ATOM 0 HE2 MET A 10 10.717 2.048 -15.077 1.00 65.13 H new ATOM 0 HE3 MET A 10 12.413 2.361 -14.635 1.00 65.13 H new ATOM 157 N VAL A 11 6.801 1.456 -11.248 1.00 1.42 N ATOM 158 CA VAL A 11 5.513 1.168 -10.629 1.00 30.15 C ATOM 159 C VAL A 11 4.394 1.961 -11.294 1.00 34.41 C ATOM 160 O VAL A 11 3.217 1.618 -11.168 1.00 44.30 O ATOM 161 CB VAL A 11 5.530 1.490 -9.122 1.00 72.43 C ATOM 162 CG1 VAL A 11 4.475 0.674 -8.390 1.00 62.32 C ATOM 163 CG2 VAL A 11 6.912 1.236 -8.539 1.00 73.12 C ATOM 0 H VAL A 11 7.306 2.237 -10.828 1.00 1.42 H new ATOM 0 HA VAL A 11 5.328 0.102 -10.763 1.00 30.15 H new ATOM 0 HB VAL A 11 5.294 2.546 -8.991 1.00 72.43 H new ATOM 0 HG11 VAL A 11 4.502 0.915 -7.327 1.00 62.32 H new ATOM 0 HG12 VAL A 11 3.489 0.910 -8.791 1.00 62.32 H new ATOM 0 HG13 VAL A 11 4.677 -0.388 -8.527 1.00 62.32 H new ATOM 0 HG21 VAL A 11 6.906 1.469 -7.474 1.00 73.12 H new ATOM 0 HG22 VAL A 11 7.180 0.189 -8.680 1.00 73.12 H new ATOM 0 HG23 VAL A 11 7.642 1.868 -9.044 1.00 73.12 H new ATOM 173 N ILE A 12 4.767 3.021 -12.002 1.00 62.23 N ATOM 174 CA ILE A 12 3.794 3.861 -12.689 1.00 45.43 C ATOM 175 C ILE A 12 3.421 3.274 -14.046 1.00 31.42 C ATOM 176 O ILE A 12 2.313 3.483 -14.541 1.00 3.21 O ATOM 177 CB ILE A 12 4.329 5.291 -12.892 1.00 4.33 C ATOM 178 CG1 ILE A 12 3.172 6.291 -12.936 1.00 32.13 C ATOM 179 CG2 ILE A 12 5.155 5.372 -14.167 1.00 41.30 C ATOM 180 CD1 ILE A 12 3.034 7.112 -11.673 1.00 22.13 C ATOM 0 H ILE A 12 5.736 3.319 -12.115 1.00 62.23 H new ATOM 0 HA ILE A 12 2.908 3.899 -12.056 1.00 45.43 H new ATOM 0 HB ILE A 12 4.972 5.545 -12.049 1.00 4.33 H new ATOM 0 HG12 ILE A 12 3.315 6.963 -13.782 1.00 32.13 H new ATOM 0 HG13 ILE A 12 2.242 5.751 -13.112 1.00 32.13 H new ATOM 0 HG21 ILE A 12 5.526 6.389 -14.296 1.00 41.30 H new ATOM 0 HG22 ILE A 12 5.998 4.684 -14.099 1.00 41.30 H new ATOM 0 HG23 ILE A 12 4.534 5.101 -15.021 1.00 41.30 H new ATOM 0 HD11 ILE A 12 2.194 7.799 -11.776 1.00 22.13 H new ATOM 0 HD12 ILE A 12 2.859 6.449 -10.825 1.00 22.13 H new ATOM 0 HD13 ILE A 12 3.949 7.680 -11.507 1.00 22.13 H new ATOM 192 N ASP A 13 4.351 2.536 -14.641 1.00 64.40 N ATOM 193 CA ASP A 13 4.119 1.914 -15.940 1.00 23.04 C ATOM 194 C ASP A 13 3.328 0.618 -15.788 1.00 43.43 C ATOM 195 O ASP A 13 2.694 0.152 -16.735 1.00 34.00 O ATOM 196 CB ASP A 13 5.450 1.635 -16.640 1.00 72.15 C ATOM 197 CG ASP A 13 5.292 0.720 -17.839 1.00 41.43 C ATOM 198 OD1 ASP A 13 4.468 1.037 -18.722 1.00 53.00 O ATOM 199 OD2 ASP A 13 5.992 -0.312 -17.894 1.00 64.34 O ATOM 0 H ASP A 13 5.273 2.353 -14.245 1.00 64.40 H new ATOM 0 HA ASP A 13 3.536 2.605 -16.548 1.00 23.04 H new ATOM 0 HB2 ASP A 13 5.893 2.578 -16.962 1.00 72.15 H new ATOM 0 HB3 ASP A 13 6.143 1.183 -15.930 1.00 72.15 H new ATOM 204 N HIS A 14 3.372 0.041 -14.592 1.00 34.21 N ATOM 205 CA HIS A 14 2.659 -1.202 -14.317 1.00 3.14 C ATOM 206 C HIS A 14 1.192 -0.929 -14.002 1.00 55.43 C ATOM 207 O HIS A 14 0.298 -1.561 -14.567 1.00 1.23 O ATOM 208 CB HIS A 14 3.314 -1.942 -13.149 1.00 54.25 C ATOM 209 CG HIS A 14 3.703 -3.351 -13.476 1.00 51.31 C ATOM 210 ND1 HIS A 14 2.923 -4.187 -14.247 1.00 25.43 N ATOM 211 CD2 HIS A 14 4.798 -4.069 -13.133 1.00 52.23 C ATOM 212 CE1 HIS A 14 3.521 -5.360 -14.362 1.00 42.23 C ATOM 213 NE2 HIS A 14 4.661 -5.314 -13.696 1.00 51.11 N ATOM 0 H HIS A 14 3.893 0.413 -13.798 1.00 34.21 H new ATOM 0 HA HIS A 14 2.711 -1.827 -15.209 1.00 3.14 H new ATOM 0 HB2 HIS A 14 4.201 -1.393 -12.833 1.00 54.25 H new ATOM 0 HB3 HIS A 14 2.626 -1.950 -12.303 1.00 54.25 H new ATOM 0 HD2 HIS A 14 5.625 -3.727 -12.529 1.00 52.23 H new ATOM 0 HE1 HIS A 14 3.142 -6.211 -14.908 1.00 42.23 H new ATOM 0 HE2 HIS A 14 5.331 -6.079 -13.613 1.00 51.11 H new ATOM 221 N ILE A 15 0.951 0.015 -13.099 1.00 12.32 N ATOM 222 CA ILE A 15 -0.408 0.372 -12.710 1.00 72.44 C ATOM 223 C ILE A 15 -1.239 0.776 -13.924 1.00 23.42 C ATOM 224 O ILE A 15 -2.466 0.670 -13.913 1.00 61.32 O ATOM 225 CB ILE A 15 -0.418 1.524 -11.689 1.00 0.12 C ATOM 226 CG1 ILE A 15 0.332 1.116 -10.419 1.00 64.25 C ATOM 227 CG2 ILE A 15 -1.847 1.927 -11.359 1.00 54.51 C ATOM 228 CD1 ILE A 15 0.822 2.291 -9.603 1.00 3.12 C ATOM 0 H ILE A 15 1.679 0.547 -12.623 1.00 12.32 H new ATOM 0 HA ILE A 15 -0.847 -0.513 -12.250 1.00 72.44 H new ATOM 0 HB ILE A 15 0.089 2.383 -12.128 1.00 0.12 H new ATOM 0 HG12 ILE A 15 -0.324 0.503 -9.801 1.00 64.25 H new ATOM 0 HG13 ILE A 15 1.184 0.494 -10.694 1.00 64.25 H new ATOM 0 HG21 ILE A 15 -1.837 2.743 -10.636 1.00 54.51 H new ATOM 0 HG22 ILE A 15 -2.352 2.254 -12.268 1.00 54.51 H new ATOM 0 HG23 ILE A 15 -2.377 1.074 -10.936 1.00 54.51 H new ATOM 0 HD11 ILE A 15 1.344 1.927 -8.718 1.00 3.12 H new ATOM 0 HD12 ILE A 15 1.503 2.893 -10.204 1.00 3.12 H new ATOM 0 HD13 ILE A 15 -0.028 2.901 -9.297 1.00 3.12 H new ATOM 240 N LEU A 16 -0.562 1.237 -14.970 1.00 11.45 N ATOM 241 CA LEU A 16 -1.237 1.656 -16.193 1.00 41.02 C ATOM 242 C LEU A 16 -2.167 0.561 -16.704 1.00 35.41 C ATOM 243 O LEU A 16 -3.334 0.813 -17.005 1.00 74.52 O ATOM 244 CB LEU A 16 -0.210 2.011 -17.270 1.00 3.24 C ATOM 245 CG LEU A 16 -0.759 2.207 -18.683 1.00 71.11 C ATOM 246 CD1 LEU A 16 -0.021 3.332 -19.392 1.00 0.24 C ATOM 247 CD2 LEU A 16 -0.655 0.914 -19.479 1.00 53.34 C ATOM 0 H LEU A 16 0.453 1.330 -14.996 1.00 11.45 H new ATOM 0 HA LEU A 16 -1.835 2.538 -15.964 1.00 41.02 H new ATOM 0 HB2 LEU A 16 0.300 2.927 -16.970 1.00 3.24 H new ATOM 0 HB3 LEU A 16 0.542 1.223 -17.300 1.00 3.24 H new ATOM 0 HG LEU A 16 -1.811 2.481 -18.608 1.00 71.11 H new ATOM 0 HD11 LEU A 16 -0.426 3.456 -20.396 1.00 0.24 H new ATOM 0 HD12 LEU A 16 -0.147 4.259 -18.833 1.00 0.24 H new ATOM 0 HD13 LEU A 16 1.039 3.088 -19.456 1.00 0.24 H new ATOM 0 HD21 LEU A 16 -1.050 1.072 -20.482 1.00 53.34 H new ATOM 0 HD22 LEU A 16 0.390 0.610 -19.544 1.00 53.34 H new ATOM 0 HD23 LEU A 16 -1.230 0.133 -18.981 1.00 53.34 H new ATOM 259 N LYS A 17 -1.644 -0.657 -16.797 1.00 32.10 N ATOM 260 CA LYS A 17 -2.428 -1.793 -17.268 1.00 22.25 C ATOM 261 C LYS A 17 -3.548 -2.125 -16.287 1.00 22.33 C ATOM 262 O LYS A 17 -4.515 -2.800 -16.640 1.00 74.24 O ATOM 263 CB LYS A 17 -1.527 -3.015 -17.462 1.00 1.10 C ATOM 264 CG LYS A 17 -0.731 -2.984 -18.755 1.00 73.35 C ATOM 265 CD LYS A 17 -0.015 -4.302 -19.001 1.00 53.21 C ATOM 266 CE LYS A 17 1.312 -4.361 -18.261 1.00 30.44 C ATOM 267 NZ LYS A 17 1.716 -5.762 -17.958 1.00 62.44 N ATOM 0 H LYS A 17 -0.680 -0.883 -16.552 1.00 32.10 H new ATOM 0 HA LYS A 17 -2.875 -1.523 -18.225 1.00 22.25 H new ATOM 0 HB2 LYS A 17 -0.836 -3.084 -16.621 1.00 1.10 H new ATOM 0 HB3 LYS A 17 -2.141 -3.915 -17.445 1.00 1.10 H new ATOM 0 HG2 LYS A 17 -1.399 -2.770 -19.589 1.00 73.35 H new ATOM 0 HG3 LYS A 17 -0.002 -2.175 -18.715 1.00 73.35 H new ATOM 0 HD2 LYS A 17 -0.650 -5.128 -18.679 1.00 53.21 H new ATOM 0 HD3 LYS A 17 0.157 -4.430 -20.070 1.00 53.21 H new ATOM 0 HE2 LYS A 17 2.085 -3.882 -18.862 1.00 30.44 H new ATOM 0 HE3 LYS A 17 1.235 -3.796 -17.332 1.00 30.44 H new ATOM 0 HZ1 LYS A 17 2.625 -5.760 -17.453 1.00 62.44 H new ATOM 0 HZ2 LYS A 17 0.991 -6.211 -17.363 1.00 62.44 H new ATOM 0 HZ3 LYS A 17 1.814 -6.295 -18.846 1.00 62.44 H new ATOM 281 N CYS A 18 -3.411 -1.646 -15.055 1.00 62.34 N ATOM 282 CA CYS A 18 -4.412 -1.892 -14.024 1.00 31.24 C ATOM 283 C CYS A 18 -5.631 -0.997 -14.224 1.00 61.55 C ATOM 284 O CYS A 18 -6.769 -1.432 -14.050 1.00 32.45 O ATOM 285 CB CYS A 18 -3.814 -1.655 -12.636 1.00 63.52 C ATOM 286 SG CYS A 18 -3.768 -3.130 -11.591 1.00 11.14 S ATOM 0 H CYS A 18 -2.617 -1.085 -14.747 1.00 62.34 H new ATOM 0 HA CYS A 18 -4.730 -2.932 -14.103 1.00 31.24 H new ATOM 0 HB2 CYS A 18 -2.800 -1.271 -12.750 1.00 63.52 H new ATOM 0 HB3 CYS A 18 -4.392 -0.882 -12.130 1.00 63.52 H new ATOM 0 HG CYS A 18 -3.244 -2.830 -10.440 1.00 11.14 H new ATOM 292 N VAL A 19 -5.384 0.256 -14.591 1.00 52.24 N ATOM 293 CA VAL A 19 -6.461 1.213 -14.816 1.00 12.15 C ATOM 294 C VAL A 19 -6.959 1.153 -16.255 1.00 73.31 C ATOM 295 O VAL A 19 -8.119 1.458 -16.536 1.00 23.54 O ATOM 296 CB VAL A 19 -6.009 2.651 -14.500 1.00 43.33 C ATOM 297 CG1 VAL A 19 -5.887 3.465 -15.779 1.00 43.35 C ATOM 298 CG2 VAL A 19 -6.974 3.312 -13.528 1.00 52.11 C ATOM 0 H VAL A 19 -4.448 0.632 -14.739 1.00 52.24 H new ATOM 0 HA VAL A 19 -7.273 0.939 -14.143 1.00 12.15 H new ATOM 0 HB VAL A 19 -5.027 2.609 -14.029 1.00 43.33 H new ATOM 0 HG11 VAL A 19 -5.567 4.478 -15.536 1.00 43.35 H new ATOM 0 HG12 VAL A 19 -5.153 3.000 -16.437 1.00 43.35 H new ATOM 0 HG13 VAL A 19 -6.854 3.501 -16.281 1.00 43.35 H new ATOM 0 HG21 VAL A 19 -6.639 4.327 -13.316 1.00 52.11 H new ATOM 0 HG22 VAL A 19 -7.970 3.343 -13.969 1.00 52.11 H new ATOM 0 HG23 VAL A 19 -7.006 2.740 -12.601 1.00 52.11 H new ATOM 308 N PHE A 20 -6.075 0.757 -17.165 1.00 74.21 N ATOM 309 CA PHE A 20 -6.425 0.656 -18.577 1.00 41.43 C ATOM 310 C PHE A 20 -7.165 -0.647 -18.863 1.00 62.02 C ATOM 311 O PHE A 20 -7.841 -0.778 -19.883 1.00 74.44 O ATOM 312 CB PHE A 20 -5.166 0.742 -19.443 1.00 53.12 C ATOM 313 CG PHE A 20 -5.414 1.324 -20.806 1.00 35.24 C ATOM 314 CD1 PHE A 20 -6.025 0.570 -21.795 1.00 33.34 C ATOM 315 CD2 PHE A 20 -5.038 2.625 -21.097 1.00 65.21 C ATOM 316 CE1 PHE A 20 -6.254 1.102 -23.049 1.00 40.42 C ATOM 317 CE2 PHE A 20 -5.264 3.163 -22.350 1.00 11.11 C ATOM 318 CZ PHE A 20 -5.874 2.401 -23.327 1.00 11.02 C ATOM 0 H PHE A 20 -5.111 0.501 -16.950 1.00 74.21 H new ATOM 0 HA PHE A 20 -7.085 1.488 -18.823 1.00 41.43 H new ATOM 0 HB2 PHE A 20 -4.421 1.349 -18.928 1.00 53.12 H new ATOM 0 HB3 PHE A 20 -4.743 -0.256 -19.555 1.00 53.12 H new ATOM 0 HD1 PHE A 20 -6.326 -0.445 -21.583 1.00 33.34 H new ATOM 0 HD2 PHE A 20 -4.563 3.226 -20.336 1.00 65.21 H new ATOM 0 HE1 PHE A 20 -6.730 0.503 -23.812 1.00 40.42 H new ATOM 0 HE2 PHE A 20 -4.964 4.178 -22.565 1.00 11.11 H new ATOM 0 HZ PHE A 20 -6.054 2.820 -24.306 1.00 11.02 H new ATOM 328 N ASP A 21 -7.030 -1.608 -17.956 1.00 14.23 N ATOM 329 CA ASP A 21 -7.686 -2.901 -18.109 1.00 21.41 C ATOM 330 C ASP A 21 -9.199 -2.762 -17.979 1.00 75.41 C ATOM 331 O ASP A 21 -9.951 -3.190 -18.856 1.00 23.44 O ATOM 332 CB ASP A 21 -7.161 -3.890 -17.067 1.00 3.25 C ATOM 333 CG ASP A 21 -8.050 -5.109 -16.925 1.00 74.21 C ATOM 334 OD1 ASP A 21 -9.017 -5.051 -16.136 1.00 3.22 O ATOM 335 OD2 ASP A 21 -7.781 -6.122 -17.604 1.00 41.33 O ATOM 0 H ASP A 21 -6.472 -1.516 -17.107 1.00 14.23 H new ATOM 0 HA ASP A 21 -7.458 -3.280 -19.105 1.00 21.41 H new ATOM 0 HB2 ASP A 21 -6.156 -4.207 -17.346 1.00 3.25 H new ATOM 0 HB3 ASP A 21 -7.081 -3.388 -16.103 1.00 3.25 H new ATOM 340 N LYS A 22 -9.641 -2.162 -16.879 1.00 71.21 N ATOM 341 CA LYS A 22 -11.065 -1.966 -16.633 1.00 22.00 C ATOM 342 C LYS A 22 -11.693 -1.107 -17.726 1.00 4.12 C ATOM 343 O LYS A 22 -12.824 -1.350 -18.146 1.00 71.53 O ATOM 344 CB LYS A 22 -11.282 -1.311 -15.267 1.00 22.11 C ATOM 345 CG LYS A 22 -12.239 -2.077 -14.370 1.00 63.42 C ATOM 346 CD LYS A 22 -11.526 -2.657 -13.160 1.00 3.32 C ATOM 347 CE LYS A 22 -10.575 -3.776 -13.556 1.00 32.11 C ATOM 348 NZ LYS A 22 -11.066 -5.107 -13.102 1.00 4.22 N ATOM 0 H LYS A 22 -9.033 -1.803 -16.143 1.00 71.21 H new ATOM 0 HA LYS A 22 -11.548 -2.943 -16.641 1.00 22.00 H new ATOM 0 HB2 LYS A 22 -10.321 -1.217 -14.762 1.00 22.11 H new ATOM 0 HB3 LYS A 22 -11.665 -0.301 -15.414 1.00 22.11 H new ATOM 0 HG2 LYS A 22 -13.038 -1.414 -14.039 1.00 63.42 H new ATOM 0 HG3 LYS A 22 -12.707 -2.881 -14.938 1.00 63.42 H new ATOM 0 HD2 LYS A 22 -10.970 -1.869 -12.652 1.00 3.32 H new ATOM 0 HD3 LYS A 22 -12.261 -3.037 -12.451 1.00 3.32 H new ATOM 0 HE2 LYS A 22 -10.454 -3.784 -14.639 1.00 32.11 H new ATOM 0 HE3 LYS A 22 -9.591 -3.586 -13.127 1.00 32.11 H new ATOM 0 HZ1 LYS A 22 -10.391 -5.843 -13.391 1.00 4.22 H new ATOM 0 HZ2 LYS A 22 -11.158 -5.108 -12.066 1.00 4.22 H new ATOM 0 HZ3 LYS A 22 -11.993 -5.300 -13.532 1.00 4.22 H new ATOM 362 N ILE A 23 -10.951 -0.103 -18.182 1.00 72.11 N ATOM 363 CA ILE A 23 -11.435 0.790 -19.228 1.00 31.52 C ATOM 364 C ILE A 23 -11.930 0.003 -20.437 1.00 33.35 C ATOM 365 O ILE A 23 -12.894 0.397 -21.095 1.00 4.43 O ATOM 366 CB ILE A 23 -10.338 1.771 -19.682 1.00 75.23 C ATOM 367 CG1 ILE A 23 -10.066 2.807 -18.590 1.00 22.33 C ATOM 368 CG2 ILE A 23 -10.744 2.455 -20.979 1.00 54.11 C ATOM 369 CD1 ILE A 23 -8.736 3.511 -18.743 1.00 51.23 C ATOM 0 H ILE A 23 -10.013 0.112 -17.844 1.00 72.11 H new ATOM 0 HA ILE A 23 -12.264 1.356 -18.802 1.00 31.52 H new ATOM 0 HB ILE A 23 -9.421 1.210 -19.861 1.00 75.23 H new ATOM 0 HG12 ILE A 23 -10.864 3.549 -18.598 1.00 22.33 H new ATOM 0 HG13 ILE A 23 -10.098 2.315 -17.618 1.00 22.33 H new ATOM 0 HG21 ILE A 23 -9.959 3.145 -21.287 1.00 54.11 H new ATOM 0 HG22 ILE A 23 -10.893 1.704 -21.755 1.00 54.11 H new ATOM 0 HG23 ILE A 23 -11.672 3.006 -20.825 1.00 54.11 H new ATOM 0 HD11 ILE A 23 -8.610 4.231 -17.934 1.00 51.23 H new ATOM 0 HD12 ILE A 23 -7.930 2.778 -18.705 1.00 51.23 H new ATOM 0 HD13 ILE A 23 -8.708 4.032 -19.700 1.00 51.23 H new ATOM 381 N CYS A 24 -11.267 -1.112 -20.722 1.00 22.12 N ATOM 382 CA CYS A 24 -11.640 -1.956 -21.851 1.00 71.14 C ATOM 383 C CYS A 24 -12.814 -2.861 -21.490 1.00 3.41 C ATOM 384 O CYS A 24 -13.586 -3.270 -22.357 1.00 15.05 O ATOM 385 CB CYS A 24 -10.447 -2.802 -22.299 1.00 32.34 C ATOM 386 SG CYS A 24 -9.631 -2.196 -23.794 1.00 74.20 S ATOM 0 H CYS A 24 -10.468 -1.453 -20.187 1.00 22.12 H new ATOM 0 HA CYS A 24 -11.944 -1.307 -22.672 1.00 71.14 H new ATOM 0 HB2 CYS A 24 -9.718 -2.839 -21.490 1.00 32.34 H new ATOM 0 HB3 CYS A 24 -10.785 -3.824 -22.471 1.00 32.34 H new ATOM 0 HG CYS A 24 -8.634 -2.976 -24.091 1.00 74.20 H new ATOM 392 N LYS A 25 -12.941 -3.171 -20.204 1.00 43.31 N ATOM 393 CA LYS A 25 -14.019 -4.027 -19.726 1.00 73.41 C ATOM 394 C LYS A 25 -15.335 -3.259 -19.657 1.00 1.52 C ATOM 395 O LYS A 25 -16.323 -3.643 -20.283 1.00 43.25 O ATOM 396 CB LYS A 25 -13.675 -4.595 -18.347 1.00 43.31 C ATOM 397 CG LYS A 25 -13.102 -6.001 -18.394 1.00 5.43 C ATOM 398 CD LYS A 25 -12.572 -6.432 -17.036 1.00 71.24 C ATOM 399 CE LYS A 25 -13.643 -7.138 -16.219 1.00 71.22 C ATOM 400 NZ LYS A 25 -13.666 -8.604 -16.483 1.00 1.43 N ATOM 0 H LYS A 25 -12.310 -2.841 -19.474 1.00 43.31 H new ATOM 0 HA LYS A 25 -14.135 -4.849 -20.432 1.00 73.41 H new ATOM 0 HB2 LYS A 25 -12.957 -3.935 -17.860 1.00 43.31 H new ATOM 0 HB3 LYS A 25 -14.574 -4.598 -17.730 1.00 43.31 H new ATOM 0 HG2 LYS A 25 -13.872 -6.698 -18.723 1.00 5.43 H new ATOM 0 HG3 LYS A 25 -12.299 -6.043 -19.129 1.00 5.43 H new ATOM 0 HD2 LYS A 25 -11.719 -7.097 -17.171 1.00 71.24 H new ATOM 0 HD3 LYS A 25 -12.213 -5.559 -16.491 1.00 71.24 H new ATOM 0 HE2 LYS A 25 -13.465 -6.963 -15.158 1.00 71.22 H new ATOM 0 HE3 LYS A 25 -14.618 -6.711 -16.453 1.00 71.22 H new ATOM 0 HZ1 LYS A 25 -14.409 -9.049 -15.907 1.00 1.43 H new ATOM 0 HZ2 LYS A 25 -13.861 -8.772 -17.491 1.00 1.43 H new ATOM 0 HZ3 LYS A 25 -12.744 -9.016 -16.236 1.00 1.43 H new ATOM 414 N ILE A 26 -15.340 -2.171 -18.893 1.00 61.30 N ATOM 415 CA ILE A 26 -16.533 -1.348 -18.745 1.00 54.31 C ATOM 416 C ILE A 26 -17.106 -0.961 -20.104 1.00 73.04 C ATOM 417 O ILE A 26 -18.313 -0.772 -20.250 1.00 73.52 O ATOM 418 CB ILE A 26 -16.238 -0.067 -17.942 1.00 61.21 C ATOM 419 CG1 ILE A 26 -17.537 0.684 -17.641 1.00 62.54 C ATOM 420 CG2 ILE A 26 -15.269 0.824 -18.704 1.00 43.12 C ATOM 421 CD1 ILE A 26 -18.515 -0.113 -16.807 1.00 14.52 C ATOM 0 H ILE A 26 -14.531 -1.840 -18.367 1.00 61.30 H new ATOM 0 HA ILE A 26 -17.264 -1.947 -18.202 1.00 54.31 H new ATOM 0 HB ILE A 26 -15.776 -0.348 -16.996 1.00 61.21 H new ATOM 0 HG12 ILE A 26 -17.299 1.611 -17.120 1.00 62.54 H new ATOM 0 HG13 ILE A 26 -18.014 0.960 -18.581 1.00 62.54 H new ATOM 0 HG21 ILE A 26 -15.070 1.725 -18.124 1.00 43.12 H new ATOM 0 HG22 ILE A 26 -14.335 0.287 -18.871 1.00 43.12 H new ATOM 0 HG23 ILE A 26 -15.706 1.099 -19.664 1.00 43.12 H new ATOM 0 HD11 ILE A 26 -19.412 0.481 -16.632 1.00 14.52 H new ATOM 0 HD12 ILE A 26 -18.782 -1.028 -17.335 1.00 14.52 H new ATOM 0 HD13 ILE A 26 -18.056 -0.367 -15.851 1.00 14.52 H new ATOM 433 N GLY A 27 -16.231 -0.846 -21.099 1.00 30.23 N ATOM 434 CA GLY A 27 -16.669 -0.484 -22.434 1.00 63.22 C ATOM 435 C GLY A 27 -17.518 -1.562 -23.078 1.00 15.12 C ATOM 436 O GLY A 27 -18.456 -1.265 -23.819 1.00 12.32 O ATOM 0 H GLY A 27 -15.227 -0.997 -21.004 1.00 30.23 H new ATOM 0 HA2 GLY A 27 -17.239 0.444 -22.387 1.00 63.22 H new ATOM 0 HA3 GLY A 27 -15.797 -0.291 -23.059 1.00 63.22 H new ATOM 440 N THR A 28 -17.190 -2.819 -22.797 1.00 32.14 N ATOM 441 CA THR A 28 -17.928 -3.945 -23.355 1.00 40.03 C ATOM 442 C THR A 28 -19.054 -4.381 -22.425 1.00 11.42 C ATOM 443 O THR A 28 -20.009 -5.028 -22.853 1.00 0.02 O ATOM 444 CB THR A 28 -17.002 -5.147 -23.620 1.00 73.34 C ATOM 445 OG1 THR A 28 -15.639 -4.713 -23.673 1.00 63.34 O ATOM 446 CG2 THR A 28 -17.371 -5.837 -24.925 1.00 73.10 C ATOM 0 H THR A 28 -16.417 -3.083 -22.186 1.00 32.14 H new ATOM 0 HA THR A 28 -18.353 -3.607 -24.300 1.00 40.03 H new ATOM 0 HB THR A 28 -17.125 -5.859 -22.804 1.00 73.34 H new ATOM 0 HG1 THR A 28 -15.057 -5.483 -23.840 1.00 63.34 H new ATOM 0 HG21 THR A 28 -16.703 -6.683 -25.091 1.00 73.10 H new ATOM 0 HG22 THR A 28 -18.400 -6.192 -24.870 1.00 73.10 H new ATOM 0 HG23 THR A 28 -17.274 -5.131 -25.750 1.00 73.10 H new ATOM 454 N GLU A 29 -18.936 -4.020 -21.151 1.00 25.53 N ATOM 455 CA GLU A 29 -19.945 -4.375 -20.160 1.00 71.41 C ATOM 456 C GLU A 29 -21.220 -3.562 -20.367 1.00 23.20 C ATOM 457 O GLU A 29 -22.328 -4.086 -20.256 1.00 20.32 O ATOM 458 CB GLU A 29 -19.406 -4.149 -18.746 1.00 51.42 C ATOM 459 CG GLU A 29 -18.426 -5.216 -18.290 1.00 34.44 C ATOM 460 CD GLU A 29 -18.933 -6.000 -17.094 1.00 63.13 C ATOM 461 OE1 GLU A 29 -19.295 -5.368 -16.080 1.00 63.30 O ATOM 462 OE2 GLU A 29 -18.967 -7.246 -17.174 1.00 71.10 O ATOM 0 H GLU A 29 -18.152 -3.482 -20.781 1.00 25.53 H new ATOM 0 HA GLU A 29 -20.184 -5.431 -20.285 1.00 71.41 H new ATOM 0 HB2 GLU A 29 -18.916 -3.176 -18.704 1.00 51.42 H new ATOM 0 HB3 GLU A 29 -20.243 -4.115 -18.049 1.00 51.42 H new ATOM 0 HG2 GLU A 29 -18.232 -5.902 -19.114 1.00 34.44 H new ATOM 0 HG3 GLU A 29 -17.476 -4.747 -18.036 1.00 34.44 H new ATOM 469 N SER A 30 -21.053 -2.278 -20.668 1.00 32.31 N ATOM 470 CA SER A 30 -22.189 -1.391 -20.886 1.00 14.30 C ATOM 471 C SER A 30 -22.952 -1.785 -22.147 1.00 51.53 C ATOM 472 O SER A 30 -24.104 -1.393 -22.338 1.00 62.40 O ATOM 473 CB SER A 30 -21.717 0.060 -20.994 1.00 42.33 C ATOM 474 OG SER A 30 -21.338 0.569 -19.727 1.00 53.21 O ATOM 0 H SER A 30 -20.142 -1.829 -20.766 1.00 32.31 H new ATOM 0 HA SER A 30 -22.860 -1.484 -20.032 1.00 14.30 H new ATOM 0 HB2 SER A 30 -20.873 0.121 -21.681 1.00 42.33 H new ATOM 0 HB3 SER A 30 -22.514 0.675 -21.413 1.00 42.33 H new ATOM 0 HG SER A 30 -21.039 1.497 -19.824 1.00 53.21 H new ATOM 480 N VAL A 31 -22.301 -2.562 -23.007 1.00 2.13 N ATOM 481 CA VAL A 31 -22.916 -3.011 -24.250 1.00 14.41 C ATOM 482 C VAL A 31 -24.019 -4.029 -23.981 1.00 42.31 C ATOM 483 O VAL A 31 -24.894 -4.246 -24.819 1.00 3.23 O ATOM 484 CB VAL A 31 -21.876 -3.635 -25.198 1.00 24.51 C ATOM 485 CG1 VAL A 31 -22.471 -3.843 -26.582 1.00 43.23 C ATOM 486 CG2 VAL A 31 -20.630 -2.765 -25.269 1.00 21.21 C ATOM 0 H VAL A 31 -21.347 -2.894 -22.865 1.00 2.13 H new ATOM 0 HA VAL A 31 -23.347 -2.130 -24.726 1.00 14.41 H new ATOM 0 HB VAL A 31 -21.589 -4.609 -24.803 1.00 24.51 H new ATOM 0 HG11 VAL A 31 -21.721 -4.285 -27.238 1.00 43.23 H new ATOM 0 HG12 VAL A 31 -23.330 -4.510 -26.512 1.00 43.23 H new ATOM 0 HG13 VAL A 31 -22.789 -2.883 -26.989 1.00 43.23 H new ATOM 0 HG21 VAL A 31 -19.906 -3.221 -25.944 1.00 21.21 H new ATOM 0 HG22 VAL A 31 -20.898 -1.776 -25.640 1.00 21.21 H new ATOM 0 HG23 VAL A 31 -20.193 -2.674 -24.275 1.00 21.21 H new ATOM 496 N GLU A 32 -23.970 -4.650 -22.807 1.00 1.33 N ATOM 497 CA GLU A 32 -24.965 -5.646 -22.428 1.00 53.21 C ATOM 498 C GLU A 32 -26.185 -4.982 -21.796 1.00 34.54 C ATOM 499 O GLU A 32 -27.305 -5.120 -22.288 1.00 22.22 O ATOM 500 CB GLU A 32 -24.360 -6.659 -21.455 1.00 32.44 C ATOM 501 CG GLU A 32 -22.904 -6.984 -21.742 1.00 21.45 C ATOM 502 CD GLU A 32 -22.578 -8.448 -21.517 1.00 63.22 C ATOM 503 OE1 GLU A 32 -23.183 -9.303 -22.197 1.00 54.41 O ATOM 504 OE2 GLU A 32 -21.716 -8.739 -20.661 1.00 41.13 O ATOM 0 H GLU A 32 -23.252 -4.481 -22.102 1.00 1.33 H new ATOM 0 HA GLU A 32 -25.283 -6.167 -23.331 1.00 53.21 H new ATOM 0 HB2 GLU A 32 -24.443 -6.270 -20.440 1.00 32.44 H new ATOM 0 HB3 GLU A 32 -24.943 -7.579 -21.493 1.00 32.44 H new ATOM 0 HG2 GLU A 32 -22.673 -6.718 -22.774 1.00 21.45 H new ATOM 0 HG3 GLU A 32 -22.266 -6.371 -21.105 1.00 21.45 H new ATOM 511 N ALA A 33 -25.960 -4.263 -20.701 1.00 63.02 N ATOM 512 CA ALA A 33 -27.039 -3.577 -20.002 1.00 31.11 C ATOM 513 C ALA A 33 -27.786 -2.633 -20.937 1.00 54.33 C ATOM 514 O ALA A 33 -28.934 -2.271 -20.683 1.00 13.13 O ATOM 515 CB ALA A 33 -26.491 -2.814 -18.805 1.00 52.42 C ATOM 0 H ALA A 33 -25.039 -4.141 -20.279 1.00 63.02 H new ATOM 0 HA ALA A 33 -27.745 -4.328 -19.648 1.00 31.11 H new ATOM 0 HB1 ALA A 33 -27.308 -2.306 -18.292 1.00 52.42 H new ATOM 0 HB2 ALA A 33 -26.009 -3.511 -18.119 1.00 52.42 H new ATOM 0 HB3 ALA A 33 -25.763 -2.078 -19.145 1.00 52.42 H new ATOM 521 N GLY A 34 -27.127 -2.236 -22.022 1.00 24.15 N ATOM 522 CA GLY A 34 -27.744 -1.336 -22.978 1.00 33.20 C ATOM 523 C GLY A 34 -28.715 -2.047 -23.900 1.00 30.32 C ATOM 524 O GLY A 34 -29.762 -1.502 -24.249 1.00 70.24 O ATOM 0 H GLY A 34 -26.176 -2.522 -22.255 1.00 24.15 H new ATOM 0 HA2 GLY A 34 -28.269 -0.546 -22.442 1.00 33.20 H new ATOM 0 HA3 GLY A 34 -26.968 -0.856 -23.574 1.00 33.20 H new ATOM 528 N ARG A 35 -28.367 -3.267 -24.296 1.00 22.21 N ATOM 529 CA ARG A 35 -29.214 -4.052 -25.185 1.00 61.55 C ATOM 530 C ARG A 35 -30.223 -4.875 -24.389 1.00 63.35 C ATOM 531 O ARG A 35 -31.287 -5.232 -24.897 1.00 30.15 O ATOM 532 CB ARG A 35 -28.359 -4.976 -26.055 1.00 22.32 C ATOM 533 CG ARG A 35 -28.215 -4.500 -27.491 1.00 60.30 C ATOM 534 CD ARG A 35 -27.873 -3.020 -27.556 1.00 14.13 C ATOM 535 NE ARG A 35 -29.010 -2.214 -27.993 1.00 34.31 N ATOM 536 CZ ARG A 35 -29.460 -2.196 -29.243 1.00 15.44 C ATOM 537 NH1 ARG A 35 -28.873 -2.935 -30.173 1.00 51.24 N ATOM 538 NH2 ARG A 35 -30.501 -1.437 -29.563 1.00 44.41 N ATOM 0 H ARG A 35 -27.504 -3.733 -24.015 1.00 22.21 H new ATOM 0 HA ARG A 35 -29.761 -3.362 -25.828 1.00 61.55 H new ATOM 0 HB2 ARG A 35 -27.368 -5.066 -25.610 1.00 22.32 H new ATOM 0 HB3 ARG A 35 -28.800 -5.973 -26.054 1.00 22.32 H new ATOM 0 HG2 ARG A 35 -27.436 -5.077 -27.990 1.00 60.30 H new ATOM 0 HG3 ARG A 35 -29.144 -4.684 -28.031 1.00 60.30 H new ATOM 0 HD2 ARG A 35 -27.544 -2.680 -26.574 1.00 14.13 H new ATOM 0 HD3 ARG A 35 -27.038 -2.871 -28.241 1.00 14.13 H new ATOM 0 HE ARG A 35 -29.484 -1.634 -27.301 1.00 34.31 H new ATOM 0 HH11 ARG A 35 -28.073 -3.520 -29.930 1.00 51.24 H new ATOM 0 HH12 ARG A 35 -29.221 -2.919 -31.132 1.00 51.24 H new ATOM 0 HH21 ARG A 35 -30.956 -0.867 -28.849 1.00 44.41 H new ATOM 0 HH22 ARG A 35 -30.846 -1.423 -30.523 1.00 44.41 H new ATOM 552 N LEU A 36 -29.881 -5.173 -23.141 1.00 31.51 N ATOM 553 CA LEU A 36 -30.756 -5.955 -22.274 1.00 54.10 C ATOM 554 C LEU A 36 -31.915 -5.105 -21.762 1.00 30.43 C ATOM 555 O LEU A 36 -33.051 -5.572 -21.681 1.00 35.42 O ATOM 556 CB LEU A 36 -29.965 -6.522 -21.095 1.00 25.34 C ATOM 557 CG LEU A 36 -29.702 -8.028 -21.125 1.00 32.43 C ATOM 558 CD1 LEU A 36 -28.608 -8.360 -22.128 1.00 14.21 C ATOM 559 CD2 LEU A 36 -29.328 -8.532 -19.739 1.00 23.35 C ATOM 0 H LEU A 36 -29.004 -4.885 -22.706 1.00 31.51 H new ATOM 0 HA LEU A 36 -31.164 -6.779 -22.859 1.00 54.10 H new ATOM 0 HB2 LEU A 36 -29.006 -6.007 -21.046 1.00 25.34 H new ATOM 0 HB3 LEU A 36 -30.501 -6.285 -20.176 1.00 25.34 H new ATOM 0 HG LEU A 36 -30.617 -8.530 -21.438 1.00 32.43 H new ATOM 0 HD11 LEU A 36 -28.435 -9.436 -22.135 1.00 14.21 H new ATOM 0 HD12 LEU A 36 -28.915 -8.035 -23.122 1.00 14.21 H new ATOM 0 HD13 LEU A 36 -27.689 -7.847 -21.847 1.00 14.21 H new ATOM 0 HD21 LEU A 36 -29.144 -9.606 -19.780 1.00 23.35 H new ATOM 0 HD22 LEU A 36 -28.427 -8.022 -19.397 1.00 23.35 H new ATOM 0 HD23 LEU A 36 -30.144 -8.329 -19.046 1.00 23.35 H new ATOM 571 N ILE A 37 -31.620 -3.856 -21.419 1.00 64.03 N ATOM 572 CA ILE A 37 -32.637 -2.941 -20.918 1.00 54.24 C ATOM 573 C ILE A 37 -33.580 -2.503 -22.034 1.00 41.32 C ATOM 574 O ILE A 37 -34.800 -2.546 -21.881 1.00 51.24 O ATOM 575 CB ILE A 37 -32.005 -1.692 -20.276 1.00 43.03 C ATOM 576 CG1 ILE A 37 -31.731 -1.938 -18.791 1.00 70.43 C ATOM 577 CG2 ILE A 37 -32.912 -0.485 -20.460 1.00 50.41 C ATOM 578 CD1 ILE A 37 -31.007 -3.238 -18.518 1.00 34.32 C ATOM 0 H ILE A 37 -30.684 -3.455 -21.479 1.00 64.03 H new ATOM 0 HA ILE A 37 -33.202 -3.483 -20.159 1.00 54.24 H new ATOM 0 HB ILE A 37 -31.056 -1.488 -20.772 1.00 43.03 H new ATOM 0 HG12 ILE A 37 -31.139 -1.112 -18.397 1.00 70.43 H new ATOM 0 HG13 ILE A 37 -32.677 -1.938 -18.250 1.00 70.43 H new ATOM 0 HG21 ILE A 37 -32.451 0.390 -20.001 1.00 50.41 H new ATOM 0 HG22 ILE A 37 -33.061 -0.300 -21.524 1.00 50.41 H new ATOM 0 HG23 ILE A 37 -33.875 -0.678 -19.987 1.00 50.41 H new ATOM 0 HD11 ILE A 37 -30.846 -3.347 -17.445 1.00 34.32 H new ATOM 0 HD12 ILE A 37 -31.607 -4.072 -18.881 1.00 34.32 H new ATOM 0 HD13 ILE A 37 -30.045 -3.233 -19.030 1.00 34.32 H new ATOM 590 N GLU A 38 -33.005 -2.083 -23.157 1.00 24.12 N ATOM 591 CA GLU A 38 -33.794 -1.638 -24.299 1.00 74.20 C ATOM 592 C GLU A 38 -34.810 -2.702 -24.706 1.00 63.20 C ATOM 593 O GLU A 38 -36.018 -2.463 -24.687 1.00 61.23 O ATOM 594 CB GLU A 38 -32.881 -1.310 -25.482 1.00 71.10 C ATOM 595 CG GLU A 38 -33.197 0.021 -26.144 1.00 61.51 C ATOM 596 CD GLU A 38 -32.161 0.418 -27.178 1.00 14.10 C ATOM 597 OE1 GLU A 38 -30.957 0.206 -26.922 1.00 53.45 O ATOM 598 OE2 GLU A 38 -32.554 0.941 -28.242 1.00 34.24 O ATOM 0 H GLU A 38 -31.996 -2.042 -23.300 1.00 24.12 H new ATOM 0 HA GLU A 38 -34.334 -0.738 -24.006 1.00 74.20 H new ATOM 0 HB2 GLU A 38 -31.846 -1.299 -25.139 1.00 71.10 H new ATOM 0 HB3 GLU A 38 -32.963 -2.104 -26.224 1.00 71.10 H new ATOM 0 HG2 GLU A 38 -34.176 -0.037 -26.620 1.00 61.51 H new ATOM 0 HG3 GLU A 38 -33.259 0.797 -25.381 1.00 61.51 H new ATOM 605 N LEU A 39 -34.311 -3.877 -25.074 1.00 60.21 N ATOM 606 CA LEU A 39 -35.173 -4.979 -25.486 1.00 75.14 C ATOM 607 C LEU A 39 -36.273 -5.224 -24.458 1.00 55.35 C ATOM 608 O LEU A 39 -37.404 -5.559 -24.812 1.00 62.20 O ATOM 609 CB LEU A 39 -34.349 -6.253 -25.681 1.00 1.22 C ATOM 610 CG LEU A 39 -33.900 -6.550 -27.112 1.00 4.40 C ATOM 611 CD1 LEU A 39 -33.257 -5.320 -27.735 1.00 60.45 C ATOM 612 CD2 LEU A 39 -32.936 -7.727 -27.135 1.00 71.20 C ATOM 0 H LEU A 39 -33.314 -4.091 -25.095 1.00 60.21 H new ATOM 0 HA LEU A 39 -35.640 -4.707 -26.433 1.00 75.14 H new ATOM 0 HB2 LEU A 39 -33.463 -6.189 -25.050 1.00 1.22 H new ATOM 0 HB3 LEU A 39 -34.935 -7.099 -25.323 1.00 1.22 H new ATOM 0 HG LEU A 39 -34.778 -6.814 -27.701 1.00 4.40 H new ATOM 0 HD11 LEU A 39 -32.943 -5.550 -28.753 1.00 60.45 H new ATOM 0 HD12 LEU A 39 -33.978 -4.502 -27.753 1.00 60.45 H new ATOM 0 HD13 LEU A 39 -32.389 -5.025 -27.146 1.00 60.45 H new ATOM 0 HD21 LEU A 39 -32.627 -7.924 -28.161 1.00 71.20 H new ATOM 0 HD22 LEU A 39 -32.060 -7.491 -26.531 1.00 71.20 H new ATOM 0 HD23 LEU A 39 -33.430 -8.610 -26.729 1.00 71.20 H new ATOM 624 N SER A 40 -35.935 -5.051 -23.185 1.00 20.43 N ATOM 625 CA SER A 40 -36.893 -5.255 -22.105 1.00 14.12 C ATOM 626 C SER A 40 -38.134 -4.391 -22.310 1.00 32.23 C ATOM 627 O SER A 40 -39.249 -4.804 -21.992 1.00 53.13 O ATOM 628 CB SER A 40 -36.250 -4.931 -20.755 1.00 43.13 C ATOM 629 OG SER A 40 -36.835 -5.695 -19.715 1.00 4.53 O ATOM 0 H SER A 40 -35.005 -4.770 -22.876 1.00 20.43 H new ATOM 0 HA SER A 40 -37.194 -6.302 -22.113 1.00 14.12 H new ATOM 0 HB2 SER A 40 -35.180 -5.133 -20.801 1.00 43.13 H new ATOM 0 HB3 SER A 40 -36.365 -3.869 -20.539 1.00 43.13 H new ATOM 0 HG SER A 40 -36.406 -5.471 -18.863 1.00 4.53 H new ATOM 635 N GLN A 41 -37.930 -3.191 -22.842 1.00 53.42 N ATOM 636 CA GLN A 41 -39.032 -2.268 -23.089 1.00 50.20 C ATOM 637 C GLN A 41 -39.602 -2.463 -24.490 1.00 50.01 C ATOM 638 O GLN A 41 -40.814 -2.397 -24.691 1.00 51.24 O ATOM 639 CB GLN A 41 -38.564 -0.822 -22.913 1.00 24.41 C ATOM 640 CG GLN A 41 -37.562 -0.641 -21.784 1.00 14.45 C ATOM 641 CD GLN A 41 -38.132 -1.023 -20.432 1.00 23.34 C ATOM 642 OE1 GLN A 41 -39.346 -1.152 -20.270 1.00 64.13 O ATOM 643 NE2 GLN A 41 -37.256 -1.208 -19.451 1.00 2.32 N ATOM 0 H GLN A 41 -37.013 -2.835 -23.110 1.00 53.42 H new ATOM 0 HA GLN A 41 -39.818 -2.479 -22.364 1.00 50.20 H new ATOM 0 HB2 GLN A 41 -38.115 -0.478 -23.845 1.00 24.41 H new ATOM 0 HB3 GLN A 41 -39.431 -0.189 -22.724 1.00 24.41 H new ATOM 0 HG2 GLN A 41 -36.679 -1.247 -21.986 1.00 14.45 H new ATOM 0 HG3 GLN A 41 -37.236 0.399 -21.756 1.00 14.45 H new ATOM 0 HE21 GLN A 41 -36.259 -1.091 -19.629 1.00 2.32 H new ATOM 0 HE22 GLN A 41 -37.581 -1.467 -18.520 1.00 2.32 H new ATOM 652 N GLU A 42 -38.719 -2.703 -25.455 1.00 33.13 N ATOM 653 CA GLU A 42 -39.136 -2.906 -26.837 1.00 60.52 C ATOM 654 C GLU A 42 -37.936 -3.216 -27.727 1.00 63.22 C ATOM 655 O GLU A 42 -38.033 -4.003 -28.668 1.00 54.43 O ATOM 656 CB GLU A 42 -39.867 -1.668 -27.360 1.00 63.14 C ATOM 657 CG GLU A 42 -41.009 -1.991 -28.309 1.00 44.24 C ATOM 658 CD GLU A 42 -42.354 -1.532 -27.781 1.00 3.31 C ATOM 659 OE1 GLU A 42 -42.488 -0.332 -27.461 1.00 31.42 O ATOM 660 OE2 GLU A 42 -43.272 -2.373 -27.688 1.00 13.10 O ATOM 0 H GLU A 42 -37.712 -2.761 -25.305 1.00 33.13 H new ATOM 0 HA GLU A 42 -39.816 -3.758 -26.863 1.00 60.52 H new ATOM 0 HB2 GLU A 42 -40.258 -1.103 -26.514 1.00 63.14 H new ATOM 0 HB3 GLU A 42 -39.152 -1.023 -27.871 1.00 63.14 H new ATOM 0 HG2 GLU A 42 -40.821 -1.518 -29.273 1.00 44.24 H new ATOM 0 HG3 GLU A 42 -41.039 -3.067 -28.483 1.00 44.24 H new ATOM 667 N GLY A 43 -36.803 -2.591 -27.422 1.00 42.40 N ATOM 668 CA GLY A 43 -35.600 -2.811 -28.203 1.00 61.14 C ATOM 669 C GLY A 43 -35.418 -1.773 -29.292 1.00 45.35 C ATOM 670 O GLY A 43 -34.295 -1.490 -29.709 1.00 21.13 O ATOM 0 H GLY A 43 -36.697 -1.936 -26.647 1.00 42.40 H new ATOM 0 HA2 GLY A 43 -34.733 -2.795 -27.542 1.00 61.14 H new ATOM 0 HA3 GLY A 43 -35.639 -3.803 -28.654 1.00 61.14 H new ATOM 674 N GLY A 44 -36.526 -1.203 -29.757 1.00 63.41 N ATOM 675 CA GLY A 44 -36.461 -0.198 -30.802 1.00 34.22 C ATOM 676 C GLY A 44 -36.156 -0.794 -32.162 1.00 35.22 C ATOM 677 O GLY A 44 -37.019 -1.411 -32.785 1.00 35.45 O ATOM 0 H GLY A 44 -37.467 -1.419 -29.429 1.00 63.41 H new ATOM 0 HA2 GLY A 44 -37.410 0.336 -30.847 1.00 34.22 H new ATOM 0 HA3 GLY A 44 -35.695 0.535 -30.550 1.00 34.22 H new ATOM 681 N GLY A 45 -34.924 -0.608 -32.625 1.00 52.13 N ATOM 682 CA GLY A 45 -34.530 -1.136 -33.918 1.00 71.32 C ATOM 683 C GLY A 45 -33.437 -0.314 -34.572 1.00 21.43 C ATOM 684 O GLY A 45 -32.615 0.293 -33.888 1.00 4.52 O ATOM 0 H GLY A 45 -34.192 -0.101 -32.128 1.00 52.13 H new ATOM 0 HA2 GLY A 45 -34.185 -2.163 -33.798 1.00 71.32 H new ATOM 0 HA3 GLY A 45 -35.399 -1.167 -34.575 1.00 71.32 H new ATOM 688 N GLY A 46 -33.426 -0.297 -35.901 1.00 53.32 N ATOM 689 CA GLY A 46 -32.420 0.458 -36.625 1.00 51.10 C ATOM 690 C GLY A 46 -31.047 -0.179 -36.543 1.00 10.33 C ATOM 691 O GLY A 46 -30.910 -1.395 -36.670 1.00 13.40 O ATOM 0 H GLY A 46 -34.096 -0.793 -36.489 1.00 53.32 H new ATOM 0 HA2 GLY A 46 -32.716 0.542 -37.671 1.00 51.10 H new ATOM 0 HA3 GLY A 46 -32.372 1.471 -36.224 1.00 51.10 H new ATOM 695 N GLY A 47 -30.026 0.646 -36.331 1.00 25.23 N ATOM 696 CA GLY A 47 -28.669 0.138 -36.237 1.00 73.24 C ATOM 697 C GLY A 47 -28.541 -0.991 -35.234 1.00 62.33 C ATOM 698 O GLY A 47 -29.454 -1.240 -34.449 1.00 74.40 O ATOM 0 H GLY A 47 -30.114 1.656 -36.223 1.00 25.23 H new ATOM 0 HA2 GLY A 47 -28.347 -0.213 -37.217 1.00 73.24 H new ATOM 0 HA3 GLY A 47 -27.999 0.950 -35.953 1.00 73.24 H new ATOM 702 N GLY A 48 -27.403 -1.678 -35.261 1.00 64.22 N ATOM 703 CA GLY A 48 -27.180 -2.780 -34.344 1.00 25.33 C ATOM 704 C GLY A 48 -26.401 -2.361 -33.112 1.00 72.24 C ATOM 705 O GLY A 48 -26.044 -1.195 -32.945 1.00 23.01 O ATOM 0 H GLY A 48 -26.632 -1.491 -35.902 1.00 64.22 H new ATOM 0 HA2 GLY A 48 -28.141 -3.195 -34.039 1.00 25.33 H new ATOM 0 HA3 GLY A 48 -26.639 -3.574 -34.859 1.00 25.33 H new ATOM 709 N PRO A 49 -26.129 -3.327 -32.223 1.00 23.24 N ATOM 710 CA PRO A 49 -25.386 -3.076 -30.984 1.00 41.11 C ATOM 711 C PRO A 49 -23.916 -2.764 -31.243 1.00 21.02 C ATOM 712 O PRO A 49 -23.193 -2.338 -30.341 1.00 41.12 O ATOM 713 CB PRO A 49 -25.526 -4.391 -30.214 1.00 22.15 C ATOM 714 CG PRO A 49 -25.752 -5.423 -31.264 1.00 24.32 C ATOM 715 CD PRO A 49 -26.524 -4.739 -32.357 1.00 72.24 C ATOM 0 HA PRO A 49 -25.770 -2.209 -30.447 1.00 41.11 H new ATOM 0 HB2 PRO A 49 -24.629 -4.607 -29.633 1.00 22.15 H new ATOM 0 HB3 PRO A 49 -26.359 -4.352 -29.512 1.00 22.15 H new ATOM 0 HG2 PRO A 49 -24.805 -5.812 -31.639 1.00 24.32 H new ATOM 0 HG3 PRO A 49 -26.309 -6.271 -30.865 1.00 24.32 H new ATOM 0 HD2 PRO A 49 -26.267 -5.136 -33.339 1.00 72.24 H new ATOM 0 HD3 PRO A 49 -27.599 -4.869 -32.231 1.00 72.24 H new ATOM 723 N LEU A 50 -23.479 -2.978 -32.479 1.00 72.30 N ATOM 724 CA LEU A 50 -22.094 -2.719 -32.857 1.00 32.41 C ATOM 725 C LEU A 50 -21.876 -1.237 -33.142 1.00 64.14 C ATOM 726 O LEU A 50 -20.804 -0.694 -32.874 1.00 24.23 O ATOM 727 CB LEU A 50 -21.717 -3.548 -34.086 1.00 23.31 C ATOM 728 CG LEU A 50 -21.996 -5.049 -33.995 1.00 4.02 C ATOM 729 CD1 LEU A 50 -21.824 -5.538 -32.565 1.00 64.11 C ATOM 730 CD2 LEU A 50 -23.395 -5.363 -34.503 1.00 60.22 C ATOM 0 H LEU A 50 -24.064 -3.330 -33.237 1.00 72.30 H new ATOM 0 HA LEU A 50 -21.455 -3.007 -32.022 1.00 32.41 H new ATOM 0 HB2 LEU A 50 -22.255 -3.150 -34.947 1.00 23.31 H new ATOM 0 HB3 LEU A 50 -20.654 -3.408 -34.282 1.00 23.31 H new ATOM 0 HG LEU A 50 -21.276 -5.572 -34.625 1.00 4.02 H new ATOM 0 HD11 LEU A 50 -22.027 -6.608 -32.520 1.00 64.11 H new ATOM 0 HD12 LEU A 50 -20.802 -5.348 -32.236 1.00 64.11 H new ATOM 0 HD13 LEU A 50 -22.520 -5.009 -31.913 1.00 64.11 H new ATOM 0 HD21 LEU A 50 -23.576 -6.435 -34.431 1.00 60.22 H new ATOM 0 HD22 LEU A 50 -24.129 -4.830 -33.900 1.00 60.22 H new ATOM 0 HD23 LEU A 50 -23.483 -5.049 -35.543 1.00 60.22 H new ATOM 742 N TYR A 51 -22.899 -0.588 -33.686 1.00 43.32 N ATOM 743 CA TYR A 51 -22.819 0.832 -34.008 1.00 43.21 C ATOM 744 C TYR A 51 -22.684 1.671 -32.741 1.00 51.30 C ATOM 745 O TYR A 51 -21.915 2.632 -32.697 1.00 70.22 O ATOM 746 CB TYR A 51 -24.056 1.269 -34.793 1.00 54.14 C ATOM 747 CG TYR A 51 -24.412 2.726 -34.601 1.00 54.02 C ATOM 748 CD1 TYR A 51 -23.875 3.707 -35.425 1.00 41.25 C ATOM 749 CD2 TYR A 51 -25.285 3.122 -33.595 1.00 70.32 C ATOM 750 CE1 TYR A 51 -24.197 5.040 -35.253 1.00 64.43 C ATOM 751 CE2 TYR A 51 -25.614 4.451 -33.417 1.00 5.54 C ATOM 752 CZ TYR A 51 -25.067 5.407 -34.248 1.00 24.31 C ATOM 753 OH TYR A 51 -25.390 6.733 -34.072 1.00 72.44 O ATOM 0 H TYR A 51 -23.793 -1.022 -33.913 1.00 43.32 H new ATOM 0 HA TYR A 51 -21.933 0.990 -34.623 1.00 43.21 H new ATOM 0 HB2 TYR A 51 -23.888 1.082 -35.854 1.00 54.14 H new ATOM 0 HB3 TYR A 51 -24.904 0.654 -34.491 1.00 54.14 H new ATOM 0 HD1 TYR A 51 -23.194 3.423 -36.214 1.00 41.25 H new ATOM 0 HD2 TYR A 51 -25.714 2.377 -32.941 1.00 70.32 H new ATOM 0 HE1 TYR A 51 -23.770 5.790 -35.902 1.00 64.43 H new ATOM 0 HE2 TYR A 51 -26.296 4.741 -32.631 1.00 5.54 H new ATOM 0 HH TYR A 51 -25.347 7.197 -34.934 1.00 72.44 H new ATOM 763 N PHE A 52 -23.438 1.301 -31.711 1.00 63.21 N ATOM 764 CA PHE A 52 -23.404 2.018 -30.442 1.00 51.20 C ATOM 765 C PHE A 52 -22.020 1.933 -29.806 1.00 2.52 C ATOM 766 O PHE A 52 -21.593 2.845 -29.096 1.00 74.50 O ATOM 767 CB PHE A 52 -24.454 1.452 -29.484 1.00 22.33 C ATOM 768 CG PHE A 52 -24.027 1.477 -28.044 1.00 23.11 C ATOM 769 CD1 PHE A 52 -24.276 2.587 -27.253 1.00 43.00 C ATOM 770 CD2 PHE A 52 -23.377 0.390 -27.481 1.00 43.32 C ATOM 771 CE1 PHE A 52 -23.883 2.613 -25.928 1.00 61.02 C ATOM 772 CE2 PHE A 52 -22.982 0.410 -26.157 1.00 0.33 C ATOM 773 CZ PHE A 52 -23.236 1.523 -25.379 1.00 35.10 C ATOM 0 H PHE A 52 -24.080 0.509 -31.731 1.00 63.21 H new ATOM 0 HA PHE A 52 -23.630 3.066 -30.639 1.00 51.20 H new ATOM 0 HB2 PHE A 52 -25.377 2.022 -29.591 1.00 22.33 H new ATOM 0 HB3 PHE A 52 -24.679 0.425 -29.770 1.00 22.33 H new ATOM 0 HD1 PHE A 52 -24.783 3.442 -27.676 1.00 43.00 H new ATOM 0 HD2 PHE A 52 -23.177 -0.483 -28.084 1.00 43.32 H new ATOM 0 HE1 PHE A 52 -24.082 3.485 -25.322 1.00 61.02 H new ATOM 0 HE2 PHE A 52 -22.475 -0.443 -25.731 1.00 0.33 H new ATOM 0 HZ PHE A 52 -22.929 1.541 -24.344 1.00 35.10 H new ATOM 783 N VAL A 53 -21.322 0.832 -30.065 1.00 73.11 N ATOM 784 CA VAL A 53 -19.986 0.627 -29.519 1.00 70.01 C ATOM 785 C VAL A 53 -18.920 1.205 -30.443 1.00 72.03 C ATOM 786 O VAL A 53 -17.844 1.602 -29.996 1.00 60.41 O ATOM 787 CB VAL A 53 -19.696 -0.868 -29.291 1.00 71.53 C ATOM 788 CG1 VAL A 53 -18.220 -1.088 -28.998 1.00 43.24 C ATOM 789 CG2 VAL A 53 -20.559 -1.412 -28.162 1.00 44.11 C ATOM 0 H VAL A 53 -21.660 0.068 -30.650 1.00 73.11 H new ATOM 0 HA VAL A 53 -19.953 1.146 -28.561 1.00 70.01 H new ATOM 0 HB VAL A 53 -19.945 -1.411 -30.203 1.00 71.53 H new ATOM 0 HG11 VAL A 53 -18.035 -2.150 -28.840 1.00 43.24 H new ATOM 0 HG12 VAL A 53 -17.625 -0.738 -29.842 1.00 43.24 H new ATOM 0 HG13 VAL A 53 -17.940 -0.534 -28.102 1.00 43.24 H new ATOM 0 HG21 VAL A 53 -20.341 -2.470 -28.015 1.00 44.11 H new ATOM 0 HG22 VAL A 53 -20.344 -0.866 -27.244 1.00 44.11 H new ATOM 0 HG23 VAL A 53 -21.612 -1.291 -28.418 1.00 44.11 H new ATOM 799 N VAL A 54 -19.227 1.250 -31.736 1.00 1.30 N ATOM 800 CA VAL A 54 -18.296 1.782 -32.724 1.00 72.34 C ATOM 801 C VAL A 54 -18.342 3.305 -32.759 1.00 41.20 C ATOM 802 O VAL A 54 -17.353 3.958 -33.089 1.00 52.53 O ATOM 803 CB VAL A 54 -18.602 1.238 -34.133 1.00 22.34 C ATOM 804 CG1 VAL A 54 -17.834 2.021 -35.186 1.00 51.42 C ATOM 805 CG2 VAL A 54 -18.272 -0.245 -34.214 1.00 20.13 C ATOM 0 H VAL A 54 -20.113 0.925 -32.123 1.00 1.30 H new ATOM 0 HA VAL A 54 -17.299 1.458 -32.425 1.00 72.34 H new ATOM 0 HB VAL A 54 -19.667 1.362 -34.328 1.00 22.34 H new ATOM 0 HG11 VAL A 54 -18.063 1.623 -36.174 1.00 51.42 H new ATOM 0 HG12 VAL A 54 -18.124 3.071 -35.142 1.00 51.42 H new ATOM 0 HG13 VAL A 54 -16.764 1.932 -34.997 1.00 51.42 H new ATOM 0 HG21 VAL A 54 -18.494 -0.613 -35.216 1.00 20.13 H new ATOM 0 HG22 VAL A 54 -17.214 -0.395 -33.999 1.00 20.13 H new ATOM 0 HG23 VAL A 54 -18.871 -0.791 -33.486 1.00 20.13 H new ATOM 815 N ASN A 55 -19.497 3.865 -32.415 1.00 72.01 N ATOM 816 CA ASN A 55 -19.672 5.313 -32.407 1.00 35.22 C ATOM 817 C ASN A 55 -19.283 5.900 -31.054 1.00 10.23 C ATOM 818 O ASN A 55 -18.923 7.073 -30.954 1.00 54.43 O ATOM 819 CB ASN A 55 -21.123 5.674 -32.734 1.00 20.34 C ATOM 820 CG ASN A 55 -21.925 6.024 -31.495 1.00 21.51 C ATOM 821 OD1 ASN A 55 -22.307 7.177 -31.294 1.00 64.42 O ATOM 822 ND2 ASN A 55 -22.184 5.026 -30.657 1.00 2.52 N ATOM 0 H ASN A 55 -20.326 3.338 -32.138 1.00 72.01 H new ATOM 0 HA ASN A 55 -19.018 5.737 -33.169 1.00 35.22 H new ATOM 0 HB2 ASN A 55 -21.138 6.518 -33.424 1.00 20.34 H new ATOM 0 HB3 ASN A 55 -21.597 4.836 -33.245 1.00 20.34 H new ATOM 0 HD21 ASN A 55 -22.720 5.200 -29.807 1.00 2.52 H new ATOM 0 HD22 ASN A 55 -21.847 4.086 -30.864 1.00 2.52 H new ATOM 829 N VAL A 56 -19.357 5.076 -30.013 1.00 62.24 N ATOM 830 CA VAL A 56 -19.010 5.512 -28.666 1.00 53.21 C ATOM 831 C VAL A 56 -17.526 5.305 -28.386 1.00 12.01 C ATOM 832 O VAL A 56 -16.929 6.025 -27.585 1.00 41.24 O ATOM 833 CB VAL A 56 -19.832 4.759 -27.603 1.00 72.14 C ATOM 834 CG1 VAL A 56 -19.290 3.351 -27.408 1.00 0.22 C ATOM 835 CG2 VAL A 56 -19.834 5.526 -26.290 1.00 31.34 C ATOM 0 H VAL A 56 -19.654 4.102 -30.077 1.00 62.24 H new ATOM 0 HA VAL A 56 -19.242 6.575 -28.608 1.00 53.21 H new ATOM 0 HB VAL A 56 -20.862 4.681 -27.952 1.00 72.14 H new ATOM 0 HG11 VAL A 56 -19.883 2.834 -26.653 1.00 0.22 H new ATOM 0 HG12 VAL A 56 -19.346 2.806 -28.350 1.00 0.22 H new ATOM 0 HG13 VAL A 56 -18.252 3.403 -27.080 1.00 0.22 H new ATOM 0 HG21 VAL A 56 -20.419 4.980 -25.550 1.00 31.34 H new ATOM 0 HG22 VAL A 56 -18.810 5.638 -25.932 1.00 31.34 H new ATOM 0 HG23 VAL A 56 -20.274 6.511 -26.445 1.00 31.34 H new ATOM 845 N ILE A 57 -16.937 4.317 -29.051 1.00 4.04 N ATOM 846 CA ILE A 57 -15.521 4.016 -28.874 1.00 53.21 C ATOM 847 C ILE A 57 -14.667 4.780 -29.880 1.00 53.12 C ATOM 848 O ILE A 57 -13.494 5.054 -29.631 1.00 62.31 O ATOM 849 CB ILE A 57 -15.244 2.509 -29.022 1.00 24.51 C ATOM 850 CG1 ILE A 57 -15.890 1.734 -27.872 1.00 20.52 C ATOM 851 CG2 ILE A 57 -13.745 2.248 -29.067 1.00 74.14 C ATOM 852 CD1 ILE A 57 -15.290 2.047 -26.519 1.00 42.12 C ATOM 0 H ILE A 57 -17.417 3.712 -29.717 1.00 4.04 H new ATOM 0 HA ILE A 57 -15.255 4.329 -27.864 1.00 53.21 H new ATOM 0 HB ILE A 57 -15.682 2.164 -29.959 1.00 24.51 H new ATOM 0 HG12 ILE A 57 -16.956 1.958 -27.848 1.00 20.52 H new ATOM 0 HG13 ILE A 57 -15.793 0.666 -28.065 1.00 20.52 H new ATOM 0 HG21 ILE A 57 -13.565 1.178 -29.172 1.00 74.14 H new ATOM 0 HG22 ILE A 57 -13.309 2.774 -29.916 1.00 74.14 H new ATOM 0 HG23 ILE A 57 -13.286 2.605 -28.145 1.00 74.14 H new ATOM 0 HD11 ILE A 57 -15.797 1.462 -25.752 1.00 42.12 H new ATOM 0 HD12 ILE A 57 -14.229 1.797 -26.525 1.00 42.12 H new ATOM 0 HD13 ILE A 57 -15.411 3.109 -26.304 1.00 42.12 H new ATOM 864 N GLU A 58 -15.266 5.123 -31.017 1.00 23.32 N ATOM 865 CA GLU A 58 -14.559 5.856 -32.060 1.00 52.43 C ATOM 866 C GLU A 58 -13.879 7.097 -31.488 1.00 23.52 C ATOM 867 O GLU A 58 -12.659 7.253 -31.554 1.00 32.43 O ATOM 868 CB GLU A 58 -15.527 6.261 -33.175 1.00 24.34 C ATOM 869 CG GLU A 58 -15.319 5.493 -34.469 1.00 72.41 C ATOM 870 CD GLU A 58 -16.421 5.745 -35.480 1.00 20.50 C ATOM 871 OE1 GLU A 58 -17.600 5.793 -35.073 1.00 75.32 O ATOM 872 OE2 GLU A 58 -16.103 5.894 -36.679 1.00 22.25 O ATOM 0 H GLU A 58 -16.238 4.905 -31.238 1.00 23.32 H new ATOM 0 HA GLU A 58 -13.793 5.200 -32.473 1.00 52.43 H new ATOM 0 HB2 GLU A 58 -16.550 6.107 -32.831 1.00 24.34 H new ATOM 0 HB3 GLU A 58 -15.415 7.327 -33.373 1.00 24.34 H new ATOM 0 HG2 GLU A 58 -14.360 5.775 -34.904 1.00 72.41 H new ATOM 0 HG3 GLU A 58 -15.269 4.426 -34.250 1.00 72.41 H new ATOM 879 N PRO A 59 -14.685 8.001 -30.913 1.00 30.04 N ATOM 880 CA PRO A 59 -14.184 9.243 -30.317 1.00 43.23 C ATOM 881 C PRO A 59 -13.389 8.994 -29.040 1.00 11.42 C ATOM 882 O PRO A 59 -12.429 9.708 -28.746 1.00 62.41 O ATOM 883 CB PRO A 59 -15.461 10.029 -30.008 1.00 65.03 C ATOM 884 CG PRO A 59 -16.517 8.990 -29.853 1.00 24.22 C ATOM 885 CD PRO A 59 -16.148 7.880 -30.798 1.00 52.25 C ATOM 0 HA PRO A 59 -13.496 9.765 -30.982 1.00 43.23 H new ATOM 0 HB2 PRO A 59 -15.351 10.621 -29.099 1.00 65.03 H new ATOM 0 HB3 PRO A 59 -15.703 10.723 -30.813 1.00 65.03 H new ATOM 0 HG2 PRO A 59 -16.561 8.629 -28.825 1.00 24.22 H new ATOM 0 HG3 PRO A 59 -17.501 9.395 -30.091 1.00 24.22 H new ATOM 0 HD2 PRO A 59 -16.441 6.906 -30.407 1.00 52.25 H new ATOM 0 HD3 PRO A 59 -16.638 7.996 -31.765 1.00 52.25 H new ATOM 893 N CYS A 60 -13.795 7.980 -28.285 1.00 25.43 N ATOM 894 CA CYS A 60 -13.120 7.637 -27.038 1.00 2.13 C ATOM 895 C CYS A 60 -11.681 7.202 -27.299 1.00 55.35 C ATOM 896 O CYS A 60 -10.793 7.428 -26.477 1.00 75.10 O ATOM 897 CB CYS A 60 -13.878 6.524 -26.312 1.00 42.44 C ATOM 898 SG CYS A 60 -15.214 7.115 -25.247 1.00 21.33 S ATOM 0 H CYS A 60 -14.588 7.381 -28.514 1.00 25.43 H new ATOM 0 HA CYS A 60 -13.103 8.526 -26.408 1.00 2.13 H new ATOM 0 HB2 CYS A 60 -14.293 5.839 -27.052 1.00 42.44 H new ATOM 0 HB3 CYS A 60 -13.173 5.952 -25.709 1.00 42.44 H new ATOM 0 HG CYS A 60 -16.359 6.884 -25.818 1.00 21.33 H new ATOM 904 N LYS A 61 -11.458 6.576 -28.450 1.00 34.33 N ATOM 905 CA LYS A 61 -10.128 6.108 -28.821 1.00 74.23 C ATOM 906 C LYS A 61 -9.103 7.231 -28.700 1.00 30.51 C ATOM 907 O LYS A 61 -8.071 7.075 -28.047 1.00 0.13 O ATOM 908 CB LYS A 61 -10.138 5.564 -30.252 1.00 22.23 C ATOM 909 CG LYS A 61 -10.747 4.177 -30.371 1.00 45.41 C ATOM 910 CD LYS A 61 -9.750 3.178 -30.934 1.00 33.52 C ATOM 911 CE LYS A 61 -9.710 3.226 -32.454 1.00 5.45 C ATOM 912 NZ LYS A 61 -8.463 2.617 -32.995 1.00 11.32 N ATOM 0 H LYS A 61 -12.182 6.381 -29.142 1.00 34.33 H new ATOM 0 HA LYS A 61 -9.847 5.308 -28.136 1.00 74.23 H new ATOM 0 HB2 LYS A 61 -10.694 6.252 -30.889 1.00 22.23 H new ATOM 0 HB3 LYS A 61 -9.115 5.536 -30.628 1.00 22.23 H new ATOM 0 HG2 LYS A 61 -11.086 3.842 -29.391 1.00 45.41 H new ATOM 0 HG3 LYS A 61 -11.626 4.218 -31.015 1.00 45.41 H new ATOM 0 HD2 LYS A 61 -8.757 3.389 -30.536 1.00 33.52 H new ATOM 0 HD3 LYS A 61 -10.017 2.173 -30.608 1.00 33.52 H new ATOM 0 HE2 LYS A 61 -10.576 2.700 -32.857 1.00 5.45 H new ATOM 0 HE3 LYS A 61 -9.783 4.261 -32.787 1.00 5.45 H new ATOM 0 HZ1 LYS A 61 -8.474 2.669 -34.034 1.00 11.32 H new ATOM 0 HZ2 LYS A 61 -7.638 3.134 -32.631 1.00 11.32 H new ATOM 0 HZ3 LYS A 61 -8.406 1.622 -32.699 1.00 11.32 H new ATOM 926 N LYS A 62 -9.394 8.362 -29.332 1.00 12.51 N ATOM 927 CA LYS A 62 -8.500 9.513 -29.293 1.00 4.22 C ATOM 928 C LYS A 62 -8.213 9.931 -27.854 1.00 22.30 C ATOM 929 O LYS A 62 -7.179 10.534 -27.567 1.00 22.05 O ATOM 930 CB LYS A 62 -9.110 10.686 -30.063 1.00 41.14 C ATOM 931 CG LYS A 62 -8.359 11.034 -31.337 1.00 70.51 C ATOM 932 CD LYS A 62 -7.021 11.686 -31.035 1.00 5.21 C ATOM 933 CE LYS A 62 -7.137 13.202 -30.991 1.00 1.11 C ATOM 934 NZ LYS A 62 -7.007 13.728 -29.604 1.00 2.40 N ATOM 0 H LYS A 62 -10.243 8.507 -29.878 1.00 12.51 H new ATOM 0 HA LYS A 62 -7.560 9.226 -29.764 1.00 4.22 H new ATOM 0 HB2 LYS A 62 -10.143 10.447 -30.314 1.00 41.14 H new ATOM 0 HB3 LYS A 62 -9.134 11.562 -29.415 1.00 41.14 H new ATOM 0 HG2 LYS A 62 -8.200 10.130 -31.925 1.00 70.51 H new ATOM 0 HG3 LYS A 62 -8.964 11.707 -31.945 1.00 70.51 H new ATOM 0 HD2 LYS A 62 -6.645 11.321 -30.079 1.00 5.21 H new ATOM 0 HD3 LYS A 62 -6.295 11.397 -31.795 1.00 5.21 H new ATOM 0 HE2 LYS A 62 -6.365 13.644 -31.621 1.00 1.11 H new ATOM 0 HE3 LYS A 62 -8.098 13.505 -31.406 1.00 1.11 H new ATOM 0 HZ1 LYS A 62 -7.092 14.764 -29.616 1.00 2.40 H new ATOM 0 HZ2 LYS A 62 -7.759 13.326 -29.008 1.00 2.40 H new ATOM 0 HZ3 LYS A 62 -6.079 13.461 -29.217 1.00 2.40 H new ATOM 948 N PHE A 63 -9.134 9.605 -26.953 1.00 61.33 N ATOM 949 CA PHE A 63 -8.979 9.946 -25.544 1.00 34.41 C ATOM 950 C PHE A 63 -8.097 8.925 -24.831 1.00 33.21 C ATOM 951 O PHE A 63 -7.475 9.229 -23.813 1.00 50.34 O ATOM 952 CB PHE A 63 -10.347 10.019 -24.862 1.00 52.01 C ATOM 953 CG PHE A 63 -10.366 9.411 -23.489 1.00 2.23 C ATOM 954 CD1 PHE A 63 -10.660 8.068 -23.315 1.00 1.40 C ATOM 955 CD2 PHE A 63 -10.089 10.182 -22.372 1.00 2.55 C ATOM 956 CE1 PHE A 63 -10.678 7.507 -22.052 1.00 74.12 C ATOM 957 CE2 PHE A 63 -10.105 9.626 -21.106 1.00 54.42 C ATOM 958 CZ PHE A 63 -10.400 8.287 -20.947 1.00 24.54 C ATOM 0 H PHE A 63 -9.995 9.105 -27.174 1.00 61.33 H new ATOM 0 HA PHE A 63 -8.497 10.922 -25.483 1.00 34.41 H new ATOM 0 HB2 PHE A 63 -10.654 11.063 -24.793 1.00 52.01 H new ATOM 0 HB3 PHE A 63 -11.082 9.511 -25.486 1.00 52.01 H new ATOM 0 HD1 PHE A 63 -10.877 7.453 -24.176 1.00 1.40 H new ATOM 0 HD2 PHE A 63 -9.858 11.230 -22.491 1.00 2.55 H new ATOM 0 HE1 PHE A 63 -10.909 6.459 -21.929 1.00 74.12 H new ATOM 0 HE2 PHE A 63 -9.887 10.238 -20.243 1.00 54.42 H new ATOM 0 HZ PHE A 63 -10.413 7.850 -19.959 1.00 24.54 H new ATOM 968 N SER A 64 -8.050 7.712 -25.373 1.00 23.03 N ATOM 969 CA SER A 64 -7.248 6.644 -24.787 1.00 2.10 C ATOM 970 C SER A 64 -5.780 7.051 -24.702 1.00 41.20 C ATOM 971 O SER A 64 -5.096 6.746 -23.726 1.00 32.33 O ATOM 972 CB SER A 64 -7.387 5.363 -25.611 1.00 64.32 C ATOM 973 OG SER A 64 -7.760 4.268 -24.793 1.00 23.34 O ATOM 0 H SER A 64 -8.557 7.444 -26.216 1.00 23.03 H new ATOM 0 HA SER A 64 -7.615 6.460 -23.777 1.00 2.10 H new ATOM 0 HB2 SER A 64 -8.134 5.508 -26.392 1.00 64.32 H new ATOM 0 HB3 SER A 64 -6.443 5.143 -26.110 1.00 64.32 H new ATOM 0 HG SER A 64 -7.039 4.073 -24.158 1.00 23.34 H new ATOM 979 N GLU A 65 -5.303 7.742 -25.733 1.00 14.53 N ATOM 980 CA GLU A 65 -3.917 8.191 -25.775 1.00 45.00 C ATOM 981 C GLU A 65 -3.587 9.055 -24.561 1.00 23.42 C ATOM 982 O GLU A 65 -2.436 9.124 -24.128 1.00 64.40 O ATOM 983 CB GLU A 65 -3.650 8.977 -27.061 1.00 33.42 C ATOM 984 CG GLU A 65 -3.994 8.208 -28.326 1.00 14.43 C ATOM 985 CD GLU A 65 -4.229 9.119 -29.516 1.00 31.35 C ATOM 986 OE1 GLU A 65 -3.909 10.322 -29.413 1.00 72.34 O ATOM 987 OE2 GLU A 65 -4.732 8.629 -30.548 1.00 34.11 O ATOM 0 H GLU A 65 -5.856 8.003 -26.549 1.00 14.53 H new ATOM 0 HA GLU A 65 -3.277 7.309 -25.757 1.00 45.00 H new ATOM 0 HB2 GLU A 65 -4.228 9.901 -27.039 1.00 33.42 H new ATOM 0 HB3 GLU A 65 -2.598 9.260 -27.092 1.00 33.42 H new ATOM 0 HG2 GLU A 65 -3.185 7.516 -28.557 1.00 14.43 H new ATOM 0 HG3 GLU A 65 -4.887 7.608 -28.151 1.00 14.43 H new ATOM 994 N LEU A 66 -4.604 9.712 -24.016 1.00 54.11 N ATOM 995 CA LEU A 66 -4.424 10.572 -22.852 1.00 11.32 C ATOM 996 C LEU A 66 -4.062 9.751 -21.619 1.00 32.24 C ATOM 997 O LEU A 66 -3.317 10.207 -20.751 1.00 42.51 O ATOM 998 CB LEU A 66 -5.697 11.378 -22.586 1.00 40.04 C ATOM 999 CG LEU A 66 -6.247 12.173 -23.771 1.00 74.10 C ATOM 1000 CD1 LEU A 66 -7.073 13.354 -23.284 1.00 63.11 C ATOM 1001 CD2 LEU A 66 -5.113 12.646 -24.669 1.00 15.23 C ATOM 0 H LEU A 66 -5.563 9.666 -24.362 1.00 54.11 H new ATOM 0 HA LEU A 66 -3.604 11.259 -23.062 1.00 11.32 H new ATOM 0 HB2 LEU A 66 -6.472 10.693 -22.243 1.00 40.04 H new ATOM 0 HB3 LEU A 66 -5.500 12.072 -21.769 1.00 40.04 H new ATOM 0 HG LEU A 66 -6.895 11.518 -24.354 1.00 74.10 H new ATOM 0 HD11 LEU A 66 -7.456 13.908 -24.141 1.00 63.11 H new ATOM 0 HD12 LEU A 66 -7.907 12.991 -22.684 1.00 63.11 H new ATOM 0 HD13 LEU A 66 -6.448 14.010 -22.678 1.00 63.11 H new ATOM 0 HD21 LEU A 66 -5.523 13.210 -25.507 1.00 15.23 H new ATOM 0 HD22 LEU A 66 -4.439 13.284 -24.098 1.00 15.23 H new ATOM 0 HD23 LEU A 66 -4.564 11.783 -25.046 1.00 15.23 H new ATOM 1013 N THR A 67 -4.593 8.534 -21.547 1.00 54.14 N ATOM 1014 CA THR A 67 -4.326 7.648 -20.422 1.00 10.14 C ATOM 1015 C THR A 67 -2.844 7.303 -20.333 1.00 42.23 C ATOM 1016 O THR A 67 -2.347 6.922 -19.274 1.00 73.33 O ATOM 1017 CB THR A 67 -5.139 6.344 -20.527 1.00 54.24 C ATOM 1018 OG1 THR A 67 -6.482 6.636 -20.932 1.00 64.44 O ATOM 1019 CG2 THR A 67 -5.155 5.606 -19.197 1.00 45.51 C ATOM 0 H THR A 67 -5.211 8.140 -22.256 1.00 54.14 H new ATOM 0 HA THR A 67 -4.627 8.183 -19.521 1.00 10.14 H new ATOM 0 HB THR A 67 -4.665 5.706 -21.272 1.00 54.24 H new ATOM 0 HG1 THR A 67 -6.992 5.802 -20.998 1.00 64.44 H new ATOM 0 HG21 THR A 67 -5.735 4.689 -19.297 1.00 45.51 H new ATOM 0 HG22 THR A 67 -4.134 5.360 -18.905 1.00 45.51 H new ATOM 0 HG23 THR A 67 -5.607 6.240 -18.434 1.00 45.51 H new ATOM 1027 N GLY A 68 -2.141 7.441 -21.454 1.00 21.34 N ATOM 1028 CA GLY A 68 -0.721 7.140 -21.480 1.00 55.04 C ATOM 1029 C GLY A 68 0.137 8.375 -21.292 1.00 55.44 C ATOM 1030 O GLY A 68 1.347 8.275 -21.085 1.00 74.55 O ATOM 0 H GLY A 68 -2.529 7.755 -22.343 1.00 21.34 H new ATOM 0 HA2 GLY A 68 -0.491 6.419 -20.696 1.00 55.04 H new ATOM 0 HA3 GLY A 68 -0.470 6.668 -22.430 1.00 55.04 H new ATOM 1034 N LEU A 69 -0.489 9.545 -21.366 1.00 32.13 N ATOM 1035 CA LEU A 69 0.225 10.806 -21.204 1.00 4.45 C ATOM 1036 C LEU A 69 0.227 11.248 -19.743 1.00 72.44 C ATOM 1037 O LEU A 69 0.964 12.156 -19.359 1.00 31.30 O ATOM 1038 CB LEU A 69 -0.410 11.891 -22.075 1.00 71.13 C ATOM 1039 CG LEU A 69 0.485 13.080 -22.427 1.00 21.32 C ATOM 1040 CD1 LEU A 69 1.745 12.608 -23.136 1.00 20.22 C ATOM 1041 CD2 LEU A 69 -0.271 14.080 -23.289 1.00 11.34 C ATOM 0 H LEU A 69 -1.489 9.646 -21.537 1.00 32.13 H new ATOM 0 HA LEU A 69 1.257 10.653 -21.520 1.00 4.45 H new ATOM 0 HB2 LEU A 69 -0.750 11.431 -23.003 1.00 71.13 H new ATOM 0 HB3 LEU A 69 -1.295 12.268 -21.563 1.00 71.13 H new ATOM 0 HG LEU A 69 0.777 13.576 -21.502 1.00 21.32 H new ATOM 0 HD11 LEU A 69 2.370 13.468 -23.379 1.00 20.22 H new ATOM 0 HD12 LEU A 69 2.297 11.931 -22.484 1.00 20.22 H new ATOM 0 HD13 LEU A 69 1.473 12.087 -24.054 1.00 20.22 H new ATOM 0 HD21 LEU A 69 0.381 14.919 -23.530 1.00 11.34 H new ATOM 0 HD22 LEU A 69 -0.594 13.595 -24.210 1.00 11.34 H new ATOM 0 HD23 LEU A 69 -1.143 14.443 -22.745 1.00 11.34 H new ATOM 1053 N VAL A 70 -0.602 10.597 -18.933 1.00 53.21 N ATOM 1054 CA VAL A 70 -0.694 10.920 -17.514 1.00 75.23 C ATOM 1055 C VAL A 70 0.205 10.011 -16.684 1.00 72.43 C ATOM 1056 O VAL A 70 0.734 10.419 -15.651 1.00 5.13 O ATOM 1057 CB VAL A 70 -2.142 10.796 -17.004 1.00 14.44 C ATOM 1058 CG1 VAL A 70 -2.159 10.481 -15.516 1.00 22.43 C ATOM 1059 CG2 VAL A 70 -2.920 12.071 -17.295 1.00 71.11 C ATOM 0 H VAL A 70 -1.219 9.843 -19.235 1.00 53.21 H new ATOM 0 HA VAL A 70 -0.364 11.953 -17.402 1.00 75.23 H new ATOM 0 HB VAL A 70 -2.625 9.973 -17.531 1.00 14.44 H new ATOM 0 HG11 VAL A 70 -3.190 10.397 -15.174 1.00 22.43 H new ATOM 0 HG12 VAL A 70 -1.640 9.539 -15.337 1.00 22.43 H new ATOM 0 HG13 VAL A 70 -1.659 11.280 -14.969 1.00 22.43 H new ATOM 0 HG21 VAL A 70 -3.941 11.966 -16.928 1.00 71.11 H new ATOM 0 HG22 VAL A 70 -2.440 12.912 -16.796 1.00 71.11 H new ATOM 0 HG23 VAL A 70 -2.937 12.249 -18.370 1.00 71.11 H new ATOM 1069 N PHE A 71 0.374 8.775 -17.144 1.00 14.20 N ATOM 1070 CA PHE A 71 1.209 7.807 -16.444 1.00 30.53 C ATOM 1071 C PHE A 71 2.669 7.942 -16.866 1.00 20.41 C ATOM 1072 O PHE A 71 3.532 7.197 -16.402 1.00 24.44 O ATOM 1073 CB PHE A 71 0.717 6.384 -16.718 1.00 55.00 C ATOM 1074 CG PHE A 71 -0.576 6.054 -16.029 1.00 34.13 C ATOM 1075 CD1 PHE A 71 -1.745 6.720 -16.363 1.00 23.33 C ATOM 1076 CD2 PHE A 71 -0.623 5.078 -15.046 1.00 55.01 C ATOM 1077 CE1 PHE A 71 -2.936 6.418 -15.731 1.00 13.24 C ATOM 1078 CE2 PHE A 71 -1.812 4.772 -14.411 1.00 31.11 C ATOM 1079 CZ PHE A 71 -2.970 5.444 -14.753 1.00 23.44 C ATOM 0 H PHE A 71 -0.056 8.421 -17.998 1.00 14.20 H new ATOM 0 HA PHE A 71 1.138 8.009 -15.375 1.00 30.53 H new ATOM 0 HB2 PHE A 71 0.591 6.252 -17.793 1.00 55.00 H new ATOM 0 HB3 PHE A 71 1.481 5.676 -16.398 1.00 55.00 H new ATOM 0 HD1 PHE A 71 -1.725 7.484 -17.126 1.00 23.33 H new ATOM 0 HD2 PHE A 71 0.279 4.551 -14.773 1.00 55.01 H new ATOM 0 HE1 PHE A 71 -3.840 6.944 -16.002 1.00 13.24 H new ATOM 0 HE2 PHE A 71 -1.836 4.008 -13.648 1.00 31.11 H new ATOM 0 HZ PHE A 71 -3.900 5.208 -14.256 1.00 23.44 H new ATOM 1089 N TYR A 72 2.937 8.897 -17.749 1.00 70.44 N ATOM 1090 CA TYR A 72 4.291 9.128 -18.237 1.00 43.43 C ATOM 1091 C TYR A 72 4.764 10.535 -17.885 1.00 0.51 C ATOM 1092 O TYR A 72 5.627 10.716 -17.025 1.00 12.34 O ATOM 1093 CB TYR A 72 4.353 8.922 -19.752 1.00 14.13 C ATOM 1094 CG TYR A 72 5.077 7.660 -20.162 1.00 44.21 C ATOM 1095 CD1 TYR A 72 6.352 7.381 -19.686 1.00 2.34 C ATOM 1096 CD2 TYR A 72 4.486 6.746 -21.026 1.00 4.11 C ATOM 1097 CE1 TYR A 72 7.018 6.230 -20.059 1.00 22.14 C ATOM 1098 CE2 TYR A 72 5.144 5.591 -21.403 1.00 44.42 C ATOM 1099 CZ TYR A 72 6.410 5.338 -20.917 1.00 41.13 C ATOM 1100 OH TYR A 72 7.070 4.189 -21.290 1.00 53.32 O ATOM 0 H TYR A 72 2.234 9.524 -18.142 1.00 70.44 H new ATOM 0 HA TYR A 72 4.952 8.409 -17.752 1.00 43.43 H new ATOM 0 HB2 TYR A 72 3.338 8.894 -20.148 1.00 14.13 H new ATOM 0 HB3 TYR A 72 4.849 9.779 -20.207 1.00 14.13 H new ATOM 0 HD1 TYR A 72 6.831 8.076 -19.012 1.00 2.34 H new ATOM 0 HD2 TYR A 72 3.495 6.942 -21.409 1.00 4.11 H new ATOM 0 HE1 TYR A 72 8.010 6.030 -19.681 1.00 22.14 H new ATOM 0 HE2 TYR A 72 4.670 4.890 -22.074 1.00 44.42 H new ATOM 0 HH TYR A 72 6.503 3.668 -21.897 1.00 53.32 H new ATOM 1110 N LEU A 73 4.192 11.530 -18.555 1.00 63.43 N ATOM 1111 CA LEU A 73 4.553 12.922 -18.314 1.00 2.32 C ATOM 1112 C LEU A 73 3.309 13.800 -18.225 1.00 34.32 C ATOM 1113 O LEU A 73 2.977 14.545 -19.147 1.00 3.10 O ATOM 1114 CB LEU A 73 5.472 13.432 -19.426 1.00 32.22 C ATOM 1115 CG LEU A 73 6.973 13.340 -19.151 1.00 2.33 C ATOM 1116 CD1 LEU A 73 7.338 14.139 -17.909 1.00 40.21 C ATOM 1117 CD2 LEU A 73 7.400 11.888 -18.997 1.00 34.32 C ATOM 0 H LEU A 73 3.476 11.398 -19.270 1.00 63.43 H new ATOM 0 HA LEU A 73 5.081 12.974 -17.362 1.00 2.32 H new ATOM 0 HB2 LEU A 73 5.255 12.872 -20.335 1.00 32.22 H new ATOM 0 HB3 LEU A 73 5.223 14.474 -19.627 1.00 32.22 H new ATOM 0 HG LEU A 73 7.505 13.766 -20.002 1.00 2.33 H new ATOM 0 HD11 LEU A 73 8.410 14.062 -17.729 1.00 40.21 H new ATOM 0 HD12 LEU A 73 7.069 15.185 -18.057 1.00 40.21 H new ATOM 0 HD13 LEU A 73 6.796 13.744 -17.050 1.00 40.21 H new ATOM 0 HD21 LEU A 73 8.471 11.843 -18.802 1.00 34.32 H new ATOM 0 HD22 LEU A 73 6.860 11.436 -18.165 1.00 34.32 H new ATOM 0 HD23 LEU A 73 7.175 11.343 -19.914 1.00 34.32 H new ATOM 1129 N PRO A 74 2.603 13.712 -17.088 1.00 12.34 N ATOM 1130 CA PRO A 74 1.385 14.493 -16.850 1.00 2.14 C ATOM 1131 C PRO A 74 1.675 15.979 -16.670 1.00 44.33 C ATOM 1132 O PRO A 74 2.595 16.360 -15.945 1.00 41.43 O ATOM 1133 CB PRO A 74 0.829 13.897 -15.554 1.00 71.22 C ATOM 1134 CG PRO A 74 2.016 13.324 -14.860 1.00 43.23 C ATOM 1135 CD PRO A 74 2.939 12.845 -15.946 1.00 63.23 C ATOM 0 HA PRO A 74 0.695 14.438 -17.692 1.00 2.14 H new ATOM 0 HB2 PRO A 74 0.344 14.659 -14.944 1.00 71.22 H new ATOM 0 HB3 PRO A 74 0.082 13.130 -15.760 1.00 71.22 H new ATOM 0 HG2 PRO A 74 2.503 14.074 -14.236 1.00 43.23 H new ATOM 0 HG3 PRO A 74 1.726 12.503 -14.204 1.00 43.23 H new ATOM 0 HD2 PRO A 74 3.985 12.948 -15.658 1.00 63.23 H new ATOM 0 HD3 PRO A 74 2.774 11.793 -16.178 1.00 63.23 H new ATOM 1143 N THR A 75 0.885 16.817 -17.335 1.00 61.52 N ATOM 1144 CA THR A 75 1.058 18.261 -17.250 1.00 14.15 C ATOM 1145 C THR A 75 0.860 18.755 -15.821 1.00 21.31 C ATOM 1146 O THR A 75 1.267 19.864 -15.475 1.00 64.04 O ATOM 1147 CB THR A 75 0.074 19.000 -18.177 1.00 2.35 C ATOM 1148 OG1 THR A 75 0.215 18.524 -19.520 1.00 32.04 O ATOM 1149 CG2 THR A 75 0.318 20.501 -18.137 1.00 52.43 C ATOM 0 H THR A 75 0.119 16.519 -17.939 1.00 61.52 H new ATOM 0 HA THR A 75 2.078 18.477 -17.569 1.00 14.15 H new ATOM 0 HB THR A 75 -0.939 18.803 -17.827 1.00 2.35 H new ATOM 0 HG1 THR A 75 -0.415 18.997 -20.103 1.00 32.04 H new ATOM 0 HG21 THR A 75 -0.388 21.002 -18.799 1.00 52.43 H new ATOM 0 HG22 THR A 75 0.182 20.865 -17.119 1.00 52.43 H new ATOM 0 HG23 THR A 75 1.336 20.713 -18.465 1.00 52.43 H new ATOM 1157 N ASP A 76 0.234 17.924 -14.994 1.00 53.54 N ATOM 1158 CA ASP A 76 -0.016 18.276 -13.601 1.00 51.24 C ATOM 1159 C ASP A 76 -0.694 17.126 -12.864 1.00 15.02 C ATOM 1160 O ASP A 76 -0.838 16.029 -13.403 1.00 24.44 O ATOM 1161 CB ASP A 76 -0.883 19.534 -13.518 1.00 61.42 C ATOM 1162 CG ASP A 76 -0.507 20.420 -12.347 1.00 22.41 C ATOM 1163 OD1 ASP A 76 0.648 20.892 -12.308 1.00 2.21 O ATOM 1164 OD2 ASP A 76 -1.367 20.640 -11.469 1.00 33.44 O ATOM 0 H ASP A 76 -0.109 17.002 -15.264 1.00 53.54 H new ATOM 0 HA ASP A 76 0.944 18.474 -13.124 1.00 51.24 H new ATOM 0 HB2 ASP A 76 -0.786 20.100 -14.444 1.00 61.42 H new ATOM 0 HB3 ASP A 76 -1.930 19.245 -13.429 1.00 61.42 H new ATOM 1169 N SER A 77 -1.109 17.385 -11.628 1.00 13.12 N ATOM 1170 CA SER A 77 -1.768 16.370 -10.814 1.00 50.11 C ATOM 1171 C SER A 77 -3.073 15.917 -11.462 1.00 11.42 C ATOM 1172 O SER A 77 -3.616 14.867 -11.123 1.00 24.51 O ATOM 1173 CB SER A 77 -2.043 16.912 -9.410 1.00 33.51 C ATOM 1174 OG SER A 77 -2.468 15.878 -8.539 1.00 34.30 O ATOM 0 H SER A 77 -1.001 18.289 -11.168 1.00 13.12 H new ATOM 0 HA SER A 77 -1.102 15.510 -10.740 1.00 50.11 H new ATOM 0 HB2 SER A 77 -1.141 17.378 -9.013 1.00 33.51 H new ATOM 0 HB3 SER A 77 -2.807 17.688 -9.459 1.00 33.51 H new ATOM 0 HG SER A 77 -2.636 16.249 -7.648 1.00 34.30 H new ATOM 1180 N GLY A 78 -3.572 16.720 -12.397 1.00 50.11 N ATOM 1181 CA GLY A 78 -4.809 16.386 -13.078 1.00 53.32 C ATOM 1182 C GLY A 78 -5.110 17.326 -14.229 1.00 5.22 C ATOM 1183 O GLY A 78 -6.261 17.701 -14.448 1.00 20.42 O ATOM 0 H GLY A 78 -3.142 17.596 -12.695 1.00 50.11 H new ATOM 0 HA2 GLY A 78 -4.749 15.364 -13.454 1.00 53.32 H new ATOM 0 HA3 GLY A 78 -5.632 16.415 -12.364 1.00 53.32 H new ATOM 1187 N GLU A 79 -4.071 17.709 -14.965 1.00 3.45 N ATOM 1188 CA GLU A 79 -4.230 18.614 -16.097 1.00 62.12 C ATOM 1189 C GLU A 79 -4.584 17.841 -17.365 1.00 3.42 C ATOM 1190 O GLU A 79 -5.429 18.270 -18.151 1.00 64.53 O ATOM 1191 CB GLU A 79 -2.948 19.420 -16.319 1.00 70.50 C ATOM 1192 CG GLU A 79 -2.960 20.780 -15.643 1.00 4.12 C ATOM 1193 CD GLU A 79 -3.964 21.732 -16.264 1.00 23.32 C ATOM 1194 OE1 GLU A 79 -4.690 21.307 -17.187 1.00 42.32 O ATOM 1195 OE2 GLU A 79 -4.023 22.900 -15.827 1.00 54.02 O ATOM 0 H GLU A 79 -3.111 17.407 -14.798 1.00 3.45 H new ATOM 0 HA GLU A 79 -5.046 19.300 -15.870 1.00 62.12 H new ATOM 0 HB2 GLU A 79 -2.099 18.846 -15.947 1.00 70.50 H new ATOM 0 HB3 GLU A 79 -2.796 19.557 -17.390 1.00 70.50 H new ATOM 0 HG2 GLU A 79 -3.191 20.654 -14.585 1.00 4.12 H new ATOM 0 HG3 GLU A 79 -1.964 21.219 -15.702 1.00 4.12 H new ATOM 1202 N LYS A 80 -3.931 16.700 -17.557 1.00 2.23 N ATOM 1203 CA LYS A 80 -4.175 15.866 -18.727 1.00 71.13 C ATOM 1204 C LYS A 80 -5.420 15.007 -18.533 1.00 34.21 C ATOM 1205 O LYS A 80 -6.098 14.653 -19.497 1.00 53.22 O ATOM 1206 CB LYS A 80 -2.964 14.972 -19.004 1.00 10.03 C ATOM 1207 CG LYS A 80 -2.032 15.523 -20.068 1.00 44.35 C ATOM 1208 CD LYS A 80 -2.713 15.592 -21.425 1.00 22.10 C ATOM 1209 CE LYS A 80 -2.303 16.840 -22.192 1.00 61.30 C ATOM 1210 NZ LYS A 80 -3.439 17.414 -22.965 1.00 10.13 N ATOM 0 H LYS A 80 -3.228 16.332 -16.916 1.00 2.23 H new ATOM 0 HA LYS A 80 -4.337 16.522 -19.582 1.00 71.13 H new ATOM 0 HB2 LYS A 80 -2.405 14.835 -18.078 1.00 10.03 H new ATOM 0 HB3 LYS A 80 -3.313 13.987 -19.314 1.00 10.03 H new ATOM 0 HG2 LYS A 80 -1.695 16.518 -19.778 1.00 44.35 H new ATOM 0 HG3 LYS A 80 -1.145 14.894 -20.137 1.00 44.35 H new ATOM 0 HD2 LYS A 80 -2.458 14.706 -22.007 1.00 22.10 H new ATOM 0 HD3 LYS A 80 -3.795 15.585 -21.291 1.00 22.10 H new ATOM 0 HE2 LYS A 80 -1.924 17.587 -21.494 1.00 61.30 H new ATOM 0 HE3 LYS A 80 -1.487 16.596 -22.872 1.00 61.30 H new ATOM 0 HZ1 LYS A 80 -3.119 18.263 -23.474 1.00 10.13 H new ATOM 0 HZ2 LYS A 80 -3.784 16.710 -23.649 1.00 10.13 H new ATOM 0 HZ3 LYS A 80 -4.208 17.670 -22.313 1.00 10.13 H new ATOM 1224 N MET A 81 -5.716 14.676 -17.280 1.00 40.11 N ATOM 1225 CA MET A 81 -6.882 13.861 -16.960 1.00 61.32 C ATOM 1226 C MET A 81 -8.161 14.689 -17.033 1.00 60.41 C ATOM 1227 O MET A 81 -9.145 14.278 -17.650 1.00 43.30 O ATOM 1228 CB MET A 81 -6.736 13.248 -15.566 1.00 4.31 C ATOM 1229 CG MET A 81 -5.372 12.626 -15.315 1.00 45.24 C ATOM 1230 SD MET A 81 -5.165 12.068 -13.613 1.00 64.15 S ATOM 1231 CE MET A 81 -3.571 12.782 -13.214 1.00 71.24 C ATOM 0 H MET A 81 -5.165 14.960 -16.470 1.00 40.11 H new ATOM 0 HA MET A 81 -6.947 13.060 -17.696 1.00 61.32 H new ATOM 0 HB2 MET A 81 -6.917 14.020 -14.818 1.00 4.31 H new ATOM 0 HB3 MET A 81 -7.504 12.486 -15.431 1.00 4.31 H new ATOM 0 HG2 MET A 81 -5.233 11.781 -15.990 1.00 45.24 H new ATOM 0 HG3 MET A 81 -4.596 13.354 -15.551 1.00 45.24 H new ATOM 0 HE1 MET A 81 -3.554 13.070 -12.163 1.00 71.24 H new ATOM 0 HE2 MET A 81 -2.787 12.049 -13.402 1.00 71.24 H new ATOM 0 HE3 MET A 81 -3.401 13.662 -13.834 1.00 71.24 H new ATOM 1241 N THR A 82 -8.141 15.857 -16.399 1.00 35.01 N ATOM 1242 CA THR A 82 -9.300 16.742 -16.391 1.00 23.43 C ATOM 1243 C THR A 82 -9.766 17.050 -17.809 1.00 4.51 C ATOM 1244 O THR A 82 -10.953 17.266 -18.048 1.00 52.30 O ATOM 1245 CB THR A 82 -8.991 18.064 -15.664 1.00 51.43 C ATOM 1246 OG1 THR A 82 -10.196 18.817 -15.484 1.00 20.10 O ATOM 1247 CG2 THR A 82 -7.984 18.891 -16.450 1.00 21.24 C ATOM 0 H THR A 82 -7.335 16.212 -15.884 1.00 35.01 H new ATOM 0 HA THR A 82 -10.094 16.220 -15.857 1.00 23.43 H new ATOM 0 HB THR A 82 -8.562 17.826 -14.691 1.00 51.43 H new ATOM 0 HG1 THR A 82 -9.992 19.655 -15.020 1.00 20.10 H new ATOM 0 HG21 THR A 82 -7.781 19.820 -15.917 1.00 21.24 H new ATOM 0 HG22 THR A 82 -7.058 18.327 -16.561 1.00 21.24 H new ATOM 0 HG23 THR A 82 -8.391 19.119 -17.435 1.00 21.24 H new ATOM 1255 N GLU A 83 -8.823 17.069 -18.746 1.00 3.21 N ATOM 1256 CA GLU A 83 -9.139 17.352 -20.141 1.00 43.10 C ATOM 1257 C GLU A 83 -9.543 16.078 -20.876 1.00 71.35 C ATOM 1258 O GLU A 83 -10.185 16.131 -21.926 1.00 22.24 O ATOM 1259 CB GLU A 83 -7.939 17.997 -20.838 1.00 52.50 C ATOM 1260 CG GLU A 83 -7.590 19.375 -20.299 1.00 34.41 C ATOM 1261 CD GLU A 83 -7.808 20.474 -21.321 1.00 34.53 C ATOM 1262 OE1 GLU A 83 -8.856 20.451 -22.001 1.00 65.21 O ATOM 1263 OE2 GLU A 83 -6.933 21.356 -21.440 1.00 63.53 O ATOM 0 H GLU A 83 -7.835 16.892 -18.564 1.00 3.21 H new ATOM 0 HA GLU A 83 -9.979 18.046 -20.163 1.00 43.10 H new ATOM 0 HB2 GLU A 83 -7.073 17.344 -20.730 1.00 52.50 H new ATOM 0 HB3 GLU A 83 -8.148 18.076 -21.905 1.00 52.50 H new ATOM 0 HG2 GLU A 83 -8.196 19.580 -19.416 1.00 34.41 H new ATOM 0 HG3 GLU A 83 -6.548 19.383 -19.979 1.00 34.41 H new ATOM 1270 N SER A 84 -9.162 14.933 -20.318 1.00 53.12 N ATOM 1271 CA SER A 84 -9.481 13.645 -20.922 1.00 63.34 C ATOM 1272 C SER A 84 -10.882 13.190 -20.526 1.00 11.31 C ATOM 1273 O SER A 84 -11.530 12.433 -21.249 1.00 12.22 O ATOM 1274 CB SER A 84 -8.453 12.592 -20.502 1.00 0.42 C ATOM 1275 OG SER A 84 -8.801 12.008 -19.259 1.00 30.13 O ATOM 0 H SER A 84 -8.632 14.871 -19.449 1.00 53.12 H new ATOM 0 HA SER A 84 -9.449 13.763 -22.005 1.00 63.34 H new ATOM 0 HB2 SER A 84 -8.388 11.817 -21.266 1.00 0.42 H new ATOM 0 HB3 SER A 84 -7.467 13.051 -20.429 1.00 0.42 H new ATOM 0 HG SER A 84 -8.949 12.714 -18.596 1.00 30.13 H new ATOM 1281 N LYS A 85 -11.344 13.658 -19.371 1.00 53.34 N ATOM 1282 CA LYS A 85 -12.669 13.303 -18.876 1.00 60.35 C ATOM 1283 C LYS A 85 -13.737 14.206 -19.484 1.00 54.02 C ATOM 1284 O LYS A 85 -14.861 13.771 -19.736 1.00 50.35 O ATOM 1285 CB LYS A 85 -12.709 13.403 -17.350 1.00 34.21 C ATOM 1286 CG LYS A 85 -13.777 12.531 -16.711 1.00 63.03 C ATOM 1287 CD LYS A 85 -14.038 12.935 -15.270 1.00 52.32 C ATOM 1288 CE LYS A 85 -12.747 13.018 -14.471 1.00 45.54 C ATOM 1289 NZ LYS A 85 -12.267 14.422 -14.336 1.00 74.11 N ATOM 0 H LYS A 85 -10.820 14.284 -18.760 1.00 53.34 H new ATOM 0 HA LYS A 85 -12.877 12.275 -19.172 1.00 60.35 H new ATOM 0 HB2 LYS A 85 -11.735 13.122 -16.950 1.00 34.21 H new ATOM 0 HB3 LYS A 85 -12.882 14.441 -17.067 1.00 34.21 H new ATOM 0 HG2 LYS A 85 -14.701 12.607 -17.284 1.00 63.03 H new ATOM 0 HG3 LYS A 85 -13.465 11.487 -16.746 1.00 63.03 H new ATOM 0 HD2 LYS A 85 -14.543 13.901 -15.248 1.00 52.32 H new ATOM 0 HD3 LYS A 85 -14.709 12.213 -14.805 1.00 52.32 H new ATOM 0 HE2 LYS A 85 -12.905 12.591 -13.480 1.00 45.54 H new ATOM 0 HE3 LYS A 85 -11.979 12.417 -14.958 1.00 45.54 H new ATOM 0 HZ1 LYS A 85 -11.251 14.464 -14.555 1.00 74.11 H new ATOM 0 HZ2 LYS A 85 -12.789 15.032 -14.997 1.00 74.11 H new ATOM 0 HZ3 LYS A 85 -12.425 14.751 -13.362 1.00 74.11 H new ATOM 1303 N SER A 86 -13.379 15.464 -19.718 1.00 41.50 N ATOM 1304 CA SER A 86 -14.308 16.429 -20.294 1.00 40.42 C ATOM 1305 C SER A 86 -14.745 15.996 -21.690 1.00 44.35 C ATOM 1306 O SER A 86 -15.751 16.473 -22.214 1.00 75.15 O ATOM 1307 CB SER A 86 -13.663 17.816 -20.356 1.00 74.52 C ATOM 1308 OG SER A 86 -14.346 18.655 -21.272 1.00 25.31 O ATOM 0 H SER A 86 -12.452 15.839 -19.518 1.00 41.50 H new ATOM 0 HA SER A 86 -15.189 16.474 -19.654 1.00 40.42 H new ATOM 0 HB2 SER A 86 -13.673 18.270 -19.365 1.00 74.52 H new ATOM 0 HB3 SER A 86 -12.618 17.722 -20.653 1.00 74.52 H new ATOM 0 HG SER A 86 -13.916 19.535 -21.292 1.00 25.31 H new ATOM 1314 N VAL A 87 -13.979 15.089 -22.288 1.00 61.22 N ATOM 1315 CA VAL A 87 -14.286 14.589 -23.623 1.00 44.42 C ATOM 1316 C VAL A 87 -15.300 13.453 -23.565 1.00 52.01 C ATOM 1317 O VAL A 87 -15.998 13.179 -24.542 1.00 73.42 O ATOM 1318 CB VAL A 87 -13.017 14.094 -24.342 1.00 61.04 C ATOM 1319 CG1 VAL A 87 -13.277 13.931 -25.832 1.00 45.43 C ATOM 1320 CG2 VAL A 87 -11.858 15.048 -24.096 1.00 12.23 C ATOM 0 H VAL A 87 -13.141 14.685 -21.869 1.00 61.22 H new ATOM 0 HA VAL A 87 -14.711 15.422 -24.183 1.00 44.42 H new ATOM 0 HB VAL A 87 -12.747 13.119 -23.935 1.00 61.04 H new ATOM 0 HG11 VAL A 87 -12.369 13.581 -26.324 1.00 45.43 H new ATOM 0 HG12 VAL A 87 -14.076 13.205 -25.985 1.00 45.43 H new ATOM 0 HG13 VAL A 87 -13.572 14.890 -26.257 1.00 45.43 H new ATOM 0 HG21 VAL A 87 -10.970 14.682 -24.612 1.00 12.23 H new ATOM 0 HG22 VAL A 87 -12.115 16.038 -24.474 1.00 12.23 H new ATOM 0 HG23 VAL A 87 -11.657 15.109 -23.026 1.00 12.23 H new ATOM 1330 N LEU A 88 -15.378 12.795 -22.414 1.00 23.12 N ATOM 1331 CA LEU A 88 -16.308 11.687 -22.227 1.00 31.10 C ATOM 1332 C LEU A 88 -17.709 12.200 -21.909 1.00 21.10 C ATOM 1333 O LEU A 88 -18.707 11.615 -22.330 1.00 61.14 O ATOM 1334 CB LEU A 88 -15.821 10.770 -21.103 1.00 51.15 C ATOM 1335 CG LEU A 88 -14.415 10.193 -21.270 1.00 2.21 C ATOM 1336 CD1 LEU A 88 -13.973 9.489 -19.997 1.00 22.52 C ATOM 1337 CD2 LEU A 88 -14.367 9.239 -22.454 1.00 64.12 C ATOM 0 H LEU A 88 -14.808 13.010 -21.596 1.00 23.12 H new ATOM 0 HA LEU A 88 -16.351 11.120 -23.157 1.00 31.10 H new ATOM 0 HB2 LEU A 88 -15.855 11.327 -20.167 1.00 51.15 H new ATOM 0 HB3 LEU A 88 -16.523 9.942 -21.007 1.00 51.15 H new ATOM 0 HG LEU A 88 -13.726 11.015 -21.464 1.00 2.21 H new ATOM 0 HD11 LEU A 88 -12.970 9.085 -20.134 1.00 22.52 H new ATOM 0 HD12 LEU A 88 -13.968 10.200 -19.171 1.00 22.52 H new ATOM 0 HD13 LEU A 88 -14.664 8.677 -19.772 1.00 22.52 H new ATOM 0 HD21 LEU A 88 -13.359 8.838 -22.558 1.00 64.12 H new ATOM 0 HD22 LEU A 88 -15.068 8.420 -22.290 1.00 64.12 H new ATOM 0 HD23 LEU A 88 -14.640 9.774 -23.364 1.00 64.12 H new ATOM 1349 N LYS A 89 -17.776 13.298 -21.164 1.00 52.33 N ATOM 1350 CA LYS A 89 -19.054 13.894 -20.792 1.00 20.31 C ATOM 1351 C LYS A 89 -19.625 14.720 -21.940 1.00 65.12 C ATOM 1352 O LYS A 89 -20.839 14.782 -22.129 1.00 13.43 O ATOM 1353 CB LYS A 89 -18.888 14.773 -19.550 1.00 62.14 C ATOM 1354 CG LYS A 89 -18.540 13.993 -18.295 1.00 24.33 C ATOM 1355 CD LYS A 89 -19.784 13.455 -17.609 1.00 74.43 C ATOM 1356 CE LYS A 89 -20.296 14.416 -16.547 1.00 43.15 C ATOM 1357 NZ LYS A 89 -19.596 14.229 -15.246 1.00 73.52 N ATOM 0 H LYS A 89 -16.960 13.794 -20.806 1.00 52.33 H new ATOM 0 HA LYS A 89 -19.751 13.086 -20.568 1.00 20.31 H new ATOM 0 HB2 LYS A 89 -18.107 15.509 -19.738 1.00 62.14 H new ATOM 0 HB3 LYS A 89 -19.812 15.325 -19.380 1.00 62.14 H new ATOM 0 HG2 LYS A 89 -17.879 13.166 -18.552 1.00 24.33 H new ATOM 0 HG3 LYS A 89 -17.993 14.636 -17.606 1.00 24.33 H new ATOM 0 HD2 LYS A 89 -20.564 13.282 -18.351 1.00 74.43 H new ATOM 0 HD3 LYS A 89 -19.560 12.491 -17.151 1.00 74.43 H new ATOM 0 HE2 LYS A 89 -20.159 15.442 -16.889 1.00 43.15 H new ATOM 0 HE3 LYS A 89 -21.367 14.267 -16.408 1.00 43.15 H new ATOM 0 HZ1 LYS A 89 -19.973 14.902 -14.549 1.00 73.52 H new ATOM 0 HZ2 LYS A 89 -19.748 13.258 -14.907 1.00 73.52 H new ATOM 0 HZ3 LYS A 89 -18.577 14.396 -15.373 1.00 73.52 H new ATOM 1371 N SER A 90 -18.740 15.351 -22.706 1.00 0.24 N ATOM 1372 CA SER A 90 -19.156 16.175 -23.834 1.00 52.33 C ATOM 1373 C SER A 90 -19.454 15.312 -25.056 1.00 55.24 C ATOM 1374 O SER A 90 -20.151 15.739 -25.978 1.00 15.42 O ATOM 1375 CB SER A 90 -18.072 17.200 -24.172 1.00 44.10 C ATOM 1376 OG SER A 90 -17.051 16.620 -24.966 1.00 32.11 O ATOM 0 H SER A 90 -17.731 15.307 -22.565 1.00 0.24 H new ATOM 0 HA SER A 90 -20.068 16.701 -23.551 1.00 52.33 H new ATOM 0 HB2 SER A 90 -18.516 18.042 -24.703 1.00 44.10 H new ATOM 0 HB3 SER A 90 -17.641 17.595 -23.252 1.00 44.10 H new ATOM 0 HG SER A 90 -16.371 17.296 -25.170 1.00 32.11 H new ATOM 1382 N LEU A 91 -18.922 14.095 -25.057 1.00 41.23 N ATOM 1383 CA LEU A 91 -19.130 13.170 -26.166 1.00 31.34 C ATOM 1384 C LEU A 91 -20.569 12.665 -26.191 1.00 13.14 C ATOM 1385 O LEU A 91 -21.210 12.633 -27.242 1.00 0.01 O ATOM 1386 CB LEU A 91 -18.165 11.988 -26.057 1.00 70.12 C ATOM 1387 CG LEU A 91 -18.675 10.653 -26.600 1.00 72.34 C ATOM 1388 CD1 LEU A 91 -19.010 10.771 -28.079 1.00 73.01 C ATOM 1389 CD2 LEU A 91 -17.646 9.555 -26.371 1.00 12.40 C ATOM 0 H LEU A 91 -18.343 13.725 -24.303 1.00 41.23 H new ATOM 0 HA LEU A 91 -18.936 13.706 -27.095 1.00 31.34 H new ATOM 0 HB2 LEU A 91 -17.246 12.245 -26.585 1.00 70.12 H new ATOM 0 HB3 LEU A 91 -17.903 11.854 -25.007 1.00 70.12 H new ATOM 0 HG LEU A 91 -19.585 10.388 -26.062 1.00 72.34 H new ATOM 0 HD11 LEU A 91 -19.371 9.811 -28.448 1.00 73.01 H new ATOM 0 HD12 LEU A 91 -19.783 11.527 -28.218 1.00 73.01 H new ATOM 0 HD13 LEU A 91 -18.116 11.059 -28.633 1.00 73.01 H new ATOM 0 HD21 LEU A 91 -18.026 8.612 -26.764 1.00 12.40 H new ATOM 0 HD22 LEU A 91 -16.719 9.813 -26.882 1.00 12.40 H new ATOM 0 HD23 LEU A 91 -17.455 9.452 -25.303 1.00 12.40 H new ATOM 1401 N THR A 92 -21.074 12.273 -25.025 1.00 21.12 N ATOM 1402 CA THR A 92 -22.438 11.771 -24.912 1.00 44.12 C ATOM 1403 C THR A 92 -23.438 12.760 -25.500 1.00 64.24 C ATOM 1404 O THR A 92 -24.511 12.371 -25.959 1.00 15.14 O ATOM 1405 CB THR A 92 -22.813 11.490 -23.445 1.00 74.21 C ATOM 1406 OG1 THR A 92 -23.933 10.599 -23.388 1.00 63.43 O ATOM 1407 CG2 THR A 92 -23.150 12.782 -22.715 1.00 63.54 C ATOM 0 H THR A 92 -20.558 12.294 -24.145 1.00 21.12 H new ATOM 0 HA THR A 92 -22.480 10.839 -25.475 1.00 44.12 H new ATOM 0 HB THR A 92 -21.955 11.028 -22.956 1.00 74.21 H new ATOM 0 HG1 THR A 92 -23.614 9.681 -23.263 1.00 63.43 H new ATOM 0 HG21 THR A 92 -23.412 12.558 -21.681 1.00 63.54 H new ATOM 0 HG22 THR A 92 -22.287 13.447 -22.735 1.00 63.54 H new ATOM 0 HG23 THR A 92 -23.993 13.268 -23.206 1.00 63.54 H new ATOM 1415 N GLU A 93 -23.077 14.039 -25.485 1.00 10.22 N ATOM 1416 CA GLU A 93 -23.945 15.083 -26.017 1.00 44.25 C ATOM 1417 C GLU A 93 -24.333 14.783 -27.462 1.00 42.35 C ATOM 1418 O GLU A 93 -25.420 15.145 -27.913 1.00 60.34 O ATOM 1419 CB GLU A 93 -23.251 16.445 -25.936 1.00 64.53 C ATOM 1420 CG GLU A 93 -24.100 17.523 -25.284 1.00 63.41 C ATOM 1421 CD GLU A 93 -23.926 18.879 -25.940 1.00 22.30 C ATOM 1422 OE1 GLU A 93 -22.898 19.080 -26.620 1.00 41.51 O ATOM 1423 OE2 GLU A 93 -24.817 19.738 -25.773 1.00 65.33 O ATOM 0 H GLU A 93 -22.190 14.377 -25.111 1.00 10.22 H new ATOM 0 HA GLU A 93 -24.852 15.109 -25.413 1.00 44.25 H new ATOM 0 HB2 GLU A 93 -22.322 16.337 -25.376 1.00 64.53 H new ATOM 0 HB3 GLU A 93 -22.981 16.766 -26.942 1.00 64.53 H new ATOM 0 HG2 GLU A 93 -25.149 17.232 -25.332 1.00 63.41 H new ATOM 0 HG3 GLU A 93 -23.838 17.598 -24.229 1.00 63.41 H new ATOM 1430 N LYS A 94 -23.436 14.120 -28.184 1.00 43.44 N ATOM 1431 CA LYS A 94 -23.682 13.770 -29.578 1.00 52.11 C ATOM 1432 C LYS A 94 -24.494 12.482 -29.680 1.00 45.42 C ATOM 1433 O LYS A 94 -25.163 12.236 -30.685 1.00 2.34 O ATOM 1434 CB LYS A 94 -22.357 13.611 -30.328 1.00 14.45 C ATOM 1435 CG LYS A 94 -22.423 14.055 -31.779 1.00 24.22 C ATOM 1436 CD LYS A 94 -21.695 15.372 -31.993 1.00 34.42 C ATOM 1437 CE LYS A 94 -22.554 16.556 -31.577 1.00 40.44 C ATOM 1438 NZ LYS A 94 -21.784 17.544 -30.772 1.00 2.21 N ATOM 0 H LYS A 94 -22.531 13.814 -27.826 1.00 43.44 H new ATOM 0 HA LYS A 94 -24.255 14.578 -30.034 1.00 52.11 H new ATOM 0 HB2 LYS A 94 -21.587 14.187 -29.815 1.00 14.45 H new ATOM 0 HB3 LYS A 94 -22.051 12.566 -30.290 1.00 14.45 H new ATOM 0 HG2 LYS A 94 -21.983 13.287 -32.416 1.00 24.22 H new ATOM 0 HG3 LYS A 94 -23.465 14.161 -32.081 1.00 24.22 H new ATOM 0 HD2 LYS A 94 -20.768 15.374 -31.420 1.00 34.42 H new ATOM 0 HD3 LYS A 94 -21.421 15.471 -33.043 1.00 34.42 H new ATOM 0 HE2 LYS A 94 -22.954 17.044 -32.466 1.00 40.44 H new ATOM 0 HE3 LYS A 94 -23.406 16.201 -30.998 1.00 40.44 H new ATOM 0 HZ1 LYS A 94 -22.405 18.336 -30.508 1.00 2.21 H new ATOM 0 HZ2 LYS A 94 -21.423 17.085 -29.911 1.00 2.21 H new ATOM 0 HZ3 LYS A 94 -20.985 17.902 -31.334 1.00 2.21 H new ATOM 1452 N LEU A 95 -24.431 11.665 -28.635 1.00 70.11 N ATOM 1453 CA LEU A 95 -25.162 10.403 -28.606 1.00 63.54 C ATOM 1454 C LEU A 95 -26.608 10.620 -28.173 1.00 2.12 C ATOM 1455 O LEU A 95 -27.486 9.811 -28.474 1.00 11.44 O ATOM 1456 CB LEU A 95 -24.476 9.415 -27.660 1.00 15.42 C ATOM 1457 CG LEU A 95 -24.864 7.946 -27.827 1.00 71.21 C ATOM 1458 CD1 LEU A 95 -24.593 7.481 -29.249 1.00 64.43 C ATOM 1459 CD2 LEU A 95 -24.112 7.079 -26.828 1.00 33.23 C ATOM 0 H LEU A 95 -23.881 11.853 -27.797 1.00 70.11 H new ATOM 0 HA LEU A 95 -25.163 9.989 -29.614 1.00 63.54 H new ATOM 0 HB2 LEU A 95 -23.398 9.503 -27.795 1.00 15.42 H new ATOM 0 HB3 LEU A 95 -24.694 9.713 -26.635 1.00 15.42 H new ATOM 0 HG LEU A 95 -25.932 7.848 -27.632 1.00 71.21 H new ATOM 0 HD11 LEU A 95 -24.875 6.433 -29.349 1.00 64.43 H new ATOM 0 HD12 LEU A 95 -25.177 8.082 -29.946 1.00 64.43 H new ATOM 0 HD13 LEU A 95 -23.532 7.594 -29.473 1.00 64.43 H new ATOM 0 HD21 LEU A 95 -24.401 6.036 -26.961 1.00 33.23 H new ATOM 0 HD22 LEU A 95 -23.039 7.182 -26.992 1.00 33.23 H new ATOM 0 HD23 LEU A 95 -24.357 7.396 -25.814 1.00 33.23 H new ATOM 1471 N LYS A 96 -26.849 11.719 -27.466 1.00 31.12 N ATOM 1472 CA LYS A 96 -28.189 12.046 -26.993 1.00 40.32 C ATOM 1473 C LYS A 96 -29.113 12.375 -28.161 1.00 42.45 C ATOM 1474 O LYS A 96 -30.313 12.104 -28.113 1.00 63.34 O ATOM 1475 CB LYS A 96 -28.135 13.229 -26.023 1.00 71.21 C ATOM 1476 CG LYS A 96 -27.456 12.903 -24.704 1.00 73.10 C ATOM 1477 CD LYS A 96 -28.368 13.188 -23.522 1.00 70.23 C ATOM 1478 CE LYS A 96 -28.020 12.315 -22.326 1.00 62.14 C ATOM 1479 NZ LYS A 96 -29.229 11.684 -21.730 1.00 32.54 N ATOM 0 H LYS A 96 -26.133 12.399 -27.208 1.00 31.12 H new ATOM 0 HA LYS A 96 -28.586 11.175 -26.472 1.00 40.32 H new ATOM 0 HB2 LYS A 96 -27.607 14.055 -26.499 1.00 71.21 H new ATOM 0 HB3 LYS A 96 -29.150 13.572 -25.824 1.00 71.21 H new ATOM 0 HG2 LYS A 96 -27.163 11.853 -24.694 1.00 73.10 H new ATOM 0 HG3 LYS A 96 -26.542 13.490 -24.609 1.00 73.10 H new ATOM 0 HD2 LYS A 96 -28.286 14.239 -23.243 1.00 70.23 H new ATOM 0 HD3 LYS A 96 -29.405 13.015 -23.811 1.00 70.23 H new ATOM 0 HE2 LYS A 96 -27.320 11.539 -22.635 1.00 62.14 H new ATOM 0 HE3 LYS A 96 -27.515 12.918 -21.571 1.00 62.14 H new ATOM 0 HZ1 LYS A 96 -28.950 11.097 -20.918 1.00 32.54 H new ATOM 0 HZ2 LYS A 96 -29.886 12.425 -21.412 1.00 32.54 H new ATOM 0 HZ3 LYS A 96 -29.697 11.088 -22.443 1.00 32.54 H new ATOM 1493 N LYS A 97 -28.546 12.961 -29.211 1.00 72.42 N ATOM 1494 CA LYS A 97 -29.318 13.324 -30.394 1.00 4.42 C ATOM 1495 C LYS A 97 -29.798 12.080 -31.134 1.00 13.22 C ATOM 1496 O LYS A 97 -30.653 12.163 -32.017 1.00 4.43 O ATOM 1497 CB LYS A 97 -28.475 14.194 -31.330 1.00 32.11 C ATOM 1498 CG LYS A 97 -29.035 15.592 -31.529 1.00 63.24 C ATOM 1499 CD LYS A 97 -30.080 15.622 -32.632 1.00 44.12 C ATOM 1500 CE LYS A 97 -31.458 15.253 -32.105 1.00 4.03 C ATOM 1501 NZ LYS A 97 -31.966 16.258 -31.131 1.00 12.22 N ATOM 0 H LYS A 97 -27.555 13.195 -29.267 1.00 72.42 H new ATOM 0 HA LYS A 97 -30.191 13.890 -30.068 1.00 4.42 H new ATOM 0 HB2 LYS A 97 -27.464 14.270 -30.930 1.00 32.11 H new ATOM 0 HB3 LYS A 97 -28.398 13.701 -32.299 1.00 32.11 H new ATOM 0 HG2 LYS A 97 -29.478 15.944 -30.597 1.00 63.24 H new ATOM 0 HG3 LYS A 97 -28.225 16.278 -31.775 1.00 63.24 H new ATOM 0 HD2 LYS A 97 -30.114 16.617 -33.076 1.00 44.12 H new ATOM 0 HD3 LYS A 97 -29.795 14.929 -33.424 1.00 44.12 H new ATOM 0 HE2 LYS A 97 -32.155 15.170 -32.939 1.00 4.03 H new ATOM 0 HE3 LYS A 97 -31.414 14.274 -31.627 1.00 4.03 H new ATOM 0 HZ1 LYS A 97 -33.004 16.208 -31.090 1.00 12.22 H new ATOM 0 HZ2 LYS A 97 -31.572 16.058 -30.189 1.00 12.22 H new ATOM 0 HZ3 LYS A 97 -31.677 17.210 -31.432 1.00 12.22 H new ATOM 1515 N ILE A 98 -29.246 10.929 -30.767 1.00 64.12 N ATOM 1516 CA ILE A 98 -29.621 9.668 -31.395 1.00 23.01 C ATOM 1517 C ILE A 98 -31.133 9.476 -31.381 1.00 73.42 C ATOM 1518 O ILE A 98 -31.686 8.755 -32.212 1.00 60.32 O ATOM 1519 CB ILE A 98 -28.956 8.470 -30.692 1.00 63.43 C ATOM 1520 CG1 ILE A 98 -28.949 7.249 -31.615 1.00 43.11 C ATOM 1521 CG2 ILE A 98 -29.676 8.152 -29.391 1.00 14.14 C ATOM 1522 CD1 ILE A 98 -27.591 6.951 -32.213 1.00 14.32 C ATOM 0 H ILE A 98 -28.538 10.843 -30.038 1.00 64.12 H new ATOM 0 HA ILE A 98 -29.272 9.713 -32.427 1.00 23.01 H new ATOM 0 HB ILE A 98 -27.924 8.732 -30.458 1.00 63.43 H new ATOM 0 HG12 ILE A 98 -29.289 6.378 -31.055 1.00 43.11 H new ATOM 0 HG13 ILE A 98 -29.665 7.409 -32.421 1.00 43.11 H new ATOM 0 HG21 ILE A 98 -29.194 7.303 -28.906 1.00 14.14 H new ATOM 0 HG22 ILE A 98 -29.634 9.018 -28.731 1.00 14.14 H new ATOM 0 HG23 ILE A 98 -30.717 7.906 -29.602 1.00 14.14 H new ATOM 0 HD11 ILE A 98 -27.661 6.073 -32.856 1.00 14.32 H new ATOM 0 HD12 ILE A 98 -27.257 7.806 -32.801 1.00 14.32 H new ATOM 0 HD13 ILE A 98 -26.876 6.759 -31.413 1.00 14.32 H new ATOM 1534 N VAL A 99 -31.799 10.127 -30.432 1.00 63.15 N ATOM 1535 CA VAL A 99 -33.248 10.030 -30.312 1.00 15.33 C ATOM 1536 C VAL A 99 -33.938 10.467 -31.600 1.00 5.14 C ATOM 1537 O VAL A 99 -35.090 10.115 -31.848 1.00 51.11 O ATOM 1538 CB VAL A 99 -33.773 10.889 -29.145 1.00 60.43 C ATOM 1539 CG1 VAL A 99 -34.086 12.300 -29.619 1.00 74.42 C ATOM 1540 CG2 VAL A 99 -35.000 10.243 -28.519 1.00 24.12 C ATOM 0 H VAL A 99 -31.357 10.727 -29.735 1.00 63.15 H new ATOM 0 HA VAL A 99 -33.480 8.983 -30.117 1.00 15.33 H new ATOM 0 HB VAL A 99 -32.995 10.952 -28.384 1.00 60.43 H new ATOM 0 HG11 VAL A 99 -34.455 12.892 -28.781 1.00 74.42 H new ATOM 0 HG12 VAL A 99 -33.181 12.759 -30.017 1.00 74.42 H new ATOM 0 HG13 VAL A 99 -34.846 12.261 -30.399 1.00 74.42 H new ATOM 0 HG21 VAL A 99 -35.358 10.863 -27.697 1.00 24.12 H new ATOM 0 HG22 VAL A 99 -35.784 10.148 -29.270 1.00 24.12 H new ATOM 0 HG23 VAL A 99 -34.738 9.255 -28.141 1.00 24.12 H new ATOM 1550 N GLU A 100 -33.223 11.236 -32.415 1.00 63.35 N ATOM 1551 CA GLU A 100 -33.767 11.721 -33.678 1.00 64.25 C ATOM 1552 C GLU A 100 -33.532 10.709 -34.796 1.00 44.14 C ATOM 1553 O GLU A 100 -34.192 10.750 -35.835 1.00 72.13 O ATOM 1554 CB GLU A 100 -33.134 13.064 -34.050 1.00 23.44 C ATOM 1555 CG GLU A 100 -33.423 13.499 -35.476 1.00 51.32 C ATOM 1556 CD GLU A 100 -33.431 15.007 -35.635 1.00 44.25 C ATOM 1557 OE1 GLU A 100 -34.483 15.627 -35.376 1.00 32.30 O ATOM 1558 OE2 GLU A 100 -32.383 15.568 -36.020 1.00 24.33 O ATOM 0 H GLU A 100 -32.267 11.536 -32.224 1.00 63.35 H new ATOM 0 HA GLU A 100 -34.841 11.856 -33.553 1.00 64.25 H new ATOM 0 HB2 GLU A 100 -33.498 13.830 -33.365 1.00 23.44 H new ATOM 0 HB3 GLU A 100 -32.055 12.998 -33.911 1.00 23.44 H new ATOM 0 HG2 GLU A 100 -32.673 13.071 -36.142 1.00 51.32 H new ATOM 0 HG3 GLU A 100 -34.389 13.100 -35.785 1.00 51.32 H new ATOM 1565 N LEU A 101 -32.586 9.802 -34.576 1.00 52.23 N ATOM 1566 CA LEU A 101 -32.262 8.779 -35.565 1.00 14.15 C ATOM 1567 C LEU A 101 -33.122 7.536 -35.363 1.00 33.55 C ATOM 1568 O LEU A 101 -33.985 7.225 -36.185 1.00 65.00 O ATOM 1569 CB LEU A 101 -30.781 8.408 -35.477 1.00 41.42 C ATOM 1570 CG LEU A 101 -29.939 8.711 -36.717 1.00 40.41 C ATOM 1571 CD1 LEU A 101 -29.807 10.213 -36.919 1.00 33.10 C ATOM 1572 CD2 LEU A 101 -28.566 8.065 -36.601 1.00 34.41 C ATOM 0 H LEU A 101 -32.030 9.754 -33.722 1.00 52.23 H new ATOM 0 HA LEU A 101 -32.470 9.186 -36.555 1.00 14.15 H new ATOM 0 HB2 LEU A 101 -30.345 8.935 -34.628 1.00 41.42 H new ATOM 0 HB3 LEU A 101 -30.706 7.342 -35.263 1.00 41.42 H new ATOM 0 HG LEU A 101 -30.444 8.291 -37.587 1.00 40.41 H new ATOM 0 HD11 LEU A 101 -29.205 10.409 -37.806 1.00 33.10 H new ATOM 0 HD12 LEU A 101 -30.797 10.651 -37.048 1.00 33.10 H new ATOM 0 HD13 LEU A 101 -29.325 10.656 -36.048 1.00 33.10 H new ATOM 0 HD21 LEU A 101 -27.981 8.291 -37.492 1.00 34.41 H new ATOM 0 HD22 LEU A 101 -28.053 8.455 -35.722 1.00 34.41 H new ATOM 0 HD23 LEU A 101 -28.679 6.985 -36.506 1.00 34.41 H new ATOM 1584 N ILE A 102 -32.883 6.829 -34.263 1.00 10.43 N ATOM 1585 CA ILE A 102 -33.638 5.622 -33.951 1.00 61.04 C ATOM 1586 C ILE A 102 -33.989 5.560 -32.469 1.00 22.03 C ATOM 1587 O ILE A 102 -33.412 4.790 -31.701 1.00 1.05 O ATOM 1588 CB ILE A 102 -32.854 4.353 -34.335 1.00 40.25 C ATOM 1589 CG1 ILE A 102 -32.410 4.425 -35.798 1.00 73.41 C ATOM 1590 CG2 ILE A 102 -33.702 3.113 -34.093 1.00 44.33 C ATOM 1591 CD1 ILE A 102 -30.970 4.852 -35.972 1.00 41.34 C ATOM 0 H ILE A 102 -32.172 7.072 -33.573 1.00 10.43 H new ATOM 0 HA ILE A 102 -34.556 5.664 -34.537 1.00 61.04 H new ATOM 0 HB ILE A 102 -31.965 4.289 -33.708 1.00 40.25 H new ATOM 0 HG12 ILE A 102 -32.549 3.448 -36.260 1.00 73.41 H new ATOM 0 HG13 ILE A 102 -33.055 5.124 -36.331 1.00 73.41 H new ATOM 0 HG21 ILE A 102 -33.134 2.224 -34.369 1.00 44.33 H new ATOM 0 HG22 ILE A 102 -33.973 3.058 -33.039 1.00 44.33 H new ATOM 0 HG23 ILE A 102 -34.607 3.168 -34.698 1.00 44.33 H new ATOM 0 HD11 ILE A 102 -30.725 4.881 -37.034 1.00 41.34 H new ATOM 0 HD12 ILE A 102 -30.830 5.843 -35.540 1.00 41.34 H new ATOM 0 HD13 ILE A 102 -30.316 4.140 -35.468 1.00 41.34 H new ATOM 1603 N PRO A 103 -34.959 6.389 -32.055 1.00 71.42 N ATOM 1604 CA PRO A 103 -35.411 6.445 -30.662 1.00 0.32 C ATOM 1605 C PRO A 103 -36.171 5.190 -30.247 1.00 53.15 C ATOM 1606 O PRO A 103 -36.402 4.296 -31.061 1.00 62.40 O ATOM 1607 CB PRO A 103 -36.337 7.664 -30.639 1.00 33.33 C ATOM 1608 CG PRO A 103 -36.821 7.798 -32.041 1.00 53.22 C ATOM 1609 CD PRO A 103 -35.690 7.334 -32.916 1.00 71.50 C ATOM 0 HA PRO A 103 -34.576 6.513 -29.965 1.00 0.32 H new ATOM 0 HB2 PRO A 103 -37.166 7.519 -29.946 1.00 33.33 H new ATOM 0 HB3 PRO A 103 -35.805 8.559 -30.316 1.00 33.33 H new ATOM 0 HG2 PRO A 103 -37.714 7.195 -32.205 1.00 53.22 H new ATOM 0 HG3 PRO A 103 -37.089 8.831 -32.264 1.00 53.22 H new ATOM 0 HD2 PRO A 103 -36.055 6.852 -33.823 1.00 71.50 H new ATOM 0 HD3 PRO A 103 -35.057 8.164 -33.229 1.00 71.50 H new ATOM 1617 N SER A 104 -36.559 5.131 -28.977 1.00 61.24 N ATOM 1618 CA SER A 104 -37.291 3.983 -28.454 1.00 63.04 C ATOM 1619 C SER A 104 -38.194 4.396 -27.296 1.00 41.44 C ATOM 1620 O SER A 104 -38.381 5.585 -27.032 1.00 74.45 O ATOM 1621 CB SER A 104 -36.316 2.897 -27.994 1.00 14.14 C ATOM 1622 OG SER A 104 -35.637 3.289 -26.813 1.00 41.05 O ATOM 0 H SER A 104 -36.379 5.864 -28.291 1.00 61.24 H new ATOM 0 HA SER A 104 -37.915 3.586 -29.254 1.00 63.04 H new ATOM 0 HB2 SER A 104 -36.859 1.969 -27.814 1.00 14.14 H new ATOM 0 HB3 SER A 104 -35.592 2.695 -28.784 1.00 14.14 H new ATOM 0 HG SER A 104 -35.021 2.578 -26.538 1.00 41.05 H new ATOM 1628 N THR A 105 -38.753 3.406 -26.607 1.00 45.21 N ATOM 1629 CA THR A 105 -39.637 3.665 -25.478 1.00 72.02 C ATOM 1630 C THR A 105 -38.988 4.614 -24.477 1.00 53.34 C ATOM 1631 O THR A 105 -37.770 4.788 -24.472 1.00 63.23 O ATOM 1632 CB THR A 105 -40.022 2.360 -24.756 1.00 12.24 C ATOM 1633 OG1 THR A 105 -38.881 1.818 -24.082 1.00 62.12 O ATOM 1634 CG2 THR A 105 -40.570 1.338 -25.740 1.00 62.20 C ATOM 0 H THR A 105 -38.609 2.417 -26.812 1.00 45.21 H new ATOM 0 HA THR A 105 -40.537 4.128 -25.881 1.00 72.02 H new ATOM 0 HB THR A 105 -40.799 2.590 -24.026 1.00 12.24 H new ATOM 0 HG1 THR A 105 -38.176 1.627 -24.735 1.00 62.12 H new ATOM 0 HG21 THR A 105 -40.835 0.425 -25.207 1.00 62.20 H new ATOM 0 HG22 THR A 105 -41.456 1.743 -26.229 1.00 62.20 H new ATOM 0 HG23 THR A 105 -39.812 1.113 -26.491 1.00 62.20 H new ATOM 1642 N SER A 106 -39.810 5.226 -23.631 1.00 11.33 N ATOM 1643 CA SER A 106 -39.316 6.161 -22.627 1.00 23.04 C ATOM 1644 C SER A 106 -38.974 5.434 -21.329 1.00 42.15 C ATOM 1645 O SER A 106 -38.656 6.061 -20.319 1.00 12.02 O ATOM 1646 CB SER A 106 -40.357 7.249 -22.356 1.00 24.03 C ATOM 1647 OG SER A 106 -39.782 8.540 -22.454 1.00 2.51 O ATOM 0 H SER A 106 -40.821 5.091 -23.621 1.00 11.33 H new ATOM 0 HA SER A 106 -38.409 6.625 -23.014 1.00 23.04 H new ATOM 0 HB2 SER A 106 -41.177 7.158 -23.068 1.00 24.03 H new ATOM 0 HB3 SER A 106 -40.782 7.111 -21.362 1.00 24.03 H new ATOM 0 HG SER A 106 -40.468 9.218 -22.278 1.00 2.51 H new ATOM 1653 N SER A 107 -39.042 4.107 -21.367 1.00 5.25 N ATOM 1654 CA SER A 107 -38.743 3.293 -20.194 1.00 14.53 C ATOM 1655 C SER A 107 -37.240 3.078 -20.050 1.00 2.10 C ATOM 1656 O SER A 107 -36.682 3.223 -18.963 1.00 11.33 O ATOM 1657 CB SER A 107 -39.457 1.943 -20.289 1.00 3.42 C ATOM 1658 OG SER A 107 -40.864 2.109 -20.291 1.00 10.21 O ATOM 0 H SER A 107 -39.301 3.573 -22.196 1.00 5.25 H new ATOM 0 HA SER A 107 -39.102 3.824 -19.312 1.00 14.53 H new ATOM 0 HB2 SER A 107 -39.147 1.428 -21.198 1.00 3.42 H new ATOM 0 HB3 SER A 107 -39.163 1.313 -19.449 1.00 3.42 H new ATOM 0 HG SER A 107 -41.297 1.232 -20.354 1.00 10.21 H new ATOM 1664 N ALA A 108 -36.590 2.731 -21.156 1.00 21.41 N ATOM 1665 CA ALA A 108 -35.151 2.497 -21.155 1.00 31.21 C ATOM 1666 C ALA A 108 -34.383 3.802 -21.332 1.00 43.02 C ATOM 1667 O ALA A 108 -33.186 3.872 -21.053 1.00 43.35 O ATOM 1668 CB ALA A 108 -34.776 1.509 -22.249 1.00 73.53 C ATOM 0 H ALA A 108 -37.037 2.606 -22.064 1.00 21.41 H new ATOM 0 HA ALA A 108 -34.877 2.073 -20.189 1.00 31.21 H new ATOM 0 HB1 ALA A 108 -33.699 1.344 -22.236 1.00 73.53 H new ATOM 0 HB2 ALA A 108 -35.290 0.563 -22.077 1.00 73.53 H new ATOM 0 HB3 ALA A 108 -35.070 1.911 -23.219 1.00 73.53 H new ATOM 1674 N VAL A 109 -35.078 4.834 -21.798 1.00 54.35 N ATOM 1675 CA VAL A 109 -34.461 6.138 -22.013 1.00 34.23 C ATOM 1676 C VAL A 109 -33.719 6.606 -20.766 1.00 62.13 C ATOM 1677 O VAL A 109 -32.519 6.880 -20.794 1.00 62.25 O ATOM 1678 CB VAL A 109 -35.509 7.198 -22.401 1.00 72.20 C ATOM 1679 CG1 VAL A 109 -35.100 8.568 -21.882 1.00 55.03 C ATOM 1680 CG2 VAL A 109 -35.704 7.226 -23.909 1.00 52.04 C ATOM 0 H VAL A 109 -36.069 4.793 -22.034 1.00 54.35 H new ATOM 0 HA VAL A 109 -33.752 6.022 -22.833 1.00 34.23 H new ATOM 0 HB VAL A 109 -36.460 6.931 -21.940 1.00 72.20 H new ATOM 0 HG11 VAL A 109 -35.852 9.304 -22.166 1.00 55.03 H new ATOM 0 HG12 VAL A 109 -35.016 8.535 -20.796 1.00 55.03 H new ATOM 0 HG13 VAL A 109 -34.138 8.848 -22.312 1.00 55.03 H new ATOM 0 HG21 VAL A 109 -36.448 7.980 -24.166 1.00 52.04 H new ATOM 0 HG22 VAL A 109 -34.758 7.469 -24.394 1.00 52.04 H new ATOM 0 HG23 VAL A 109 -36.046 6.249 -24.250 1.00 52.04 H new ATOM 1690 N PRO A 110 -34.447 6.700 -19.644 1.00 53.10 N ATOM 1691 CA PRO A 110 -33.878 7.134 -18.365 1.00 1.02 C ATOM 1692 C PRO A 110 -32.923 6.101 -17.775 1.00 54.41 C ATOM 1693 O PRO A 110 -32.176 6.394 -16.841 1.00 2.11 O ATOM 1694 CB PRO A 110 -35.107 7.300 -17.468 1.00 30.14 C ATOM 1695 CG PRO A 110 -36.130 6.389 -18.054 1.00 41.41 C ATOM 1696 CD PRO A 110 -35.883 6.390 -19.537 1.00 62.24 C ATOM 0 HA PRO A 110 -33.284 8.042 -18.470 1.00 1.02 H new ATOM 0 HB2 PRO A 110 -34.883 7.031 -16.436 1.00 30.14 H new ATOM 0 HB3 PRO A 110 -35.455 8.333 -17.460 1.00 30.14 H new ATOM 0 HG2 PRO A 110 -36.038 5.383 -17.644 1.00 41.41 H new ATOM 0 HG3 PRO A 110 -37.138 6.736 -17.826 1.00 41.41 H new ATOM 0 HD2 PRO A 110 -36.120 5.425 -19.984 1.00 62.24 H new ATOM 0 HD3 PRO A 110 -36.494 7.136 -20.046 1.00 62.24 H new ATOM 1704 N LEU A 111 -32.953 4.893 -18.326 1.00 20.12 N ATOM 1705 CA LEU A 111 -32.089 3.816 -17.854 1.00 74.12 C ATOM 1706 C LEU A 111 -30.706 3.909 -18.490 1.00 72.24 C ATOM 1707 O LEU A 111 -29.697 4.012 -17.792 1.00 51.53 O ATOM 1708 CB LEU A 111 -32.718 2.457 -18.169 1.00 3.12 C ATOM 1709 CG LEU A 111 -33.148 1.621 -16.963 1.00 3.12 C ATOM 1710 CD1 LEU A 111 -34.251 0.650 -17.353 1.00 21.33 C ATOM 1711 CD2 LEU A 111 -31.957 0.873 -16.381 1.00 12.24 C ATOM 0 H LEU A 111 -33.566 4.634 -19.099 1.00 20.12 H new ATOM 0 HA LEU A 111 -31.979 3.918 -16.774 1.00 74.12 H new ATOM 0 HB2 LEU A 111 -33.590 2.621 -18.802 1.00 3.12 H new ATOM 0 HB3 LEU A 111 -32.005 1.876 -18.753 1.00 3.12 H new ATOM 0 HG LEU A 111 -33.538 2.293 -16.199 1.00 3.12 H new ATOM 0 HD11 LEU A 111 -34.544 0.064 -16.482 1.00 21.33 H new ATOM 0 HD12 LEU A 111 -35.112 1.207 -17.722 1.00 21.33 H new ATOM 0 HD13 LEU A 111 -33.888 -0.018 -18.135 1.00 21.33 H new ATOM 0 HD21 LEU A 111 -32.281 0.283 -15.524 1.00 12.24 H new ATOM 0 HD22 LEU A 111 -31.537 0.211 -17.139 1.00 12.24 H new ATOM 0 HD23 LEU A 111 -31.198 1.588 -16.063 1.00 12.24 H new ATOM 1723 N ILE A 112 -30.668 3.873 -19.818 1.00 43.10 N ATOM 1724 CA ILE A 112 -29.409 3.957 -20.548 1.00 23.23 C ATOM 1725 C ILE A 112 -28.639 5.219 -20.173 1.00 70.22 C ATOM 1726 O ILE A 112 -27.416 5.272 -20.296 1.00 11.14 O ATOM 1727 CB ILE A 112 -29.639 3.942 -22.071 1.00 5.15 C ATOM 1728 CG1 ILE A 112 -28.386 3.442 -22.793 1.00 3.04 C ATOM 1729 CG2 ILE A 112 -30.021 5.330 -22.562 1.00 11.32 C ATOM 1730 CD1 ILE A 112 -28.666 2.876 -24.167 1.00 61.01 C ATOM 0 H ILE A 112 -31.494 3.786 -20.410 1.00 43.10 H new ATOM 0 HA ILE A 112 -28.823 3.081 -20.269 1.00 23.23 H new ATOM 0 HB ILE A 112 -30.460 3.260 -22.293 1.00 5.15 H new ATOM 0 HG12 ILE A 112 -27.677 4.265 -22.885 1.00 3.04 H new ATOM 0 HG13 ILE A 112 -27.907 2.675 -22.184 1.00 3.04 H new ATOM 0 HG21 ILE A 112 -30.180 5.304 -23.640 1.00 11.32 H new ATOM 0 HG22 ILE A 112 -30.938 5.651 -22.068 1.00 11.32 H new ATOM 0 HG23 ILE A 112 -29.219 6.031 -22.331 1.00 11.32 H new ATOM 0 HD11 ILE A 112 -27.733 2.541 -24.620 1.00 61.01 H new ATOM 0 HD12 ILE A 112 -29.351 2.032 -24.080 1.00 61.01 H new ATOM 0 HD13 ILE A 112 -29.117 3.646 -24.793 1.00 61.01 H new ATOM 1742 N GLY A 113 -29.365 6.234 -19.714 1.00 21.10 N ATOM 1743 CA GLY A 113 -28.733 7.482 -19.326 1.00 75.24 C ATOM 1744 C GLY A 113 -27.908 7.346 -18.062 1.00 75.11 C ATOM 1745 O GLY A 113 -27.016 8.154 -17.804 1.00 31.12 O ATOM 0 H GLY A 113 -30.379 6.215 -19.604 1.00 21.10 H new ATOM 0 HA2 GLY A 113 -28.094 7.830 -20.138 1.00 75.24 H new ATOM 0 HA3 GLY A 113 -29.499 8.242 -19.176 1.00 75.24 H new ATOM 1749 N LYS A 114 -28.207 6.322 -17.270 1.00 32.02 N ATOM 1750 CA LYS A 114 -27.488 6.082 -16.025 1.00 4.04 C ATOM 1751 C LYS A 114 -26.237 5.244 -16.272 1.00 33.15 C ATOM 1752 O LYS A 114 -25.144 5.597 -15.828 1.00 32.31 O ATOM 1753 CB LYS A 114 -28.396 5.377 -15.014 1.00 43.14 C ATOM 1754 CG LYS A 114 -27.740 5.147 -13.664 1.00 1.32 C ATOM 1755 CD LYS A 114 -28.369 3.974 -12.931 1.00 64.00 C ATOM 1756 CE LYS A 114 -27.829 2.646 -13.439 1.00 60.31 C ATOM 1757 NZ LYS A 114 -28.490 1.488 -12.775 1.00 50.13 N ATOM 0 H LYS A 114 -28.943 5.644 -17.469 1.00 32.02 H new ATOM 0 HA LYS A 114 -27.184 7.047 -15.619 1.00 4.04 H new ATOM 0 HB2 LYS A 114 -29.299 5.971 -14.873 1.00 43.14 H new ATOM 0 HB3 LYS A 114 -28.707 4.417 -15.426 1.00 43.14 H new ATOM 0 HG2 LYS A 114 -26.675 4.962 -13.803 1.00 1.32 H new ATOM 0 HG3 LYS A 114 -27.830 6.047 -13.056 1.00 1.32 H new ATOM 0 HD2 LYS A 114 -28.172 4.063 -11.863 1.00 64.00 H new ATOM 0 HD3 LYS A 114 -29.451 4.001 -13.059 1.00 64.00 H new ATOM 0 HE2 LYS A 114 -27.979 2.581 -14.517 1.00 60.31 H new ATOM 0 HE3 LYS A 114 -26.754 2.600 -13.264 1.00 60.31 H new ATOM 0 HZ1 LYS A 114 -28.094 0.602 -13.148 1.00 50.13 H new ATOM 0 HZ2 LYS A 114 -28.325 1.536 -11.749 1.00 50.13 H new ATOM 0 HZ3 LYS A 114 -29.512 1.517 -12.963 1.00 50.13 H new ATOM 1771 N TYR A 115 -26.405 4.135 -16.983 1.00 33.45 N ATOM 1772 CA TYR A 115 -25.290 3.246 -17.288 1.00 12.14 C ATOM 1773 C TYR A 115 -24.142 4.015 -17.935 1.00 33.13 C ATOM 1774 O TYR A 115 -22.971 3.734 -17.680 1.00 54.25 O ATOM 1775 CB TYR A 115 -25.748 2.117 -18.213 1.00 14.52 C ATOM 1776 CG TYR A 115 -26.400 0.964 -17.484 1.00 51.11 C ATOM 1777 CD1 TYR A 115 -25.638 0.054 -16.761 1.00 53.31 C ATOM 1778 CD2 TYR A 115 -27.777 0.783 -17.519 1.00 52.32 C ATOM 1779 CE1 TYR A 115 -26.229 -1.002 -16.094 1.00 52.53 C ATOM 1780 CE2 TYR A 115 -28.377 -0.269 -16.854 1.00 43.42 C ATOM 1781 CZ TYR A 115 -27.599 -1.158 -16.143 1.00 64.44 C ATOM 1782 OH TYR A 115 -28.192 -2.208 -15.481 1.00 21.42 O ATOM 0 H TYR A 115 -27.303 3.830 -17.359 1.00 33.45 H new ATOM 0 HA TYR A 115 -24.934 2.817 -16.351 1.00 12.14 H new ATOM 0 HB2 TYR A 115 -26.451 2.519 -18.942 1.00 14.52 H new ATOM 0 HB3 TYR A 115 -24.889 1.744 -18.770 1.00 14.52 H new ATOM 0 HD1 TYR A 115 -24.566 0.174 -16.720 1.00 53.31 H new ATOM 0 HD2 TYR A 115 -28.389 1.477 -18.076 1.00 52.32 H new ATOM 0 HE1 TYR A 115 -25.622 -1.701 -15.538 1.00 52.53 H new ATOM 0 HE2 TYR A 115 -29.449 -0.394 -16.891 1.00 43.42 H new ATOM 0 HH TYR A 115 -29.162 -2.173 -15.615 1.00 21.42 H new ATOM 1792 N MET A 116 -24.488 4.987 -18.772 1.00 40.14 N ATOM 1793 CA MET A 116 -23.487 5.799 -19.455 1.00 72.44 C ATOM 1794 C MET A 116 -22.599 6.526 -18.451 1.00 13.22 C ATOM 1795 O MET A 116 -21.379 6.580 -18.610 1.00 52.44 O ATOM 1796 CB MET A 116 -24.165 6.811 -20.381 1.00 72.51 C ATOM 1797 CG MET A 116 -24.558 6.232 -21.731 1.00 24.22 C ATOM 1798 SD MET A 116 -24.703 7.493 -23.011 1.00 75.33 S ATOM 1799 CE MET A 116 -26.009 8.515 -22.333 1.00 62.40 C ATOM 0 H MET A 116 -25.453 5.232 -18.994 1.00 40.14 H new ATOM 0 HA MET A 116 -22.862 5.134 -20.051 1.00 72.44 H new ATOM 0 HB2 MET A 116 -25.056 7.201 -19.889 1.00 72.51 H new ATOM 0 HB3 MET A 116 -23.493 7.654 -20.538 1.00 72.51 H new ATOM 0 HG2 MET A 116 -23.816 5.494 -22.036 1.00 24.22 H new ATOM 0 HG3 MET A 116 -25.508 5.707 -21.634 1.00 24.22 H new ATOM 0 HE1 MET A 116 -26.276 9.289 -23.052 1.00 62.40 H new ATOM 0 HE2 MET A 116 -26.883 7.898 -22.124 1.00 62.40 H new ATOM 0 HE3 MET A 116 -25.664 8.981 -21.410 1.00 62.40 H new ATOM 1809 N LEU A 117 -23.218 7.084 -17.416 1.00 55.35 N ATOM 1810 CA LEU A 117 -22.484 7.809 -16.385 1.00 50.45 C ATOM 1811 C LEU A 117 -21.576 6.868 -15.600 1.00 14.42 C ATOM 1812 O LEU A 117 -20.552 7.285 -15.059 1.00 64.12 O ATOM 1813 CB LEU A 117 -23.457 8.509 -15.435 1.00 51.42 C ATOM 1814 CG LEU A 117 -23.450 10.038 -15.474 1.00 33.03 C ATOM 1815 CD1 LEU A 117 -24.831 10.586 -15.146 1.00 45.34 C ATOM 1816 CD2 LEU A 117 -22.412 10.591 -14.509 1.00 0.24 C ATOM 0 H LEU A 117 -24.227 7.048 -17.269 1.00 55.35 H new ATOM 0 HA LEU A 117 -21.863 8.559 -16.875 1.00 50.45 H new ATOM 0 HB2 LEU A 117 -24.466 8.164 -15.661 1.00 51.42 H new ATOM 0 HB3 LEU A 117 -23.232 8.190 -14.417 1.00 51.42 H new ATOM 0 HG LEU A 117 -23.185 10.356 -16.482 1.00 33.03 H new ATOM 0 HD11 LEU A 117 -24.807 11.675 -15.178 1.00 45.34 H new ATOM 0 HD12 LEU A 117 -25.552 10.217 -15.876 1.00 45.34 H new ATOM 0 HD13 LEU A 117 -25.125 10.259 -14.149 1.00 45.34 H new ATOM 0 HD21 LEU A 117 -22.421 11.680 -14.550 1.00 0.24 H new ATOM 0 HD22 LEU A 117 -22.646 10.264 -13.496 1.00 0.24 H new ATOM 0 HD23 LEU A 117 -21.424 10.226 -14.789 1.00 0.24 H new ATOM 1828 N PHE A 118 -21.959 5.597 -15.542 1.00 64.14 N ATOM 1829 CA PHE A 118 -21.179 4.596 -14.824 1.00 23.11 C ATOM 1830 C PHE A 118 -19.722 4.613 -15.277 1.00 41.23 C ATOM 1831 O PHE A 118 -18.807 4.422 -14.475 1.00 70.34 O ATOM 1832 CB PHE A 118 -21.775 3.203 -15.039 1.00 11.31 C ATOM 1833 CG PHE A 118 -21.240 2.169 -14.090 1.00 42.03 C ATOM 1834 CD1 PHE A 118 -19.962 1.657 -14.252 1.00 35.04 C ATOM 1835 CD2 PHE A 118 -22.014 1.709 -13.037 1.00 43.30 C ATOM 1836 CE1 PHE A 118 -19.468 0.705 -13.381 1.00 20.34 C ATOM 1837 CE2 PHE A 118 -21.524 0.757 -12.162 1.00 54.35 C ATOM 1838 CZ PHE A 118 -20.249 0.255 -12.334 1.00 53.20 C ATOM 0 H PHE A 118 -22.805 5.236 -15.983 1.00 64.14 H new ATOM 0 HA PHE A 118 -21.214 4.839 -13.762 1.00 23.11 H new ATOM 0 HB2 PHE A 118 -22.858 3.259 -14.930 1.00 11.31 H new ATOM 0 HB3 PHE A 118 -21.574 2.884 -16.062 1.00 11.31 H new ATOM 0 HD1 PHE A 118 -19.346 2.006 -15.068 1.00 35.04 H new ATOM 0 HD2 PHE A 118 -23.012 2.099 -12.898 1.00 43.30 H new ATOM 0 HE1 PHE A 118 -18.471 0.313 -13.519 1.00 20.34 H new ATOM 0 HE2 PHE A 118 -22.138 0.407 -11.345 1.00 54.35 H new ATOM 0 HZ PHE A 118 -19.863 -0.488 -11.651 1.00 53.20 H new ATOM 1848 N THR A 119 -19.513 4.844 -16.570 1.00 32.41 N ATOM 1849 CA THR A 119 -18.169 4.884 -17.132 1.00 11.32 C ATOM 1850 C THR A 119 -17.472 6.197 -16.794 1.00 43.14 C ATOM 1851 O THR A 119 -16.334 6.205 -16.323 1.00 73.00 O ATOM 1852 CB THR A 119 -18.194 4.708 -18.662 1.00 32.12 C ATOM 1853 OG1 THR A 119 -18.897 5.798 -19.269 1.00 70.21 O ATOM 1854 CG2 THR A 119 -18.858 3.394 -19.044 1.00 71.32 C ATOM 0 H THR A 119 -20.258 5.006 -17.247 1.00 32.41 H new ATOM 0 HA THR A 119 -17.616 4.056 -16.688 1.00 11.32 H new ATOM 0 HB THR A 119 -17.165 4.695 -19.021 1.00 32.12 H new ATOM 0 HG1 THR A 119 -19.849 5.741 -19.042 1.00 70.21 H new ATOM 0 HG21 THR A 119 -18.864 3.291 -20.129 1.00 71.32 H new ATOM 0 HG22 THR A 119 -18.304 2.565 -18.604 1.00 71.32 H new ATOM 0 HG23 THR A 119 -19.883 3.383 -18.673 1.00 71.32 H new ATOM 1862 N LYS A 120 -18.160 7.307 -17.038 1.00 13.12 N ATOM 1863 CA LYS A 120 -17.608 8.627 -16.758 1.00 53.42 C ATOM 1864 C LYS A 120 -17.241 8.762 -15.284 1.00 14.52 C ATOM 1865 O LYS A 120 -16.412 9.593 -14.916 1.00 1.44 O ATOM 1866 CB LYS A 120 -18.612 9.715 -17.147 1.00 12.24 C ATOM 1867 CG LYS A 120 -18.825 9.839 -18.645 1.00 53.13 C ATOM 1868 CD LYS A 120 -20.278 10.135 -18.979 1.00 62.35 C ATOM 1869 CE LYS A 120 -20.685 9.505 -20.303 1.00 23.33 C ATOM 1870 NZ LYS A 120 -22.076 9.871 -20.687 1.00 10.11 N ATOM 0 H LYS A 120 -19.102 7.319 -17.429 1.00 13.12 H new ATOM 0 HA LYS A 120 -16.702 8.748 -17.352 1.00 53.42 H new ATOM 0 HB2 LYS A 120 -19.568 9.503 -16.669 1.00 12.24 H new ATOM 0 HB3 LYS A 120 -18.266 10.672 -16.757 1.00 12.24 H new ATOM 0 HG2 LYS A 120 -18.191 10.633 -19.039 1.00 53.13 H new ATOM 0 HG3 LYS A 120 -18.519 8.914 -19.135 1.00 53.13 H new ATOM 0 HD2 LYS A 120 -20.920 9.758 -18.183 1.00 62.35 H new ATOM 0 HD3 LYS A 120 -20.429 11.213 -19.026 1.00 62.35 H new ATOM 0 HE2 LYS A 120 -19.996 9.826 -21.085 1.00 23.33 H new ATOM 0 HE3 LYS A 120 -20.602 8.421 -20.230 1.00 23.33 H new ATOM 0 HZ1 LYS A 120 -22.327 9.395 -21.577 1.00 10.11 H new ATOM 0 HZ2 LYS A 120 -22.733 9.573 -19.938 1.00 10.11 H new ATOM 0 HZ3 LYS A 120 -22.141 10.901 -20.815 1.00 10.11 H new ATOM 1884 N GLU A 121 -17.864 7.939 -14.446 1.00 2.33 N ATOM 1885 CA GLU A 121 -17.601 7.968 -13.012 1.00 21.03 C ATOM 1886 C GLU A 121 -16.392 7.105 -12.663 1.00 4.11 C ATOM 1887 O GLU A 121 -15.614 7.438 -11.768 1.00 55.40 O ATOM 1888 CB GLU A 121 -18.828 7.484 -12.236 1.00 63.41 C ATOM 1889 CG GLU A 121 -19.129 8.309 -10.997 1.00 12.14 C ATOM 1890 CD GLU A 121 -19.725 7.481 -9.875 1.00 14.01 C ATOM 1891 OE1 GLU A 121 -20.877 7.022 -10.025 1.00 71.30 O ATOM 1892 OE2 GLU A 121 -19.041 7.293 -8.848 1.00 32.54 O ATOM 0 H GLU A 121 -18.553 7.245 -14.735 1.00 2.33 H new ATOM 0 HA GLU A 121 -17.384 8.998 -12.729 1.00 21.03 H new ATOM 0 HB2 GLU A 121 -19.696 7.504 -12.895 1.00 63.41 H new ATOM 0 HB3 GLU A 121 -18.675 6.445 -11.942 1.00 63.41 H new ATOM 0 HG2 GLU A 121 -18.211 8.780 -10.647 1.00 12.14 H new ATOM 0 HG3 GLU A 121 -19.820 9.111 -11.258 1.00 12.14 H new ATOM 1899 N PHE A 122 -16.240 5.994 -13.376 1.00 22.13 N ATOM 1900 CA PHE A 122 -15.127 5.081 -13.141 1.00 43.44 C ATOM 1901 C PHE A 122 -13.798 5.742 -13.495 1.00 43.44 C ATOM 1902 O PHE A 122 -12.746 5.361 -12.983 1.00 4.04 O ATOM 1903 CB PHE A 122 -15.307 3.802 -13.961 1.00 31.01 C ATOM 1904 CG PHE A 122 -14.688 2.590 -13.325 1.00 0.32 C ATOM 1905 CD1 PHE A 122 -15.361 1.890 -12.336 1.00 41.43 C ATOM 1906 CD2 PHE A 122 -13.433 2.151 -13.716 1.00 35.03 C ATOM 1907 CE1 PHE A 122 -14.793 0.776 -11.749 1.00 30.31 C ATOM 1908 CE2 PHE A 122 -12.861 1.037 -13.132 1.00 63.42 C ATOM 1909 CZ PHE A 122 -13.542 0.347 -12.148 1.00 40.52 C ATOM 0 H PHE A 122 -16.873 5.704 -14.121 1.00 22.13 H new ATOM 0 HA PHE A 122 -15.116 4.826 -12.081 1.00 43.44 H new ATOM 0 HB2 PHE A 122 -16.372 3.621 -14.108 1.00 31.01 H new ATOM 0 HB3 PHE A 122 -14.869 3.948 -14.948 1.00 31.01 H new ATOM 0 HD1 PHE A 122 -16.340 2.219 -12.021 1.00 41.43 H new ATOM 0 HD2 PHE A 122 -12.896 2.686 -14.486 1.00 35.03 H new ATOM 0 HE1 PHE A 122 -15.327 0.240 -10.978 1.00 30.31 H new ATOM 0 HE2 PHE A 122 -11.882 0.706 -13.445 1.00 63.42 H new ATOM 0 HZ PHE A 122 -13.098 -0.525 -11.692 1.00 40.52 H new ATOM 1919 N VAL A 123 -13.854 6.736 -14.377 1.00 31.12 N ATOM 1920 CA VAL A 123 -12.656 7.451 -14.800 1.00 52.31 C ATOM 1921 C VAL A 123 -11.941 8.078 -13.609 1.00 3.13 C ATOM 1922 O VAL A 123 -10.737 8.329 -13.657 1.00 51.05 O ATOM 1923 CB VAL A 123 -12.992 8.554 -15.821 1.00 55.13 C ATOM 1924 CG1 VAL A 123 -11.737 9.316 -16.218 1.00 20.31 C ATOM 1925 CG2 VAL A 123 -13.673 7.958 -17.044 1.00 61.22 C ATOM 0 H VAL A 123 -14.716 7.064 -14.812 1.00 31.12 H new ATOM 0 HA VAL A 123 -12.000 6.718 -15.270 1.00 52.31 H new ATOM 0 HB VAL A 123 -13.682 9.257 -15.355 1.00 55.13 H new ATOM 0 HG11 VAL A 123 -11.995 10.091 -16.940 1.00 20.31 H new ATOM 0 HG12 VAL A 123 -11.296 9.776 -15.334 1.00 20.31 H new ATOM 0 HG13 VAL A 123 -11.020 8.628 -16.665 1.00 20.31 H new ATOM 0 HG21 VAL A 123 -13.903 8.751 -17.755 1.00 61.22 H new ATOM 0 HG22 VAL A 123 -13.009 7.232 -17.513 1.00 61.22 H new ATOM 0 HG23 VAL A 123 -14.596 7.463 -16.742 1.00 61.22 H new ATOM 1935 N GLU A 124 -12.690 8.328 -12.540 1.00 32.24 N ATOM 1936 CA GLU A 124 -12.126 8.926 -11.335 1.00 75.11 C ATOM 1937 C GLU A 124 -11.061 8.020 -10.725 1.00 70.31 C ATOM 1938 O GLU A 124 -10.220 8.469 -9.946 1.00 54.13 O ATOM 1939 CB GLU A 124 -13.229 9.197 -10.309 1.00 51.15 C ATOM 1940 CG GLU A 124 -13.906 10.546 -10.485 1.00 44.24 C ATOM 1941 CD GLU A 124 -14.519 11.063 -9.199 1.00 15.22 C ATOM 1942 OE1 GLU A 124 -13.875 10.927 -8.138 1.00 5.00 O ATOM 1943 OE2 GLU A 124 -15.644 11.603 -9.252 1.00 41.34 O ATOM 0 H GLU A 124 -13.688 8.126 -12.483 1.00 32.24 H new ATOM 0 HA GLU A 124 -11.659 9.870 -11.614 1.00 75.11 H new ATOM 0 HB2 GLU A 124 -13.981 8.411 -10.380 1.00 51.15 H new ATOM 0 HB3 GLU A 124 -12.803 9.142 -9.307 1.00 51.15 H new ATOM 0 HG2 GLU A 124 -13.177 11.269 -10.852 1.00 44.24 H new ATOM 0 HG3 GLU A 124 -14.683 10.462 -11.245 1.00 44.24 H new ATOM 1950 N SER A 125 -11.104 6.741 -11.085 1.00 23.22 N ATOM 1951 CA SER A 125 -10.145 5.770 -10.570 1.00 74.43 C ATOM 1952 C SER A 125 -8.716 6.188 -10.903 1.00 33.20 C ATOM 1953 O SER A 125 -7.768 5.786 -10.229 1.00 45.05 O ATOM 1954 CB SER A 125 -10.431 4.383 -11.150 1.00 51.03 C ATOM 1955 OG SER A 125 -11.761 3.979 -10.874 1.00 61.20 O ATOM 0 H SER A 125 -11.792 6.353 -11.731 1.00 23.22 H new ATOM 0 HA SER A 125 -10.250 5.732 -9.486 1.00 74.43 H new ATOM 0 HB2 SER A 125 -10.268 4.395 -12.228 1.00 51.03 H new ATOM 0 HB3 SER A 125 -9.733 3.659 -10.730 1.00 51.03 H new ATOM 0 HG SER A 125 -12.366 4.371 -11.538 1.00 61.20 H new ATOM 1961 N SER A 126 -8.571 6.998 -11.947 1.00 33.31 N ATOM 1962 CA SER A 126 -7.258 7.468 -12.373 1.00 14.33 C ATOM 1963 C SER A 126 -6.661 8.418 -11.340 1.00 4.55 C ATOM 1964 O SER A 126 -5.559 8.193 -10.837 1.00 52.01 O ATOM 1965 CB SER A 126 -7.360 8.169 -13.729 1.00 4.33 C ATOM 1966 OG SER A 126 -8.042 7.361 -14.671 1.00 60.53 O ATOM 0 H SER A 126 -9.346 7.342 -12.513 1.00 33.31 H new ATOM 0 HA SER A 126 -6.602 6.603 -12.468 1.00 14.33 H new ATOM 0 HB2 SER A 126 -7.884 9.118 -13.613 1.00 4.33 H new ATOM 0 HB3 SER A 126 -6.361 8.399 -14.099 1.00 4.33 H new ATOM 0 HG SER A 126 -9.009 7.468 -14.554 1.00 60.53 H new ATOM 1972 N ILE A 127 -7.395 9.481 -11.028 1.00 2.12 N ATOM 1973 CA ILE A 127 -6.939 10.465 -10.054 1.00 45.32 C ATOM 1974 C ILE A 127 -6.859 9.860 -8.657 1.00 10.22 C ATOM 1975 O ILE A 127 -6.079 10.309 -7.817 1.00 3.20 O ATOM 1976 CB ILE A 127 -7.867 11.693 -10.018 1.00 12.44 C ATOM 1977 CG1 ILE A 127 -9.311 11.260 -9.758 1.00 15.34 C ATOM 1978 CG2 ILE A 127 -7.768 12.471 -11.321 1.00 53.34 C ATOM 1979 CD1 ILE A 127 -10.242 12.413 -9.450 1.00 23.34 C ATOM 0 H ILE A 127 -8.308 9.683 -11.436 1.00 2.12 H new ATOM 0 HA ILE A 127 -5.944 10.781 -10.367 1.00 45.32 H new ATOM 0 HB ILE A 127 -7.551 12.345 -9.204 1.00 12.44 H new ATOM 0 HG12 ILE A 127 -9.684 10.726 -10.632 1.00 15.34 H new ATOM 0 HG13 ILE A 127 -9.327 10.558 -8.924 1.00 15.34 H new ATOM 0 HG21 ILE A 127 -8.430 13.336 -11.280 1.00 53.34 H new ATOM 0 HG22 ILE A 127 -6.741 12.807 -11.467 1.00 53.34 H new ATOM 0 HG23 ILE A 127 -8.062 11.829 -12.151 1.00 53.34 H new ATOM 0 HD11 ILE A 127 -11.248 12.032 -9.277 1.00 23.34 H new ATOM 0 HD12 ILE A 127 -9.893 12.934 -8.559 1.00 23.34 H new ATOM 0 HD13 ILE A 127 -10.256 13.104 -10.293 1.00 23.34 H new ATOM 1991 N LYS A 128 -7.671 8.837 -8.414 1.00 62.32 N ATOM 1992 CA LYS A 128 -7.691 8.166 -7.120 1.00 15.03 C ATOM 1993 C LYS A 128 -6.518 7.201 -6.988 1.00 61.53 C ATOM 1994 O LYS A 128 -6.021 6.959 -5.888 1.00 10.32 O ATOM 1995 CB LYS A 128 -9.010 7.411 -6.934 1.00 42.32 C ATOM 1996 CG LYS A 128 -9.206 6.866 -5.530 1.00 71.13 C ATOM 1997 CD LYS A 128 -10.616 6.335 -5.330 1.00 42.04 C ATOM 1998 CE LYS A 128 -10.697 5.410 -4.125 1.00 55.54 C ATOM 1999 NZ LYS A 128 -11.655 4.292 -4.348 1.00 51.13 N ATOM 0 H LYS A 128 -8.325 8.454 -9.097 1.00 62.32 H new ATOM 0 HA LYS A 128 -7.602 8.926 -6.344 1.00 15.03 H new ATOM 0 HB2 LYS A 128 -9.838 8.078 -7.175 1.00 42.32 H new ATOM 0 HB3 LYS A 128 -9.049 6.585 -7.644 1.00 42.32 H new ATOM 0 HG2 LYS A 128 -8.486 6.069 -5.344 1.00 71.13 H new ATOM 0 HG3 LYS A 128 -9.006 7.652 -4.802 1.00 71.13 H new ATOM 0 HD2 LYS A 128 -11.305 7.169 -5.197 1.00 42.04 H new ATOM 0 HD3 LYS A 128 -10.934 5.799 -6.224 1.00 42.04 H new ATOM 0 HE2 LYS A 128 -9.708 5.004 -3.912 1.00 55.54 H new ATOM 0 HE3 LYS A 128 -11.003 5.981 -3.249 1.00 55.54 H new ATOM 0 HZ1 LYS A 128 -11.682 3.684 -3.504 1.00 51.13 H new ATOM 0 HZ2 LYS A 128 -12.604 4.678 -4.527 1.00 51.13 H new ATOM 0 HZ3 LYS A 128 -11.349 3.731 -5.169 1.00 51.13 H new ATOM 2013 N ILE A 129 -6.079 6.653 -8.117 1.00 33.45 N ATOM 2014 CA ILE A 129 -4.963 5.716 -8.127 1.00 24.15 C ATOM 2015 C ILE A 129 -3.627 6.452 -8.147 1.00 15.45 C ATOM 2016 O ILE A 129 -2.717 6.132 -7.382 1.00 10.35 O ATOM 2017 CB ILE A 129 -5.032 4.770 -9.340 1.00 34.33 C ATOM 2018 CG1 ILE A 129 -6.052 3.657 -9.088 1.00 61.11 C ATOM 2019 CG2 ILE A 129 -3.660 4.182 -9.633 1.00 30.15 C ATOM 2020 CD1 ILE A 129 -6.417 2.879 -10.333 1.00 54.41 C ATOM 0 H ILE A 129 -6.479 6.842 -9.036 1.00 33.45 H new ATOM 0 HA ILE A 129 -5.038 5.127 -7.213 1.00 24.15 H new ATOM 0 HB ILE A 129 -5.353 5.342 -10.210 1.00 34.33 H new ATOM 0 HG12 ILE A 129 -5.651 2.969 -8.344 1.00 61.11 H new ATOM 0 HG13 ILE A 129 -6.956 4.093 -8.664 1.00 61.11 H new ATOM 0 HG21 ILE A 129 -3.726 3.516 -10.493 1.00 30.15 H new ATOM 0 HG22 ILE A 129 -2.958 4.987 -9.851 1.00 30.15 H new ATOM 0 HG23 ILE A 129 -3.312 3.621 -8.766 1.00 30.15 H new ATOM 0 HD11 ILE A 129 -7.144 2.107 -10.080 1.00 54.41 H new ATOM 0 HD12 ILE A 129 -6.848 3.555 -11.071 1.00 54.41 H new ATOM 0 HD13 ILE A 129 -5.522 2.413 -10.746 1.00 54.41 H new ATOM 2032 N THR A 130 -3.517 7.443 -9.026 1.00 53.13 N ATOM 2033 CA THR A 130 -2.294 8.226 -9.146 1.00 52.40 C ATOM 2034 C THR A 130 -2.062 9.077 -7.902 1.00 61.33 C ATOM 2035 O THR A 130 -0.934 9.477 -7.615 1.00 71.52 O ATOM 2036 CB THR A 130 -2.334 9.145 -10.382 1.00 31.11 C ATOM 2037 OG1 THR A 130 -3.569 9.869 -10.415 1.00 33.41 O ATOM 2038 CG2 THR A 130 -2.179 8.337 -11.662 1.00 14.23 C ATOM 0 H THR A 130 -4.261 7.722 -9.666 1.00 53.13 H new ATOM 0 HA THR A 130 -1.474 7.516 -9.256 1.00 52.40 H new ATOM 0 HB THR A 130 -1.504 9.848 -10.312 1.00 31.11 H new ATOM 0 HG1 THR A 130 -4.265 9.310 -10.818 1.00 33.41 H new ATOM 0 HG21 THR A 130 -2.210 9.007 -12.521 1.00 14.23 H new ATOM 0 HG22 THR A 130 -1.225 7.811 -11.647 1.00 14.23 H new ATOM 0 HG23 THR A 130 -2.991 7.614 -11.736 1.00 14.23 H new ATOM 2046 N GLU A 131 -3.136 9.349 -7.168 1.00 20.32 N ATOM 2047 CA GLU A 131 -3.047 10.152 -5.954 1.00 52.43 C ATOM 2048 C GLU A 131 -2.117 9.499 -4.936 1.00 12.21 C ATOM 2049 O GLU A 131 -1.640 10.152 -4.009 1.00 4.12 O ATOM 2050 CB GLU A 131 -4.436 10.347 -5.342 1.00 60.30 C ATOM 2051 CG GLU A 131 -4.989 11.750 -5.522 1.00 13.45 C ATOM 2052 CD GLU A 131 -5.073 12.516 -4.215 1.00 72.12 C ATOM 2053 OE1 GLU A 131 -4.016 12.953 -3.714 1.00 33.42 O ATOM 2054 OE2 GLU A 131 -6.197 12.678 -3.695 1.00 2.24 O ATOM 0 H GLU A 131 -4.077 9.026 -7.392 1.00 20.32 H new ATOM 0 HA GLU A 131 -2.636 11.125 -6.222 1.00 52.43 H new ATOM 0 HB2 GLU A 131 -5.126 9.633 -5.793 1.00 60.30 H new ATOM 0 HB3 GLU A 131 -4.390 10.117 -4.277 1.00 60.30 H new ATOM 0 HG2 GLU A 131 -4.357 12.299 -6.221 1.00 13.45 H new ATOM 0 HG3 GLU A 131 -5.982 11.691 -5.969 1.00 13.45 H new ATOM 2061 N GLU A 132 -1.866 8.206 -5.116 1.00 52.24 N ATOM 2062 CA GLU A 132 -0.995 7.465 -4.213 1.00 21.55 C ATOM 2063 C GLU A 132 0.472 7.680 -4.572 1.00 44.22 C ATOM 2064 O GLU A 132 1.362 7.481 -3.745 1.00 32.12 O ATOM 2065 CB GLU A 132 -1.328 5.972 -4.258 1.00 33.25 C ATOM 2066 CG GLU A 132 -0.778 5.189 -3.077 1.00 41.40 C ATOM 2067 CD GLU A 132 -1.649 4.006 -2.704 1.00 75.23 C ATOM 2068 OE1 GLU A 132 -2.602 4.195 -1.918 1.00 45.24 O ATOM 2069 OE2 GLU A 132 -1.380 2.891 -3.198 1.00 22.02 O ATOM 0 H GLU A 132 -2.254 7.651 -5.879 1.00 52.24 H new ATOM 0 HA GLU A 132 -1.162 7.838 -3.202 1.00 21.55 H new ATOM 0 HB2 GLU A 132 -2.411 5.851 -4.291 1.00 33.25 H new ATOM 0 HB3 GLU A 132 -0.932 5.548 -5.181 1.00 33.25 H new ATOM 0 HG2 GLU A 132 0.225 4.836 -3.316 1.00 41.40 H new ATOM 0 HG3 GLU A 132 -0.686 5.853 -2.217 1.00 41.40 H new ATOM 2076 N VAL A 133 0.718 8.088 -5.813 1.00 55.53 N ATOM 2077 CA VAL A 133 2.076 8.332 -6.284 1.00 11.03 C ATOM 2078 C VAL A 133 2.674 9.567 -5.620 1.00 2.11 C ATOM 2079 O VAL A 133 3.894 9.729 -5.572 1.00 30.11 O ATOM 2080 CB VAL A 133 2.116 8.514 -7.813 1.00 2.04 C ATOM 2081 CG1 VAL A 133 1.913 9.976 -8.182 1.00 63.51 C ATOM 2082 CG2 VAL A 133 3.428 7.990 -8.377 1.00 2.13 C ATOM 0 H VAL A 133 -0.006 8.257 -6.511 1.00 55.53 H new ATOM 0 HA VAL A 133 2.667 7.456 -6.015 1.00 11.03 H new ATOM 0 HB VAL A 133 1.302 7.937 -8.252 1.00 2.04 H new ATOM 0 HG11 VAL A 133 1.944 10.085 -9.266 1.00 63.51 H new ATOM 0 HG12 VAL A 133 0.945 10.314 -7.811 1.00 63.51 H new ATOM 0 HG13 VAL A 133 2.704 10.578 -7.734 1.00 63.51 H new ATOM 0 HG21 VAL A 133 3.439 8.126 -9.458 1.00 2.13 H new ATOM 0 HG22 VAL A 133 4.259 8.538 -7.933 1.00 2.13 H new ATOM 0 HG23 VAL A 133 3.527 6.930 -8.144 1.00 2.13 H new ATOM 2092 N ILE A 134 1.808 10.435 -5.109 1.00 0.42 N ATOM 2093 CA ILE A 134 2.251 11.656 -4.446 1.00 23.41 C ATOM 2094 C ILE A 134 3.051 11.338 -3.187 1.00 61.11 C ATOM 2095 O ILE A 134 3.850 12.151 -2.726 1.00 3.34 O ATOM 2096 CB ILE A 134 1.060 12.557 -4.070 1.00 21.40 C ATOM 2097 CG1 ILE A 134 0.324 11.986 -2.856 1.00 4.23 C ATOM 2098 CG2 ILE A 134 0.112 12.701 -5.251 1.00 11.01 C ATOM 2099 CD1 ILE A 134 0.750 12.608 -1.544 1.00 41.32 C ATOM 0 H ILE A 134 0.795 10.316 -5.141 1.00 0.42 H new ATOM 0 HA ILE A 134 2.887 12.187 -5.154 1.00 23.41 H new ATOM 0 HB ILE A 134 1.439 13.545 -3.810 1.00 21.40 H new ATOM 0 HG12 ILE A 134 -0.748 12.134 -2.988 1.00 4.23 H new ATOM 0 HG13 ILE A 134 0.494 10.910 -2.811 1.00 4.23 H new ATOM 0 HG21 ILE A 134 -0.725 13.341 -4.970 1.00 11.01 H new ATOM 0 HG22 ILE A 134 0.643 13.147 -6.092 1.00 11.01 H new ATOM 0 HG23 ILE A 134 -0.263 11.719 -5.539 1.00 11.01 H new ATOM 0 HD11 ILE A 134 0.188 12.156 -0.727 1.00 41.32 H new ATOM 0 HD12 ILE A 134 1.815 12.437 -1.389 1.00 41.32 H new ATOM 0 HD13 ILE A 134 0.554 13.680 -1.569 1.00 41.32 H new ATOM 2111 N ASN A 135 2.831 10.148 -2.637 1.00 71.03 N ATOM 2112 CA ASN A 135 3.532 9.721 -1.432 1.00 2.52 C ATOM 2113 C ASN A 135 5.041 9.885 -1.593 1.00 75.55 C ATOM 2114 O ASN A 135 5.747 10.216 -0.640 1.00 72.54 O ATOM 2115 CB ASN A 135 3.197 8.264 -1.111 1.00 21.45 C ATOM 2116 CG ASN A 135 4.344 7.323 -1.428 1.00 12.32 C ATOM 2117 OD1 ASN A 135 5.184 7.041 -0.574 1.00 4.34 O ATOM 2118 ND2 ASN A 135 4.383 6.833 -2.661 1.00 50.44 N ATOM 0 H ASN A 135 2.173 9.462 -3.007 1.00 71.03 H new ATOM 0 HA ASN A 135 3.202 10.352 -0.607 1.00 2.52 H new ATOM 0 HB2 ASN A 135 2.941 8.177 -0.055 1.00 21.45 H new ATOM 0 HB3 ASN A 135 2.316 7.963 -1.679 1.00 21.45 H new ATOM 0 HD21 ASN A 135 5.131 6.195 -2.933 1.00 50.44 H new ATOM 0 HD22 ASN A 135 3.665 7.094 -3.337 1.00 50.44 H new ATOM 2125 N THR A 136 5.529 9.650 -2.808 1.00 11.33 N ATOM 2126 CA THR A 136 6.953 9.770 -3.095 1.00 54.40 C ATOM 2127 C THR A 136 7.282 11.139 -3.681 1.00 32.40 C ATOM 2128 O THR A 136 8.423 11.596 -3.614 1.00 23.35 O ATOM 2129 CB THR A 136 7.422 8.678 -4.075 1.00 10.51 C ATOM 2130 OG1 THR A 136 6.291 8.064 -4.703 1.00 12.54 O ATOM 2131 CG2 THR A 136 8.244 7.621 -3.354 1.00 1.14 C ATOM 0 H THR A 136 4.959 9.376 -3.608 1.00 11.33 H new ATOM 0 HA THR A 136 7.478 9.648 -2.148 1.00 54.40 H new ATOM 0 HB THR A 136 8.048 9.147 -4.834 1.00 10.51 H new ATOM 0 HG1 THR A 136 6.598 7.372 -5.325 1.00 12.54 H new ATOM 0 HG21 THR A 136 8.564 6.861 -4.066 1.00 1.14 H new ATOM 0 HG22 THR A 136 9.120 8.087 -2.902 1.00 1.14 H new ATOM 0 HG23 THR A 136 7.638 7.157 -2.576 1.00 1.14 H new ATOM 2139 N HIS A 137 6.275 11.789 -4.256 1.00 10.04 N ATOM 2140 CA HIS A 137 6.458 13.107 -4.853 1.00 11.23 C ATOM 2141 C HIS A 137 6.488 14.191 -3.779 1.00 33.42 C ATOM 2142 O HIS A 137 6.699 15.367 -4.075 1.00 42.11 O ATOM 2143 CB HIS A 137 5.340 13.396 -5.854 1.00 54.34 C ATOM 2144 CG HIS A 137 5.581 14.618 -6.686 1.00 3.53 C ATOM 2145 ND1 HIS A 137 5.025 15.847 -6.397 1.00 70.23 N ATOM 2146 CD2 HIS A 137 6.326 14.797 -7.802 1.00 1.13 C ATOM 2147 CE1 HIS A 137 5.416 16.728 -7.301 1.00 33.30 C ATOM 2148 NE2 HIS A 137 6.206 16.116 -8.164 1.00 44.13 N ATOM 0 H HIS A 137 5.325 11.425 -4.321 1.00 10.04 H new ATOM 0 HA HIS A 137 7.414 13.112 -5.376 1.00 11.23 H new ATOM 0 HB2 HIS A 137 5.222 12.536 -6.513 1.00 54.34 H new ATOM 0 HB3 HIS A 137 4.401 13.514 -5.313 1.00 54.34 H new ATOM 0 HD2 HIS A 137 6.907 14.043 -8.312 1.00 1.13 H new ATOM 0 HE1 HIS A 137 5.137 17.771 -7.329 1.00 33.30 H new ATOM 0 HE2 HIS A 137 6.655 16.553 -8.969 1.00 44.13 H new ATOM 2156 N HIS A 138 6.274 13.786 -2.531 1.00 13.22 N ATOM 2157 CA HIS A 138 6.276 14.723 -1.413 1.00 20.24 C ATOM 2158 C HIS A 138 7.415 14.412 -0.446 1.00 34.22 C ATOM 2159 O HIS A 138 7.800 15.253 0.366 1.00 14.31 O ATOM 2160 CB HIS A 138 4.937 14.673 -0.675 1.00 44.14 C ATOM 2161 CG HIS A 138 4.344 16.024 -0.420 1.00 12.20 C ATOM 2162 ND1 HIS A 138 3.800 16.390 0.793 1.00 12.11 N ATOM 2163 CD2 HIS A 138 4.212 17.101 -1.230 1.00 22.13 C ATOM 2164 CE1 HIS A 138 3.358 17.633 0.718 1.00 34.30 C ATOM 2165 NE2 HIS A 138 3.596 18.087 -0.499 1.00 43.00 N ATOM 0 H HIS A 138 6.097 12.816 -2.269 1.00 13.22 H new ATOM 0 HA HIS A 138 6.425 15.726 -1.812 1.00 20.24 H new ATOM 0 HB2 HIS A 138 4.232 14.080 -1.258 1.00 44.14 H new ATOM 0 HB3 HIS A 138 5.075 14.160 0.277 1.00 44.14 H new ATOM 0 HD2 HIS A 138 4.532 17.171 -2.259 1.00 22.13 H new ATOM 0 HE1 HIS A 138 2.883 18.184 1.516 1.00 34.30 H new ATOM 0 HE2 HIS A 138 3.361 19.019 -0.841 1.00 43.00 H new ATOM 2173 N ARG A 139 7.948 13.198 -0.538 1.00 41.14 N ATOM 2174 CA ARG A 139 9.041 12.776 0.329 1.00 31.23 C ATOM 2175 C ARG A 139 10.354 12.707 -0.445 1.00 21.53 C ATOM 2176 O ARG A 139 11.413 13.053 0.078 1.00 24.41 O ATOM 2177 CB ARG A 139 8.730 11.413 0.950 1.00 70.40 C ATOM 2178 CG ARG A 139 9.970 10.605 1.298 1.00 75.31 C ATOM 2179 CD ARG A 139 10.385 9.699 0.149 1.00 12.01 C ATOM 2180 NE ARG A 139 10.145 8.290 0.449 1.00 61.12 N ATOM 2181 CZ ARG A 139 10.486 7.297 -0.365 1.00 50.13 C ATOM 2182 NH1 ARG A 139 11.079 7.558 -1.522 1.00 74.13 N ATOM 2183 NH2 ARG A 139 10.235 6.040 -0.022 1.00 54.23 N ATOM 0 H ARG A 139 7.640 12.490 -1.204 1.00 41.14 H new ATOM 0 HA ARG A 139 9.147 13.514 1.124 1.00 31.23 H new ATOM 0 HB2 ARG A 139 8.138 11.561 1.853 1.00 70.40 H new ATOM 0 HB3 ARG A 139 8.115 10.839 0.257 1.00 70.40 H new ATOM 0 HG2 ARG A 139 10.789 11.281 1.544 1.00 75.31 H new ATOM 0 HG3 ARG A 139 9.776 10.003 2.186 1.00 75.31 H new ATOM 0 HD2 ARG A 139 9.834 9.977 -0.749 1.00 12.01 H new ATOM 0 HD3 ARG A 139 11.443 9.849 -0.067 1.00 12.01 H new ATOM 0 HE ARG A 139 9.691 8.056 1.332 1.00 61.12 H new ATOM 0 HH11 ARG A 139 11.274 8.523 -1.789 1.00 74.13 H new ATOM 0 HH12 ARG A 139 11.340 6.794 -2.145 1.00 74.13 H new ATOM 0 HH21 ARG A 139 9.780 5.835 0.868 1.00 54.23 H new ATOM 0 HH22 ARG A 139 10.497 5.278 -0.648 1.00 54.23 H new ATOM 2197 N SER A 140 10.276 12.257 -1.693 1.00 62.41 N ATOM 2198 CA SER A 140 11.459 12.138 -2.538 1.00 32.21 C ATOM 2199 C SER A 140 12.493 11.217 -1.898 1.00 61.52 C ATOM 2200 O SER A 140 13.650 11.181 -2.315 1.00 54.34 O ATOM 2201 CB SER A 140 12.073 13.516 -2.789 1.00 11.41 C ATOM 2202 OG SER A 140 12.442 13.671 -4.148 1.00 73.44 O ATOM 0 H SER A 140 9.406 11.969 -2.142 1.00 62.41 H new ATOM 0 HA SER A 140 11.153 11.706 -3.491 1.00 32.21 H new ATOM 0 HB2 SER A 140 11.359 14.291 -2.512 1.00 11.41 H new ATOM 0 HB3 SER A 140 12.949 13.648 -2.154 1.00 11.41 H new ATOM 0 HG SER A 140 12.830 14.561 -4.282 1.00 73.44 H new TER 2208 SER A 140