USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1027 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 102 THR OG1 : rot 180:sc= 0.0359 USER MOD Set 1.2: A 111 ASN : amide:sc= 0.559 K(o=-2.6,f=-6.2!) USER MOD Set 1.3: A 124 SER OG : rot -23:sc= -3.23! USER MOD Set 2.1: A 43 HIS : no HE2:sc= -0.273 K(o=-0.4,f=-2.1) USER MOD Set 2.2: A 85 MET CE :methyl -162:sc= -0.123 (180deg=-0.327) USER MOD Set 3.1: A 74 MET CE :methyl -127:sc= 0 (180deg=-1.8!) USER MOD Set 3.2: A 120 TYR OH : rot 37:sc= -1.15 USER MOD Set 4.1: A 73 THR OG1 : rot 113:sc= 0.464 USER MOD Set 4.2: A 75 THR OG1 : rot -151:sc= 1.52 USER MOD Set 5.1: A 49 LYS NZ :NH3+ -145:sc= 1.16 (180deg=-0.154) USER MOD Set 5.2: A 51 THR OG1 : rot -150:sc= 1 USER MOD Set 6.1: A 2 ASN : amide:sc= 0.9 K(o=-5.5,f=-7.2) USER MOD Set 6.2: A 89 ASN :FLIP amide:sc= -6.44! C(o=-7.2!,f=-5.5!) USER MOD Single : A 1 MET CE :methyl -163:sc= -0.06 (180deg=-0.472) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0284) USER MOD Single : A 4 SER OG : rot 15:sc= 1.32 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -19:sc= 0.0411 USER MOD Single : A 8 GLN : amide:sc= 0.93 K(o=0.93,f=-0.012) USER MOD Single : A 10 GLN : amide:sc= -0.309 X(o=-0.31,f=-0.56) USER MOD Single : A 11 SER OG : rot 16:sc= 0.723 USER MOD Single : A 12 GLN :FLIP amide:sc= -0.111 F(o=-0.72,f=-0.11) USER MOD Single : A 14 ASN : amide:sc= 0.938 K(o=0.94,f=-0.96) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 170:sc= 1.24 (180deg=1.16) USER MOD Single : A 22 MET CE :methyl 179:sc= -2.47 (180deg=-2.5) USER MOD Single : A 30 GLN : amide:sc= 0.511 K(o=0.51,f=-0.33) USER MOD Single : A 31 LYS NZ :NH3+ -179:sc= -0.966! (180deg=-1.02!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 136:sc= 1.26 (180deg=1.01) USER MOD Single : A 39 SER OG : rot 90:sc= -0.419 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot -46:sc= 0.101 USER MOD Single : A 57 LYS NZ :NH3+ -177:sc= -2.01! (180deg=-2.32!) USER MOD Single : A 60 HIS : no HE2:sc= 0.0174 K(o=0.017,f=-6.7!) USER MOD Single : A 61 ASN :FLIP amide:sc= -0.419 F(o=-5.2!,f=-0.42) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -155:sc= 0.981 USER MOD Single : A 78 LYS NZ :NH3+ -132:sc= 1.18 (180deg=0.602) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00755) USER MOD Single : A 91 MET CE :methyl -143:sc= -0.656 (180deg=-3.67!) USER MOD Single : A 93 THR OG1 : rot -170:sc= -0.144 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 ASN :FLIP amide:sc= -0.198 F(o=-1.8!,f=-0.2) USER MOD Single : A 108 THR OG1 : rot 31:sc= 0.573 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl 166:sc= -0.467 (180deg=-0.906) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -168:sc= -0.0194 (180deg=-0.155) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.024 -17.630 4.127 1.00 0.00 N ATOM 2 CA MET A 1 10.636 -16.362 3.675 1.00 0.00 C ATOM 3 C MET A 1 9.590 -15.260 3.635 1.00 0.00 C ATOM 4 O MET A 1 9.527 -14.428 4.537 1.00 0.00 O ATOM 5 CB MET A 1 11.285 -16.523 2.300 1.00 0.00 C ATOM 6 CG MET A 1 12.497 -17.438 2.310 1.00 0.00 C ATOM 7 SD MET A 1 13.797 -16.852 3.416 1.00 0.00 S ATOM 8 CE MET A 1 14.236 -15.299 2.635 1.00 0.00 C ATOM 0 H1 MET A 1 10.765 -18.349 4.248 1.00 0.00 H new ATOM 0 H2 MET A 1 9.538 -17.477 5.034 1.00 0.00 H new ATOM 0 H3 MET A 1 9.337 -17.956 3.417 1.00 0.00 H new ATOM 0 HA MET A 1 11.415 -16.089 4.387 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.547 -16.917 1.602 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.582 -15.542 1.929 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.190 -18.439 2.614 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.895 -17.520 1.298 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.205 -14.966 3.006 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.289 -15.437 1.555 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.481 -14.548 2.868 1.00 0.00 H new ATOM 20 N ASN A 2 8.747 -15.265 2.611 1.00 0.00 N ATOM 21 CA ASN A 2 7.686 -14.273 2.520 1.00 0.00 C ATOM 22 C ASN A 2 6.528 -14.639 3.431 1.00 0.00 C ATOM 23 O ASN A 2 5.635 -15.409 3.073 1.00 0.00 O ATOM 24 CB ASN A 2 7.195 -14.100 1.084 1.00 0.00 C ATOM 25 CG ASN A 2 7.124 -15.410 0.322 1.00 0.00 C ATOM 26 OD1 ASN A 2 8.114 -15.844 -0.265 1.00 0.00 O ATOM 27 ND2 ASN A 2 5.966 -16.048 0.308 1.00 0.00 N ATOM 0 H ASN A 2 8.776 -15.935 1.842 1.00 0.00 H new ATOM 0 HA ASN A 2 8.104 -13.321 2.847 1.00 0.00 H new ATOM 0 HB2 ASN A 2 6.207 -13.639 1.096 1.00 0.00 H new ATOM 0 HB3 ASN A 2 7.860 -13.415 0.558 1.00 0.00 H new ATOM 0 HD21 ASN A 2 5.874 -16.928 -0.200 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.164 -15.661 0.805 1.00 0.00 H new ATOM 34 N PHE A 3 6.551 -14.055 4.608 1.00 0.00 N ATOM 35 CA PHE A 3 5.527 -14.242 5.600 1.00 0.00 C ATOM 36 C PHE A 3 5.418 -12.974 6.401 1.00 0.00 C ATOM 37 O PHE A 3 5.864 -12.921 7.546 1.00 0.00 O ATOM 38 CB PHE A 3 5.839 -15.404 6.541 1.00 0.00 C ATOM 39 CG PHE A 3 5.473 -16.760 6.003 1.00 0.00 C ATOM 40 CD1 PHE A 3 4.174 -17.229 6.110 1.00 0.00 C ATOM 41 CD2 PHE A 3 6.425 -17.568 5.405 1.00 0.00 C ATOM 42 CE1 PHE A 3 3.831 -18.477 5.626 1.00 0.00 C ATOM 43 CE2 PHE A 3 6.087 -18.817 4.918 1.00 0.00 C ATOM 44 CZ PHE A 3 4.788 -19.271 5.029 1.00 0.00 C ATOM 0 H PHE A 3 7.298 -13.426 4.904 1.00 0.00 H new ATOM 0 HA PHE A 3 4.592 -14.477 5.092 1.00 0.00 H new ATOM 0 HB2 PHE A 3 6.905 -15.394 6.769 1.00 0.00 H new ATOM 0 HB3 PHE A 3 5.310 -15.245 7.481 1.00 0.00 H new ATOM 0 HD1 PHE A 3 3.421 -16.612 6.577 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.443 -17.219 5.318 1.00 0.00 H new ATOM 0 HE1 PHE A 3 2.814 -18.830 5.715 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.838 -19.437 4.451 1.00 0.00 H new ATOM 0 HZ PHE A 3 4.522 -20.246 4.649 1.00 0.00 H new ATOM 54 N SER A 4 4.885 -11.940 5.762 1.00 0.00 N ATOM 55 CA SER A 4 4.618 -10.665 6.419 1.00 0.00 C ATOM 56 C SER A 4 5.887 -10.054 7.021 1.00 0.00 C ATOM 57 O SER A 4 6.997 -10.360 6.586 1.00 0.00 O ATOM 58 CB SER A 4 3.535 -10.841 7.474 1.00 0.00 C ATOM 59 OG SER A 4 3.894 -11.742 8.509 1.00 0.00 O ATOM 0 H SER A 4 4.626 -11.961 4.776 1.00 0.00 H new ATOM 0 HA SER A 4 4.262 -9.964 5.664 1.00 0.00 H new ATOM 0 HB2 SER A 4 3.305 -9.870 7.912 1.00 0.00 H new ATOM 0 HB3 SER A 4 2.624 -11.197 6.992 1.00 0.00 H new ATOM 0 HG SER A 4 4.860 -11.905 8.480 1.00 0.00 H new ATOM 65 N GLY A 5 5.711 -9.183 8.006 1.00 0.00 N ATOM 66 CA GLY A 5 6.835 -8.528 8.636 1.00 0.00 C ATOM 67 C GLY A 5 6.925 -7.073 8.272 1.00 0.00 C ATOM 68 O GLY A 5 6.039 -6.538 7.609 1.00 0.00 O ATOM 0 H GLY A 5 4.800 -8.918 8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 5 6.749 -8.625 9.718 1.00 0.00 H new ATOM 0 HA3 GLY A 5 7.757 -9.031 8.343 1.00 0.00 H new ATOM 72 N LYS A 6 7.996 -6.434 8.694 1.00 0.00 N ATOM 73 CA LYS A 6 8.157 -5.007 8.472 1.00 0.00 C ATOM 74 C LYS A 6 8.961 -4.762 7.197 1.00 0.00 C ATOM 75 O LYS A 6 10.114 -5.175 7.083 1.00 0.00 O ATOM 76 CB LYS A 6 8.891 -4.349 9.639 1.00 0.00 C ATOM 77 CG LYS A 6 8.340 -4.716 10.994 1.00 0.00 C ATOM 78 CD LYS A 6 9.080 -4.008 12.118 1.00 0.00 C ATOM 79 CE LYS A 6 9.015 -2.492 11.971 1.00 0.00 C ATOM 80 NZ LYS A 6 9.657 -1.788 13.113 1.00 0.00 N ATOM 0 H LYS A 6 8.768 -6.877 9.192 1.00 0.00 H new ATOM 0 HA LYS A 6 7.161 -4.573 8.381 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.943 -4.630 9.598 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.845 -3.266 9.520 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.282 -4.458 11.037 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.412 -5.794 11.135 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.650 -4.299 13.076 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.122 -4.328 12.126 1.00 0.00 H new ATOM 0 HE2 LYS A 6 9.505 -2.197 11.043 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.973 -2.181 11.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.589 -0.760 12.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.174 -2.047 13.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.658 -2.064 13.172 1.00 0.00 H new ATOM 94 N TYR A 7 8.339 -4.109 6.248 1.00 0.00 N ATOM 95 CA TYR A 7 8.997 -3.676 5.037 1.00 0.00 C ATOM 96 C TYR A 7 8.886 -2.167 4.961 1.00 0.00 C ATOM 97 O TYR A 7 7.791 -1.618 4.990 1.00 0.00 O ATOM 98 CB TYR A 7 8.338 -4.311 3.807 1.00 0.00 C ATOM 99 CG TYR A 7 8.376 -5.827 3.790 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.558 -6.572 4.629 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.219 -6.513 2.927 1.00 0.00 C ATOM 102 CE1 TYR A 7 7.581 -7.952 4.613 1.00 0.00 C ATOM 103 CE2 TYR A 7 9.248 -7.897 2.904 1.00 0.00 C ATOM 104 CZ TYR A 7 8.429 -8.609 3.749 1.00 0.00 C ATOM 105 OH TYR A 7 8.451 -9.986 3.729 1.00 0.00 O ATOM 0 H TYR A 7 7.351 -3.859 6.293 1.00 0.00 H new ATOM 0 HA TYR A 7 10.043 -3.984 5.052 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.299 -3.985 3.757 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.833 -3.937 2.911 1.00 0.00 H new ATOM 0 HD1 TYR A 7 6.891 -6.062 5.308 1.00 0.00 H new ATOM 0 HD2 TYR A 7 9.864 -5.958 2.262 1.00 0.00 H new ATOM 0 HE1 TYR A 7 6.938 -8.514 5.274 1.00 0.00 H new ATOM 0 HE2 TYR A 7 9.910 -8.415 2.226 1.00 0.00 H new ATOM 0 HH TYR A 7 8.061 -10.331 4.559 1.00 0.00 H new ATOM 115 N GLN A 8 10.005 -1.494 4.860 1.00 0.00 N ATOM 116 CA GLN A 8 10.009 -0.051 4.920 1.00 0.00 C ATOM 117 C GLN A 8 10.023 0.509 3.506 1.00 0.00 C ATOM 118 O GLN A 8 10.809 0.057 2.670 1.00 0.00 O ATOM 119 CB GLN A 8 11.226 0.426 5.709 1.00 0.00 C ATOM 120 CG GLN A 8 10.957 1.635 6.585 1.00 0.00 C ATOM 121 CD GLN A 8 11.707 2.871 6.140 1.00 0.00 C ATOM 122 OE1 GLN A 8 12.841 3.099 6.555 1.00 0.00 O ATOM 123 NE2 GLN A 8 11.074 3.690 5.319 1.00 0.00 N ATOM 0 H GLN A 8 10.924 -1.920 4.736 1.00 0.00 H new ATOM 0 HA GLN A 8 9.112 0.305 5.427 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.584 -0.391 6.335 1.00 0.00 H new ATOM 0 HB3 GLN A 8 12.028 0.667 5.011 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.888 1.846 6.583 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.234 1.400 7.613 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.133 3.463 4.998 1.00 0.00 H new ATOM 0 HE22 GLN A 8 11.527 4.549 5.006 1.00 0.00 H new ATOM 132 N VAL A 9 9.130 1.449 3.217 1.00 0.00 N ATOM 133 CA VAL A 9 9.089 2.032 1.883 1.00 0.00 C ATOM 134 C VAL A 9 10.320 2.910 1.635 1.00 0.00 C ATOM 135 O VAL A 9 10.787 3.630 2.518 1.00 0.00 O ATOM 136 CB VAL A 9 7.789 2.832 1.624 1.00 0.00 C ATOM 137 CG1 VAL A 9 7.943 4.266 2.020 1.00 0.00 C ATOM 138 CG2 VAL A 9 7.359 2.712 0.171 1.00 0.00 C ATOM 0 H VAL A 9 8.440 1.816 3.872 1.00 0.00 H new ATOM 0 HA VAL A 9 9.099 1.202 1.177 1.00 0.00 H new ATOM 0 HB VAL A 9 7.005 2.401 2.246 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.013 4.799 1.825 1.00 0.00 H new ATOM 0 HG12 VAL A 9 8.180 4.327 3.082 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.748 4.719 1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.444 3.283 0.014 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.145 3.103 -0.475 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.179 1.664 -0.070 1.00 0.00 H new ATOM 148 N GLN A 10 10.833 2.828 0.422 1.00 0.00 N ATOM 149 CA GLN A 10 12.038 3.539 0.032 1.00 0.00 C ATOM 150 C GLN A 10 11.708 4.674 -0.926 1.00 0.00 C ATOM 151 O GLN A 10 12.288 5.756 -0.859 1.00 0.00 O ATOM 152 CB GLN A 10 13.018 2.601 -0.648 1.00 0.00 C ATOM 153 CG GLN A 10 13.687 1.607 0.274 1.00 0.00 C ATOM 154 CD GLN A 10 14.104 2.208 1.606 1.00 0.00 C ATOM 155 OE1 GLN A 10 13.352 2.194 2.578 1.00 0.00 O ATOM 156 NE2 GLN A 10 15.308 2.751 1.655 1.00 0.00 N ATOM 0 H GLN A 10 10.425 2.265 -0.324 1.00 0.00 H new ATOM 0 HA GLN A 10 12.487 3.944 0.939 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.492 2.053 -1.430 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.788 3.196 -1.138 1.00 0.00 H new ATOM 0 HG2 GLN A 10 13.006 0.776 0.456 1.00 0.00 H new ATOM 0 HG3 GLN A 10 14.566 1.196 -0.222 1.00 0.00 H new ATOM 0 HE21 GLN A 10 15.905 2.744 0.828 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.640 3.177 2.520 1.00 0.00 H new ATOM 165 N SER A 11 10.780 4.407 -1.831 1.00 0.00 N ATOM 166 CA SER A 11 10.438 5.346 -2.890 1.00 0.00 C ATOM 167 C SER A 11 9.056 5.055 -3.456 1.00 0.00 C ATOM 168 O SER A 11 8.539 3.947 -3.303 1.00 0.00 O ATOM 169 CB SER A 11 11.481 5.268 -4.000 1.00 0.00 C ATOM 170 OG SER A 11 12.667 5.958 -3.640 1.00 0.00 O ATOM 0 H SER A 11 10.245 3.539 -1.854 1.00 0.00 H new ATOM 0 HA SER A 11 10.426 6.351 -2.468 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.714 4.224 -4.211 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.073 5.695 -4.916 1.00 0.00 H new ATOM 0 HG SER A 11 12.672 6.118 -2.673 1.00 0.00 H new ATOM 176 N GLN A 12 8.463 6.047 -4.112 1.00 0.00 N ATOM 177 CA GLN A 12 7.161 5.876 -4.741 1.00 0.00 C ATOM 178 C GLN A 12 7.106 6.561 -6.093 1.00 0.00 C ATOM 179 O GLN A 12 7.885 7.465 -6.387 1.00 0.00 O ATOM 180 CB GLN A 12 6.016 6.394 -3.875 1.00 0.00 C ATOM 181 CG GLN A 12 5.791 5.594 -2.601 1.00 0.00 C ATOM 182 CD GLN A 12 6.120 6.355 -1.331 1.00 0.00 C ATOM 183 OE1 GLN A 12 7.086 7.259 -1.399 1.00 0.00 O flip ATOM 184 NE2 GLN A 12 5.514 6.118 -0.290 1.00 0.00 N flip ATOM 0 H GLN A 12 8.865 6.978 -4.221 1.00 0.00 H new ATOM 0 HA GLN A 12 7.034 4.801 -4.869 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.216 7.432 -3.609 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.098 6.387 -4.463 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.749 5.276 -2.563 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.399 4.690 -2.639 1.00 0.00 H new ATOM 0 HE21 GLN A 12 4.776 5.414 -0.278 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.748 6.625 0.563 1.00 0.00 H new ATOM 193 N GLU A 13 6.188 6.089 -6.908 1.00 0.00 N ATOM 194 CA GLU A 13 5.971 6.592 -8.248 1.00 0.00 C ATOM 195 C GLU A 13 4.603 7.243 -8.342 1.00 0.00 C ATOM 196 O GLU A 13 3.603 6.628 -7.981 1.00 0.00 O ATOM 197 CB GLU A 13 6.060 5.413 -9.192 1.00 0.00 C ATOM 198 CG GLU A 13 5.690 5.701 -10.628 1.00 0.00 C ATOM 199 CD GLU A 13 6.672 6.628 -11.314 1.00 0.00 C ATOM 200 OE1 GLU A 13 6.708 7.826 -10.971 1.00 0.00 O ATOM 201 OE2 GLU A 13 7.417 6.161 -12.200 1.00 0.00 O ATOM 0 H GLU A 13 5.558 5.329 -6.653 1.00 0.00 H new ATOM 0 HA GLU A 13 6.717 7.344 -8.506 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.079 5.027 -9.168 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.410 4.621 -8.819 1.00 0.00 H new ATOM 0 HG2 GLU A 13 5.638 4.762 -11.180 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.695 6.145 -10.660 1.00 0.00 H new ATOM 208 N ASN A 14 4.569 8.483 -8.813 1.00 0.00 N ATOM 209 CA ASN A 14 3.316 9.220 -8.978 1.00 0.00 C ATOM 210 C ASN A 14 2.545 9.322 -7.676 1.00 0.00 C ATOM 211 O ASN A 14 1.319 9.284 -7.658 1.00 0.00 O ATOM 212 CB ASN A 14 2.435 8.555 -10.013 1.00 0.00 C ATOM 213 CG ASN A 14 2.978 8.655 -11.407 1.00 0.00 C ATOM 214 OD1 ASN A 14 3.542 9.668 -11.826 1.00 0.00 O ATOM 215 ND2 ASN A 14 2.829 7.575 -12.111 1.00 0.00 N ATOM 0 H ASN A 14 5.400 9.005 -9.090 1.00 0.00 H new ATOM 0 HA ASN A 14 3.584 10.224 -9.307 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.311 7.504 -9.753 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.445 9.009 -9.983 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.188 7.534 -13.065 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.353 6.767 -11.710 1.00 0.00 H new ATOM 222 N PHE A 15 3.274 9.447 -6.600 1.00 0.00 N ATOM 223 CA PHE A 15 2.706 9.668 -5.266 1.00 0.00 C ATOM 224 C PHE A 15 2.080 11.065 -5.148 1.00 0.00 C ATOM 225 O PHE A 15 1.908 11.590 -4.052 1.00 0.00 O ATOM 226 CB PHE A 15 3.784 9.465 -4.191 1.00 0.00 C ATOM 227 CG PHE A 15 5.037 10.269 -4.422 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.047 9.781 -5.236 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.203 11.506 -3.828 1.00 0.00 C ATOM 230 CE1 PHE A 15 7.197 10.514 -5.452 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.353 12.244 -4.042 1.00 0.00 C ATOM 232 CZ PHE A 15 7.350 11.746 -4.853 1.00 0.00 C ATOM 0 H PHE A 15 4.293 9.400 -6.608 1.00 0.00 H new ATOM 0 HA PHE A 15 1.912 8.937 -5.111 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.368 9.730 -3.219 1.00 0.00 H new ATOM 0 HB3 PHE A 15 4.045 8.408 -4.148 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.933 8.816 -5.707 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.426 11.901 -3.190 1.00 0.00 H new ATOM 0 HE1 PHE A 15 7.976 10.122 -6.090 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.470 13.210 -3.574 1.00 0.00 H new ATOM 0 HZ PHE A 15 8.250 12.320 -5.019 1.00 0.00 H new ATOM 242 N GLU A 16 1.741 11.646 -6.287 1.00 0.00 N ATOM 243 CA GLU A 16 1.281 13.032 -6.370 1.00 0.00 C ATOM 244 C GLU A 16 0.069 13.147 -7.275 1.00 0.00 C ATOM 245 O GLU A 16 -0.929 13.749 -6.893 1.00 0.00 O ATOM 246 CB GLU A 16 2.414 13.907 -6.873 1.00 0.00 C ATOM 247 CG GLU A 16 3.635 13.763 -6.041 1.00 0.00 C ATOM 248 CD GLU A 16 4.794 14.587 -6.553 1.00 0.00 C ATOM 249 OE1 GLU A 16 5.349 14.228 -7.614 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.165 15.582 -5.908 1.00 0.00 O ATOM 0 H GLU A 16 1.776 11.170 -7.189 1.00 0.00 H new ATOM 0 HA GLU A 16 0.982 13.368 -5.377 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.645 13.644 -7.905 1.00 0.00 H new ATOM 0 HB3 GLU A 16 2.095 14.949 -6.873 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.408 14.060 -5.017 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.927 12.713 -6.011 1.00 0.00 H new ATOM 257 N PRO A 17 0.107 12.556 -8.482 1.00 0.00 N ATOM 258 CA PRO A 17 -1.066 12.488 -9.318 1.00 0.00 C ATOM 259 C PRO A 17 -2.052 11.515 -8.721 1.00 0.00 C ATOM 260 O PRO A 17 -3.258 11.612 -8.919 1.00 0.00 O ATOM 261 CB PRO A 17 -0.563 11.982 -10.644 1.00 0.00 C ATOM 262 CG PRO A 17 0.684 11.251 -10.328 1.00 0.00 C ATOM 263 CD PRO A 17 1.256 11.889 -9.103 1.00 0.00 C ATOM 0 HA PRO A 17 -1.573 13.448 -9.416 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.294 11.328 -11.120 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.374 12.804 -11.334 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.480 10.194 -10.155 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.387 11.308 -11.159 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.696 11.148 -8.436 1.00 0.00 H new ATOM 0 HD3 PRO A 17 2.043 12.600 -9.354 1.00 0.00 H new ATOM 271 N PHE A 18 -1.496 10.578 -7.974 1.00 0.00 N ATOM 272 CA PHE A 18 -2.265 9.609 -7.236 1.00 0.00 C ATOM 273 C PHE A 18 -3.060 10.320 -6.172 1.00 0.00 C ATOM 274 O PHE A 18 -4.274 10.165 -6.072 1.00 0.00 O ATOM 275 CB PHE A 18 -1.309 8.606 -6.600 1.00 0.00 C ATOM 276 CG PHE A 18 -1.985 7.399 -6.034 1.00 0.00 C ATOM 277 CD1 PHE A 18 -2.210 6.311 -6.831 1.00 0.00 C ATOM 278 CD2 PHE A 18 -2.392 7.360 -4.710 1.00 0.00 C ATOM 279 CE1 PHE A 18 -2.832 5.186 -6.336 1.00 0.00 C ATOM 280 CE2 PHE A 18 -3.016 6.240 -4.201 1.00 0.00 C ATOM 281 CZ PHE A 18 -3.238 5.150 -5.017 1.00 0.00 C ATOM 0 H PHE A 18 -0.487 10.473 -7.866 1.00 0.00 H new ATOM 0 HA PHE A 18 -2.951 9.081 -7.898 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -0.583 8.286 -7.348 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -0.751 9.103 -5.807 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -1.895 6.334 -7.864 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.219 8.214 -4.071 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -3.002 4.334 -6.978 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.330 6.217 -3.168 1.00 0.00 H new ATOM 0 HZ PHE A 18 -3.728 4.271 -4.625 1.00 0.00 H new ATOM 291 N MET A 19 -2.358 11.118 -5.390 1.00 0.00 N ATOM 292 CA MET A 19 -2.981 11.955 -4.397 1.00 0.00 C ATOM 293 C MET A 19 -3.931 12.952 -5.034 1.00 0.00 C ATOM 294 O MET A 19 -5.016 13.170 -4.523 1.00 0.00 O ATOM 295 CB MET A 19 -1.901 12.703 -3.640 1.00 0.00 C ATOM 296 CG MET A 19 -0.868 11.811 -3.001 1.00 0.00 C ATOM 297 SD MET A 19 -1.545 10.728 -1.731 1.00 0.00 S ATOM 298 CE MET A 19 -0.053 9.924 -1.154 1.00 0.00 C ATOM 0 H MET A 19 -1.342 11.200 -5.429 1.00 0.00 H new ATOM 0 HA MET A 19 -3.556 11.323 -3.720 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.401 13.388 -4.324 1.00 0.00 H new ATOM 0 HB3 MET A 19 -2.369 13.311 -2.866 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.396 11.203 -3.773 1.00 0.00 H new ATOM 0 HG3 MET A 19 -0.086 12.430 -2.561 1.00 0.00 H new ATOM 0 HE1 MET A 19 -0.303 9.218 -0.362 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.416 9.390 -1.981 1.00 0.00 H new ATOM 0 HE3 MET A 19 0.638 10.673 -0.768 1.00 0.00 H new ATOM 308 N LYS A 20 -3.536 13.553 -6.154 1.00 0.00 N ATOM 309 CA LYS A 20 -4.345 14.604 -6.757 1.00 0.00 C ATOM 310 C LYS A 20 -5.641 14.030 -7.309 1.00 0.00 C ATOM 311 O LYS A 20 -6.687 14.683 -7.297 1.00 0.00 O ATOM 312 CB LYS A 20 -3.564 15.358 -7.841 1.00 0.00 C ATOM 313 CG LYS A 20 -3.706 14.824 -9.255 1.00 0.00 C ATOM 314 CD LYS A 20 -2.931 15.721 -10.190 1.00 0.00 C ATOM 315 CE LYS A 20 -2.225 14.945 -11.275 1.00 0.00 C ATOM 316 NZ LYS A 20 -1.248 15.797 -12.001 1.00 0.00 N ATOM 0 H LYS A 20 -2.675 13.334 -6.654 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.597 15.325 -5.979 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.884 16.400 -7.833 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.507 15.347 -7.574 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -3.330 13.803 -9.313 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.757 14.794 -9.544 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -3.611 16.441 -10.645 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.198 16.291 -9.619 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.710 14.090 -10.837 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -2.958 14.549 -11.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.662 15.202 -12.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.758 16.498 -12.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -0.639 16.288 -11.316 1.00 0.00 H new ATOM 330 N ALA A 21 -5.553 12.806 -7.797 1.00 0.00 N ATOM 331 CA ALA A 21 -6.726 12.062 -8.223 1.00 0.00 C ATOM 332 C ALA A 21 -7.568 11.647 -7.017 1.00 0.00 C ATOM 333 O ALA A 21 -8.791 11.540 -7.097 1.00 0.00 O ATOM 334 CB ALA A 21 -6.301 10.842 -9.021 1.00 0.00 C ATOM 0 H ALA A 21 -4.673 12.302 -7.909 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.337 12.704 -8.858 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.185 10.288 -9.338 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.738 11.159 -9.899 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.675 10.201 -8.400 1.00 0.00 H new ATOM 340 N MET A 22 -6.883 11.441 -5.902 1.00 0.00 N ATOM 341 CA MET A 22 -7.485 10.948 -4.668 1.00 0.00 C ATOM 342 C MET A 22 -8.138 12.061 -3.837 1.00 0.00 C ATOM 343 O MET A 22 -9.278 11.918 -3.393 1.00 0.00 O ATOM 344 CB MET A 22 -6.415 10.212 -3.860 1.00 0.00 C ATOM 345 CG MET A 22 -6.636 10.253 -2.374 1.00 0.00 C ATOM 346 SD MET A 22 -5.376 9.347 -1.462 1.00 0.00 S ATOM 347 CE MET A 22 -5.589 7.709 -2.156 1.00 0.00 C ATOM 0 H MET A 22 -5.881 11.613 -5.826 1.00 0.00 H new ATOM 0 HA MET A 22 -8.292 10.264 -4.931 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.381 9.172 -4.184 1.00 0.00 H new ATOM 0 HB3 MET A 22 -5.441 10.647 -4.084 1.00 0.00 H new ATOM 0 HG2 MET A 22 -6.645 11.291 -2.040 1.00 0.00 H new ATOM 0 HG3 MET A 22 -7.616 9.835 -2.144 1.00 0.00 H new ATOM 0 HE1 MET A 22 -4.867 7.027 -1.707 1.00 0.00 H new ATOM 0 HE2 MET A 22 -6.599 7.355 -1.950 1.00 0.00 H new ATOM 0 HE3 MET A 22 -5.431 7.747 -3.234 1.00 0.00 H new ATOM 357 N GLY A 23 -7.426 13.158 -3.625 1.00 0.00 N ATOM 358 CA GLY A 23 -7.943 14.229 -2.805 1.00 0.00 C ATOM 359 C GLY A 23 -6.867 15.210 -2.384 1.00 0.00 C ATOM 360 O GLY A 23 -7.125 16.409 -2.258 1.00 0.00 O ATOM 0 H GLY A 23 -6.496 13.324 -4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.720 14.761 -3.355 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.413 13.807 -1.917 1.00 0.00 H new ATOM 364 N LEU A 24 -5.659 14.706 -2.161 1.00 0.00 N ATOM 365 CA LEU A 24 -4.539 15.546 -1.800 1.00 0.00 C ATOM 366 C LEU A 24 -4.063 16.304 -3.032 1.00 0.00 C ATOM 367 O LEU A 24 -3.774 15.702 -4.059 1.00 0.00 O ATOM 368 CB LEU A 24 -3.403 14.675 -1.258 1.00 0.00 C ATOM 369 CG LEU A 24 -2.449 15.341 -0.267 1.00 0.00 C ATOM 370 CD1 LEU A 24 -1.802 16.546 -0.873 1.00 0.00 C ATOM 371 CD2 LEU A 24 -3.185 15.724 0.998 1.00 0.00 C ATOM 0 H LEU A 24 -5.436 13.713 -2.226 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.844 16.257 -1.032 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.842 13.802 -0.775 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.818 14.311 -2.103 1.00 0.00 H new ATOM 0 HG LEU A 24 -1.668 14.623 -0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.128 17.001 -0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.237 16.250 -1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.569 17.266 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.492 16.197 1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.987 16.421 0.755 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.607 14.831 1.458 1.00 0.00 H new ATOM 383 N PRO A 25 -3.955 17.628 -2.950 1.00 0.00 N ATOM 384 CA PRO A 25 -3.501 18.431 -4.070 1.00 0.00 C ATOM 385 C PRO A 25 -1.987 18.383 -4.204 1.00 0.00 C ATOM 386 O PRO A 25 -1.287 18.366 -3.190 1.00 0.00 O ATOM 387 CB PRO A 25 -3.985 19.829 -3.709 1.00 0.00 C ATOM 388 CG PRO A 25 -3.961 19.852 -2.233 1.00 0.00 C ATOM 389 CD PRO A 25 -4.226 18.449 -1.759 1.00 0.00 C ATOM 0 HA PRO A 25 -3.882 18.084 -5.031 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -3.335 20.596 -4.130 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -4.988 20.015 -4.094 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.996 20.204 -1.870 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -4.716 20.537 -1.847 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -3.576 18.177 -0.927 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -5.253 18.329 -1.414 1.00 0.00 H new ATOM 397 N GLU A 26 -1.476 18.343 -5.428 1.00 0.00 N ATOM 398 CA GLU A 26 -0.047 18.226 -5.648 1.00 0.00 C ATOM 399 C GLU A 26 0.720 19.234 -4.833 1.00 0.00 C ATOM 400 O GLU A 26 1.688 18.854 -4.209 1.00 0.00 O ATOM 401 CB GLU A 26 0.282 18.389 -7.121 1.00 0.00 C ATOM 402 CG GLU A 26 1.103 17.249 -7.694 1.00 0.00 C ATOM 403 CD GLU A 26 1.109 17.255 -9.210 1.00 0.00 C ATOM 404 OE1 GLU A 26 0.096 16.850 -9.820 1.00 0.00 O ATOM 405 OE2 GLU A 26 2.115 17.685 -9.803 1.00 0.00 O ATOM 0 H GLU A 26 -2.033 18.390 -6.281 1.00 0.00 H new ATOM 0 HA GLU A 26 0.254 17.229 -5.325 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.647 18.474 -7.684 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.826 19.323 -7.261 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.127 17.321 -7.328 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.703 16.300 -7.337 1.00 0.00 H new ATOM 412 N ASP A 27 0.252 20.477 -4.755 1.00 0.00 N ATOM 413 CA ASP A 27 0.956 21.489 -3.968 1.00 0.00 C ATOM 414 C ASP A 27 1.127 21.005 -2.542 1.00 0.00 C ATOM 415 O ASP A 27 2.220 21.020 -2.024 1.00 0.00 O ATOM 416 CB ASP A 27 0.216 22.821 -3.980 1.00 0.00 C ATOM 417 CG ASP A 27 0.864 23.869 -3.094 1.00 0.00 C ATOM 418 OD1 ASP A 27 0.570 23.904 -1.880 1.00 0.00 O ATOM 419 OD2 ASP A 27 1.663 24.679 -3.614 1.00 0.00 O ATOM 0 H ASP A 27 -0.596 20.805 -5.217 1.00 0.00 H new ATOM 0 HA ASP A 27 1.935 21.646 -4.421 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.171 23.196 -5.003 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.812 22.662 -3.653 1.00 0.00 H new ATOM 424 N LEU A 28 0.091 20.435 -1.958 1.00 0.00 N ATOM 425 CA LEU A 28 0.186 19.988 -0.570 1.00 0.00 C ATOM 426 C LEU A 28 1.146 18.802 -0.473 1.00 0.00 C ATOM 427 O LEU A 28 1.852 18.637 0.524 1.00 0.00 O ATOM 428 CB LEU A 28 -1.195 19.647 -0.011 1.00 0.00 C ATOM 429 CG LEU A 28 -1.982 20.842 0.517 1.00 0.00 C ATOM 430 CD1 LEU A 28 -3.415 20.458 0.842 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.309 21.371 1.750 1.00 0.00 C ATOM 0 H LEU A 28 -0.811 20.270 -2.406 1.00 0.00 H new ATOM 0 HA LEU A 28 0.585 20.799 0.039 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.779 19.162 -0.793 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.077 18.922 0.795 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.005 21.610 -0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.950 21.331 1.216 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.906 20.090 -0.059 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.419 19.677 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.868 22.226 2.131 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.276 20.590 2.510 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.293 21.682 1.505 1.00 0.00 H new ATOM 443 N ILE A 29 1.168 17.983 -1.515 1.00 0.00 N ATOM 444 CA ILE A 29 2.181 16.953 -1.670 1.00 0.00 C ATOM 445 C ILE A 29 3.575 17.559 -1.842 1.00 0.00 C ATOM 446 O ILE A 29 4.514 17.130 -1.223 1.00 0.00 O ATOM 447 CB ILE A 29 1.880 16.116 -2.900 1.00 0.00 C ATOM 448 CG1 ILE A 29 0.515 15.517 -2.769 1.00 0.00 C ATOM 449 CG2 ILE A 29 2.893 15.016 -3.064 1.00 0.00 C ATOM 450 CD1 ILE A 29 -0.109 15.208 -4.083 1.00 0.00 C ATOM 0 H ILE A 29 0.486 18.015 -2.273 1.00 0.00 H new ATOM 0 HA ILE A 29 2.164 16.341 -0.768 1.00 0.00 H new ATOM 0 HB ILE A 29 1.925 16.761 -3.777 1.00 0.00 H new ATOM 0 HG12 ILE A 29 0.580 14.603 -2.179 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.127 16.206 -2.220 1.00 0.00 H new ATOM 0 HG21 ILE A 29 2.654 14.431 -3.952 1.00 0.00 H new ATOM 0 HG22 ILE A 29 3.887 15.450 -3.171 1.00 0.00 H new ATOM 0 HG23 ILE A 29 2.872 14.369 -2.187 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.097 14.776 -3.924 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.203 16.124 -4.666 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.515 14.497 -4.624 1.00 0.00 H new ATOM 462 N GLN A 30 3.674 18.590 -2.666 1.00 0.00 N ATOM 463 CA GLN A 30 4.967 19.210 -3.030 1.00 0.00 C ATOM 464 C GLN A 30 5.762 19.591 -1.794 1.00 0.00 C ATOM 465 O GLN A 30 6.977 19.427 -1.744 1.00 0.00 O ATOM 466 CB GLN A 30 4.745 20.476 -3.874 1.00 0.00 C ATOM 467 CG GLN A 30 3.904 20.249 -5.084 1.00 0.00 C ATOM 468 CD GLN A 30 4.394 19.089 -5.931 1.00 0.00 C ATOM 469 OE1 GLN A 30 5.227 19.263 -6.822 1.00 0.00 O ATOM 470 NE2 GLN A 30 3.874 17.904 -5.668 1.00 0.00 N ATOM 0 H GLN A 30 2.868 19.031 -3.109 1.00 0.00 H new ATOM 0 HA GLN A 30 5.525 18.472 -3.606 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.274 21.238 -3.253 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.713 20.870 -4.184 1.00 0.00 H new ATOM 0 HG2 GLN A 30 2.876 20.059 -4.776 1.00 0.00 H new ATOM 0 HG3 GLN A 30 3.893 21.156 -5.689 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.187 17.803 -4.921 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.160 17.090 -6.212 1.00 0.00 H new ATOM 479 N LYS A 31 5.068 20.120 -0.811 1.00 0.00 N ATOM 480 CA LYS A 31 5.691 20.493 0.446 1.00 0.00 C ATOM 481 C LYS A 31 6.087 19.262 1.257 1.00 0.00 C ATOM 482 O LYS A 31 7.075 19.274 1.988 1.00 0.00 O ATOM 483 CB LYS A 31 4.767 21.379 1.253 1.00 0.00 C ATOM 484 CG LYS A 31 4.559 22.774 0.647 1.00 0.00 C ATOM 485 CD LYS A 31 3.593 22.779 -0.535 1.00 0.00 C ATOM 486 CE LYS A 31 4.262 23.062 -1.886 1.00 0.00 C ATOM 487 NZ LYS A 31 5.717 23.366 -1.760 1.00 0.00 N ATOM 0 H LYS A 31 4.066 20.304 -0.856 1.00 0.00 H new ATOM 0 HA LYS A 31 6.599 21.049 0.215 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.799 20.887 1.349 1.00 0.00 H new ATOM 0 HB3 LYS A 31 5.170 21.487 2.260 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.182 23.446 1.418 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.522 23.169 0.323 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.091 21.813 -0.585 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.823 23.530 -0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.131 22.199 -2.538 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.760 23.903 -2.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.113 23.566 -2.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.846 24.196 -1.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.208 22.549 -1.344 1.00 0.00 H new ATOM 501 N GLY A 32 5.314 18.193 1.110 1.00 0.00 N ATOM 502 CA GLY A 32 5.502 17.021 1.940 1.00 0.00 C ATOM 503 C GLY A 32 5.524 15.726 1.139 1.00 0.00 C ATOM 504 O GLY A 32 4.892 14.747 1.520 1.00 0.00 O ATOM 0 H GLY A 32 4.559 18.118 0.429 1.00 0.00 H new ATOM 0 HA2 GLY A 32 6.438 17.118 2.490 1.00 0.00 H new ATOM 0 HA3 GLY A 32 4.702 16.972 2.678 1.00 0.00 H new ATOM 508 N LYS A 33 6.245 15.733 0.028 1.00 0.00 N ATOM 509 CA LYS A 33 6.151 14.671 -0.966 1.00 0.00 C ATOM 510 C LYS A 33 6.939 13.417 -0.599 1.00 0.00 C ATOM 511 O LYS A 33 6.478 12.296 -0.800 1.00 0.00 O ATOM 512 CB LYS A 33 6.612 15.179 -2.337 1.00 0.00 C ATOM 513 CG LYS A 33 8.081 15.543 -2.472 1.00 0.00 C ATOM 514 CD LYS A 33 8.491 16.848 -1.785 1.00 0.00 C ATOM 515 CE LYS A 33 9.094 16.611 -0.410 1.00 0.00 C ATOM 516 NZ LYS A 33 9.658 17.852 0.189 1.00 0.00 N ATOM 0 H LYS A 33 6.909 16.470 -0.211 1.00 0.00 H new ATOM 0 HA LYS A 33 5.099 14.387 -1.000 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.382 14.414 -3.078 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.019 16.058 -2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.680 14.730 -2.061 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.326 15.616 -3.532 1.00 0.00 H new ATOM 0 HD2 LYS A 33 9.213 17.374 -2.410 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.619 17.496 -1.690 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.329 16.207 0.253 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.880 15.859 -0.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.056 17.636 1.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 10.407 18.226 -0.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 8.905 18.562 0.289 1.00 0.00 H new ATOM 530 N ASP A 34 8.116 13.616 -0.042 1.00 0.00 N ATOM 531 CA ASP A 34 9.082 12.534 0.109 1.00 0.00 C ATOM 532 C ASP A 34 9.027 11.975 1.516 1.00 0.00 C ATOM 533 O ASP A 34 9.988 12.041 2.283 1.00 0.00 O ATOM 534 CB ASP A 34 10.497 13.026 -0.209 1.00 0.00 C ATOM 535 CG ASP A 34 11.456 11.893 -0.536 1.00 0.00 C ATOM 536 OD1 ASP A 34 11.885 11.172 0.388 1.00 0.00 O ATOM 537 OD2 ASP A 34 11.803 11.734 -1.724 1.00 0.00 O ATOM 0 H ASP A 34 8.432 14.517 0.316 1.00 0.00 H new ATOM 0 HA ASP A 34 8.825 11.743 -0.595 1.00 0.00 H new ATOM 0 HB2 ASP A 34 10.456 13.716 -1.052 1.00 0.00 H new ATOM 0 HB3 ASP A 34 10.882 13.587 0.643 1.00 0.00 H new ATOM 542 N ILE A 35 7.867 11.462 1.860 1.00 0.00 N ATOM 543 CA ILE A 35 7.681 10.791 3.130 1.00 0.00 C ATOM 544 C ILE A 35 7.980 9.301 2.977 1.00 0.00 C ATOM 545 O ILE A 35 7.284 8.587 2.253 1.00 0.00 O ATOM 546 CB ILE A 35 6.237 10.967 3.647 1.00 0.00 C ATOM 547 CG1 ILE A 35 5.813 12.433 3.550 1.00 0.00 C ATOM 548 CG2 ILE A 35 6.152 10.508 5.087 1.00 0.00 C ATOM 549 CD1 ILE A 35 6.279 13.258 4.709 1.00 0.00 C ATOM 0 H ILE A 35 7.032 11.496 1.275 1.00 0.00 H new ATOM 0 HA ILE A 35 8.366 11.238 3.850 1.00 0.00 H new ATOM 0 HB ILE A 35 5.568 10.365 3.032 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.207 12.859 2.627 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.726 12.487 3.487 1.00 0.00 H new ATOM 0 HG21 ILE A 35 5.132 10.633 5.449 1.00 0.00 H new ATOM 0 HG22 ILE A 35 6.433 9.457 5.151 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.830 11.103 5.699 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.946 14.288 4.580 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.863 12.855 5.633 1.00 0.00 H new ATOM 0 HD13 ILE A 35 7.368 13.233 4.759 1.00 0.00 H new ATOM 561 N LYS A 36 9.020 8.839 3.658 1.00 0.00 N ATOM 562 CA LYS A 36 9.392 7.429 3.632 1.00 0.00 C ATOM 563 C LYS A 36 8.845 6.723 4.866 1.00 0.00 C ATOM 564 O LYS A 36 9.402 6.834 5.957 1.00 0.00 O ATOM 565 CB LYS A 36 10.910 7.277 3.570 1.00 0.00 C ATOM 566 CG LYS A 36 11.532 7.860 2.320 1.00 0.00 C ATOM 567 CD LYS A 36 13.002 7.524 2.247 1.00 0.00 C ATOM 568 CE LYS A 36 13.616 8.092 0.991 1.00 0.00 C ATOM 569 NZ LYS A 36 13.849 9.556 1.086 1.00 0.00 N ATOM 0 H LYS A 36 9.624 9.422 4.238 1.00 0.00 H new ATOM 0 HA LYS A 36 8.962 6.972 2.741 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.350 7.760 4.443 1.00 0.00 H new ATOM 0 HB3 LYS A 36 11.162 6.218 3.630 1.00 0.00 H new ATOM 0 HG2 LYS A 36 11.021 7.472 1.439 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.401 8.942 2.313 1.00 0.00 H new ATOM 0 HD2 LYS A 36 13.515 7.923 3.122 1.00 0.00 H new ATOM 0 HD3 LYS A 36 13.134 6.442 2.266 1.00 0.00 H new ATOM 0 HE2 LYS A 36 14.562 7.588 0.793 1.00 0.00 H new ATOM 0 HE3 LYS A 36 12.961 7.885 0.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.790 9.783 0.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.124 10.059 0.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.797 9.852 2.082 1.00 0.00 H new ATOM 583 N GLY A 37 7.745 6.013 4.688 1.00 0.00 N ATOM 584 CA GLY A 37 7.109 5.345 5.799 1.00 0.00 C ATOM 585 C GLY A 37 7.499 3.886 5.901 1.00 0.00 C ATOM 586 O GLY A 37 8.328 3.401 5.133 1.00 0.00 O ATOM 0 H GLY A 37 7.279 5.887 3.789 1.00 0.00 H new ATOM 0 HA2 GLY A 37 7.375 5.854 6.725 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.027 5.422 5.693 1.00 0.00 H new ATOM 590 N VAL A 38 6.890 3.181 6.837 1.00 0.00 N ATOM 591 CA VAL A 38 7.209 1.781 7.072 1.00 0.00 C ATOM 592 C VAL A 38 5.942 0.952 6.907 1.00 0.00 C ATOM 593 O VAL A 38 4.842 1.489 7.021 1.00 0.00 O ATOM 594 CB VAL A 38 7.784 1.564 8.489 1.00 0.00 C ATOM 595 CG1 VAL A 38 8.506 0.230 8.584 1.00 0.00 C ATOM 596 CG2 VAL A 38 8.702 2.701 8.891 1.00 0.00 C ATOM 0 H VAL A 38 6.167 3.556 7.451 1.00 0.00 H new ATOM 0 HA VAL A 38 7.965 1.472 6.351 1.00 0.00 H new ATOM 0 HB VAL A 38 6.946 1.549 9.186 1.00 0.00 H new ATOM 0 HG11 VAL A 38 8.902 0.101 9.591 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.809 -0.578 8.362 1.00 0.00 H new ATOM 0 HG13 VAL A 38 9.326 0.208 7.867 1.00 0.00 H new ATOM 0 HG21 VAL A 38 9.090 2.518 9.893 1.00 0.00 H new ATOM 0 HG22 VAL A 38 9.531 2.765 8.187 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.146 3.638 8.883 1.00 0.00 H new ATOM 606 N SER A 39 6.084 -0.324 6.590 1.00 0.00 N ATOM 607 CA SER A 39 4.927 -1.204 6.492 1.00 0.00 C ATOM 608 C SER A 39 5.179 -2.529 7.213 1.00 0.00 C ATOM 609 O SER A 39 6.065 -3.274 6.849 1.00 0.00 O ATOM 610 CB SER A 39 4.605 -1.461 5.018 1.00 0.00 C ATOM 611 OG SER A 39 4.493 -0.233 4.310 1.00 0.00 O ATOM 0 H SER A 39 6.980 -0.773 6.397 1.00 0.00 H new ATOM 0 HA SER A 39 4.079 -0.716 6.973 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.387 -2.075 4.571 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.674 -2.021 4.936 1.00 0.00 H new ATOM 0 HG SER A 39 5.371 0.022 3.956 1.00 0.00 H new ATOM 617 N GLU A 40 4.368 -2.832 8.211 1.00 0.00 N ATOM 618 CA GLU A 40 4.515 -4.053 8.975 1.00 0.00 C ATOM 619 C GLU A 40 3.287 -4.936 8.801 1.00 0.00 C ATOM 620 O GLU A 40 2.174 -4.536 9.099 1.00 0.00 O ATOM 621 CB GLU A 40 4.695 -3.739 10.452 1.00 0.00 C ATOM 622 CG GLU A 40 5.778 -2.750 10.779 1.00 0.00 C ATOM 623 CD GLU A 40 5.340 -1.302 10.685 1.00 0.00 C ATOM 624 OE1 GLU A 40 4.610 -0.849 11.587 1.00 0.00 O ATOM 625 OE2 GLU A 40 5.752 -0.607 9.742 1.00 0.00 O ATOM 0 H GLU A 40 3.593 -2.240 8.512 1.00 0.00 H new ATOM 0 HA GLU A 40 5.397 -4.578 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.751 -3.359 10.842 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.906 -4.669 10.980 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.140 -2.944 11.788 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.618 -2.909 10.103 1.00 0.00 H new ATOM 632 N ILE A 41 3.504 -6.147 8.363 1.00 0.00 N ATOM 633 CA ILE A 41 2.417 -7.038 7.980 1.00 0.00 C ATOM 634 C ILE A 41 2.375 -8.269 8.874 1.00 0.00 C ATOM 635 O ILE A 41 3.414 -8.730 9.336 1.00 0.00 O ATOM 636 CB ILE A 41 2.557 -7.486 6.519 1.00 0.00 C ATOM 637 CG1 ILE A 41 2.618 -6.276 5.597 1.00 0.00 C ATOM 638 CG2 ILE A 41 1.397 -8.386 6.127 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.240 -6.606 4.264 1.00 0.00 C ATOM 0 H ILE A 41 4.434 -6.553 8.258 1.00 0.00 H new ATOM 0 HA ILE A 41 1.489 -6.478 8.097 1.00 0.00 H new ATOM 0 HB ILE A 41 3.485 -8.049 6.418 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.611 -5.890 5.440 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.192 -5.484 6.078 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.511 -8.695 5.088 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.387 -9.267 6.769 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.459 -7.842 6.243 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.261 -5.712 3.641 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.257 -6.967 4.416 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.652 -7.379 3.769 1.00 0.00 H new ATOM 651 N VAL A 42 1.180 -8.740 9.193 1.00 0.00 N ATOM 652 CA VAL A 42 1.021 -10.053 9.804 1.00 0.00 C ATOM 653 C VAL A 42 0.391 -11.019 8.798 1.00 0.00 C ATOM 654 O VAL A 42 -0.745 -10.814 8.373 1.00 0.00 O ATOM 655 CB VAL A 42 0.161 -9.993 11.079 1.00 0.00 C ATOM 656 CG1 VAL A 42 -0.082 -11.387 11.638 1.00 0.00 C ATOM 657 CG2 VAL A 42 0.838 -9.118 12.113 1.00 0.00 C ATOM 0 H VAL A 42 0.307 -8.235 9.040 1.00 0.00 H new ATOM 0 HA VAL A 42 2.011 -10.408 10.089 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.807 -9.561 10.825 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -0.692 -11.317 12.539 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -0.601 -11.992 10.894 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.873 -11.853 11.882 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.225 -9.079 13.014 1.00 0.00 H new ATOM 0 HG22 VAL A 42 1.816 -9.533 12.357 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.961 -8.111 11.714 1.00 0.00 H new ATOM 667 N HIS A 43 1.134 -12.048 8.387 1.00 0.00 N ATOM 668 CA HIS A 43 0.604 -13.032 7.457 1.00 0.00 C ATOM 669 C HIS A 43 0.077 -14.244 8.211 1.00 0.00 C ATOM 670 O HIS A 43 0.832 -15.006 8.813 1.00 0.00 O ATOM 671 CB HIS A 43 1.675 -13.487 6.441 1.00 0.00 C ATOM 672 CG HIS A 43 1.143 -14.393 5.365 1.00 0.00 C ATOM 673 ND1 HIS A 43 1.903 -15.364 4.749 1.00 0.00 N ATOM 674 CD2 HIS A 43 -0.082 -14.462 4.793 1.00 0.00 C ATOM 675 CE1 HIS A 43 1.169 -15.989 3.846 1.00 0.00 C ATOM 676 NE2 HIS A 43 -0.043 -15.463 3.852 1.00 0.00 N ATOM 0 H HIS A 43 2.095 -12.216 8.683 1.00 0.00 H new ATOM 0 HA HIS A 43 -0.211 -12.557 6.910 1.00 0.00 H new ATOM 0 HB2 HIS A 43 2.119 -12.607 5.976 1.00 0.00 H new ATOM 0 HB3 HIS A 43 2.474 -14.002 6.975 1.00 0.00 H new ATOM 0 HD1 HIS A 43 2.880 -15.568 4.958 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -0.934 -13.843 5.032 1.00 0.00 H new ATOM 0 HE1 HIS A 43 1.503 -16.795 3.210 1.00 0.00 H new ATOM 685 N GLU A 44 -1.223 -14.401 8.145 1.00 0.00 N ATOM 686 CA GLU A 44 -1.920 -15.567 8.641 1.00 0.00 C ATOM 687 C GLU A 44 -2.791 -16.067 7.513 1.00 0.00 C ATOM 688 O GLU A 44 -3.198 -15.261 6.680 1.00 0.00 O ATOM 689 CB GLU A 44 -2.791 -15.240 9.860 1.00 0.00 C ATOM 690 CG GLU A 44 -2.613 -16.205 11.011 1.00 0.00 C ATOM 691 CD GLU A 44 -3.079 -17.608 10.676 1.00 0.00 C ATOM 692 OE1 GLU A 44 -2.296 -18.373 10.071 1.00 0.00 O ATOM 693 OE2 GLU A 44 -4.236 -17.949 11.001 1.00 0.00 O ATOM 0 H GLU A 44 -1.844 -13.704 7.734 1.00 0.00 H new ATOM 0 HA GLU A 44 -1.198 -16.317 8.962 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.557 -14.232 10.203 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.838 -15.238 9.557 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.561 -16.234 11.296 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.167 -15.839 11.875 1.00 0.00 H new ATOM 700 N GLY A 45 -2.967 -17.378 7.408 1.00 0.00 N ATOM 701 CA GLY A 45 -3.892 -17.923 6.429 1.00 0.00 C ATOM 702 C GLY A 45 -5.122 -17.042 6.276 1.00 0.00 C ATOM 703 O GLY A 45 -5.898 -16.877 7.222 1.00 0.00 O ATOM 0 H GLY A 45 -2.488 -18.073 7.981 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.390 -18.020 5.466 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.196 -18.925 6.732 1.00 0.00 H new ATOM 707 N LYS A 46 -5.252 -16.464 5.079 1.00 0.00 N ATOM 708 CA LYS A 46 -6.266 -15.451 4.708 1.00 0.00 C ATOM 709 C LYS A 46 -6.255 -14.167 5.540 1.00 0.00 C ATOM 710 O LYS A 46 -6.691 -13.125 5.058 1.00 0.00 O ATOM 711 CB LYS A 46 -7.689 -16.002 4.618 1.00 0.00 C ATOM 712 CG LYS A 46 -7.879 -17.398 5.178 1.00 0.00 C ATOM 713 CD LYS A 46 -9.269 -17.931 4.917 1.00 0.00 C ATOM 714 CE LYS A 46 -9.468 -18.198 3.442 1.00 0.00 C ATOM 715 NZ LYS A 46 -10.768 -18.861 3.170 1.00 0.00 N ATOM 0 H LYS A 46 -4.631 -16.693 4.303 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.941 -15.171 3.706 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -8.358 -15.322 5.145 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -7.995 -16.003 3.572 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -7.144 -18.069 4.734 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -7.691 -17.386 6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.424 -18.850 5.483 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.011 -17.213 5.266 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -9.418 -17.258 2.893 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -8.656 -18.826 3.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.866 -19.027 2.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.806 -19.770 3.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.544 -18.251 3.498 1.00 0.00 H new ATOM 729 N LYS A 47 -5.774 -14.220 6.755 1.00 0.00 N ATOM 730 CA LYS A 47 -5.741 -13.023 7.594 1.00 0.00 C ATOM 731 C LYS A 47 -4.418 -12.276 7.432 1.00 0.00 C ATOM 732 O LYS A 47 -3.379 -12.716 7.919 1.00 0.00 O ATOM 733 CB LYS A 47 -5.936 -13.394 9.068 1.00 0.00 C ATOM 734 CG LYS A 47 -7.051 -14.381 9.310 1.00 0.00 C ATOM 735 CD LYS A 47 -8.378 -13.871 8.786 1.00 0.00 C ATOM 736 CE LYS A 47 -9.349 -15.009 8.570 1.00 0.00 C ATOM 737 NZ LYS A 47 -9.750 -15.666 9.842 1.00 0.00 N ATOM 0 H LYS A 47 -5.401 -15.062 7.193 1.00 0.00 H new ATOM 0 HA LYS A 47 -6.555 -12.373 7.273 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.006 -13.811 9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.138 -12.486 9.637 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.809 -15.328 8.827 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -7.134 -14.580 10.378 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -8.801 -13.156 9.492 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -8.222 -13.338 7.848 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -10.238 -14.633 8.064 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -8.896 -15.749 7.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -10.416 -16.439 9.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -8.907 -16.050 10.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -10.208 -14.969 10.463 1.00 0.00 H new ATOM 751 N VAL A 48 -4.463 -11.141 6.750 1.00 0.00 N ATOM 752 CA VAL A 48 -3.273 -10.322 6.558 1.00 0.00 C ATOM 753 C VAL A 48 -3.517 -8.900 7.056 1.00 0.00 C ATOM 754 O VAL A 48 -4.468 -8.236 6.640 1.00 0.00 O ATOM 755 CB VAL A 48 -2.840 -10.290 5.075 1.00 0.00 C ATOM 756 CG1 VAL A 48 -1.544 -9.498 4.901 1.00 0.00 C ATOM 757 CG2 VAL A 48 -2.655 -11.704 4.547 1.00 0.00 C ATOM 0 H VAL A 48 -5.309 -10.766 6.321 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.468 -10.773 7.138 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.627 -9.796 4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.261 -9.491 3.848 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.694 -8.474 5.244 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.752 -9.964 5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.350 -11.665 3.501 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.887 -12.213 5.130 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.595 -12.250 4.631 1.00 0.00 H new ATOM 767 N LYS A 49 -2.670 -8.436 7.960 1.00 0.00 N ATOM 768 CA LYS A 49 -2.773 -7.104 8.479 1.00 0.00 C ATOM 769 C LYS A 49 -1.554 -6.313 8.071 1.00 0.00 C ATOM 770 O LYS A 49 -0.436 -6.812 8.105 1.00 0.00 O ATOM 771 CB LYS A 49 -2.897 -7.177 9.982 1.00 0.00 C ATOM 772 CG LYS A 49 -2.062 -6.179 10.730 1.00 0.00 C ATOM 773 CD LYS A 49 -1.790 -6.672 12.132 1.00 0.00 C ATOM 774 CE LYS A 49 -1.042 -5.642 12.964 1.00 0.00 C ATOM 775 NZ LYS A 49 0.286 -5.296 12.389 1.00 0.00 N ATOM 0 H LYS A 49 -1.898 -8.979 8.347 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.654 -6.603 8.078 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.942 -7.032 10.254 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -2.619 -8.179 10.308 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.121 -6.016 10.205 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.577 -5.219 10.768 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.734 -6.916 12.620 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.208 -7.592 12.086 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.646 -4.738 13.044 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.907 -6.026 13.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.962 -5.117 13.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.628 -6.086 11.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.198 -4.443 11.801 1.00 0.00 H new ATOM 789 N LEU A 50 -1.787 -5.092 7.704 1.00 0.00 N ATOM 790 CA LEU A 50 -0.749 -4.222 7.184 1.00 0.00 C ATOM 791 C LEU A 50 -0.659 -2.993 8.044 1.00 0.00 C ATOM 792 O LEU A 50 -1.651 -2.312 8.283 1.00 0.00 O ATOM 793 CB LEU A 50 -1.073 -3.843 5.740 1.00 0.00 C ATOM 794 CG LEU A 50 0.102 -3.503 4.827 1.00 0.00 C ATOM 795 CD1 LEU A 50 -0.407 -3.058 3.479 1.00 0.00 C ATOM 796 CD2 LEU A 50 0.967 -2.440 5.431 1.00 0.00 C ATOM 0 H LEU A 50 -2.708 -4.656 7.753 1.00 0.00 H new ATOM 0 HA LEU A 50 0.211 -4.738 7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.623 -4.669 5.289 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.745 -2.985 5.759 1.00 0.00 H new ATOM 0 HG LEU A 50 0.709 -4.400 4.704 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.437 -2.817 2.833 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.992 -3.860 3.028 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.035 -2.175 3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.795 -2.219 4.758 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.377 -1.537 5.589 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.359 -2.789 6.386 1.00 0.00 H new ATOM 808 N THR A 51 0.517 -2.723 8.545 1.00 0.00 N ATOM 809 CA THR A 51 0.719 -1.526 9.301 1.00 0.00 C ATOM 810 C THR A 51 1.592 -0.594 8.490 1.00 0.00 C ATOM 811 O THR A 51 2.659 -0.968 8.065 1.00 0.00 O ATOM 812 CB THR A 51 1.373 -1.856 10.660 1.00 0.00 C ATOM 813 OG1 THR A 51 0.580 -2.814 11.373 1.00 0.00 O ATOM 814 CG2 THR A 51 1.547 -0.627 11.501 1.00 0.00 C ATOM 0 H THR A 51 1.342 -3.314 8.442 1.00 0.00 H new ATOM 0 HA THR A 51 -0.236 -1.043 9.506 1.00 0.00 H new ATOM 0 HB THR A 51 2.359 -2.274 10.456 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.688 -2.675 12.337 1.00 0.00 H new ATOM 0 HG21 THR A 51 2.010 -0.898 12.450 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.184 0.085 10.977 1.00 0.00 H new ATOM 0 HG23 THR A 51 0.574 -0.174 11.689 1.00 0.00 H new ATOM 822 N ILE A 52 1.130 0.603 8.250 1.00 0.00 N ATOM 823 CA ILE A 52 1.853 1.528 7.419 1.00 0.00 C ATOM 824 C ILE A 52 1.981 2.850 8.151 1.00 0.00 C ATOM 825 O ILE A 52 0.998 3.466 8.534 1.00 0.00 O ATOM 826 CB ILE A 52 1.110 1.670 6.075 1.00 0.00 C ATOM 827 CG1 ILE A 52 1.668 0.715 5.034 1.00 0.00 C ATOM 828 CG2 ILE A 52 1.128 3.088 5.572 1.00 0.00 C ATOM 829 CD1 ILE A 52 1.010 0.882 3.689 1.00 0.00 C ATOM 0 H ILE A 52 0.250 0.963 8.621 1.00 0.00 H new ATOM 0 HA ILE A 52 2.860 1.169 7.208 1.00 0.00 H new ATOM 0 HB ILE A 52 0.069 1.402 6.254 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.741 0.879 4.933 1.00 0.00 H new ATOM 0 HG13 ILE A 52 1.533 -0.311 5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.594 3.144 4.623 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.644 3.739 6.300 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.159 3.410 5.428 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.445 0.176 2.981 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.059 0.691 3.781 1.00 0.00 H new ATOM 0 HD13 ILE A 52 1.168 1.899 3.331 1.00 0.00 H new ATOM 841 N THR A 53 3.203 3.264 8.362 1.00 0.00 N ATOM 842 CA THR A 53 3.479 4.461 9.102 1.00 0.00 C ATOM 843 C THR A 53 3.762 5.603 8.140 1.00 0.00 C ATOM 844 O THR A 53 4.551 5.458 7.208 1.00 0.00 O ATOM 845 CB THR A 53 4.700 4.228 10.000 1.00 0.00 C ATOM 846 OG1 THR A 53 4.565 2.982 10.689 1.00 0.00 O ATOM 847 CG2 THR A 53 4.844 5.335 10.998 1.00 0.00 C ATOM 0 H THR A 53 4.034 2.778 8.024 1.00 0.00 H new ATOM 0 HA THR A 53 2.617 4.718 9.717 1.00 0.00 H new ATOM 0 HB THR A 53 5.589 4.206 9.370 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.348 2.837 11.260 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.716 5.149 11.624 1.00 0.00 H new ATOM 0 HG22 THR A 53 4.969 6.283 10.474 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.952 5.380 11.623 1.00 0.00 H new ATOM 855 N TYR A 54 3.103 6.722 8.359 1.00 0.00 N ATOM 856 CA TYR A 54 3.339 7.916 7.581 1.00 0.00 C ATOM 857 C TYR A 54 4.044 8.928 8.463 1.00 0.00 C ATOM 858 O TYR A 54 3.448 9.486 9.386 1.00 0.00 O ATOM 859 CB TYR A 54 2.011 8.483 7.060 1.00 0.00 C ATOM 860 CG TYR A 54 2.127 9.858 6.436 1.00 0.00 C ATOM 861 CD1 TYR A 54 2.389 10.017 5.082 1.00 0.00 C ATOM 862 CD2 TYR A 54 1.974 11.001 7.211 1.00 0.00 C ATOM 863 CE1 TYR A 54 2.493 11.278 4.520 1.00 0.00 C ATOM 864 CE2 TYR A 54 2.079 12.261 6.659 1.00 0.00 C ATOM 865 CZ TYR A 54 2.339 12.396 5.314 1.00 0.00 C ATOM 866 OH TYR A 54 2.439 13.652 4.759 1.00 0.00 O ATOM 0 H TYR A 54 2.390 6.827 9.081 1.00 0.00 H new ATOM 0 HA TYR A 54 3.962 7.684 6.717 1.00 0.00 H new ATOM 0 HB2 TYR A 54 1.599 7.795 6.322 1.00 0.00 H new ATOM 0 HB3 TYR A 54 1.300 8.529 7.885 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.514 9.144 4.458 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.769 10.901 8.267 1.00 0.00 H new ATOM 0 HE1 TYR A 54 2.694 11.386 3.464 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.958 13.137 7.279 1.00 0.00 H new ATOM 0 HH TYR A 54 2.304 14.329 5.455 1.00 0.00 H new ATOM 876 N GLY A 55 5.320 9.140 8.186 1.00 0.00 N ATOM 877 CA GLY A 55 6.115 10.041 8.986 1.00 0.00 C ATOM 878 C GLY A 55 6.300 9.528 10.402 1.00 0.00 C ATOM 879 O GLY A 55 7.250 8.799 10.687 1.00 0.00 O ATOM 0 H GLY A 55 5.821 8.699 7.415 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.090 10.177 8.519 1.00 0.00 H new ATOM 0 HA3 GLY A 55 5.636 11.020 9.014 1.00 0.00 H new ATOM 883 N SER A 56 5.382 9.897 11.280 1.00 0.00 N ATOM 884 CA SER A 56 5.440 9.479 12.670 1.00 0.00 C ATOM 885 C SER A 56 4.145 8.781 13.091 1.00 0.00 C ATOM 886 O SER A 56 4.034 8.283 14.211 1.00 0.00 O ATOM 887 CB SER A 56 5.663 10.708 13.550 1.00 0.00 C ATOM 888 OG SER A 56 6.082 10.349 14.856 1.00 0.00 O ATOM 0 H SER A 56 4.583 10.489 11.052 1.00 0.00 H new ATOM 0 HA SER A 56 6.262 8.773 12.787 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.413 11.353 13.092 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.740 11.285 13.610 1.00 0.00 H new ATOM 0 HG SER A 56 5.514 9.626 15.195 1.00 0.00 H new ATOM 894 N LYS A 57 3.172 8.730 12.191 1.00 0.00 N ATOM 895 CA LYS A 57 1.841 8.274 12.544 1.00 0.00 C ATOM 896 C LYS A 57 1.447 7.077 11.679 1.00 0.00 C ATOM 897 O LYS A 57 1.653 7.082 10.472 1.00 0.00 O ATOM 898 CB LYS A 57 0.866 9.443 12.390 1.00 0.00 C ATOM 899 CG LYS A 57 -0.385 9.343 13.242 1.00 0.00 C ATOM 900 CD LYS A 57 -1.382 8.309 12.735 1.00 0.00 C ATOM 901 CE LYS A 57 -1.979 8.704 11.405 1.00 0.00 C ATOM 902 NZ LYS A 57 -3.248 7.979 11.123 1.00 0.00 N ATOM 0 H LYS A 57 3.283 8.999 11.213 1.00 0.00 H new ATOM 0 HA LYS A 57 1.815 7.938 13.580 1.00 0.00 H new ATOM 0 HB2 LYS A 57 1.386 10.367 12.640 1.00 0.00 H new ATOM 0 HB3 LYS A 57 0.571 9.517 11.343 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -0.100 9.092 14.264 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -0.871 10.318 13.277 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.885 7.344 12.637 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -2.179 8.184 13.468 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.166 9.778 11.397 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.261 8.499 10.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.596 8.243 10.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -3.077 6.954 11.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.959 8.234 11.838 1.00 0.00 H new ATOM 916 N VAL A 58 0.863 6.069 12.303 1.00 0.00 N ATOM 917 CA VAL A 58 0.579 4.802 11.646 1.00 0.00 C ATOM 918 C VAL A 58 -0.855 4.712 11.172 1.00 0.00 C ATOM 919 O VAL A 58 -1.800 5.054 11.883 1.00 0.00 O ATOM 920 CB VAL A 58 0.874 3.621 12.590 1.00 0.00 C ATOM 921 CG1 VAL A 58 0.534 2.305 11.920 1.00 0.00 C ATOM 922 CG2 VAL A 58 2.332 3.633 13.014 1.00 0.00 C ATOM 0 H VAL A 58 0.572 6.104 13.280 1.00 0.00 H new ATOM 0 HA VAL A 58 1.231 4.750 10.774 1.00 0.00 H new ATOM 0 HB VAL A 58 0.251 3.728 13.478 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.749 1.483 12.603 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.524 2.292 11.659 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.132 2.192 11.016 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.524 2.792 13.681 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.968 3.550 12.133 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.552 4.566 13.533 1.00 0.00 H new ATOM 932 N ILE A 59 -0.982 4.254 9.946 1.00 0.00 N ATOM 933 CA ILE A 59 -2.239 4.011 9.325 1.00 0.00 C ATOM 934 C ILE A 59 -2.334 2.515 8.978 1.00 0.00 C ATOM 935 O ILE A 59 -1.531 1.960 8.223 1.00 0.00 O ATOM 936 CB ILE A 59 -2.399 4.967 8.125 1.00 0.00 C ATOM 937 CG1 ILE A 59 -3.440 6.033 8.453 1.00 0.00 C ATOM 938 CG2 ILE A 59 -2.734 4.225 6.867 1.00 0.00 C ATOM 939 CD1 ILE A 59 -3.570 7.103 7.403 1.00 0.00 C ATOM 0 H ILE A 59 -0.184 4.039 9.348 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.078 4.223 9.988 1.00 0.00 H new ATOM 0 HB ILE A 59 -1.445 5.462 7.943 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -4.408 5.551 8.589 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -3.180 6.500 9.403 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -2.839 4.932 6.044 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.937 3.518 6.638 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.671 3.684 7.002 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -4.329 7.823 7.709 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -2.614 7.613 7.283 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -3.861 6.650 6.456 1.00 0.00 H new ATOM 951 N HIS A 60 -3.272 1.868 9.642 1.00 0.00 N ATOM 952 CA HIS A 60 -3.441 0.406 9.598 1.00 0.00 C ATOM 953 C HIS A 60 -4.331 -0.059 8.438 1.00 0.00 C ATOM 954 O HIS A 60 -5.281 0.625 8.066 1.00 0.00 O ATOM 955 CB HIS A 60 -4.045 -0.076 10.926 1.00 0.00 C ATOM 956 CG HIS A 60 -5.439 0.432 11.214 1.00 0.00 C ATOM 957 ND1 HIS A 60 -6.021 1.497 10.553 1.00 0.00 N ATOM 958 CD2 HIS A 60 -6.365 0.006 12.106 1.00 0.00 C ATOM 959 CE1 HIS A 60 -7.234 1.699 11.027 1.00 0.00 C ATOM 960 NE2 HIS A 60 -7.473 0.808 11.969 1.00 0.00 N ATOM 0 H HIS A 60 -3.953 2.338 10.238 1.00 0.00 H new ATOM 0 HA HIS A 60 -2.453 -0.027 9.439 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -4.064 -1.166 10.925 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -3.387 0.230 11.740 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -5.580 2.042 9.813 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -6.253 -0.815 12.799 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -7.919 2.467 10.698 1.00 0.00 H new ATOM 969 N ASN A 61 -4.017 -1.227 7.866 1.00 0.00 N ATOM 970 CA ASN A 61 -4.839 -1.832 6.817 1.00 0.00 C ATOM 971 C ASN A 61 -5.023 -3.322 7.101 1.00 0.00 C ATOM 972 O ASN A 61 -4.142 -4.123 6.798 1.00 0.00 O ATOM 973 CB ASN A 61 -4.189 -1.705 5.426 1.00 0.00 C ATOM 974 CG ASN A 61 -4.060 -0.288 4.882 1.00 0.00 C ATOM 975 OD1 ASN A 61 -3.701 0.670 5.721 1.00 0.00 O flip ATOM 976 ND2 ASN A 61 -4.261 -0.065 3.690 1.00 0.00 N flip ATOM 0 H ASN A 61 -3.193 -1.774 8.116 1.00 0.00 H new ATOM 0 HA ASN A 61 -5.792 -1.303 6.817 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -3.195 -2.150 5.468 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -4.772 -2.294 4.718 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -4.537 -0.825 3.068 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.152 0.880 3.323 1.00 0.00 H new ATOM 983 N GLU A 62 -6.150 -3.705 7.684 1.00 0.00 N ATOM 984 CA GLU A 62 -6.431 -5.107 7.910 1.00 0.00 C ATOM 985 C GLU A 62 -7.418 -5.625 6.885 1.00 0.00 C ATOM 986 O GLU A 62 -8.451 -4.999 6.623 1.00 0.00 O ATOM 987 CB GLU A 62 -6.997 -5.329 9.304 1.00 0.00 C ATOM 988 CG GLU A 62 -5.983 -5.156 10.414 1.00 0.00 C ATOM 989 CD GLU A 62 -5.565 -3.721 10.644 1.00 0.00 C ATOM 990 OE1 GLU A 62 -6.351 -2.965 11.255 1.00 0.00 O ATOM 991 OE2 GLU A 62 -4.445 -3.351 10.247 1.00 0.00 O ATOM 0 H GLU A 62 -6.877 -3.066 8.006 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.491 -5.651 7.815 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.820 -4.633 9.466 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.414 -6.335 9.360 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.399 -5.555 11.339 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.099 -5.749 10.181 1.00 0.00 H new ATOM 998 N PHE A 63 -7.090 -6.762 6.303 1.00 0.00 N ATOM 999 CA PHE A 63 -7.939 -7.380 5.296 1.00 0.00 C ATOM 1000 C PHE A 63 -7.813 -8.902 5.294 1.00 0.00 C ATOM 1001 O PHE A 63 -6.790 -9.466 5.681 1.00 0.00 O ATOM 1002 CB PHE A 63 -7.625 -6.817 3.905 1.00 0.00 C ATOM 1003 CG PHE A 63 -6.164 -6.769 3.573 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -5.502 -7.895 3.111 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -5.457 -5.591 3.717 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -4.159 -7.844 2.802 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -4.117 -5.534 3.410 1.00 0.00 C ATOM 1008 CZ PHE A 63 -3.465 -6.660 2.952 1.00 0.00 C ATOM 0 H PHE A 63 -6.237 -7.281 6.510 1.00 0.00 H new ATOM 0 HA PHE A 63 -8.970 -7.138 5.552 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -8.136 -7.423 3.157 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -8.035 -5.810 3.833 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -6.043 -8.822 2.992 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -5.961 -4.705 4.074 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -3.652 -8.728 2.444 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -3.575 -4.607 3.528 1.00 0.00 H new ATOM 0 HZ PHE A 63 -2.413 -6.615 2.711 1.00 0.00 H new ATOM 1018 N THR A 64 -8.885 -9.549 4.883 1.00 0.00 N ATOM 1019 CA THR A 64 -8.924 -10.987 4.722 1.00 0.00 C ATOM 1020 C THR A 64 -8.939 -11.323 3.233 1.00 0.00 C ATOM 1021 O THR A 64 -9.642 -10.667 2.466 1.00 0.00 O ATOM 1022 CB THR A 64 -10.179 -11.583 5.393 1.00 0.00 C ATOM 1023 OG1 THR A 64 -10.300 -11.103 6.741 1.00 0.00 O ATOM 1024 CG2 THR A 64 -10.112 -13.101 5.404 1.00 0.00 C ATOM 0 H THR A 64 -9.763 -9.085 4.649 1.00 0.00 H new ATOM 0 HA THR A 64 -8.042 -11.416 5.198 1.00 0.00 H new ATOM 0 HB THR A 64 -11.050 -11.269 4.817 1.00 0.00 H new ATOM 0 HG1 THR A 64 -11.101 -11.487 7.154 1.00 0.00 H new ATOM 0 HG21 THR A 64 -11.006 -13.501 5.881 1.00 0.00 H new ATOM 0 HG22 THR A 64 -10.051 -13.470 4.380 1.00 0.00 H new ATOM 0 HG23 THR A 64 -9.230 -13.422 5.958 1.00 0.00 H new ATOM 1032 N LEU A 65 -8.115 -12.282 2.816 1.00 0.00 N ATOM 1033 CA LEU A 65 -8.097 -12.718 1.408 1.00 0.00 C ATOM 1034 C LEU A 65 -9.507 -12.977 0.898 1.00 0.00 C ATOM 1035 O LEU A 65 -10.292 -13.675 1.539 1.00 0.00 O ATOM 1036 CB LEU A 65 -7.306 -14.011 1.196 1.00 0.00 C ATOM 1037 CG LEU A 65 -6.047 -14.180 2.015 1.00 0.00 C ATOM 1038 CD1 LEU A 65 -5.225 -15.350 1.496 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -5.244 -12.899 2.024 1.00 0.00 C ATOM 0 H LEU A 65 -7.455 -12.772 3.420 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.619 -11.904 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -7.966 -14.852 1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -7.037 -14.076 0.142 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.327 -14.403 3.045 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.323 -15.456 2.098 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.814 -16.265 1.560 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.949 -15.168 0.457 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -4.341 -13.040 2.618 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -4.969 -12.635 1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -5.842 -12.097 2.457 1.00 0.00 H new ATOM 1051 N GLY A 66 -9.805 -12.417 -0.257 1.00 0.00 N ATOM 1052 CA GLY A 66 -11.088 -12.624 -0.890 1.00 0.00 C ATOM 1053 C GLY A 66 -12.195 -11.882 -0.181 1.00 0.00 C ATOM 1054 O GLY A 66 -13.338 -12.339 -0.150 1.00 0.00 O ATOM 0 H GLY A 66 -9.170 -11.812 -0.778 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.038 -12.294 -1.928 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -11.317 -13.690 -0.905 1.00 0.00 H new ATOM 1058 N GLU A 67 -11.862 -10.730 0.380 1.00 0.00 N ATOM 1059 CA GLU A 67 -12.825 -9.948 1.133 1.00 0.00 C ATOM 1060 C GLU A 67 -12.767 -8.500 0.712 1.00 0.00 C ATOM 1061 O GLU A 67 -11.682 -7.965 0.469 1.00 0.00 O ATOM 1062 CB GLU A 67 -12.565 -10.053 2.627 1.00 0.00 C ATOM 1063 CG GLU A 67 -13.187 -11.282 3.249 1.00 0.00 C ATOM 1064 CD GLU A 67 -14.700 -11.273 3.161 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -15.321 -10.288 3.613 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -15.278 -12.249 2.648 1.00 0.00 O ATOM 0 H GLU A 67 -10.931 -10.317 0.327 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.817 -10.348 0.923 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -11.489 -10.068 2.803 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.956 -9.164 3.122 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.802 -12.172 2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.887 -11.348 4.295 1.00 0.00 H new ATOM 1073 N GLU A 68 -13.921 -7.868 0.588 1.00 0.00 N ATOM 1074 CA GLU A 68 -13.940 -6.445 0.344 1.00 0.00 C ATOM 1075 C GLU A 68 -13.730 -5.727 1.661 1.00 0.00 C ATOM 1076 O GLU A 68 -14.519 -5.861 2.598 1.00 0.00 O ATOM 1077 CB GLU A 68 -15.254 -5.997 -0.279 1.00 0.00 C ATOM 1078 CG GLU A 68 -15.178 -4.632 -0.948 1.00 0.00 C ATOM 1079 CD GLU A 68 -16.505 -4.197 -1.525 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -17.359 -3.706 -0.758 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -16.698 -4.335 -2.749 1.00 0.00 O ATOM 0 H GLU A 68 -14.838 -8.311 0.651 1.00 0.00 H new ATOM 0 HA GLU A 68 -13.144 -6.202 -0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -15.568 -6.736 -1.016 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -16.022 -5.971 0.494 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -14.841 -3.893 -0.221 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -14.432 -4.661 -1.742 1.00 0.00 H new ATOM 1088 N CYS A 69 -12.648 -5.010 1.727 1.00 0.00 N ATOM 1089 CA CYS A 69 -12.314 -4.202 2.880 1.00 0.00 C ATOM 1090 C CYS A 69 -11.839 -2.883 2.401 1.00 0.00 C ATOM 1091 O CYS A 69 -11.440 -2.722 1.249 1.00 0.00 O ATOM 1092 CB CYS A 69 -11.245 -4.839 3.752 1.00 0.00 C ATOM 1093 SG CYS A 69 -11.131 -4.141 5.415 1.00 0.00 S ATOM 0 H CYS A 69 -11.959 -4.964 0.977 1.00 0.00 H new ATOM 0 HA CYS A 69 -13.208 -4.104 3.496 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -11.446 -5.907 3.832 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -10.279 -4.733 3.259 1.00 0.00 H new ATOM 0 HG CYS A 69 -9.932 -4.327 5.882 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.879 -1.953 3.284 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.511 -0.617 2.941 1.00 0.00 C ATOM 1101 C GLU A 70 -10.061 -0.412 3.325 1.00 0.00 C ATOM 1102 O GLU A 70 -9.557 -0.967 4.304 1.00 0.00 O ATOM 1103 CB GLU A 70 -12.413 0.403 3.613 1.00 0.00 C ATOM 1104 CG GLU A 70 -12.028 0.635 5.025 1.00 0.00 C ATOM 1105 CD GLU A 70 -13.159 1.183 5.866 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -14.306 0.728 5.693 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -12.901 2.059 6.716 1.00 0.00 O ATOM 0 H GLU A 70 -12.163 -2.087 4.254 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.632 -0.470 1.868 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.368 1.344 3.065 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.446 0.058 3.570 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.681 -0.303 5.460 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.189 1.330 5.057 1.00 0.00 H new ATOM 1114 N LEU A 71 -9.415 0.359 2.520 1.00 0.00 N ATOM 1115 CA LEU A 71 -7.994 0.535 2.568 1.00 0.00 C ATOM 1116 C LEU A 71 -7.673 1.888 3.157 1.00 0.00 C ATOM 1117 O LEU A 71 -8.218 2.898 2.714 1.00 0.00 O ATOM 1118 CB LEU A 71 -7.456 0.430 1.142 1.00 0.00 C ATOM 1119 CG LEU A 71 -8.031 -0.726 0.328 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.527 -0.686 -1.101 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.644 -2.020 0.983 1.00 0.00 C ATOM 0 H LEU A 71 -9.869 0.903 1.786 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.531 -0.228 3.193 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.665 1.364 0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.372 0.323 1.184 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.117 -0.638 0.298 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.951 -1.520 -1.660 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.827 0.253 -1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.440 -0.762 -1.106 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -8.050 -2.854 0.410 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.557 -2.099 1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.043 -2.048 1.997 1.00 0.00 H new ATOM 1133 N GLU A 72 -6.816 1.913 4.156 1.00 0.00 N ATOM 1134 CA GLU A 72 -6.411 3.172 4.735 1.00 0.00 C ATOM 1135 C GLU A 72 -5.175 3.639 4.019 1.00 0.00 C ATOM 1136 O GLU A 72 -4.147 2.964 4.008 1.00 0.00 O ATOM 1137 CB GLU A 72 -6.147 3.041 6.232 1.00 0.00 C ATOM 1138 CG GLU A 72 -6.307 4.341 7.000 1.00 0.00 C ATOM 1139 CD GLU A 72 -6.471 4.120 8.492 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -5.481 3.767 9.170 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -7.596 4.306 8.993 1.00 0.00 O ATOM 0 H GLU A 72 -6.392 1.087 4.578 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.214 3.899 4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.828 2.298 6.648 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -5.135 2.664 6.381 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.436 4.973 6.823 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.174 4.880 6.619 1.00 0.00 H new ATOM 1148 N THR A 73 -5.285 4.794 3.424 1.00 0.00 N ATOM 1149 CA THR A 73 -4.234 5.304 2.590 1.00 0.00 C ATOM 1150 C THR A 73 -3.276 6.135 3.415 1.00 0.00 C ATOM 1151 O THR A 73 -3.599 6.490 4.539 1.00 0.00 O ATOM 1152 CB THR A 73 -4.805 6.135 1.433 1.00 0.00 C ATOM 1153 OG1 THR A 73 -5.828 7.013 1.923 1.00 0.00 O ATOM 1154 CG2 THR A 73 -5.371 5.227 0.355 1.00 0.00 C ATOM 0 H THR A 73 -6.099 5.404 3.503 1.00 0.00 H new ATOM 0 HA THR A 73 -3.693 4.460 2.162 1.00 0.00 H new ATOM 0 HB THR A 73 -4.001 6.729 0.998 1.00 0.00 H new ATOM 0 HG1 THR A 73 -5.526 7.942 1.846 1.00 0.00 H new ATOM 0 HG21 THR A 73 -5.772 5.833 -0.458 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.581 4.582 -0.029 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.167 4.614 0.777 1.00 0.00 H new ATOM 1162 N MET A 74 -2.111 6.450 2.869 1.00 0.00 N ATOM 1163 CA MET A 74 -1.118 7.221 3.609 1.00 0.00 C ATOM 1164 C MET A 74 -1.672 8.600 3.980 1.00 0.00 C ATOM 1165 O MET A 74 -1.178 9.252 4.898 1.00 0.00 O ATOM 1166 CB MET A 74 0.180 7.369 2.796 1.00 0.00 C ATOM 1167 CG MET A 74 0.837 6.045 2.430 1.00 0.00 C ATOM 1168 SD MET A 74 -0.051 5.157 1.132 1.00 0.00 S ATOM 1169 CE MET A 74 0.926 3.660 1.019 1.00 0.00 C ATOM 0 H MET A 74 -1.830 6.187 1.924 1.00 0.00 H new ATOM 0 HA MET A 74 -0.888 6.680 4.527 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.038 7.920 1.881 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.888 7.968 3.368 1.00 0.00 H new ATOM 0 HG2 MET A 74 1.860 6.231 2.102 1.00 0.00 H new ATOM 0 HG3 MET A 74 0.896 5.416 3.318 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.226 3.499 -0.016 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.814 3.757 1.644 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.333 2.812 1.361 1.00 0.00 H new ATOM 1179 N THR A 75 -2.706 9.028 3.262 1.00 0.00 N ATOM 1180 CA THR A 75 -3.370 10.287 3.547 1.00 0.00 C ATOM 1181 C THR A 75 -4.392 10.128 4.673 1.00 0.00 C ATOM 1182 O THR A 75 -4.534 11.008 5.520 1.00 0.00 O ATOM 1183 CB THR A 75 -4.068 10.835 2.290 1.00 0.00 C ATOM 1184 OG1 THR A 75 -4.739 9.768 1.607 1.00 0.00 O ATOM 1185 CG2 THR A 75 -3.067 11.496 1.358 1.00 0.00 C ATOM 0 H THR A 75 -3.101 8.514 2.474 1.00 0.00 H new ATOM 0 HA THR A 75 -2.605 10.995 3.866 1.00 0.00 H new ATOM 0 HB THR A 75 -4.795 11.586 2.598 1.00 0.00 H new ATOM 0 HG1 THR A 75 -4.778 9.967 0.648 1.00 0.00 H new ATOM 0 HG21 THR A 75 -3.585 11.875 0.477 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.579 12.322 1.875 1.00 0.00 H new ATOM 0 HG23 THR A 75 -2.318 10.766 1.052 1.00 0.00 H new ATOM 1193 N GLY A 76 -5.100 9.003 4.682 1.00 0.00 N ATOM 1194 CA GLY A 76 -6.055 8.745 5.741 1.00 0.00 C ATOM 1195 C GLY A 76 -7.402 8.258 5.238 1.00 0.00 C ATOM 1196 O GLY A 76 -8.202 7.735 6.014 1.00 0.00 O ATOM 0 H GLY A 76 -5.029 8.269 3.977 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.639 8.001 6.421 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.200 9.658 6.318 1.00 0.00 H new ATOM 1200 N GLU A 77 -7.651 8.416 3.943 1.00 0.00 N ATOM 1201 CA GLU A 77 -8.945 8.068 3.365 1.00 0.00 C ATOM 1202 C GLU A 77 -9.088 6.558 3.178 1.00 0.00 C ATOM 1203 O GLU A 77 -8.142 5.886 2.760 1.00 0.00 O ATOM 1204 CB GLU A 77 -9.130 8.786 2.038 1.00 0.00 C ATOM 1205 CG GLU A 77 -10.473 8.519 1.386 1.00 0.00 C ATOM 1206 CD GLU A 77 -10.749 9.447 0.225 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -11.200 10.585 0.465 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -10.521 9.044 -0.934 1.00 0.00 O ATOM 0 H GLU A 77 -6.975 8.783 3.273 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.722 8.389 4.059 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.019 9.859 2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.337 8.481 1.355 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -10.505 7.487 1.037 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -11.262 8.629 2.130 1.00 0.00 H new ATOM 1215 N LYS A 78 -10.271 6.034 3.497 1.00 0.00 N ATOM 1216 CA LYS A 78 -10.554 4.620 3.371 1.00 0.00 C ATOM 1217 C LYS A 78 -11.266 4.326 2.058 1.00 0.00 C ATOM 1218 O LYS A 78 -12.190 5.043 1.678 1.00 0.00 O ATOM 1219 CB LYS A 78 -11.451 4.172 4.514 1.00 0.00 C ATOM 1220 CG LYS A 78 -11.153 4.824 5.839 1.00 0.00 C ATOM 1221 CD LYS A 78 -9.773 4.456 6.338 1.00 0.00 C ATOM 1222 CE LYS A 78 -9.695 3.009 6.807 1.00 0.00 C ATOM 1223 NZ LYS A 78 -10.626 2.731 7.931 1.00 0.00 N ATOM 0 H LYS A 78 -11.054 6.584 3.849 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.606 4.082 3.397 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -12.487 4.379 4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -11.361 3.092 4.627 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -11.228 5.907 5.738 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.900 4.519 6.572 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -9.046 4.617 5.542 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.498 5.117 7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -9.927 2.346 5.973 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -8.675 2.785 7.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -10.119 2.225 8.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -10.997 3.628 8.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -11.415 2.145 7.591 1.00 0.00 H new ATOM 1237 N VAL A 79 -10.846 3.274 1.370 1.00 0.00 N ATOM 1238 CA VAL A 79 -11.501 2.878 0.130 1.00 0.00 C ATOM 1239 C VAL A 79 -11.674 1.376 0.083 1.00 0.00 C ATOM 1240 O VAL A 79 -10.737 0.634 0.335 1.00 0.00 O ATOM 1241 CB VAL A 79 -10.766 3.387 -1.133 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -9.383 3.932 -0.796 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -10.664 2.308 -2.193 1.00 0.00 C ATOM 0 H VAL A 79 -10.062 2.683 1.646 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.482 3.353 0.126 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.364 4.204 -1.537 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.897 4.280 -1.707 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.480 4.762 -0.096 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.782 3.144 -0.343 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.142 2.703 -3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.112 1.457 -1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.665 1.988 -2.484 1.00 0.00 H new ATOM 1253 N LYS A 80 -12.866 0.935 -0.242 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.159 -0.491 -0.217 1.00 0.00 C ATOM 1255 C LYS A 80 -12.717 -1.160 -1.504 1.00 0.00 C ATOM 1256 O LYS A 80 -13.106 -0.763 -2.600 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.636 -0.781 0.048 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.579 -0.191 -0.974 1.00 0.00 C ATOM 1259 CD LYS A 80 -17.005 -0.607 -0.710 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.953 0.225 -1.522 1.00 0.00 C ATOM 1261 NZ LYS A 80 -19.291 -0.412 -1.630 1.00 0.00 N ATOM 0 H LYS A 80 -13.645 1.529 -0.525 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.591 -0.909 0.614 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.782 -1.861 0.079 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.899 -0.395 1.033 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.506 0.896 -0.954 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.283 -0.512 -1.973 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.134 -1.661 -0.956 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.232 -0.497 0.350 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -18.055 1.210 -1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.541 0.377 -2.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.918 0.192 -2.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -19.197 -1.341 -2.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -19.695 -0.534 -0.680 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.889 -2.171 -1.356 1.00 0.00 N ATOM 1276 CA ALA A 81 -11.405 -2.943 -2.477 1.00 0.00 C ATOM 1277 C ALA A 81 -11.343 -4.409 -2.091 1.00 0.00 C ATOM 1278 O ALA A 81 -11.130 -4.740 -0.923 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.037 -2.443 -2.917 1.00 0.00 C ATOM 0 H ALA A 81 -11.532 -2.481 -0.452 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.090 -2.826 -3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.688 -3.036 -3.762 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.110 -1.397 -3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.332 -2.538 -2.091 1.00 0.00 H new ATOM 1285 N VAL A 82 -11.537 -5.287 -3.059 1.00 0.00 N ATOM 1286 CA VAL A 82 -11.497 -6.714 -2.795 1.00 0.00 C ATOM 1287 C VAL A 82 -10.106 -7.253 -3.065 1.00 0.00 C ATOM 1288 O VAL A 82 -9.644 -7.273 -4.207 1.00 0.00 O ATOM 1289 CB VAL A 82 -12.529 -7.476 -3.644 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -12.337 -8.980 -3.504 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -13.925 -7.073 -3.231 1.00 0.00 C ATOM 0 H VAL A 82 -11.723 -5.039 -4.031 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.749 -6.866 -1.746 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.384 -7.218 -4.693 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -13.077 -9.499 -4.113 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.336 -9.252 -3.839 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.460 -9.267 -2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.654 -7.615 -3.834 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.076 -7.312 -2.178 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.054 -6.001 -3.382 1.00 0.00 H new ATOM 1301 N VAL A 83 -9.444 -7.684 -2.006 1.00 0.00 N ATOM 1302 CA VAL A 83 -8.071 -8.156 -2.105 1.00 0.00 C ATOM 1303 C VAL A 83 -7.994 -9.673 -2.022 1.00 0.00 C ATOM 1304 O VAL A 83 -8.608 -10.289 -1.160 1.00 0.00 O ATOM 1305 CB VAL A 83 -7.158 -7.510 -1.024 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -7.973 -6.949 0.129 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -6.101 -8.481 -0.509 1.00 0.00 C ATOM 0 H VAL A 83 -9.835 -7.718 -1.064 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.705 -7.848 -3.084 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.638 -6.684 -1.510 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -7.303 -6.505 0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -8.657 -6.187 -0.245 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -8.545 -7.752 0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.488 -7.986 0.244 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.589 -9.349 -0.065 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.469 -8.804 -1.337 1.00 0.00 H new ATOM 1317 N LYS A 84 -7.249 -10.262 -2.941 1.00 0.00 N ATOM 1318 CA LYS A 84 -6.988 -11.689 -2.926 1.00 0.00 C ATOM 1319 C LYS A 84 -5.503 -11.929 -2.761 1.00 0.00 C ATOM 1320 O LYS A 84 -4.686 -11.072 -3.093 1.00 0.00 O ATOM 1321 CB LYS A 84 -7.417 -12.371 -4.200 1.00 0.00 C ATOM 1322 CG LYS A 84 -8.615 -11.742 -4.906 1.00 0.00 C ATOM 1323 CD LYS A 84 -9.873 -12.558 -4.700 1.00 0.00 C ATOM 1324 CE LYS A 84 -11.048 -11.902 -5.389 1.00 0.00 C ATOM 1325 NZ LYS A 84 -12.326 -12.625 -5.135 1.00 0.00 N ATOM 0 H LYS A 84 -6.810 -9.766 -3.716 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.562 -12.103 -2.097 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -6.573 -12.379 -4.890 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -7.654 -13.411 -3.974 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -8.770 -10.731 -4.530 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.406 -11.657 -5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -9.729 -13.565 -5.093 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.078 -12.658 -3.634 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.141 -10.872 -5.044 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -10.862 -11.863 -6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -13.103 -12.139 -5.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -12.249 -13.600 -5.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -12.519 -12.640 -4.113 1.00 0.00 H new ATOM 1339 N MET A 85 -5.165 -13.092 -2.254 1.00 0.00 N ATOM 1340 CA MET A 85 -3.774 -13.478 -2.101 1.00 0.00 C ATOM 1341 C MET A 85 -3.528 -14.812 -2.766 1.00 0.00 C ATOM 1342 O MET A 85 -4.178 -15.818 -2.476 1.00 0.00 O ATOM 1343 CB MET A 85 -3.363 -13.528 -0.618 1.00 0.00 C ATOM 1344 CG MET A 85 -2.107 -14.361 -0.330 1.00 0.00 C ATOM 1345 SD MET A 85 -0.554 -13.487 -0.592 1.00 0.00 S ATOM 1346 CE MET A 85 -0.224 -12.901 1.068 1.00 0.00 C ATOM 0 H MET A 85 -5.835 -13.793 -1.938 1.00 0.00 H new ATOM 0 HA MET A 85 -3.158 -12.721 -2.587 1.00 0.00 H new ATOM 0 HB2 MET A 85 -3.196 -12.510 -0.267 1.00 0.00 H new ATOM 0 HB3 MET A 85 -4.192 -13.933 -0.038 1.00 0.00 H new ATOM 0 HG2 MET A 85 -2.145 -14.707 0.703 1.00 0.00 H new ATOM 0 HG3 MET A 85 -2.121 -15.248 -0.964 1.00 0.00 H new ATOM 0 HE1 MET A 85 0.506 -12.092 1.030 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.148 -12.535 1.515 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.172 -13.719 1.671 1.00 0.00 H new ATOM 1356 N GLU A 86 -2.592 -14.755 -3.692 1.00 0.00 N ATOM 1357 CA GLU A 86 -2.041 -15.907 -4.371 1.00 0.00 C ATOM 1358 C GLU A 86 -1.700 -17.005 -3.370 1.00 0.00 C ATOM 1359 O GLU A 86 -1.990 -18.181 -3.585 1.00 0.00 O ATOM 1360 CB GLU A 86 -0.802 -15.428 -5.084 1.00 0.00 C ATOM 1361 CG GLU A 86 -0.074 -16.474 -5.852 1.00 0.00 C ATOM 1362 CD GLU A 86 -0.925 -17.158 -6.903 1.00 0.00 C ATOM 1363 OE1 GLU A 86 -1.138 -16.559 -7.976 1.00 0.00 O ATOM 1364 OE2 GLU A 86 -1.366 -18.300 -6.668 1.00 0.00 O ATOM 0 H GLU A 86 -2.181 -13.874 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.757 -16.331 -5.075 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.081 -14.626 -5.767 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.121 -14.998 -4.349 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.792 -16.021 -6.336 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.305 -17.225 -5.158 1.00 0.00 H new ATOM 1371 N GLY A 87 -1.088 -16.597 -2.267 1.00 0.00 N ATOM 1372 CA GLY A 87 -0.780 -17.511 -1.194 1.00 0.00 C ATOM 1373 C GLY A 87 0.590 -17.272 -0.633 1.00 0.00 C ATOM 1374 O GLY A 87 0.747 -16.973 0.552 1.00 0.00 O ATOM 0 H GLY A 87 -0.797 -15.634 -2.099 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.521 -17.404 -0.402 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -0.849 -18.536 -1.559 1.00 0.00 H new ATOM 1378 N ASP A 88 1.577 -17.397 -1.492 1.00 0.00 N ATOM 1379 CA ASP A 88 2.951 -17.119 -1.131 1.00 0.00 C ATOM 1380 C ASP A 88 3.128 -15.669 -0.760 1.00 0.00 C ATOM 1381 O ASP A 88 3.313 -15.328 0.410 1.00 0.00 O ATOM 1382 CB ASP A 88 3.876 -17.503 -2.284 1.00 0.00 C ATOM 1383 CG ASP A 88 4.916 -18.522 -1.867 1.00 0.00 C ATOM 1384 OD1 ASP A 88 5.946 -18.128 -1.284 1.00 0.00 O ATOM 1385 OD2 ASP A 88 4.698 -19.727 -2.099 1.00 0.00 O ATOM 0 H ASP A 88 1.451 -17.694 -2.460 1.00 0.00 H new ATOM 0 HA ASP A 88 3.211 -17.717 -0.257 1.00 0.00 H new ATOM 0 HB2 ASP A 88 3.283 -17.906 -3.105 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.375 -16.610 -2.660 1.00 0.00 H new ATOM 1390 N ASN A 89 3.072 -14.825 -1.749 1.00 0.00 N ATOM 1391 CA ASN A 89 3.442 -13.438 -1.547 1.00 0.00 C ATOM 1392 C ASN A 89 2.723 -12.445 -2.448 1.00 0.00 C ATOM 1393 O ASN A 89 3.133 -11.287 -2.528 1.00 0.00 O ATOM 1394 CB ASN A 89 4.945 -13.288 -1.701 1.00 0.00 C ATOM 1395 CG ASN A 89 5.508 -14.051 -2.882 1.00 0.00 C ATOM 1396 OD1 ASN A 89 5.778 -15.331 -2.681 1.00 0.00 O flip ATOM 1397 ND2 ASN A 89 5.674 -13.509 -3.969 1.00 0.00 N flip ATOM 0 H ASN A 89 2.778 -15.060 -2.697 1.00 0.00 H new ATOM 0 HA ASN A 89 3.124 -13.189 -0.535 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.188 -12.231 -1.812 1.00 0.00 H new ATOM 0 HB3 ASN A 89 5.432 -13.633 -0.789 1.00 0.00 H new ATOM 0 HD21 ASN A 89 5.454 -12.520 -4.084 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.032 -14.047 -4.758 1.00 0.00 H new ATOM 1404 N LYS A 90 1.668 -12.856 -3.126 1.00 0.00 N ATOM 1405 CA LYS A 90 0.992 -11.936 -4.012 1.00 0.00 C ATOM 1406 C LYS A 90 -0.370 -11.551 -3.461 1.00 0.00 C ATOM 1407 O LYS A 90 -1.241 -12.398 -3.299 1.00 0.00 O ATOM 1408 CB LYS A 90 0.814 -12.552 -5.395 1.00 0.00 C ATOM 1409 CG LYS A 90 2.092 -12.849 -6.139 1.00 0.00 C ATOM 1410 CD LYS A 90 2.820 -14.051 -5.593 1.00 0.00 C ATOM 1411 CE LYS A 90 4.129 -14.246 -6.323 1.00 0.00 C ATOM 1412 NZ LYS A 90 3.944 -14.771 -7.703 1.00 0.00 N ATOM 0 H LYS A 90 1.271 -13.795 -3.082 1.00 0.00 H new ATOM 0 HA LYS A 90 1.611 -11.042 -4.090 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.250 -13.479 -5.292 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.209 -11.876 -6.000 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.864 -13.015 -7.192 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.747 -11.979 -6.088 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.006 -13.919 -4.527 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.199 -14.941 -5.701 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.660 -13.295 -6.369 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.757 -14.935 -5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.874 -14.934 -8.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.417 -15.667 -7.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.412 -14.080 -8.269 1.00 0.00 H new ATOM 1426 N MET A 91 -0.559 -10.267 -3.222 1.00 0.00 N ATOM 1427 CA MET A 91 -1.854 -9.747 -2.798 1.00 0.00 C ATOM 1428 C MET A 91 -2.330 -8.701 -3.777 1.00 0.00 C ATOM 1429 O MET A 91 -1.719 -7.648 -3.925 1.00 0.00 O ATOM 1430 CB MET A 91 -1.789 -9.134 -1.400 1.00 0.00 C ATOM 1431 CG MET A 91 -1.523 -10.145 -0.308 1.00 0.00 C ATOM 1432 SD MET A 91 -1.531 -9.418 1.340 1.00 0.00 S ATOM 1433 CE MET A 91 -0.375 -8.065 1.131 1.00 0.00 C ATOM 0 H MET A 91 0.169 -9.558 -3.314 1.00 0.00 H new ATOM 0 HA MET A 91 -2.552 -10.584 -2.771 1.00 0.00 H new ATOM 0 HB2 MET A 91 -1.006 -8.376 -1.381 1.00 0.00 H new ATOM 0 HB3 MET A 91 -2.730 -8.625 -1.191 1.00 0.00 H new ATOM 0 HG2 MET A 91 -2.277 -10.931 -0.356 1.00 0.00 H new ATOM 0 HG3 MET A 91 -0.557 -10.618 -0.486 1.00 0.00 H new ATOM 0 HE1 MET A 91 0.216 -7.948 2.039 1.00 0.00 H new ATOM 0 HE2 MET A 91 0.287 -8.279 0.292 1.00 0.00 H new ATOM 0 HE3 MET A 91 -0.924 -7.144 0.934 1.00 0.00 H new ATOM 1443 N VAL A 92 -3.426 -8.985 -4.437 1.00 0.00 N ATOM 1444 CA VAL A 92 -3.949 -8.077 -5.438 1.00 0.00 C ATOM 1445 C VAL A 92 -5.385 -7.709 -5.103 1.00 0.00 C ATOM 1446 O VAL A 92 -6.243 -8.585 -4.970 1.00 0.00 O ATOM 1447 CB VAL A 92 -3.897 -8.681 -6.859 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -3.766 -7.581 -7.894 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -2.759 -9.684 -6.993 1.00 0.00 C ATOM 0 H VAL A 92 -3.975 -9.834 -4.302 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.318 -7.188 -5.428 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.831 -9.215 -7.033 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.731 -8.021 -8.890 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.623 -6.911 -7.824 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.850 -7.018 -7.713 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.750 -10.091 -8.004 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.810 -9.186 -6.793 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.902 -10.494 -6.278 1.00 0.00 H new ATOM 1459 N THR A 93 -5.643 -6.419 -4.948 1.00 0.00 N ATOM 1460 CA THR A 93 -6.980 -5.951 -4.645 1.00 0.00 C ATOM 1461 C THR A 93 -7.522 -5.152 -5.822 1.00 0.00 C ATOM 1462 O THR A 93 -6.778 -4.447 -6.509 1.00 0.00 O ATOM 1463 CB THR A 93 -7.041 -5.107 -3.341 1.00 0.00 C ATOM 1464 OG1 THR A 93 -7.339 -3.739 -3.636 1.00 0.00 O ATOM 1465 CG2 THR A 93 -5.725 -5.160 -2.578 1.00 0.00 C ATOM 0 H THR A 93 -4.943 -5.681 -5.028 1.00 0.00 H new ATOM 0 HA THR A 93 -7.603 -6.830 -4.476 1.00 0.00 H new ATOM 0 HB THR A 93 -7.830 -5.536 -2.724 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.218 -3.196 -2.829 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.805 -4.559 -1.672 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.501 -6.192 -2.309 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.925 -4.767 -3.205 1.00 0.00 H new ATOM 1473 N THR A 94 -8.810 -5.287 -6.074 1.00 0.00 N ATOM 1474 CA THR A 94 -9.412 -4.666 -7.236 1.00 0.00 C ATOM 1475 C THR A 94 -10.604 -3.786 -6.862 1.00 0.00 C ATOM 1476 O THR A 94 -11.496 -4.202 -6.119 1.00 0.00 O ATOM 1477 CB THR A 94 -9.853 -5.741 -8.243 1.00 0.00 C ATOM 1478 OG1 THR A 94 -8.781 -6.675 -8.444 1.00 0.00 O ATOM 1479 CG2 THR A 94 -10.235 -5.113 -9.572 1.00 0.00 C ATOM 0 H THR A 94 -9.457 -5.819 -5.492 1.00 0.00 H new ATOM 0 HA THR A 94 -8.656 -4.026 -7.691 1.00 0.00 H new ATOM 0 HB THR A 94 -10.725 -6.257 -7.841 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.061 -7.362 -9.084 1.00 0.00 H new ATOM 0 HG21 THR A 94 -10.543 -5.893 -10.268 1.00 0.00 H new ATOM 0 HG22 THR A 94 -11.059 -4.415 -9.421 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.378 -4.579 -9.982 1.00 0.00 H new ATOM 1487 N PHE A 95 -10.582 -2.561 -7.370 1.00 0.00 N ATOM 1488 CA PHE A 95 -11.669 -1.607 -7.203 1.00 0.00 C ATOM 1489 C PHE A 95 -11.889 -0.879 -8.530 1.00 0.00 C ATOM 1490 O PHE A 95 -10.996 -0.872 -9.375 1.00 0.00 O ATOM 1491 CB PHE A 95 -11.336 -0.610 -6.080 1.00 0.00 C ATOM 1492 CG PHE A 95 -12.398 0.433 -5.844 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -13.666 0.070 -5.414 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -12.126 1.777 -6.052 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -14.641 1.026 -5.199 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -13.098 2.737 -5.838 1.00 0.00 C ATOM 1497 CZ PHE A 95 -14.356 2.360 -5.411 1.00 0.00 C ATOM 0 H PHE A 95 -9.800 -2.198 -7.915 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.583 -2.130 -6.922 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.174 -1.163 -5.155 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.398 -0.109 -6.320 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -13.894 -0.972 -5.245 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -11.144 2.077 -6.385 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -15.625 0.730 -4.866 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.874 3.780 -6.005 1.00 0.00 H new ATOM 0 HZ PHE A 95 -15.116 3.108 -5.243 1.00 0.00 H new ATOM 1507 N LYS A 96 -13.088 -0.326 -8.724 1.00 0.00 N ATOM 1508 CA LYS A 96 -13.428 0.444 -9.931 1.00 0.00 C ATOM 1509 C LYS A 96 -12.290 1.370 -10.359 1.00 0.00 C ATOM 1510 O LYS A 96 -12.063 2.412 -9.742 1.00 0.00 O ATOM 1511 CB LYS A 96 -14.661 1.308 -9.683 1.00 0.00 C ATOM 1512 CG LYS A 96 -15.892 0.544 -9.230 1.00 0.00 C ATOM 1513 CD LYS A 96 -17.120 1.437 -9.234 1.00 0.00 C ATOM 1514 CE LYS A 96 -16.934 2.634 -8.320 1.00 0.00 C ATOM 1515 NZ LYS A 96 -18.121 3.530 -8.318 1.00 0.00 N ATOM 0 H LYS A 96 -13.852 -0.397 -8.052 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.616 -0.284 -10.720 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.417 2.057 -8.929 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.901 1.846 -10.600 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.057 -0.310 -9.888 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.730 0.148 -8.228 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -17.320 1.780 -10.249 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -17.990 0.864 -8.914 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.741 2.287 -7.305 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.056 3.198 -8.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.949 4.333 -7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.291 3.883 -9.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.955 3.001 -7.991 1.00 0.00 H new ATOM 1529 N GLY A 97 -11.581 0.982 -11.414 1.00 0.00 N ATOM 1530 CA GLY A 97 -10.481 1.780 -11.917 1.00 0.00 C ATOM 1531 C GLY A 97 -9.238 1.705 -11.045 1.00 0.00 C ATOM 1532 O GLY A 97 -8.115 1.790 -11.543 1.00 0.00 O ATOM 0 H GLY A 97 -11.752 0.121 -11.933 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -10.231 1.448 -12.924 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -10.800 2.819 -11.994 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.437 1.517 -9.748 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.349 1.508 -8.795 1.00 0.00 C ATOM 1538 C ILE A 98 -7.827 0.101 -8.646 1.00 0.00 C ATOM 1539 O ILE A 98 -8.512 -0.776 -8.120 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.781 2.025 -7.408 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -9.267 3.474 -7.488 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -7.636 1.897 -6.404 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -8.720 4.254 -8.659 1.00 0.00 C ATOM 0 H ILE A 98 -10.357 1.367 -9.333 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.576 2.174 -9.177 1.00 0.00 H new ATOM 0 HB ILE A 98 -9.612 1.409 -7.064 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -10.356 3.476 -7.543 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.993 3.987 -6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.961 2.267 -5.432 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.345 0.850 -6.315 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.783 2.482 -6.748 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -9.116 5.269 -8.637 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -7.632 4.288 -8.597 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -9.016 3.769 -9.589 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.624 -0.125 -9.108 1.00 0.00 N ATOM 1556 CA LYS A 99 -6.056 -1.444 -9.030 1.00 0.00 C ATOM 1557 C LYS A 99 -4.881 -1.446 -8.080 1.00 0.00 C ATOM 1558 O LYS A 99 -3.965 -0.637 -8.222 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.632 -1.921 -10.403 1.00 0.00 C ATOM 1560 CG LYS A 99 -5.719 -3.421 -10.543 1.00 0.00 C ATOM 1561 CD LYS A 99 -5.024 -3.911 -11.800 1.00 0.00 C ATOM 1562 CE LYS A 99 -5.002 -5.429 -11.859 1.00 0.00 C ATOM 1563 NZ LYS A 99 -4.171 -5.933 -12.981 1.00 0.00 N ATOM 0 H LYS A 99 -6.025 0.580 -9.538 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.813 -2.130 -8.650 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.262 -1.451 -11.158 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.609 -1.599 -10.596 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.268 -3.894 -9.671 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -6.766 -3.724 -10.565 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.536 -3.518 -12.678 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.004 -3.528 -11.827 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.617 -5.822 -10.918 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.021 -5.802 -11.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -4.185 -6.973 -12.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.553 -5.580 -13.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.193 -5.600 -12.865 1.00 0.00 H new ATOM 1577 N SER A 100 -4.920 -2.327 -7.097 1.00 0.00 N ATOM 1578 CA SER A 100 -3.843 -2.425 -6.136 1.00 0.00 C ATOM 1579 C SER A 100 -3.146 -3.770 -6.282 1.00 0.00 C ATOM 1580 O SER A 100 -3.759 -4.823 -6.116 1.00 0.00 O ATOM 1581 CB SER A 100 -4.388 -2.249 -4.714 1.00 0.00 C ATOM 1582 OG SER A 100 -3.341 -2.183 -3.762 1.00 0.00 O ATOM 0 H SER A 100 -5.686 -2.983 -6.945 1.00 0.00 H new ATOM 0 HA SER A 100 -3.118 -1.633 -6.325 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.986 -1.339 -4.662 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.050 -3.080 -4.471 1.00 0.00 H new ATOM 0 HG SER A 100 -3.721 -2.069 -2.866 1.00 0.00 H new ATOM 1588 N VAL A 101 -1.868 -3.728 -6.600 1.00 0.00 N ATOM 1589 CA VAL A 101 -1.082 -4.932 -6.759 1.00 0.00 C ATOM 1590 C VAL A 101 0.056 -4.945 -5.745 1.00 0.00 C ATOM 1591 O VAL A 101 0.897 -4.044 -5.731 1.00 0.00 O ATOM 1592 CB VAL A 101 -0.493 -5.018 -8.183 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.446 -6.201 -8.303 1.00 0.00 C ATOM 1594 CG2 VAL A 101 -1.604 -5.106 -9.218 1.00 0.00 C ATOM 0 H VAL A 101 -1.349 -2.864 -6.754 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.735 -5.789 -6.594 1.00 0.00 H new ATOM 0 HB VAL A 101 0.078 -4.109 -8.372 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.850 -6.244 -9.314 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.263 -6.091 -7.590 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.099 -7.121 -8.091 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.168 -5.166 -10.215 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.206 -5.995 -9.031 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.235 -4.220 -9.150 1.00 0.00 H new ATOM 1604 N THR A 102 0.061 -5.947 -4.885 1.00 0.00 N ATOM 1605 CA THR A 102 1.138 -6.138 -3.938 1.00 0.00 C ATOM 1606 C THR A 102 1.849 -7.463 -4.193 1.00 0.00 C ATOM 1607 O THR A 102 1.233 -8.525 -4.148 1.00 0.00 O ATOM 1608 CB THR A 102 0.610 -6.105 -2.491 1.00 0.00 C ATOM 1609 OG1 THR A 102 -0.125 -4.893 -2.270 1.00 0.00 O ATOM 1610 CG2 THR A 102 1.750 -6.206 -1.491 1.00 0.00 C ATOM 0 H THR A 102 -0.679 -6.647 -4.825 1.00 0.00 H new ATOM 0 HA THR A 102 1.847 -5.321 -4.072 1.00 0.00 H new ATOM 0 HB THR A 102 -0.047 -6.962 -2.347 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.460 -4.877 -1.349 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.349 -6.180 -0.478 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.287 -7.142 -1.645 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.433 -5.368 -1.632 1.00 0.00 H new ATOM 1618 N GLU A 103 3.133 -7.400 -4.471 1.00 0.00 N ATOM 1619 CA GLU A 103 3.931 -8.602 -4.641 1.00 0.00 C ATOM 1620 C GLU A 103 5.186 -8.508 -3.789 1.00 0.00 C ATOM 1621 O GLU A 103 5.971 -7.576 -3.964 1.00 0.00 O ATOM 1622 CB GLU A 103 4.318 -8.761 -6.109 1.00 0.00 C ATOM 1623 CG GLU A 103 4.888 -10.100 -6.451 1.00 0.00 C ATOM 1624 CD GLU A 103 4.729 -10.438 -7.918 1.00 0.00 C ATOM 1625 OE1 GLU A 103 3.680 -11.002 -8.293 1.00 0.00 O ATOM 1626 OE2 GLU A 103 5.647 -10.126 -8.706 1.00 0.00 O ATOM 0 H GLU A 103 3.651 -6.529 -4.585 1.00 0.00 H new ATOM 0 HA GLU A 103 3.347 -9.467 -4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.437 -8.585 -6.726 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.046 -7.992 -6.366 1.00 0.00 H new ATOM 0 HG2 GLU A 103 5.946 -10.119 -6.189 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.397 -10.865 -5.850 1.00 0.00 H new ATOM 1633 N PHE A 104 5.392 -9.434 -2.860 1.00 0.00 N ATOM 1634 CA PHE A 104 6.666 -9.459 -2.165 1.00 0.00 C ATOM 1635 C PHE A 104 7.510 -10.585 -2.722 1.00 0.00 C ATOM 1636 O PHE A 104 7.210 -11.753 -2.518 1.00 0.00 O ATOM 1637 CB PHE A 104 6.530 -9.622 -0.638 1.00 0.00 C ATOM 1638 CG PHE A 104 5.148 -9.815 -0.083 1.00 0.00 C ATOM 1639 CD1 PHE A 104 4.269 -8.776 -0.090 1.00 0.00 C ATOM 1640 CD2 PHE A 104 4.761 -11.013 0.488 1.00 0.00 C ATOM 1641 CE1 PHE A 104 3.010 -8.896 0.454 1.00 0.00 C ATOM 1642 CE2 PHE A 104 3.498 -11.157 1.034 1.00 0.00 C ATOM 1643 CZ PHE A 104 2.618 -10.092 1.018 1.00 0.00 C ATOM 0 H PHE A 104 4.721 -10.150 -2.581 1.00 0.00 H new ATOM 0 HA PHE A 104 7.140 -8.492 -2.332 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.137 -10.476 -0.335 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.962 -8.740 -0.165 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.566 -7.836 -0.532 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.451 -11.844 0.508 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.331 -8.056 0.439 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.201 -12.099 1.471 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.631 -10.195 1.444 1.00 0.00 H new ATOM 1653 N ASN A 105 8.584 -10.232 -3.392 1.00 0.00 N ATOM 1654 CA ASN A 105 9.419 -11.225 -4.034 1.00 0.00 C ATOM 1655 C ASN A 105 10.867 -11.055 -3.610 1.00 0.00 C ATOM 1656 O ASN A 105 11.531 -10.099 -4.014 1.00 0.00 O ATOM 1657 CB ASN A 105 9.289 -11.122 -5.555 1.00 0.00 C ATOM 1658 CG ASN A 105 9.622 -12.425 -6.256 1.00 0.00 C ATOM 1659 OD1 ASN A 105 9.283 -13.541 -5.628 1.00 0.00 O flip ATOM 1660 ND2 ASN A 105 10.150 -12.427 -7.368 1.00 0.00 N flip ATOM 0 H ASN A 105 8.900 -9.269 -3.507 1.00 0.00 H new ATOM 0 HA ASN A 105 9.085 -12.215 -3.724 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.272 -10.826 -5.810 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.951 -10.337 -5.921 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.396 -11.545 -7.818 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.342 -13.311 -7.840 1.00 0.00 H new ATOM 1667 N GLY A 106 11.349 -11.970 -2.786 1.00 0.00 N ATOM 1668 CA GLY A 106 12.722 -11.903 -2.331 1.00 0.00 C ATOM 1669 C GLY A 106 12.941 -10.786 -1.334 1.00 0.00 C ATOM 1670 O GLY A 106 13.896 -10.018 -1.461 1.00 0.00 O ATOM 0 H GLY A 106 10.814 -12.759 -2.423 1.00 0.00 H new ATOM 0 HA2 GLY A 106 12.998 -12.854 -1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.380 -11.757 -3.188 1.00 0.00 H new ATOM 1674 N ASP A 107 12.028 -10.678 -0.368 1.00 0.00 N ATOM 1675 CA ASP A 107 12.118 -9.683 0.709 1.00 0.00 C ATOM 1676 C ASP A 107 11.920 -8.261 0.187 1.00 0.00 C ATOM 1677 O ASP A 107 12.054 -7.290 0.933 1.00 0.00 O ATOM 1678 CB ASP A 107 13.454 -9.790 1.454 1.00 0.00 C ATOM 1679 CG ASP A 107 13.601 -11.095 2.210 1.00 0.00 C ATOM 1680 OD1 ASP A 107 14.022 -12.101 1.597 1.00 0.00 O ATOM 1681 OD2 ASP A 107 13.319 -11.117 3.421 1.00 0.00 O ATOM 0 H ASP A 107 11.204 -11.276 -0.307 1.00 0.00 H new ATOM 0 HA ASP A 107 11.311 -9.901 1.408 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.272 -9.695 0.740 1.00 0.00 H new ATOM 0 HB3 ASP A 107 13.543 -8.958 2.153 1.00 0.00 H new ATOM 1686 N THR A 108 11.606 -8.134 -1.092 1.00 0.00 N ATOM 1687 CA THR A 108 11.295 -6.835 -1.664 1.00 0.00 C ATOM 1688 C THR A 108 9.872 -6.804 -2.188 1.00 0.00 C ATOM 1689 O THR A 108 9.459 -7.681 -2.949 1.00 0.00 O ATOM 1690 CB THR A 108 12.287 -6.448 -2.783 1.00 0.00 C ATOM 1691 OG1 THR A 108 12.556 -7.577 -3.631 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.591 -5.931 -2.193 1.00 0.00 C ATOM 0 H THR A 108 11.560 -8.911 -1.751 1.00 0.00 H new ATOM 0 HA THR A 108 11.392 -6.099 -0.866 1.00 0.00 H new ATOM 0 HB THR A 108 11.830 -5.656 -3.377 1.00 0.00 H new ATOM 0 HG1 THR A 108 11.768 -8.159 -3.661 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.275 -5.664 -2.999 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.390 -5.051 -1.582 1.00 0.00 H new ATOM 0 HG23 THR A 108 14.044 -6.707 -1.575 1.00 0.00 H new ATOM 1700 N ILE A 109 9.125 -5.798 -1.762 1.00 0.00 N ATOM 1701 CA ILE A 109 7.719 -5.697 -2.093 1.00 0.00 C ATOM 1702 C ILE A 109 7.460 -4.560 -3.060 1.00 0.00 C ATOM 1703 O ILE A 109 7.937 -3.437 -2.865 1.00 0.00 O ATOM 1704 CB ILE A 109 6.846 -5.459 -0.847 1.00 0.00 C ATOM 1705 CG1 ILE A 109 7.188 -6.454 0.254 1.00 0.00 C ATOM 1706 CG2 ILE A 109 5.378 -5.545 -1.214 1.00 0.00 C ATOM 1707 CD1 ILE A 109 6.140 -6.542 1.348 1.00 0.00 C ATOM 0 H ILE A 109 9.476 -5.036 -1.182 1.00 0.00 H new ATOM 0 HA ILE A 109 7.453 -6.651 -2.549 1.00 0.00 H new ATOM 0 HB ILE A 109 7.051 -4.458 -0.467 1.00 0.00 H new ATOM 0 HG12 ILE A 109 7.320 -7.441 -0.189 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.142 -6.174 0.700 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.770 -5.375 -0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.145 -4.788 -1.963 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.161 -6.534 -1.618 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.454 -7.271 2.095 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.023 -5.566 1.819 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.189 -6.852 0.916 1.00 0.00 H new ATOM 1719 N THR A 110 6.701 -4.855 -4.088 1.00 0.00 N ATOM 1720 CA THR A 110 6.227 -3.836 -4.989 1.00 0.00 C ATOM 1721 C THR A 110 4.739 -3.601 -4.766 1.00 0.00 C ATOM 1722 O THR A 110 3.933 -4.525 -4.902 1.00 0.00 O ATOM 1723 CB THR A 110 6.443 -4.245 -6.454 1.00 0.00 C ATOM 1724 OG1 THR A 110 7.815 -4.614 -6.665 1.00 0.00 O ATOM 1725 CG2 THR A 110 6.068 -3.100 -7.380 1.00 0.00 C ATOM 0 H THR A 110 6.397 -5.800 -4.321 1.00 0.00 H new ATOM 0 HA THR A 110 6.791 -2.925 -4.787 1.00 0.00 H new ATOM 0 HB THR A 110 5.806 -5.101 -6.675 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.943 -4.875 -7.601 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.226 -3.403 -8.415 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.019 -2.842 -7.233 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.690 -2.233 -7.157 1.00 0.00 H new ATOM 1733 N ASN A 111 4.375 -2.381 -4.401 1.00 0.00 N ATOM 1734 CA ASN A 111 2.965 -2.010 -4.348 1.00 0.00 C ATOM 1735 C ASN A 111 2.636 -1.098 -5.512 1.00 0.00 C ATOM 1736 O ASN A 111 3.243 -0.040 -5.675 1.00 0.00 O ATOM 1737 CB ASN A 111 2.604 -1.318 -3.031 1.00 0.00 C ATOM 1738 CG ASN A 111 2.838 -2.192 -1.814 1.00 0.00 C ATOM 1739 OD1 ASN A 111 3.912 -2.170 -1.218 1.00 0.00 O ATOM 1740 ND2 ASN A 111 1.831 -2.956 -1.428 1.00 0.00 N ATOM 0 H ASN A 111 5.024 -1.639 -4.140 1.00 0.00 H new ATOM 0 HA ASN A 111 2.377 -2.926 -4.412 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.193 -0.406 -2.934 1.00 0.00 H new ATOM 0 HB3 ASN A 111 1.556 -1.020 -3.060 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.930 -3.555 -0.609 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.954 -2.946 -1.949 1.00 0.00 H new ATOM 1747 N THR A 112 1.688 -1.520 -6.325 1.00 0.00 N ATOM 1748 CA THR A 112 1.291 -0.750 -7.489 1.00 0.00 C ATOM 1749 C THR A 112 -0.196 -0.403 -7.438 1.00 0.00 C ATOM 1750 O THR A 112 -1.037 -1.293 -7.403 1.00 0.00 O ATOM 1751 CB THR A 112 1.594 -1.522 -8.785 1.00 0.00 C ATOM 1752 OG1 THR A 112 2.288 -2.739 -8.478 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.442 -0.681 -9.715 1.00 0.00 C ATOM 0 H THR A 112 1.177 -2.394 -6.201 1.00 0.00 H new ATOM 0 HA THR A 112 1.868 0.175 -7.481 1.00 0.00 H new ATOM 0 HB THR A 112 0.650 -1.755 -9.278 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.476 -3.226 -9.307 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.647 -1.242 -10.627 1.00 0.00 H new ATOM 0 HG22 THR A 112 1.908 0.236 -9.965 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.382 -0.431 -9.224 1.00 0.00 H new ATOM 1761 N MET A 113 -0.517 0.884 -7.410 1.00 0.00 N ATOM 1762 CA MET A 113 -1.898 1.325 -7.424 1.00 0.00 C ATOM 1763 C MET A 113 -2.123 2.289 -8.575 1.00 0.00 C ATOM 1764 O MET A 113 -1.212 2.983 -8.985 1.00 0.00 O ATOM 1765 CB MET A 113 -2.270 1.960 -6.089 1.00 0.00 C ATOM 1766 CG MET A 113 -2.339 0.946 -4.969 1.00 0.00 C ATOM 1767 SD MET A 113 -3.067 1.596 -3.451 1.00 0.00 S ATOM 1768 CE MET A 113 -1.809 2.756 -2.927 1.00 0.00 C ATOM 0 H MET A 113 0.166 1.641 -7.377 1.00 0.00 H new ATOM 0 HA MET A 113 -2.546 0.461 -7.571 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.537 2.726 -5.837 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.234 2.460 -6.183 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.921 0.087 -5.303 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.333 0.585 -4.754 1.00 0.00 H new ATOM 0 HE1 MET A 113 -2.215 3.409 -2.154 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.954 2.210 -2.528 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.491 3.357 -3.779 1.00 0.00 H new ATOM 1778 N THR A 114 -3.320 2.317 -9.115 1.00 0.00 N ATOM 1779 CA THR A 114 -3.589 3.105 -10.297 1.00 0.00 C ATOM 1780 C THR A 114 -4.793 4.011 -10.078 1.00 0.00 C ATOM 1781 O THR A 114 -5.875 3.529 -9.749 1.00 0.00 O ATOM 1782 CB THR A 114 -3.841 2.176 -11.500 1.00 0.00 C ATOM 1783 OG1 THR A 114 -2.720 1.297 -11.657 1.00 0.00 O ATOM 1784 CG2 THR A 114 -4.058 2.965 -12.784 1.00 0.00 C ATOM 0 H THR A 114 -4.124 1.803 -8.755 1.00 0.00 H new ATOM 0 HA THR A 114 -2.720 3.730 -10.501 1.00 0.00 H new ATOM 0 HB THR A 114 -4.748 1.603 -11.306 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.875 0.702 -12.420 1.00 0.00 H new ATOM 0 HG21 THR A 114 -4.232 2.275 -13.610 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.923 3.618 -12.668 1.00 0.00 H new ATOM 0 HG23 THR A 114 -3.174 3.567 -12.995 1.00 0.00 H new ATOM 1792 N LEU A 115 -4.607 5.316 -10.241 1.00 0.00 N ATOM 1793 CA LEU A 115 -5.699 6.250 -10.106 1.00 0.00 C ATOM 1794 C LEU A 115 -6.017 6.856 -11.457 1.00 0.00 C ATOM 1795 O LEU A 115 -5.222 7.625 -11.984 1.00 0.00 O ATOM 1796 CB LEU A 115 -5.301 7.352 -9.125 1.00 0.00 C ATOM 1797 CG LEU A 115 -6.122 7.416 -7.845 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -7.583 7.611 -8.161 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -5.934 6.131 -7.091 1.00 0.00 C ATOM 0 H LEU A 115 -3.708 5.743 -10.466 1.00 0.00 H new ATOM 0 HA LEU A 115 -6.581 5.732 -9.730 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -4.253 7.216 -8.858 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -5.378 8.313 -9.634 1.00 0.00 H new ATOM 0 HG LEU A 115 -5.787 8.260 -7.242 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -8.153 7.654 -7.233 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.715 8.542 -8.712 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.939 6.778 -8.767 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.516 6.161 -6.170 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -6.270 5.296 -7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.879 6.002 -6.849 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.182 6.537 -11.998 1.00 0.00 N ATOM 1812 CA GLY A 116 -7.545 7.030 -13.311 1.00 0.00 C ATOM 1813 C GLY A 116 -6.528 6.665 -14.375 1.00 0.00 C ATOM 1814 O GLY A 116 -6.520 5.547 -14.897 1.00 0.00 O ATOM 0 H GLY A 116 -7.883 5.946 -11.552 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.518 6.626 -13.590 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.650 8.114 -13.271 1.00 0.00 H new ATOM 1818 N ASP A 117 -5.665 7.622 -14.679 1.00 0.00 N ATOM 1819 CA ASP A 117 -4.626 7.456 -15.686 1.00 0.00 C ATOM 1820 C ASP A 117 -3.262 7.268 -15.022 1.00 0.00 C ATOM 1821 O ASP A 117 -2.300 6.844 -15.662 1.00 0.00 O ATOM 1822 CB ASP A 117 -4.613 8.688 -16.603 1.00 0.00 C ATOM 1823 CG ASP A 117 -3.493 8.673 -17.628 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -3.676 8.073 -18.710 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -2.434 9.281 -17.367 1.00 0.00 O ATOM 0 H ASP A 117 -5.665 8.539 -14.233 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.836 6.566 -16.279 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.569 8.753 -17.123 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.521 9.585 -15.991 1.00 0.00 H new ATOM 1830 N ILE A 118 -3.192 7.545 -13.725 1.00 0.00 N ATOM 1831 CA ILE A 118 -1.916 7.557 -13.023 1.00 0.00 C ATOM 1832 C ILE A 118 -1.551 6.166 -12.506 1.00 0.00 C ATOM 1833 O ILE A 118 -2.405 5.437 -12.005 1.00 0.00 O ATOM 1834 CB ILE A 118 -1.929 8.578 -11.855 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -2.274 7.947 -10.505 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -2.917 9.680 -12.132 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -1.044 7.600 -9.708 1.00 0.00 C ATOM 0 H ILE A 118 -4.000 7.763 -13.142 1.00 0.00 H new ATOM 0 HA ILE A 118 -1.155 7.864 -13.741 1.00 0.00 H new ATOM 0 HB ILE A 118 -0.914 8.972 -11.792 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.894 8.636 -9.932 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.866 7.046 -10.668 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.914 10.388 -11.303 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -2.639 10.196 -13.051 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.915 9.255 -12.243 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -1.340 7.155 -8.758 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -0.436 6.889 -10.268 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.465 8.504 -9.521 1.00 0.00 H new ATOM 1849 N VAL A 119 -0.286 5.786 -12.650 1.00 0.00 N ATOM 1850 CA VAL A 119 0.176 4.524 -12.115 1.00 0.00 C ATOM 1851 C VAL A 119 1.161 4.748 -10.969 1.00 0.00 C ATOM 1852 O VAL A 119 2.250 5.272 -11.156 1.00 0.00 O ATOM 1853 CB VAL A 119 0.802 3.649 -13.215 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.884 4.413 -13.940 1.00 0.00 C ATOM 1855 CG2 VAL A 119 1.335 2.345 -12.636 1.00 0.00 C ATOM 0 H VAL A 119 0.428 6.334 -13.130 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.689 3.992 -11.720 1.00 0.00 H new ATOM 0 HB VAL A 119 0.027 3.392 -13.937 1.00 0.00 H new ATOM 0 HG11 VAL A 119 2.318 3.782 -14.715 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.456 5.306 -14.396 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.660 4.704 -13.232 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.772 1.745 -13.434 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.096 2.564 -11.887 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.518 1.792 -12.172 1.00 0.00 H new ATOM 1865 N TYR A 120 0.773 4.339 -9.788 1.00 0.00 N ATOM 1866 CA TYR A 120 1.594 4.519 -8.610 1.00 0.00 C ATOM 1867 C TYR A 120 2.311 3.228 -8.279 1.00 0.00 C ATOM 1868 O TYR A 120 1.689 2.204 -8.024 1.00 0.00 O ATOM 1869 CB TYR A 120 0.713 4.988 -7.450 1.00 0.00 C ATOM 1870 CG TYR A 120 1.296 4.777 -6.063 1.00 0.00 C ATOM 1871 CD1 TYR A 120 2.177 5.692 -5.498 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.946 3.658 -5.312 1.00 0.00 C ATOM 1873 CE1 TYR A 120 2.691 5.495 -4.228 1.00 0.00 C ATOM 1874 CE2 TYR A 120 1.459 3.457 -4.045 1.00 0.00 C ATOM 1875 CZ TYR A 120 2.328 4.377 -3.509 1.00 0.00 C ATOM 1876 OH TYR A 120 2.835 4.182 -2.244 1.00 0.00 O ATOM 0 H TYR A 120 -0.117 3.873 -9.612 1.00 0.00 H new ATOM 0 HA TYR A 120 2.353 5.280 -8.794 1.00 0.00 H new ATOM 0 HB2 TYR A 120 0.505 6.050 -7.580 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.242 4.466 -7.507 1.00 0.00 H new ATOM 0 HD1 TYR A 120 2.465 6.569 -6.058 1.00 0.00 H new ATOM 0 HD2 TYR A 120 0.261 2.934 -5.728 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.374 6.215 -3.802 1.00 0.00 H new ATOM 0 HE2 TYR A 120 1.179 2.581 -3.479 1.00 0.00 H new ATOM 0 HH TYR A 120 2.906 5.044 -1.783 1.00 0.00 H new ATOM 1886 N LYS A 121 3.621 3.281 -8.299 1.00 0.00 N ATOM 1887 CA LYS A 121 4.426 2.115 -8.022 1.00 0.00 C ATOM 1888 C LYS A 121 5.446 2.448 -6.951 1.00 0.00 C ATOM 1889 O LYS A 121 6.224 3.381 -7.094 1.00 0.00 O ATOM 1890 CB LYS A 121 5.101 1.642 -9.310 1.00 0.00 C ATOM 1891 CG LYS A 121 5.736 0.273 -9.218 1.00 0.00 C ATOM 1892 CD LYS A 121 7.060 0.297 -8.506 1.00 0.00 C ATOM 1893 CE LYS A 121 8.108 1.096 -9.269 1.00 0.00 C ATOM 1894 NZ LYS A 121 8.444 0.479 -10.577 1.00 0.00 N ATOM 0 H LYS A 121 4.155 4.125 -8.506 1.00 0.00 H new ATOM 0 HA LYS A 121 3.798 1.305 -7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.361 1.633 -10.111 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.866 2.366 -9.591 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.059 -0.403 -8.696 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.875 -0.127 -10.222 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.929 0.727 -7.513 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.414 -0.724 -8.367 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.742 2.110 -9.431 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.012 1.176 -8.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.295 0.933 -10.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.623 -0.537 -10.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 7.650 0.608 -11.236 1.00 0.00 H new ATOM 1908 N ARG A 122 5.454 1.688 -5.883 1.00 0.00 N ATOM 1909 CA ARG A 122 6.336 2.001 -4.773 1.00 0.00 C ATOM 1910 C ARG A 122 7.306 0.866 -4.494 1.00 0.00 C ATOM 1911 O ARG A 122 6.990 -0.305 -4.708 1.00 0.00 O ATOM 1912 CB ARG A 122 5.539 2.329 -3.511 1.00 0.00 C ATOM 1913 CG ARG A 122 5.049 1.114 -2.744 1.00 0.00 C ATOM 1914 CD ARG A 122 4.454 1.514 -1.407 1.00 0.00 C ATOM 1915 NE ARG A 122 4.383 0.386 -0.481 1.00 0.00 N ATOM 1916 CZ ARG A 122 4.291 0.505 0.841 1.00 0.00 C ATOM 1917 NH1 ARG A 122 4.209 1.707 1.405 1.00 0.00 N ATOM 1918 NH2 ARG A 122 4.281 -0.584 1.601 1.00 0.00 N ATOM 0 H ARG A 122 4.872 0.860 -5.754 1.00 0.00 H new ATOM 0 HA ARG A 122 6.912 2.880 -5.061 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.161 2.934 -2.851 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.680 2.940 -3.787 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.301 0.585 -3.334 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.877 0.423 -2.585 1.00 0.00 H new ATOM 0 HD2 ARG A 122 5.056 2.308 -0.965 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.454 1.920 -1.562 1.00 0.00 H new ATOM 0 HE ARG A 122 4.405 -0.555 -0.874 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.216 2.545 0.823 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.139 1.791 2.419 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.344 -1.507 1.171 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.211 -0.498 2.615 1.00 0.00 H new ATOM 1932 N VAL A 123 8.488 1.227 -4.020 1.00 0.00 N ATOM 1933 CA VAL A 123 9.469 0.251 -3.589 1.00 0.00 C ATOM 1934 C VAL A 123 9.464 0.159 -2.073 1.00 0.00 C ATOM 1935 O VAL A 123 9.707 1.139 -1.366 1.00 0.00 O ATOM 1936 CB VAL A 123 10.894 0.577 -4.098 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.338 1.958 -3.694 1.00 0.00 C ATOM 1938 CG2 VAL A 123 11.864 -0.473 -3.596 1.00 0.00 C ATOM 0 H VAL A 123 8.790 2.197 -3.925 1.00 0.00 H new ATOM 0 HA VAL A 123 9.189 -0.709 -4.023 1.00 0.00 H new ATOM 0 HB VAL A 123 10.877 0.561 -5.188 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.343 2.142 -4.073 1.00 0.00 H new ATOM 0 HG12 VAL A 123 10.652 2.697 -4.109 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.340 2.036 -2.607 1.00 0.00 H new ATOM 0 HG21 VAL A 123 12.867 -0.243 -3.955 1.00 0.00 H new ATOM 0 HG22 VAL A 123 11.861 -0.480 -2.506 1.00 0.00 H new ATOM 0 HG23 VAL A 123 11.563 -1.453 -3.966 1.00 0.00 H new ATOM 1948 N SER A 124 9.139 -1.021 -1.585 1.00 0.00 N ATOM 1949 CA SER A 124 9.133 -1.288 -0.168 1.00 0.00 C ATOM 1950 C SER A 124 10.018 -2.503 0.108 1.00 0.00 C ATOM 1951 O SER A 124 9.923 -3.512 -0.588 1.00 0.00 O ATOM 1952 CB SER A 124 7.692 -1.520 0.297 1.00 0.00 C ATOM 1953 OG SER A 124 7.111 -2.631 -0.353 1.00 0.00 O ATOM 0 H SER A 124 8.872 -1.819 -2.162 1.00 0.00 H new ATOM 0 HA SER A 124 9.532 -0.439 0.388 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.678 -1.680 1.375 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.097 -0.629 0.099 1.00 0.00 H new ATOM 0 HG SER A 124 7.577 -2.795 -1.200 1.00 0.00 H new ATOM 1959 N LYS A 125 10.896 -2.413 1.093 1.00 0.00 N ATOM 1960 CA LYS A 125 11.886 -3.460 1.293 1.00 0.00 C ATOM 1961 C LYS A 125 11.975 -3.917 2.749 1.00 0.00 C ATOM 1962 O LYS A 125 11.788 -3.134 3.677 1.00 0.00 O ATOM 1963 CB LYS A 125 13.243 -2.984 0.764 1.00 0.00 C ATOM 1964 CG LYS A 125 13.592 -1.566 1.116 1.00 0.00 C ATOM 1965 CD LYS A 125 14.281 -1.457 2.454 1.00 0.00 C ATOM 1966 CE LYS A 125 15.523 -2.323 2.463 1.00 0.00 C ATOM 1967 NZ LYS A 125 16.462 -1.969 3.557 1.00 0.00 N ATOM 0 H LYS A 125 10.945 -1.640 1.757 1.00 0.00 H new ATOM 0 HA LYS A 125 11.570 -4.338 0.729 1.00 0.00 H new ATOM 0 HB2 LYS A 125 14.020 -3.642 1.152 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.251 -3.087 -0.321 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.239 -1.152 0.343 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.684 -0.964 1.128 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.549 -0.419 2.652 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.603 -1.769 3.249 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.231 -3.368 2.565 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.035 -2.227 1.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.294 -2.592 3.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.765 -0.980 3.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.986 -2.086 4.474 1.00 0.00 H new ATOM 1981 N ARG A 126 12.263 -5.204 2.917 1.00 0.00 N ATOM 1982 CA ARG A 126 12.317 -5.849 4.227 1.00 0.00 C ATOM 1983 C ARG A 126 13.513 -5.382 5.041 1.00 0.00 C ATOM 1984 O ARG A 126 14.565 -5.041 4.498 1.00 0.00 O ATOM 1985 CB ARG A 126 12.340 -7.376 4.064 1.00 0.00 C ATOM 1986 CG ARG A 126 12.687 -8.147 5.331 1.00 0.00 C ATOM 1987 CD ARG A 126 14.084 -8.736 5.237 1.00 0.00 C ATOM 1988 NE ARG A 126 14.535 -9.310 6.500 1.00 0.00 N ATOM 1989 CZ ARG A 126 14.782 -10.608 6.683 1.00 0.00 C ATOM 1990 NH1 ARG A 126 14.534 -11.485 5.718 1.00 0.00 N ATOM 1991 NH2 ARG A 126 15.264 -11.037 7.842 1.00 0.00 N ATOM 0 H ARG A 126 12.467 -5.835 2.142 1.00 0.00 H new ATOM 0 HA ARG A 126 11.420 -5.561 4.775 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.362 -7.705 3.711 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.062 -7.634 3.289 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.624 -7.485 6.194 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.961 -8.945 5.487 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.099 -9.506 4.466 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.782 -7.959 4.925 1.00 0.00 H new ATOM 0 HE ARG A 126 14.670 -8.681 7.291 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.151 -11.168 4.827 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.726 -12.476 5.867 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.446 -10.374 8.595 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.452 -12.030 7.980 1.00 0.00 H new ATOM 2005 N ILE A 127 13.329 -5.383 6.347 1.00 0.00 N ATOM 2006 CA ILE A 127 14.333 -4.958 7.275 1.00 0.00 C ATOM 2007 C ILE A 127 15.269 -6.102 7.647 1.00 0.00 C ATOM 2008 O ILE A 127 14.798 -7.088 8.256 1.00 0.00 O ATOM 2009 CB ILE A 127 13.676 -4.421 8.521 1.00 0.00 C ATOM 2010 CG1 ILE A 127 12.507 -5.277 8.906 1.00 0.00 C ATOM 2011 CG2 ILE A 127 13.222 -3.005 8.285 1.00 0.00 C ATOM 2012 CD1 ILE A 127 11.981 -4.834 10.217 1.00 0.00 C ATOM 2013 OXT ILE A 127 16.466 -6.025 7.314 1.00 0.00 O ATOM 0 H ILE A 127 12.461 -5.685 6.790 1.00 0.00 H new ATOM 0 HA ILE A 127 14.924 -4.177 6.797 1.00 0.00 H new ATOM 0 HB ILE A 127 14.400 -4.436 9.336 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.727 -5.209 8.147 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.810 -6.323 8.958 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.748 -2.620 9.188 1.00 0.00 H new ATOM 0 HG22 ILE A 127 14.082 -2.384 8.034 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.507 -2.984 7.462 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.131 -5.456 10.497 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.762 -4.925 10.972 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.662 -3.794 10.149 1.00 0.00 H new TER 2025 ILE A 127