USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 876 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 6 TYR OH : rot -157:sc= 0.896 USER MOD Set 1.2: B 212 ASN :FLIP amide:sc= -17.3! C(o=-18!,f=-16!) USER MOD Set 2.1: A 40 LYS NZ :NH3+ 150:sc= -1.3 (180deg=-2.62!) USER MOD Set 2.2: A 44 ASN :FLIP amide:sc= -0.379 F(o=-2.3,f=-1.7) USER MOD Set 3.1: A 21 TYR OH : rot -172:sc=0.000307 USER MOD Set 3.2: A 45 THR OG1 : rot 88:sc= 0.479 USER MOD Set 4.1: A 13 ASN : amide:sc= -0.0446 X(o=-0.16,f=0.12) USER MOD Set 4.2: B 207 THR OG1 : rot -99:sc= -0.117 USER MOD Set 5.1: A 12 ASN : amide:sc= -10.6! C(o=-11!,f=-15!) USER MOD Set 5.2: B 206 TYR OH : rot 80:sc= -0.0211 USER MOD Single : A 1 MET CE :methyl -162:sc= -0.279 (180deg=-0.542) USER MOD Single : A 1 MET N :NH3+ -119:sc= 0.0856 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -145:sc= 1.33 (180deg=-0.872) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.83! USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.145 USER MOD Single : A 11 THR OG1 : rot 150:sc= -2.78! USER MOD Single : A 14 SER OG : rot 180:sc=-0.00413 USER MOD Single : A 15 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.48) USER MOD Single : A 18 SER OG : rot 180:sc= 0.0132 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.238 USER MOD Single : A 27 MET CE :methyl -128:sc= -1.75 (180deg=-4.57!) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0998 USER MOD Single : A 48 SER OG : rot -68:sc= 1.12 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.161! USER MOD Single : A 53 ASN : amide:sc= 0.0174! C(o=0.017!,f=-6.6!) USER MOD Single : A 55 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=0) USER MOD Single : A 58 CYS SG : rot 180:sc= 0 USER MOD Single : B 201 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.6! USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 164:sc= -2.85 USER MOD Single : B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN : amide:sc= -0.36 X(o=-0.36,f=-0.33) USER MOD Single : B 218 SER OG : rot 180:sc=0.000214 USER MOD Single : B 221 TYR OH : rot 80:sc= -4.23! USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.231 USER MOD Single : B 227 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 228 THR OG1 : rot -170:sc= -1.51! USER MOD Single : B 240 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0547) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.828 F(o=-1.7!,f=-0.83) USER MOD Single : B 245 THR OG1 : rot 180:sc= 0 USER MOD Single : B 248 SER OG : rot 180:sc= 0 USER MOD Single : B 249 TYR OH : rot 180:sc= 0 USER MOD Single : B 251 THR OG1 : rot 170:sc= -0.664! USER MOD Single : B 253 ASN : amide:sc= -0.302 K(o=-0.3,f=-3.1!) USER MOD Single : B 255 HIS :FLIP no HD1:sc= -0.252 F(o=-1.1,f=-0.25) USER MOD Single : B 258 CYS SG : rot 180:sc= -0.867! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.608 -23.054 -12.168 1.00 0.00 N ATOM 2 CA MET A 1 -1.510 -23.424 -10.767 1.00 0.00 C ATOM 3 C MET A 1 -2.072 -22.321 -9.868 1.00 0.00 C ATOM 4 O MET A 1 -2.631 -21.341 -10.357 1.00 0.00 O ATOM 5 CB MET A 1 -0.044 -23.678 -10.407 1.00 0.00 C ATOM 6 CG MET A 1 0.341 -25.134 -10.674 1.00 0.00 C ATOM 7 SD MET A 1 1.961 -25.470 -10.004 1.00 0.00 S ATOM 8 CE MET A 1 1.513 -26.482 -8.602 1.00 0.00 C ATOM 0 H1 MET A 1 -2.208 -23.741 -12.667 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.027 -22.105 -12.248 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.659 -23.050 -12.593 1.00 0.00 H new ATOM 0 HA MET A 1 -2.095 -24.330 -10.608 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.597 -23.016 -10.989 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.123 -23.441 -9.356 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.394 -25.801 -10.223 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.334 -25.330 -11.746 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.345 -26.517 -7.898 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.639 -26.056 -8.110 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.282 -27.492 -8.941 1.00 0.00 H new ATOM 18 N GLY A 2 -1.904 -22.519 -8.568 1.00 0.00 N ATOM 19 CA GLY A 2 -2.389 -21.554 -7.597 1.00 0.00 C ATOM 20 C GLY A 2 -1.380 -21.364 -6.462 1.00 0.00 C ATOM 21 O GLY A 2 -1.253 -22.221 -5.590 1.00 0.00 O ATOM 0 H GLY A 2 -1.439 -23.333 -8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -2.573 -20.599 -8.089 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -3.342 -21.891 -7.189 1.00 0.00 H new ATOM 25 N LYS A 3 -0.688 -20.234 -6.512 1.00 0.00 N ATOM 26 CA LYS A 3 0.307 -19.921 -5.499 1.00 0.00 C ATOM 27 C LYS A 3 -0.240 -18.834 -4.573 1.00 0.00 C ATOM 28 O LYS A 3 -1.269 -18.225 -4.864 1.00 0.00 O ATOM 29 CB LYS A 3 1.641 -19.558 -6.153 1.00 0.00 C ATOM 30 CG LYS A 3 2.391 -20.814 -6.603 1.00 0.00 C ATOM 31 CD LYS A 3 1.416 -21.894 -7.079 1.00 0.00 C ATOM 32 CE LYS A 3 2.165 -23.064 -7.719 1.00 0.00 C ATOM 33 NZ LYS A 3 2.750 -22.658 -9.016 1.00 0.00 N ATOM 0 H LYS A 3 -0.797 -19.525 -7.237 1.00 0.00 H new ATOM 0 HA LYS A 3 0.510 -20.795 -4.880 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.465 -18.908 -7.010 1.00 0.00 H new ATOM 0 HB3 LYS A 3 2.255 -18.997 -5.449 1.00 0.00 H new ATOM 0 HG2 LYS A 3 3.081 -20.561 -7.408 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.991 -21.199 -5.778 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.825 -22.253 -6.236 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.718 -21.467 -7.799 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.953 -23.408 -7.050 1.00 0.00 H new ATOM 0 HE3 LYS A 3 1.484 -23.902 -7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 2.717 -23.459 -9.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 2.207 -21.862 -9.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 3.738 -22.366 -8.875 1.00 0.00 H new ATOM 47 N ALA A 4 0.472 -18.622 -3.476 1.00 0.00 N ATOM 48 CA ALA A 4 0.071 -17.619 -2.504 1.00 0.00 C ATOM 49 C ALA A 4 1.010 -16.415 -2.604 1.00 0.00 C ATOM 50 O ALA A 4 2.067 -16.394 -1.975 1.00 0.00 O ATOM 51 CB ALA A 4 0.061 -18.237 -1.105 1.00 0.00 C ATOM 0 H ALA A 4 1.325 -19.128 -3.239 1.00 0.00 H new ATOM 0 HA ALA A 4 -0.940 -17.267 -2.711 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.240 -17.484 -0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.644 -19.068 -1.080 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.059 -18.600 -0.860 1.00 0.00 H new ATOM 57 N THR A 5 0.590 -15.441 -3.399 1.00 0.00 N ATOM 58 CA THR A 5 1.381 -14.237 -3.588 1.00 0.00 C ATOM 59 C THR A 5 0.474 -13.006 -3.640 1.00 0.00 C ATOM 60 O THR A 5 -0.717 -13.120 -3.925 1.00 0.00 O ATOM 61 CB THR A 5 2.227 -14.421 -4.849 1.00 0.00 C ATOM 62 OG1 THR A 5 1.274 -14.708 -5.869 1.00 0.00 O ATOM 63 CG2 THR A 5 3.100 -15.677 -4.791 1.00 0.00 C ATOM 0 H THR A 5 -0.287 -15.461 -3.919 1.00 0.00 H new ATOM 0 HA THR A 5 2.055 -14.070 -2.748 1.00 0.00 H new ATOM 0 HB THR A 5 2.860 -13.545 -4.991 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.738 -14.840 -6.722 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.680 -15.760 -5.710 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.777 -15.610 -3.940 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.465 -16.556 -4.682 1.00 0.00 H new ATOM 71 N TYR A 6 1.072 -11.858 -3.359 1.00 0.00 N ATOM 72 CA TYR A 6 0.332 -10.606 -3.369 1.00 0.00 C ATOM 73 C TYR A 6 1.133 -9.503 -4.062 1.00 0.00 C ATOM 74 O TYR A 6 2.345 -9.399 -3.877 1.00 0.00 O ATOM 75 CB TYR A 6 0.126 -10.226 -1.903 1.00 0.00 C ATOM 76 CG TYR A 6 -1.141 -10.814 -1.279 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.265 -12.180 -1.124 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.162 -9.978 -0.871 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.458 -12.733 -0.538 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.355 -10.531 -0.285 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.444 -11.882 -0.147 1.00 0.00 C ATOM 82 OH TYR A 6 -4.570 -12.404 0.406 1.00 0.00 O ATOM 0 H TYR A 6 2.060 -11.768 -3.123 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.609 -10.720 -3.907 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.990 -10.559 -1.327 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.088 -9.140 -1.822 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.467 -12.834 -1.442 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -2.065 -8.909 -0.992 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -2.567 -13.800 -0.412 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.161 -9.888 0.038 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.310 -11.770 0.302 1.00 0.00 H new ATOM 92 N THR A 7 0.424 -8.705 -4.848 1.00 0.00 N ATOM 93 CA THR A 7 1.054 -7.612 -5.570 1.00 0.00 C ATOM 94 C THR A 7 0.543 -6.267 -5.051 1.00 0.00 C ATOM 95 O THR A 7 -0.631 -5.940 -5.214 1.00 0.00 O ATOM 96 CB THR A 7 0.800 -7.824 -7.064 1.00 0.00 C ATOM 97 OG1 THR A 7 1.008 -9.221 -7.256 1.00 0.00 O ATOM 98 CG2 THR A 7 1.868 -7.164 -7.938 1.00 0.00 C ATOM 0 H THR A 7 -0.581 -8.794 -5.001 1.00 0.00 H new ATOM 0 HA THR A 7 2.132 -7.599 -5.408 1.00 0.00 H new ATOM 0 HB THR A 7 -0.180 -7.426 -7.326 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.862 -9.447 -8.198 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.641 -7.344 -8.989 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.881 -6.091 -7.749 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.844 -7.586 -7.700 1.00 0.00 H new ATOM 106 N VAL A 8 1.451 -5.521 -4.438 1.00 0.00 N ATOM 107 CA VAL A 8 1.107 -4.219 -3.895 1.00 0.00 C ATOM 108 C VAL A 8 1.654 -3.126 -4.816 1.00 0.00 C ATOM 109 O VAL A 8 2.859 -3.052 -5.051 1.00 0.00 O ATOM 110 CB VAL A 8 1.618 -4.099 -2.458 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.503 -2.660 -1.953 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.880 -5.066 -1.531 1.00 0.00 C ATOM 0 H VAL A 8 2.425 -5.794 -4.306 1.00 0.00 H new ATOM 0 HA VAL A 8 0.025 -4.098 -3.852 1.00 0.00 H new ATOM 0 HB VAL A 8 2.673 -4.371 -2.454 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.873 -2.603 -0.929 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.095 -2.003 -2.590 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.459 -2.347 -1.979 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.263 -4.960 -0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.186 -4.839 -1.543 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.037 -6.089 -1.873 1.00 0.00 H new ATOM 122 N THR A 9 0.741 -2.306 -5.314 1.00 0.00 N ATOM 123 CA THR A 9 1.116 -1.221 -6.205 1.00 0.00 C ATOM 124 C THR A 9 0.874 0.131 -5.532 1.00 0.00 C ATOM 125 O THR A 9 -0.203 0.374 -4.989 1.00 0.00 O ATOM 126 CB THR A 9 0.345 -1.395 -7.514 1.00 0.00 C ATOM 127 OG1 THR A 9 0.592 -2.747 -7.887 1.00 0.00 O ATOM 128 CG2 THR A 9 0.942 -0.577 -8.660 1.00 0.00 C ATOM 0 H THR A 9 -0.258 -2.371 -5.118 1.00 0.00 H new ATOM 0 HA THR A 9 2.182 -1.248 -6.433 1.00 0.00 H new ATOM 0 HB THR A 9 -0.694 -1.102 -7.363 1.00 0.00 H new ATOM 0 HG1 THR A 9 0.126 -2.945 -8.726 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.356 -0.737 -9.565 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.925 0.481 -8.399 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.971 -0.891 -8.833 1.00 0.00 H new ATOM 136 N VAL A 10 1.893 0.977 -5.588 1.00 0.00 N ATOM 137 CA VAL A 10 1.803 2.297 -4.990 1.00 0.00 C ATOM 138 C VAL A 10 2.147 3.353 -6.042 1.00 0.00 C ATOM 139 O VAL A 10 3.252 3.360 -6.583 1.00 0.00 O ATOM 140 CB VAL A 10 2.700 2.373 -3.753 1.00 0.00 C ATOM 141 CG1 VAL A 10 3.140 3.814 -3.481 1.00 0.00 C ATOM 142 CG2 VAL A 10 2.001 1.774 -2.531 1.00 0.00 C ATOM 0 H VAL A 10 2.785 0.773 -6.039 1.00 0.00 H new ATOM 0 HA VAL A 10 0.786 2.494 -4.651 1.00 0.00 H new ATOM 0 HB VAL A 10 3.594 1.782 -3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.776 3.839 -2.596 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.696 4.193 -4.339 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.262 4.437 -3.314 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.660 1.841 -1.666 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.082 2.325 -2.331 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.762 0.728 -2.725 1.00 0.00 H new ATOM 152 N THR A 11 1.179 4.221 -6.302 1.00 0.00 N ATOM 153 CA THR A 11 1.364 5.279 -7.281 1.00 0.00 C ATOM 154 C THR A 11 1.097 6.645 -6.646 1.00 0.00 C ATOM 155 O THR A 11 0.193 6.785 -5.824 1.00 0.00 O ATOM 156 CB THR A 11 0.462 4.978 -8.478 1.00 0.00 C ATOM 157 OG1 THR A 11 0.976 3.757 -9.004 1.00 0.00 O ATOM 158 CG2 THR A 11 0.649 5.982 -9.618 1.00 0.00 C ATOM 0 H THR A 11 0.264 4.213 -5.851 1.00 0.00 H new ATOM 0 HA THR A 11 2.395 5.316 -7.634 1.00 0.00 H new ATOM 0 HB THR A 11 -0.580 4.982 -8.157 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.249 3.248 -9.420 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.014 5.723 -10.443 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.412 6.985 -9.262 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.683 5.954 -9.961 1.00 0.00 H new ATOM 166 N ASN A 12 1.901 7.617 -7.050 1.00 0.00 N ATOM 167 CA ASN A 12 1.763 8.967 -6.532 1.00 0.00 C ATOM 168 C ASN A 12 0.995 9.821 -7.542 1.00 0.00 C ATOM 169 O ASN A 12 1.571 10.307 -8.515 1.00 0.00 O ATOM 170 CB ASN A 12 3.131 9.614 -6.309 1.00 0.00 C ATOM 171 CG ASN A 12 4.072 8.666 -5.564 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.671 7.644 -5.031 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.342 9.060 -5.556 1.00 0.00 N ATOM 0 H ASN A 12 2.651 7.496 -7.731 1.00 0.00 H new ATOM 0 HA ASN A 12 1.232 8.910 -5.582 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.569 9.886 -7.269 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.013 10.536 -5.740 1.00 0.00 H new ATOM 0 HD21 ASN A 12 6.048 8.495 -5.084 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.610 9.927 -6.022 1.00 0.00 H new ATOM 180 N ASN A 13 -0.294 9.978 -7.277 1.00 0.00 N ATOM 181 CA ASN A 13 -1.147 10.765 -8.151 1.00 0.00 C ATOM 182 C ASN A 13 -0.635 12.206 -8.195 1.00 0.00 C ATOM 183 O ASN A 13 -1.032 12.984 -9.061 1.00 0.00 O ATOM 184 CB ASN A 13 -2.588 10.791 -7.637 1.00 0.00 C ATOM 185 CG ASN A 13 -3.511 9.979 -8.548 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.003 10.453 -9.557 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.715 8.731 -8.136 1.00 0.00 N ATOM 0 H ASN A 13 -0.768 9.574 -6.469 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.125 10.310 -9.141 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.624 10.388 -6.625 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.940 11.821 -7.583 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.315 8.107 -8.676 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.271 8.398 -7.280 1.00 0.00 H new ATOM 194 N SER A 14 0.240 12.519 -7.250 1.00 0.00 N ATOM 195 CA SER A 14 0.811 13.852 -7.170 1.00 0.00 C ATOM 196 C SER A 14 1.980 13.981 -8.149 1.00 0.00 C ATOM 197 O SER A 14 2.180 15.037 -8.746 1.00 0.00 O ATOM 198 CB SER A 14 1.275 14.169 -5.746 1.00 0.00 C ATOM 199 OG SER A 14 2.670 13.935 -5.575 1.00 0.00 O ATOM 0 H SER A 14 0.567 11.871 -6.533 1.00 0.00 H new ATOM 0 HA SER A 14 0.038 14.571 -7.440 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.051 15.210 -5.515 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.715 13.558 -5.038 1.00 0.00 H new ATOM 0 HG SER A 14 2.927 14.150 -4.654 1.00 0.00 H new ATOM 205 N ASN A 15 2.719 12.890 -8.284 1.00 0.00 N ATOM 206 CA ASN A 15 3.863 12.868 -9.182 1.00 0.00 C ATOM 207 C ASN A 15 3.557 11.950 -10.366 1.00 0.00 C ATOM 208 O ASN A 15 4.404 11.749 -11.236 1.00 0.00 O ATOM 209 CB ASN A 15 5.107 12.329 -8.474 1.00 0.00 C ATOM 210 CG ASN A 15 6.315 13.236 -8.722 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.232 14.451 -8.670 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.438 12.577 -8.995 1.00 0.00 N ATOM 0 H ASN A 15 2.549 12.015 -7.788 1.00 0.00 H new ATOM 0 HA ASN A 15 4.052 13.889 -9.515 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.917 12.255 -7.403 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.325 11.322 -8.830 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.300 13.091 -9.177 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.437 11.557 -9.023 1.00 0.00 H new ATOM 219 N GLY A 16 2.345 11.415 -10.364 1.00 0.00 N ATOM 220 CA GLY A 16 1.917 10.523 -11.428 1.00 0.00 C ATOM 221 C GLY A 16 2.894 9.357 -11.590 1.00 0.00 C ATOM 222 O GLY A 16 2.895 8.681 -12.618 1.00 0.00 O ATOM 0 H GLY A 16 1.645 11.582 -9.641 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.921 10.140 -11.208 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.846 11.076 -12.365 1.00 0.00 H new ATOM 226 N VAL A 17 3.703 9.156 -10.560 1.00 0.00 N ATOM 227 CA VAL A 17 4.682 8.083 -10.576 1.00 0.00 C ATOM 228 C VAL A 17 4.056 6.818 -9.984 1.00 0.00 C ATOM 229 O VAL A 17 3.629 6.814 -8.830 1.00 0.00 O ATOM 230 CB VAL A 17 5.951 8.522 -9.843 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.877 7.330 -9.586 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.677 9.624 -10.616 1.00 0.00 C ATOM 0 H VAL A 17 3.700 9.718 -9.709 1.00 0.00 H new ATOM 0 HA VAL A 17 4.978 7.851 -11.599 1.00 0.00 H new ATOM 0 HB VAL A 17 5.655 8.930 -8.877 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.771 7.670 -9.064 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.358 6.592 -8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 17 7.161 6.879 -10.537 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.575 9.918 -10.073 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.954 9.254 -11.603 1.00 0.00 H new ATOM 0 HG23 VAL A 17 6.020 10.487 -10.723 1.00 0.00 H new ATOM 242 N SER A 18 4.022 5.775 -10.800 1.00 0.00 N ATOM 243 CA SER A 18 3.457 4.507 -10.371 1.00 0.00 C ATOM 244 C SER A 18 4.578 3.522 -10.031 1.00 0.00 C ATOM 245 O SER A 18 5.672 3.608 -10.584 1.00 0.00 O ATOM 246 CB SER A 18 2.542 3.920 -11.448 1.00 0.00 C ATOM 247 OG SER A 18 2.692 4.588 -12.698 1.00 0.00 O ATOM 0 H SER A 18 4.377 5.782 -11.756 1.00 0.00 H new ATOM 0 HA SER A 18 2.856 4.684 -9.479 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.764 2.860 -11.574 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.505 3.992 -11.121 1.00 0.00 H new ATOM 0 HG SER A 18 2.093 4.183 -13.359 1.00 0.00 H new ATOM 253 N VAL A 19 4.264 2.610 -9.123 1.00 0.00 N ATOM 254 CA VAL A 19 5.230 1.610 -8.703 1.00 0.00 C ATOM 255 C VAL A 19 4.489 0.363 -8.215 1.00 0.00 C ATOM 256 O VAL A 19 3.623 0.453 -7.346 1.00 0.00 O ATOM 257 CB VAL A 19 6.169 2.199 -7.648 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.727 1.103 -6.737 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.298 2.996 -8.302 1.00 0.00 C ATOM 0 H VAL A 19 3.354 2.543 -8.667 1.00 0.00 H new ATOM 0 HA VAL A 19 5.856 1.308 -9.543 1.00 0.00 H new ATOM 0 HB VAL A 19 5.590 2.885 -7.030 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.391 1.549 -5.996 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.905 0.598 -6.230 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.283 0.381 -7.335 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.950 3.403 -7.530 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.874 2.341 -8.956 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.875 3.812 -8.888 1.00 0.00 H new ATOM 269 N ASP A 20 4.856 -0.770 -8.794 1.00 0.00 N ATOM 270 CA ASP A 20 4.237 -2.033 -8.428 1.00 0.00 C ATOM 271 C ASP A 20 5.315 -3.002 -7.940 1.00 0.00 C ATOM 272 O ASP A 20 6.414 -3.042 -8.489 1.00 0.00 O ATOM 273 CB ASP A 20 3.537 -2.670 -9.630 1.00 0.00 C ATOM 274 CG ASP A 20 3.338 -1.743 -10.830 1.00 0.00 C ATOM 275 OD1 ASP A 20 4.353 -1.164 -11.274 1.00 0.00 O ATOM 276 OD2 ASP A 20 2.175 -1.634 -11.277 1.00 0.00 O ATOM 0 H ASP A 20 5.575 -0.840 -9.514 1.00 0.00 H new ATOM 0 HA ASP A 20 3.504 -1.836 -7.646 1.00 0.00 H new ATOM 0 HB2 ASP A 20 4.116 -3.536 -9.951 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.563 -3.039 -9.310 1.00 0.00 H new ATOM 281 N TYR A 21 4.963 -3.759 -6.912 1.00 0.00 N ATOM 282 CA TYR A 21 5.886 -4.726 -6.343 1.00 0.00 C ATOM 283 C TYR A 21 5.157 -6.011 -5.944 1.00 0.00 C ATOM 284 O TYR A 21 4.149 -5.965 -5.241 1.00 0.00 O ATOM 285 CB TYR A 21 6.462 -4.070 -5.086 1.00 0.00 C ATOM 286 CG TYR A 21 7.879 -3.523 -5.265 1.00 0.00 C ATOM 287 CD1 TYR A 21 8.844 -4.292 -5.884 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.194 -2.259 -4.807 1.00 0.00 C ATOM 289 CE1 TYR A 21 10.178 -3.777 -6.052 1.00 0.00 C ATOM 290 CE2 TYR A 21 9.528 -1.744 -4.975 1.00 0.00 C ATOM 291 CZ TYR A 21 10.454 -2.528 -5.590 1.00 0.00 C ATOM 292 OH TYR A 21 11.715 -2.042 -5.748 1.00 0.00 O ATOM 0 H TYR A 21 4.050 -3.722 -6.458 1.00 0.00 H new ATOM 0 HA TYR A 21 6.656 -4.993 -7.066 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.805 -3.256 -4.780 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.465 -4.800 -4.276 1.00 0.00 H new ATOM 0 HD1 TYR A 21 8.598 -5.281 -6.243 1.00 0.00 H new ATOM 0 HD2 TYR A 21 7.440 -1.657 -4.323 1.00 0.00 H new ATOM 0 HE1 TYR A 21 10.942 -4.369 -6.534 1.00 0.00 H new ATOM 0 HE2 TYR A 21 9.788 -0.757 -4.621 1.00 0.00 H new ATOM 0 HH TYR A 21 11.804 -1.197 -5.259 1.00 0.00 H new ATOM 302 N GLU A 22 5.697 -7.128 -6.410 1.00 0.00 N ATOM 303 CA GLU A 22 5.111 -8.424 -6.111 1.00 0.00 C ATOM 304 C GLU A 22 5.723 -9.000 -4.832 1.00 0.00 C ATOM 305 O GLU A 22 6.908 -9.325 -4.798 1.00 0.00 O ATOM 306 CB GLU A 22 5.286 -9.389 -7.285 1.00 0.00 C ATOM 307 CG GLU A 22 4.844 -10.803 -6.903 1.00 0.00 C ATOM 308 CD GLU A 22 5.271 -11.817 -7.967 1.00 0.00 C ATOM 309 OE1 GLU A 22 6.443 -12.244 -7.906 1.00 0.00 O ATOM 310 OE2 GLU A 22 4.413 -12.140 -8.817 1.00 0.00 O ATOM 0 H GLU A 22 6.534 -7.162 -6.992 1.00 0.00 H new ATOM 0 HA GLU A 22 4.041 -8.289 -5.951 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.703 -9.040 -8.137 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.330 -9.402 -7.597 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.277 -11.076 -5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.761 -10.830 -6.784 1.00 0.00 H new ATOM 317 N THR A 23 4.884 -9.110 -3.811 1.00 0.00 N ATOM 318 CA THR A 23 5.327 -9.642 -2.533 1.00 0.00 C ATOM 319 C THR A 23 4.290 -10.617 -1.973 1.00 0.00 C ATOM 320 O THR A 23 3.137 -10.247 -1.761 1.00 0.00 O ATOM 321 CB THR A 23 5.615 -8.460 -1.604 1.00 0.00 C ATOM 322 OG1 THR A 23 6.322 -9.042 -0.512 1.00 0.00 O ATOM 323 CG2 THR A 23 4.345 -7.894 -0.967 1.00 0.00 C ATOM 0 H THR A 23 3.901 -8.840 -3.843 1.00 0.00 H new ATOM 0 HA THR A 23 6.245 -10.220 -2.641 1.00 0.00 H new ATOM 0 HB THR A 23 6.122 -7.673 -2.163 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.550 -8.345 0.138 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.605 -7.058 -0.318 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.668 -7.549 -1.749 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.855 -8.671 -0.380 1.00 0.00 H new ATOM 331 N GLU A 24 4.738 -11.844 -1.751 1.00 0.00 N ATOM 332 CA GLU A 24 3.863 -12.874 -1.219 1.00 0.00 C ATOM 333 C GLU A 24 3.901 -12.865 0.311 1.00 0.00 C ATOM 334 O GLU A 24 4.795 -13.452 0.917 1.00 0.00 O ATOM 335 CB GLU A 24 4.242 -14.251 -1.768 1.00 0.00 C ATOM 336 CG GLU A 24 5.717 -14.560 -1.506 1.00 0.00 C ATOM 337 CD GLU A 24 6.492 -14.698 -2.819 1.00 0.00 C ATOM 338 OE1 GLU A 24 6.284 -15.730 -3.493 1.00 0.00 O ATOM 339 OE2 GLU A 24 7.272 -13.769 -3.118 1.00 0.00 O ATOM 0 H GLU A 24 5.695 -12.148 -1.930 1.00 0.00 H new ATOM 0 HA GLU A 24 2.844 -12.659 -1.539 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.619 -15.015 -1.304 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.044 -14.286 -2.839 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.157 -13.766 -0.902 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.802 -15.482 -0.931 1.00 0.00 H new ATOM 346 N THR A 25 2.917 -12.194 0.890 1.00 0.00 N ATOM 347 CA THR A 25 2.825 -12.101 2.337 1.00 0.00 C ATOM 348 C THR A 25 1.401 -12.412 2.803 1.00 0.00 C ATOM 349 O THR A 25 0.472 -11.659 2.513 1.00 0.00 O ATOM 350 CB THR A 25 3.311 -10.711 2.753 1.00 0.00 C ATOM 351 OG1 THR A 25 2.669 -9.830 1.835 1.00 0.00 O ATOM 352 CG2 THR A 25 4.803 -10.508 2.484 1.00 0.00 C ATOM 0 H THR A 25 2.176 -11.709 0.383 1.00 0.00 H new ATOM 0 HA THR A 25 3.460 -12.842 2.822 1.00 0.00 H new ATOM 0 HB THR A 25 3.110 -10.558 3.813 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.927 -8.906 2.034 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.096 -9.506 2.797 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.377 -11.246 3.044 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.000 -10.627 1.419 1.00 0.00 H new ATOM 360 N PRO A 26 1.271 -13.550 3.535 1.00 0.00 N ATOM 361 CA PRO A 26 -0.024 -13.969 4.044 1.00 0.00 C ATOM 362 C PRO A 26 -0.448 -13.112 5.237 1.00 0.00 C ATOM 363 O PRO A 26 -1.129 -12.101 5.070 1.00 0.00 O ATOM 364 CB PRO A 26 0.149 -15.437 4.398 1.00 0.00 C ATOM 365 CG PRO A 26 1.647 -15.664 4.512 1.00 0.00 C ATOM 366 CD PRO A 26 2.349 -14.465 3.897 1.00 0.00 C ATOM 0 HA PRO A 26 -0.824 -13.840 3.315 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.355 -15.675 5.335 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.286 -16.078 3.631 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.937 -15.782 5.556 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.934 -16.580 3.996 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.039 -14.004 4.604 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.934 -14.754 3.023 1.00 0.00 H new ATOM 374 N MET A 27 -0.027 -13.546 6.416 1.00 0.00 N ATOM 375 CA MET A 27 -0.355 -12.832 7.638 1.00 0.00 C ATOM 376 C MET A 27 0.457 -11.539 7.751 1.00 0.00 C ATOM 377 O MET A 27 0.006 -10.570 8.361 1.00 0.00 O ATOM 378 CB MET A 27 -0.064 -13.725 8.846 1.00 0.00 C ATOM 379 CG MET A 27 -0.647 -15.125 8.645 1.00 0.00 C ATOM 380 SD MET A 27 0.453 -16.348 9.339 1.00 0.00 S ATOM 381 CE MET A 27 1.974 -15.899 8.519 1.00 0.00 C ATOM 0 H MET A 27 0.539 -14.384 6.551 1.00 0.00 H new ATOM 0 HA MET A 27 -1.414 -12.574 7.613 1.00 0.00 H new ATOM 0 HB2 MET A 27 1.013 -13.794 9.001 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.487 -13.276 9.745 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.626 -15.192 9.120 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.795 -15.318 7.582 1.00 0.00 H new ATOM 0 HE1 MET A 27 2.406 -16.781 8.046 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.769 -15.144 7.760 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.677 -15.498 9.250 1.00 0.00 H new ATOM 391 N THR A 28 1.639 -11.567 7.154 1.00 0.00 N ATOM 392 CA THR A 28 2.517 -10.409 7.180 1.00 0.00 C ATOM 393 C THR A 28 1.770 -9.162 6.706 1.00 0.00 C ATOM 394 O THR A 28 2.049 -8.055 7.165 1.00 0.00 O ATOM 395 CB THR A 28 3.753 -10.735 6.339 1.00 0.00 C ATOM 396 OG1 THR A 28 3.530 -12.071 5.897 1.00 0.00 O ATOM 397 CG2 THR A 28 5.027 -10.829 7.181 1.00 0.00 C ATOM 0 H THR A 28 2.009 -12.372 6.650 1.00 0.00 H new ATOM 0 HA THR A 28 2.846 -10.185 8.195 1.00 0.00 H new ATOM 0 HB THR A 28 3.881 -9.971 5.572 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.284 -12.362 5.343 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.874 -11.062 6.535 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.204 -9.877 7.681 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.913 -11.615 7.927 1.00 0.00 H new ATOM 405 N LEU A 29 0.835 -9.382 5.793 1.00 0.00 N ATOM 406 CA LEU A 29 0.046 -8.290 5.251 1.00 0.00 C ATOM 407 C LEU A 29 -0.583 -7.501 6.401 1.00 0.00 C ATOM 408 O LEU A 29 -0.784 -6.292 6.294 1.00 0.00 O ATOM 409 CB LEU A 29 -0.972 -8.816 4.237 1.00 0.00 C ATOM 410 CG LEU A 29 -0.458 -9.008 2.809 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.387 -9.925 2.012 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.250 -7.659 2.115 1.00 0.00 C ATOM 0 H LEU A 29 0.606 -10.301 5.415 1.00 0.00 H new ATOM 0 HA LEU A 29 0.682 -7.598 4.699 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.353 -9.772 4.597 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.816 -8.127 4.209 1.00 0.00 H new ATOM 0 HG LEU A 29 0.514 -9.498 2.858 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.999 -10.045 1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.441 -10.899 2.498 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.383 -9.485 1.969 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.116 -7.824 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.197 -7.120 2.076 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.479 -7.072 2.673 1.00 0.00 H new ATOM 424 N LEU A 30 -0.876 -8.217 7.477 1.00 0.00 N ATOM 425 CA LEU A 30 -1.478 -7.600 8.647 1.00 0.00 C ATOM 426 C LEU A 30 -0.378 -7.002 9.525 1.00 0.00 C ATOM 427 O LEU A 30 -0.606 -6.019 10.231 1.00 0.00 O ATOM 428 CB LEU A 30 -2.374 -8.600 9.379 1.00 0.00 C ATOM 429 CG LEU A 30 -3.298 -9.443 8.498 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.177 -10.363 9.348 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.127 -8.557 7.566 1.00 0.00 C ATOM 0 H LEU A 30 -0.708 -9.219 7.563 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.132 -6.779 8.351 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.739 -9.274 9.954 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.987 -8.052 10.094 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.679 -10.082 7.867 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.824 -10.951 8.697 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.545 -11.032 9.932 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.789 -9.762 10.021 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.775 -9.182 6.951 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.737 -7.875 8.159 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.461 -7.982 6.923 1.00 0.00 H new ATOM 443 N VAL A 31 0.793 -7.618 9.454 1.00 0.00 N ATOM 444 CA VAL A 31 1.930 -7.158 10.235 1.00 0.00 C ATOM 445 C VAL A 31 2.224 -5.698 9.886 1.00 0.00 C ATOM 446 O VAL A 31 2.247 -5.328 8.713 1.00 0.00 O ATOM 447 CB VAL A 31 3.128 -8.082 10.007 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.377 -7.541 10.704 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.816 -9.507 10.466 1.00 0.00 C ATOM 0 H VAL A 31 0.979 -8.432 8.868 1.00 0.00 H new ATOM 0 HA VAL A 31 1.705 -7.198 11.301 1.00 0.00 H new ATOM 0 HB VAL A 31 3.329 -8.113 8.936 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.214 -8.216 10.526 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.616 -6.554 10.308 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.192 -7.466 11.776 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.684 -10.143 10.293 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.576 -9.502 11.529 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.966 -9.892 9.904 1.00 0.00 H new ATOM 459 N PRO A 32 2.449 -4.887 10.954 1.00 0.00 N ATOM 460 CA PRO A 32 2.743 -3.475 10.773 1.00 0.00 C ATOM 461 C PRO A 32 4.174 -3.272 10.273 1.00 0.00 C ATOM 462 O PRO A 32 4.414 -2.465 9.377 1.00 0.00 O ATOM 463 CB PRO A 32 2.494 -2.844 12.133 1.00 0.00 C ATOM 464 CG PRO A 32 2.521 -3.987 13.135 1.00 0.00 C ATOM 465 CD PRO A 32 2.432 -5.290 12.357 1.00 0.00 C ATOM 0 HA PRO A 32 2.117 -3.010 10.012 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.259 -2.103 12.365 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.534 -2.329 12.154 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.437 -3.956 13.725 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.689 -3.902 13.834 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.269 -5.948 12.590 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.520 -5.835 12.601 1.00 0.00 H new ATOM 473 N GLU A 33 5.088 -4.019 10.875 1.00 0.00 N ATOM 474 CA GLU A 33 6.491 -3.931 10.502 1.00 0.00 C ATOM 475 C GLU A 33 6.670 -4.278 9.023 1.00 0.00 C ATOM 476 O GLU A 33 7.486 -3.668 8.333 1.00 0.00 O ATOM 477 CB GLU A 33 7.350 -4.837 11.385 1.00 0.00 C ATOM 478 CG GLU A 33 6.872 -4.802 12.838 1.00 0.00 C ATOM 479 CD GLU A 33 8.019 -5.112 13.802 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.992 -4.328 13.796 1.00 0.00 O ATOM 481 OE2 GLU A 33 7.898 -6.128 14.521 1.00 0.00 O ATOM 0 H GLU A 33 4.885 -4.688 11.618 1.00 0.00 H new ATOM 0 HA GLU A 33 6.824 -2.905 10.657 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.310 -5.860 11.010 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.391 -4.519 11.334 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.458 -3.819 13.064 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.069 -5.526 12.978 1.00 0.00 H new ATOM 488 N VAL A 34 5.892 -5.255 8.579 1.00 0.00 N ATOM 489 CA VAL A 34 5.954 -5.689 7.194 1.00 0.00 C ATOM 490 C VAL A 34 5.168 -4.709 6.320 1.00 0.00 C ATOM 491 O VAL A 34 5.629 -4.321 5.249 1.00 0.00 O ATOM 492 CB VAL A 34 5.453 -7.130 7.075 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.474 -7.600 5.619 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.270 -8.070 7.965 1.00 0.00 C ATOM 0 H VAL A 34 5.216 -5.758 9.154 1.00 0.00 H new ATOM 0 HA VAL A 34 6.985 -5.686 6.839 1.00 0.00 H new ATOM 0 HB VAL A 34 4.419 -7.154 7.420 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.113 -8.627 5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.831 -6.956 5.019 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.493 -7.552 5.236 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.893 -9.088 7.862 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.317 -8.038 7.663 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.182 -7.754 9.005 1.00 0.00 H new ATOM 504 N ALA A 35 3.995 -4.339 6.812 1.00 0.00 N ATOM 505 CA ALA A 35 3.141 -3.412 6.089 1.00 0.00 C ATOM 506 C ALA A 35 3.846 -2.058 5.975 1.00 0.00 C ATOM 507 O ALA A 35 3.861 -1.450 4.905 1.00 0.00 O ATOM 508 CB ALA A 35 1.788 -3.306 6.796 1.00 0.00 C ATOM 0 H ALA A 35 3.616 -4.664 7.702 1.00 0.00 H new ATOM 0 HA ALA A 35 2.953 -3.773 5.078 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.148 -2.611 6.254 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.315 -4.288 6.825 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.936 -2.944 7.813 1.00 0.00 H new ATOM 514 N ALA A 36 4.412 -1.626 7.091 1.00 0.00 N ATOM 515 CA ALA A 36 5.117 -0.356 7.130 1.00 0.00 C ATOM 516 C ALA A 36 6.284 -0.395 6.142 1.00 0.00 C ATOM 517 O ALA A 36 6.445 0.514 5.328 1.00 0.00 O ATOM 518 CB ALA A 36 5.575 -0.069 8.561 1.00 0.00 C ATOM 0 H ALA A 36 4.397 -2.133 7.976 1.00 0.00 H new ATOM 0 HA ALA A 36 4.457 0.458 6.830 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.104 0.884 8.590 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.707 -0.022 9.218 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.241 -0.864 8.896 1.00 0.00 H new ATOM 524 N GLU A 37 7.069 -1.458 6.244 1.00 0.00 N ATOM 525 CA GLU A 37 8.217 -1.627 5.368 1.00 0.00 C ATOM 526 C GLU A 37 7.761 -1.746 3.912 1.00 0.00 C ATOM 527 O GLU A 37 8.455 -1.297 3.003 1.00 0.00 O ATOM 528 CB GLU A 37 9.048 -2.843 5.784 1.00 0.00 C ATOM 529 CG GLU A 37 9.976 -2.500 6.951 1.00 0.00 C ATOM 530 CD GLU A 37 10.681 -3.751 7.477 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.744 -4.084 6.911 1.00 0.00 O ATOM 532 OE2 GLU A 37 10.140 -4.346 8.434 1.00 0.00 O ATOM 0 H GLU A 37 6.933 -2.210 6.919 1.00 0.00 H new ATOM 0 HA GLU A 37 8.852 -0.746 5.458 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.386 -3.660 6.070 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.638 -3.192 4.936 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.717 -1.769 6.628 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.401 -2.038 7.753 1.00 0.00 H new ATOM 539 N VAL A 38 6.597 -2.355 3.738 1.00 0.00 N ATOM 540 CA VAL A 38 6.041 -2.538 2.409 1.00 0.00 C ATOM 541 C VAL A 38 5.590 -1.184 1.857 1.00 0.00 C ATOM 542 O VAL A 38 5.901 -0.839 0.719 1.00 0.00 O ATOM 543 CB VAL A 38 4.913 -3.571 2.452 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.778 -3.185 1.501 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.440 -4.972 2.135 1.00 0.00 C ATOM 0 H VAL A 38 6.024 -2.728 4.495 1.00 0.00 H new ATOM 0 HA VAL A 38 6.798 -2.930 1.730 1.00 0.00 H new ATOM 0 HB VAL A 38 4.511 -3.585 3.465 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.990 -3.936 1.551 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.374 -2.215 1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.161 -3.128 0.482 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.618 -5.687 2.172 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.881 -4.978 1.138 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.197 -5.251 2.868 1.00 0.00 H new ATOM 555 N ILE A 39 4.863 -0.454 2.691 1.00 0.00 N ATOM 556 CA ILE A 39 4.367 0.855 2.301 1.00 0.00 C ATOM 557 C ILE A 39 5.549 1.809 2.115 1.00 0.00 C ATOM 558 O ILE A 39 5.580 2.585 1.161 1.00 0.00 O ATOM 559 CB ILE A 39 3.326 1.354 3.306 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.074 0.476 3.279 1.00 0.00 C ATOM 561 CG2 ILE A 39 2.998 2.829 3.067 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.163 0.855 2.109 1.00 0.00 C ATOM 0 H ILE A 39 4.606 -0.744 3.634 1.00 0.00 H new ATOM 0 HA ILE A 39 3.850 0.797 1.343 1.00 0.00 H new ATOM 0 HB ILE A 39 3.751 1.277 4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.362 -0.572 3.195 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.530 0.583 4.218 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.256 3.159 3.794 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.904 3.425 3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.600 2.955 2.060 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.280 0.215 2.113 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.857 1.896 2.209 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.702 0.723 1.171 1.00 0.00 H new ATOM 574 N LYS A 40 6.492 1.720 3.040 1.00 0.00 N ATOM 575 CA LYS A 40 7.672 2.566 2.991 1.00 0.00 C ATOM 576 C LYS A 40 8.561 2.126 1.825 1.00 0.00 C ATOM 577 O LYS A 40 9.063 2.959 1.074 1.00 0.00 O ATOM 578 CB LYS A 40 8.388 2.568 4.342 1.00 0.00 C ATOM 579 CG LYS A 40 9.901 2.710 4.162 1.00 0.00 C ATOM 580 CD LYS A 40 10.597 1.353 4.270 1.00 0.00 C ATOM 581 CE LYS A 40 12.061 1.450 3.840 1.00 0.00 C ATOM 582 NZ LYS A 40 12.162 1.555 2.367 1.00 0.00 N ATOM 0 H LYS A 40 6.463 1.074 3.829 1.00 0.00 H new ATOM 0 HA LYS A 40 7.389 3.602 2.805 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.013 3.388 4.955 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.167 1.644 4.876 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.115 3.156 3.190 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.298 3.387 4.918 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.539 0.992 5.297 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.079 0.624 3.646 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.526 2.319 4.305 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.607 0.572 4.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.009 2.103 2.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.231 0.603 1.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.317 2.033 1.994 1.00 0.00 H new ATOM 596 N ASP A 41 8.726 0.816 1.711 1.00 0.00 N ATOM 597 CA ASP A 41 9.545 0.255 0.650 1.00 0.00 C ATOM 598 C ASP A 41 9.008 0.723 -0.704 1.00 0.00 C ATOM 599 O ASP A 41 9.777 1.134 -1.572 1.00 0.00 O ATOM 600 CB ASP A 41 9.503 -1.274 0.672 1.00 0.00 C ATOM 601 CG ASP A 41 10.106 -1.955 -0.558 1.00 0.00 C ATOM 602 OD1 ASP A 41 11.280 -1.649 -0.858 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.379 -2.767 -1.170 1.00 0.00 O ATOM 0 H ASP A 41 8.307 0.127 2.336 1.00 0.00 H new ATOM 0 HA ASP A 41 10.571 0.590 0.803 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.032 -1.624 1.558 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.466 -1.593 0.773 1.00 0.00 H new ATOM 608 N LEU A 42 7.693 0.645 -0.843 1.00 0.00 N ATOM 609 CA LEU A 42 7.044 1.056 -2.076 1.00 0.00 C ATOM 610 C LEU A 42 7.280 2.551 -2.298 1.00 0.00 C ATOM 611 O LEU A 42 7.753 2.957 -3.357 1.00 0.00 O ATOM 612 CB LEU A 42 5.566 0.661 -2.061 1.00 0.00 C ATOM 613 CG LEU A 42 5.244 -0.752 -2.552 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.626 -1.593 -1.433 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.353 -0.711 -3.796 1.00 0.00 C ATOM 0 H LEU A 42 7.059 0.303 -0.121 1.00 0.00 H new ATOM 0 HA LEU A 42 7.480 0.535 -2.928 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.193 0.764 -1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.014 1.372 -2.675 1.00 0.00 H new ATOM 0 HG LEU A 42 6.178 -1.234 -2.840 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.407 -2.593 -1.808 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.327 -1.663 -0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.704 -1.123 -1.092 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.139 -1.728 -4.124 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.419 -0.203 -3.558 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.866 -0.173 -4.593 1.00 0.00 H new ATOM 627 N VAL A 43 6.938 3.328 -1.281 1.00 0.00 N ATOM 628 CA VAL A 43 7.106 4.770 -1.352 1.00 0.00 C ATOM 629 C VAL A 43 8.575 5.095 -1.629 1.00 0.00 C ATOM 630 O VAL A 43 8.882 5.899 -2.508 1.00 0.00 O ATOM 631 CB VAL A 43 6.581 5.421 -0.070 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.426 6.638 0.311 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.106 5.802 -0.213 1.00 0.00 C ATOM 0 H VAL A 43 6.545 2.987 -0.404 1.00 0.00 H new ATOM 0 HA VAL A 43 6.521 5.183 -2.174 1.00 0.00 H new ATOM 0 HB VAL A 43 6.662 4.690 0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.032 7.082 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.458 6.328 0.474 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.390 7.372 -0.494 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.758 6.262 0.712 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.991 6.508 -1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.517 4.908 -0.417 1.00 0.00 H new ATOM 643 N ASN A 44 9.445 4.450 -0.865 1.00 0.00 N ATOM 644 CA ASN A 44 10.874 4.661 -1.017 1.00 0.00 C ATOM 645 C ASN A 44 11.278 4.363 -2.462 1.00 0.00 C ATOM 646 O ASN A 44 12.163 5.018 -3.012 1.00 0.00 O ATOM 647 CB ASN A 44 11.669 3.727 -0.102 1.00 0.00 C ATOM 648 CG ASN A 44 12.211 4.481 1.114 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.275 4.849 1.984 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.401 4.714 1.252 1.00 0.00 N flip ATOM 0 H ASN A 44 9.187 3.781 -0.139 1.00 0.00 H new ATOM 0 HA ASN A 44 11.092 5.696 -0.753 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.032 2.907 0.229 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.495 3.284 -0.658 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.067 4.403 0.545 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.730 5.220 2.074 1.00 0.00 H new ATOM 657 N THR A 45 10.610 3.375 -3.039 1.00 0.00 N ATOM 658 CA THR A 45 10.887 2.982 -4.410 1.00 0.00 C ATOM 659 C THR A 45 10.314 4.011 -5.386 1.00 0.00 C ATOM 660 O THR A 45 10.969 4.377 -6.361 1.00 0.00 O ATOM 661 CB THR A 45 10.332 1.571 -4.619 1.00 0.00 C ATOM 662 OG1 THR A 45 11.260 0.729 -3.941 1.00 0.00 O ATOM 663 CG2 THR A 45 10.416 1.119 -6.078 1.00 0.00 C ATOM 0 H THR A 45 9.876 2.834 -2.581 1.00 0.00 H new ATOM 0 HA THR A 45 11.959 2.957 -4.605 1.00 0.00 H new ATOM 0 HB THR A 45 9.294 1.537 -4.288 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.996 0.641 -3.001 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.009 0.112 -6.171 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.841 1.802 -6.704 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.457 1.121 -6.400 1.00 0.00 H new ATOM 671 N VAL A 46 9.100 4.449 -5.089 1.00 0.00 N ATOM 672 CA VAL A 46 8.432 5.430 -5.928 1.00 0.00 C ATOM 673 C VAL A 46 9.261 6.715 -5.961 1.00 0.00 C ATOM 674 O VAL A 46 9.391 7.347 -7.009 1.00 0.00 O ATOM 675 CB VAL A 46 7.002 5.653 -5.435 1.00 0.00 C ATOM 676 CG1 VAL A 46 6.174 6.406 -6.478 1.00 0.00 C ATOM 677 CG2 VAL A 46 6.337 4.327 -5.061 1.00 0.00 C ATOM 0 H VAL A 46 8.561 4.143 -4.279 1.00 0.00 H new ATOM 0 HA VAL A 46 8.355 5.067 -6.953 1.00 0.00 H new ATOM 0 HB VAL A 46 7.050 6.268 -4.537 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.161 6.552 -6.103 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.631 7.376 -6.674 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.139 5.828 -7.401 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.321 4.515 -4.714 1.00 0.00 H new ATOM 0 HG22 VAL A 46 6.307 3.676 -5.935 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.908 3.844 -4.268 1.00 0.00 H new ATOM 687 N ARG A 47 9.799 7.064 -4.802 1.00 0.00 N ATOM 688 CA ARG A 47 10.612 8.263 -4.685 1.00 0.00 C ATOM 689 C ARG A 47 11.977 8.044 -5.338 1.00 0.00 C ATOM 690 O ARG A 47 12.575 8.982 -5.865 1.00 0.00 O ATOM 691 CB ARG A 47 10.811 8.653 -3.218 1.00 0.00 C ATOM 692 CG ARG A 47 9.576 9.371 -2.669 1.00 0.00 C ATOM 693 CD ARG A 47 9.899 10.093 -1.360 1.00 0.00 C ATOM 694 NE ARG A 47 8.778 10.982 -0.983 1.00 0.00 N ATOM 695 CZ ARG A 47 8.857 11.933 -0.042 1.00 0.00 C ATOM 696 NH1 ARG A 47 10.005 12.123 0.624 1.00 0.00 N ATOM 697 NH2 ARG A 47 7.789 12.693 0.235 1.00 0.00 N ATOM 0 H ARG A 47 9.688 6.538 -3.935 1.00 0.00 H new ATOM 0 HA ARG A 47 10.087 9.071 -5.195 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.011 7.761 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.683 9.300 -3.125 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.211 10.089 -3.404 1.00 0.00 H new ATOM 0 HG3 ARG A 47 8.775 8.650 -2.503 1.00 0.00 H new ATOM 0 HD2 ARG A 47 10.079 9.365 -0.569 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.814 10.675 -1.472 1.00 0.00 H new ATOM 0 HE ARG A 47 7.889 10.864 -1.470 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.818 11.544 0.414 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.065 12.847 1.340 1.00 0.00 H new ATOM 0 HH21 ARG A 47 6.915 12.548 -0.270 1.00 0.00 H new ATOM 0 HH22 ARG A 47 7.850 13.417 0.951 1.00 0.00 H new ATOM 711 N SER A 48 12.432 6.801 -5.281 1.00 0.00 N ATOM 712 CA SER A 48 13.718 6.448 -5.860 1.00 0.00 C ATOM 713 C SER A 48 13.772 6.890 -7.324 1.00 0.00 C ATOM 714 O SER A 48 14.767 7.460 -7.767 1.00 0.00 O ATOM 715 CB SER A 48 13.976 4.944 -5.751 1.00 0.00 C ATOM 716 OG SER A 48 13.516 4.238 -6.899 1.00 0.00 O ATOM 0 H SER A 48 11.934 6.026 -4.843 1.00 0.00 H new ATOM 0 HA SER A 48 14.498 6.965 -5.302 1.00 0.00 H new ATOM 0 HB2 SER A 48 15.044 4.768 -5.621 1.00 0.00 H new ATOM 0 HB3 SER A 48 13.479 4.555 -4.863 1.00 0.00 H new ATOM 0 HG SER A 48 12.537 4.264 -6.928 1.00 0.00 H new ATOM 722 N TYR A 49 12.688 6.610 -8.034 1.00 0.00 N ATOM 723 CA TYR A 49 12.600 6.972 -9.438 1.00 0.00 C ATOM 724 C TYR A 49 12.708 8.487 -9.621 1.00 0.00 C ATOM 725 O TYR A 49 13.155 8.959 -10.665 1.00 0.00 O ATOM 726 CB TYR A 49 11.219 6.510 -9.906 1.00 0.00 C ATOM 727 CG TYR A 49 11.180 6.039 -11.361 1.00 0.00 C ATOM 728 CD1 TYR A 49 11.782 4.848 -11.717 1.00 0.00 C ATOM 729 CD2 TYR A 49 10.544 6.802 -12.318 1.00 0.00 C ATOM 730 CE1 TYR A 49 11.747 4.404 -13.086 1.00 0.00 C ATOM 731 CE2 TYR A 49 10.507 6.359 -13.687 1.00 0.00 C ATOM 732 CZ TYR A 49 11.111 5.181 -14.004 1.00 0.00 C ATOM 733 OH TYR A 49 11.077 4.762 -15.297 1.00 0.00 O ATOM 0 H TYR A 49 11.864 6.137 -7.663 1.00 0.00 H new ATOM 0 HA TYR A 49 13.409 6.512 -10.005 1.00 0.00 H new ATOM 0 HB2 TYR A 49 10.882 5.697 -9.263 1.00 0.00 H new ATOM 0 HB3 TYR A 49 10.511 7.330 -9.781 1.00 0.00 H new ATOM 0 HD1 TYR A 49 12.279 4.250 -10.968 1.00 0.00 H new ATOM 0 HD2 TYR A 49 10.073 7.733 -12.040 1.00 0.00 H new ATOM 0 HE1 TYR A 49 12.215 3.475 -13.378 1.00 0.00 H new ATOM 0 HE2 TYR A 49 10.012 6.948 -14.445 1.00 0.00 H new ATOM 0 HH TYR A 49 10.589 5.416 -15.840 1.00 0.00 H new ATOM 743 N ASP A 50 12.289 9.207 -8.591 1.00 0.00 N ATOM 744 CA ASP A 50 12.333 10.659 -8.625 1.00 0.00 C ATOM 745 C ASP A 50 13.677 11.138 -8.075 1.00 0.00 C ATOM 746 O ASP A 50 13.725 11.845 -7.071 1.00 0.00 O ATOM 747 CB ASP A 50 11.225 11.264 -7.760 1.00 0.00 C ATOM 748 CG ASP A 50 11.058 12.779 -7.890 1.00 0.00 C ATOM 749 OD1 ASP A 50 12.100 13.456 -8.026 1.00 0.00 O ATOM 750 OD2 ASP A 50 9.891 13.227 -7.849 1.00 0.00 O ATOM 0 H ASP A 50 11.917 8.812 -7.727 1.00 0.00 H new ATOM 0 HA ASP A 50 12.197 10.976 -9.659 1.00 0.00 H new ATOM 0 HB2 ASP A 50 10.280 10.786 -8.019 1.00 0.00 H new ATOM 0 HB3 ASP A 50 11.428 11.024 -6.716 1.00 0.00 H new ATOM 755 N THR A 51 14.738 10.733 -8.758 1.00 0.00 N ATOM 756 CA THR A 51 16.080 11.112 -8.351 1.00 0.00 C ATOM 757 C THR A 51 16.829 11.759 -9.517 1.00 0.00 C ATOM 758 O THR A 51 16.280 11.903 -10.609 1.00 0.00 O ATOM 759 CB THR A 51 16.776 9.866 -7.798 1.00 0.00 C ATOM 760 OG1 THR A 51 18.123 10.282 -7.597 1.00 0.00 O ATOM 761 CG2 THR A 51 16.883 8.747 -8.836 1.00 0.00 C ATOM 0 H THR A 51 14.695 10.146 -9.591 1.00 0.00 H new ATOM 0 HA THR A 51 16.056 11.865 -7.564 1.00 0.00 H new ATOM 0 HB THR A 51 16.232 9.502 -6.926 1.00 0.00 H new ATOM 0 HG1 THR A 51 18.646 9.535 -7.238 1.00 0.00 H new ATOM 0 HG21 THR A 51 17.384 7.886 -8.393 1.00 0.00 H new ATOM 0 HG22 THR A 51 15.884 8.457 -9.162 1.00 0.00 H new ATOM 0 HG23 THR A 51 17.457 9.099 -9.693 1.00 0.00 H new ATOM 769 N GLU A 52 18.071 12.132 -9.247 1.00 0.00 N ATOM 770 CA GLU A 52 18.901 12.761 -10.261 1.00 0.00 C ATOM 771 C GLU A 52 18.772 12.014 -11.591 1.00 0.00 C ATOM 772 O GLU A 52 18.331 12.586 -12.587 1.00 0.00 O ATOM 773 CB GLU A 52 20.362 12.828 -9.809 1.00 0.00 C ATOM 774 CG GLU A 52 20.672 14.176 -9.156 1.00 0.00 C ATOM 775 CD GLU A 52 21.388 13.984 -7.817 1.00 0.00 C ATOM 776 OE1 GLU A 52 20.722 13.489 -6.884 1.00 0.00 O ATOM 777 OE2 GLU A 52 22.586 14.338 -7.758 1.00 0.00 O ATOM 0 H GLU A 52 18.523 12.011 -8.341 1.00 0.00 H new ATOM 0 HA GLU A 52 18.552 13.784 -10.406 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.565 12.023 -9.103 1.00 0.00 H new ATOM 0 HB3 GLU A 52 21.019 12.675 -10.665 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.294 14.773 -9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 52 19.747 14.731 -9.002 1.00 0.00 H new ATOM 784 N ASN A 53 19.163 10.749 -11.562 1.00 0.00 N ATOM 785 CA ASN A 53 19.097 9.919 -12.753 1.00 0.00 C ATOM 786 C ASN A 53 18.006 8.862 -12.572 1.00 0.00 C ATOM 787 O ASN A 53 17.912 8.237 -11.517 1.00 0.00 O ATOM 788 CB ASN A 53 20.422 9.195 -12.995 1.00 0.00 C ATOM 789 CG ASN A 53 21.026 8.702 -11.678 1.00 0.00 C ATOM 790 OD1 ASN A 53 21.111 9.423 -10.697 1.00 0.00 O ATOM 791 ND2 ASN A 53 21.440 7.439 -11.711 1.00 0.00 N ATOM 0 H ASN A 53 19.526 10.278 -10.733 1.00 0.00 H new ATOM 0 HA ASN A 53 18.880 10.566 -13.603 1.00 0.00 H new ATOM 0 HB2 ASN A 53 20.262 8.350 -13.665 1.00 0.00 H new ATOM 0 HB3 ASN A 53 21.122 9.867 -13.491 1.00 0.00 H new ATOM 0 HD21 ASN A 53 21.859 7.018 -10.882 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.339 6.891 -12.566 1.00 0.00 H new ATOM 798 N GLU A 54 17.209 8.694 -13.617 1.00 0.00 N ATOM 799 CA GLU A 54 16.129 7.723 -13.587 1.00 0.00 C ATOM 800 C GLU A 54 16.674 6.315 -13.832 1.00 0.00 C ATOM 801 O GLU A 54 17.882 6.127 -13.962 1.00 0.00 O ATOM 802 CB GLU A 54 15.045 8.076 -14.607 1.00 0.00 C ATOM 803 CG GLU A 54 15.567 7.926 -16.037 1.00 0.00 C ATOM 804 CD GLU A 54 15.559 9.270 -16.769 1.00 0.00 C ATOM 805 OE1 GLU A 54 15.973 10.264 -16.135 1.00 0.00 O ATOM 806 OE2 GLU A 54 15.136 9.272 -17.946 1.00 0.00 O ATOM 0 H GLU A 54 17.290 9.215 -14.490 1.00 0.00 H new ATOM 0 HA GLU A 54 15.672 7.748 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 54 14.180 7.429 -14.462 1.00 0.00 H new ATOM 0 HB3 GLU A 54 14.708 9.100 -14.445 1.00 0.00 H new ATOM 0 HG2 GLU A 54 16.580 7.525 -16.018 1.00 0.00 H new ATOM 0 HG3 GLU A 54 14.951 7.209 -16.579 1.00 0.00 H new ATOM 813 N HIS A 55 15.756 5.361 -13.887 1.00 0.00 N ATOM 814 CA HIS A 55 16.130 3.975 -14.113 1.00 0.00 C ATOM 815 C HIS A 55 16.840 3.426 -12.875 1.00 0.00 C ATOM 816 O HIS A 55 16.262 2.649 -12.117 1.00 0.00 O ATOM 817 CB HIS A 55 16.967 3.840 -15.386 1.00 0.00 C ATOM 818 CG HIS A 55 16.298 3.040 -16.479 1.00 0.00 C ATOM 819 ND1 HIS A 55 16.906 1.963 -17.099 1.00 0.00 N ATOM 820 CD2 HIS A 55 15.069 3.172 -17.056 1.00 0.00 C ATOM 821 CE1 HIS A 55 16.072 1.476 -18.007 1.00 0.00 C ATOM 822 NE2 HIS A 55 14.934 2.227 -17.978 1.00 0.00 N ATOM 0 H HIS A 55 14.754 5.520 -13.779 1.00 0.00 H new ATOM 0 HA HIS A 55 15.235 3.374 -14.271 1.00 0.00 H new ATOM 0 HB2 HIS A 55 17.195 4.836 -15.766 1.00 0.00 H new ATOM 0 HB3 HIS A 55 17.918 3.369 -15.135 1.00 0.00 H new ATOM 0 HD2 HIS A 55 14.331 3.919 -16.805 1.00 0.00 H new ATOM 0 HE1 HIS A 55 16.260 0.633 -18.655 1.00 0.00 H new ATOM 0 HE2 HIS A 55 14.114 2.086 -18.568 1.00 0.00 H new ATOM 830 N ASP A 56 18.084 3.851 -12.708 1.00 0.00 N ATOM 831 CA ASP A 56 18.880 3.411 -11.575 1.00 0.00 C ATOM 832 C ASP A 56 18.978 4.548 -10.556 1.00 0.00 C ATOM 833 O ASP A 56 18.975 5.721 -10.926 1.00 0.00 O ATOM 834 CB ASP A 56 20.300 3.041 -12.010 1.00 0.00 C ATOM 835 CG ASP A 56 20.956 4.026 -12.979 1.00 0.00 C ATOM 836 OD1 ASP A 56 20.233 4.505 -13.878 1.00 0.00 O ATOM 837 OD2 ASP A 56 22.168 4.277 -12.797 1.00 0.00 O ATOM 0 H ASP A 56 18.560 4.496 -13.339 1.00 0.00 H new ATOM 0 HA ASP A 56 18.397 2.535 -11.142 1.00 0.00 H new ATOM 0 HB2 ASP A 56 20.926 2.957 -11.122 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.276 2.056 -12.477 1.00 0.00 H new ATOM 842 N VAL A 57 19.064 4.160 -9.291 1.00 0.00 N ATOM 843 CA VAL A 57 19.163 5.132 -8.216 1.00 0.00 C ATOM 844 C VAL A 57 20.629 5.283 -7.805 1.00 0.00 C ATOM 845 O VAL A 57 21.421 4.354 -7.963 1.00 0.00 O ATOM 846 CB VAL A 57 18.256 4.722 -7.054 1.00 0.00 C ATOM 847 CG1 VAL A 57 18.765 3.443 -6.385 1.00 0.00 C ATOM 848 CG2 VAL A 57 18.121 5.856 -6.037 1.00 0.00 C ATOM 0 H VAL A 57 19.067 3.186 -8.987 1.00 0.00 H new ATOM 0 HA VAL A 57 18.817 6.109 -8.552 1.00 0.00 H new ATOM 0 HB VAL A 57 17.265 4.516 -7.460 1.00 0.00 H new ATOM 0 HG11 VAL A 57 18.102 3.174 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL A 57 18.785 2.634 -7.115 1.00 0.00 H new ATOM 0 HG13 VAL A 57 19.771 3.609 -6.000 1.00 0.00 H new ATOM 0 HG21 VAL A 57 17.471 5.538 -5.222 1.00 0.00 H new ATOM 0 HG22 VAL A 57 19.104 6.108 -5.640 1.00 0.00 H new ATOM 0 HG23 VAL A 57 17.691 6.732 -6.523 1.00 0.00 H new ATOM 858 N CYS A 58 20.947 6.458 -7.283 1.00 0.00 N ATOM 859 CA CYS A 58 22.303 6.743 -6.848 1.00 0.00 C ATOM 860 C CYS A 58 22.276 7.023 -5.344 1.00 0.00 C ATOM 861 O CYS A 58 22.015 8.149 -4.923 1.00 0.00 O ATOM 862 CB CYS A 58 22.919 7.902 -7.634 1.00 0.00 C ATOM 863 SG CYS A 58 24.313 7.296 -8.654 1.00 0.00 S ATOM 0 H CYS A 58 20.287 7.225 -7.151 1.00 0.00 H new ATOM 0 HA CYS A 58 22.939 5.880 -7.045 1.00 0.00 H new ATOM 0 HB2 CYS A 58 22.164 8.362 -8.272 1.00 0.00 H new ATOM 0 HB3 CYS A 58 23.268 8.673 -6.947 1.00 0.00 H new ATOM 0 HG CYS A 58 24.827 8.288 -9.319 1.00 0.00 H new ATOM 869 N GLY A 59 22.551 5.980 -4.575 1.00 0.00 N ATOM 870 CA GLY A 59 22.562 6.101 -3.126 1.00 0.00 C ATOM 871 C GLY A 59 21.194 5.751 -2.537 1.00 0.00 C ATOM 872 O GLY A 59 20.756 4.604 -2.613 1.00 0.00 O ATOM 0 H GLY A 59 22.768 5.048 -4.927 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.322 5.441 -2.708 1.00 0.00 H new ATOM 0 HA3 GLY A 59 22.834 7.118 -2.844 1.00 0.00 H new ATOM 876 N TRP A 60 20.556 6.762 -1.965 1.00 0.00 N ATOM 877 CA TRP A 60 19.247 6.576 -1.363 1.00 0.00 C ATOM 878 C TRP A 60 19.323 5.365 -0.430 1.00 0.00 C ATOM 879 O TRP A 60 20.337 5.148 0.230 1.00 0.00 O ATOM 880 CB TRP A 60 18.165 6.439 -2.436 1.00 0.00 C ATOM 881 CG TRP A 60 17.181 7.608 -2.480 1.00 0.00 C ATOM 882 CD1 TRP A 60 16.794 8.321 -3.547 1.00 0.00 C ATOM 883 CD2 TRP A 60 16.468 8.176 -1.360 1.00 0.00 C ATOM 884 NE1 TRP A 60 15.889 9.302 -3.198 1.00 0.00 N ATOM 885 CE2 TRP A 60 15.684 9.211 -1.827 1.00 0.00 C ATOM 886 CE3 TRP A 60 16.486 7.825 0.001 1.00 0.00 C ATOM 887 CZ2 TRP A 60 14.860 9.981 -0.998 1.00 0.00 C ATOM 888 CZ3 TRP A 60 15.656 8.604 0.816 1.00 0.00 C ATOM 889 CH2 TRP A 60 14.861 9.650 0.362 1.00 0.00 C ATOM 0 H TRP A 60 20.922 7.712 -1.906 1.00 0.00 H new ATOM 0 HA TRP A 60 18.964 7.450 -0.776 1.00 0.00 H new ATOM 0 HB2 TRP A 60 18.644 6.344 -3.410 1.00 0.00 H new ATOM 0 HB3 TRP A 60 17.610 5.517 -2.262 1.00 0.00 H new ATOM 0 HD1 TRP A 60 17.146 8.149 -4.553 1.00 0.00 H new ATOM 0 HE1 TRP A 60 15.451 9.971 -3.831 1.00 0.00 H new ATOM 0 HE3 TRP A 60 17.092 7.019 0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 14.256 10.787 -1.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 15.632 8.376 1.871 1.00 0.00 H new ATOM 0 HH2 TRP A 60 14.247 10.205 1.056 1.00 0.00 H new TER 900 TRP A 60 ATOM 901 N MET B 201 -6.507 18.768 -11.370 1.00 0.00 N ATOM 902 CA MET B 201 -5.629 19.758 -10.768 1.00 0.00 C ATOM 903 C MET B 201 -4.515 19.084 -9.964 1.00 0.00 C ATOM 904 O MET B 201 -4.698 17.987 -9.440 1.00 0.00 O ATOM 905 CB MET B 201 -6.442 20.671 -9.849 1.00 0.00 C ATOM 906 CG MET B 201 -6.882 21.938 -10.584 1.00 0.00 C ATOM 907 SD MET B 201 -8.429 22.526 -9.917 1.00 0.00 S ATOM 908 CE MET B 201 -9.513 22.177 -11.292 1.00 0.00 C ATOM 0 HA MET B 201 -5.173 20.345 -11.565 1.00 0.00 H new ATOM 0 HB2 MET B 201 -7.318 20.136 -9.482 1.00 0.00 H new ATOM 0 HB3 MET B 201 -5.845 20.941 -8.978 1.00 0.00 H new ATOM 0 HG2 MET B 201 -6.118 22.709 -10.486 1.00 0.00 H new ATOM 0 HG3 MET B 201 -6.991 21.731 -11.649 1.00 0.00 H new ATOM 0 HE1 MET B 201 -10.528 22.485 -11.042 1.00 0.00 H new ATOM 0 HE2 MET B 201 -9.173 22.725 -12.171 1.00 0.00 H new ATOM 0 HE3 MET B 201 -9.500 21.108 -11.503 1.00 0.00 H new ATOM 918 N GLY B 202 -3.382 19.771 -9.895 1.00 0.00 N ATOM 919 CA GLY B 202 -2.238 19.254 -9.164 1.00 0.00 C ATOM 920 C GLY B 202 -2.590 19.010 -7.695 1.00 0.00 C ATOM 921 O GLY B 202 -2.585 19.940 -6.889 1.00 0.00 O ATOM 0 H GLY B 202 -3.233 20.680 -10.333 1.00 0.00 H new ATOM 0 HA2 GLY B 202 -1.901 18.323 -9.620 1.00 0.00 H new ATOM 0 HA3 GLY B 202 -1.410 19.960 -9.231 1.00 0.00 H new ATOM 925 N LYS B 203 -2.888 17.755 -7.390 1.00 0.00 N ATOM 926 CA LYS B 203 -3.241 17.378 -6.033 1.00 0.00 C ATOM 927 C LYS B 203 -2.256 16.321 -5.528 1.00 0.00 C ATOM 928 O LYS B 203 -1.617 15.634 -6.323 1.00 0.00 O ATOM 929 CB LYS B 203 -4.705 16.936 -5.963 1.00 0.00 C ATOM 930 CG LYS B 203 -5.335 17.338 -4.628 1.00 0.00 C ATOM 931 CD LYS B 203 -6.862 17.376 -4.732 1.00 0.00 C ATOM 932 CE LYS B 203 -7.383 18.811 -4.617 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.739 18.917 -5.199 1.00 0.00 N ATOM 0 H LYS B 203 -2.892 16.986 -8.061 1.00 0.00 H new ATOM 0 HA LYS B 203 -3.158 18.236 -5.366 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.264 17.386 -6.783 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.769 15.855 -6.089 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.037 16.631 -3.854 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.963 18.317 -4.326 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.176 16.946 -5.683 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.299 16.762 -3.945 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -7.405 19.113 -3.570 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.706 19.493 -5.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -9.078 19.896 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.708 18.648 -6.203 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -9.386 18.281 -4.690 1.00 0.00 H new ATOM 947 N ALA B 204 -2.163 16.227 -4.210 1.00 0.00 N ATOM 948 CA ALA B 204 -1.266 15.265 -3.591 1.00 0.00 C ATOM 949 C ALA B 204 -2.075 14.064 -3.096 1.00 0.00 C ATOM 950 O ALA B 204 -2.808 14.166 -2.113 1.00 0.00 O ATOM 951 CB ALA B 204 -0.487 15.947 -2.464 1.00 0.00 C ATOM 0 H ALA B 204 -2.693 16.800 -3.554 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.539 14.897 -4.315 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.186 15.227 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.093 16.775 -2.872 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -1.185 16.326 -1.717 1.00 0.00 H new ATOM 957 N THR B 205 -1.915 12.953 -3.801 1.00 0.00 N ATOM 958 CA THR B 205 -2.621 11.734 -3.446 1.00 0.00 C ATOM 959 C THR B 205 -1.777 10.507 -3.796 1.00 0.00 C ATOM 960 O THR B 205 -0.795 10.614 -4.531 1.00 0.00 O ATOM 961 CB THR B 205 -3.982 11.755 -4.146 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.661 11.938 -5.523 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.806 12.992 -3.788 1.00 0.00 C ATOM 0 H THR B 205 -1.307 12.872 -4.616 1.00 0.00 H new ATOM 0 HA THR B 205 -2.793 11.675 -2.371 1.00 0.00 H new ATOM 0 HB THR B 205 -4.541 10.858 -3.880 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.486 11.962 -6.051 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.761 12.957 -4.311 1.00 0.00 H new ATOM 0 HG22 THR B 205 -4.982 13.013 -2.713 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.263 13.889 -4.085 1.00 0.00 H new ATOM 971 N TYR B 206 -2.188 9.370 -3.254 1.00 0.00 N ATOM 972 CA TYR B 206 -1.481 8.126 -3.500 1.00 0.00 C ATOM 973 C TYR B 206 -2.461 6.990 -3.803 1.00 0.00 C ATOM 974 O TYR B 206 -3.561 6.951 -3.254 1.00 0.00 O ATOM 975 CB TYR B 206 -0.731 7.804 -2.205 1.00 0.00 C ATOM 976 CG TYR B 206 0.784 7.997 -2.299 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.331 9.251 -2.127 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.602 6.916 -2.558 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.757 9.433 -2.216 1.00 0.00 C ATOM 980 CE2 TYR B 206 3.028 7.098 -2.648 1.00 0.00 C ATOM 981 CZ TYR B 206 3.535 8.347 -2.472 1.00 0.00 C ATOM 982 OH TYR B 206 4.882 8.519 -2.555 1.00 0.00 O ATOM 0 H TYR B 206 -3.002 9.285 -2.645 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.814 8.226 -4.356 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.119 8.436 -1.406 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.939 6.772 -1.924 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.690 10.097 -1.926 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.173 5.934 -2.693 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.199 10.410 -2.083 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.680 6.261 -2.851 1.00 0.00 H new ATOM 0 HH TYR B 206 5.263 8.561 -1.653 1.00 0.00 H new ATOM 992 N THR B 207 -2.026 6.093 -4.676 1.00 0.00 N ATOM 993 CA THR B 207 -2.850 4.960 -5.058 1.00 0.00 C ATOM 994 C THR B 207 -2.184 3.648 -4.635 1.00 0.00 C ATOM 995 O THR B 207 -1.200 3.225 -5.240 1.00 0.00 O ATOM 996 CB THR B 207 -3.110 5.051 -6.563 1.00 0.00 C ATOM 997 OG1 THR B 207 -3.303 6.443 -6.798 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.443 4.417 -6.967 1.00 0.00 C ATOM 0 H THR B 207 -1.113 6.128 -5.130 1.00 0.00 H new ATOM 0 HA THR B 207 -3.811 4.980 -4.545 1.00 0.00 H new ATOM 0 HB THR B 207 -2.298 4.563 -7.102 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.262 6.637 -6.845 1.00 0.00 H new ATOM 0 HG21 THR B 207 -4.578 4.509 -8.045 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.443 3.363 -6.690 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.259 4.927 -6.455 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.747 3.043 -3.600 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.221 1.789 -3.089 1.00 0.00 C ATOM 1008 C VAL B 208 -3.143 0.644 -3.510 1.00 0.00 C ATOM 1009 O VAL B 208 -4.312 0.611 -3.127 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.033 1.879 -1.573 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.732 0.504 -0.975 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.938 2.886 -1.214 1.00 0.00 C ATOM 0 H VAL B 208 -3.563 3.398 -3.101 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.238 1.587 -3.514 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.968 2.234 -1.140 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.603 0.597 0.103 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.560 -0.173 -1.184 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.818 0.107 -1.417 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.825 2.930 -0.131 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.004 2.575 -1.665 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.212 3.871 -1.591 1.00 0.00 H new ATOM 1022 N THR B 209 -2.584 -0.267 -4.293 1.00 0.00 N ATOM 1023 CA THR B 209 -3.343 -1.411 -4.771 1.00 0.00 C ATOM 1024 C THR B 209 -2.861 -2.693 -4.088 1.00 0.00 C ATOM 1025 O THR B 209 -1.677 -2.831 -3.784 1.00 0.00 O ATOM 1026 CB THR B 209 -3.225 -1.453 -6.295 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.220 -0.082 -6.681 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.477 -2.024 -6.964 1.00 0.00 C ATOM 0 H THR B 209 -1.615 -0.236 -4.609 1.00 0.00 H new ATOM 0 HA THR B 209 -4.399 -1.321 -4.515 1.00 0.00 H new ATOM 0 HB THR B 209 -2.359 -2.052 -6.575 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.144 -0.017 -7.656 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.340 -2.031 -8.045 1.00 0.00 H new ATOM 0 HG22 THR B 209 -4.645 -3.042 -6.613 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.339 -1.406 -6.711 1.00 0.00 H new ATOM 1036 N VAL B 210 -3.803 -3.597 -3.868 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.490 -4.864 -3.227 1.00 0.00 C ATOM 1038 C VAL B 210 -4.273 -5.985 -3.912 1.00 0.00 C ATOM 1039 O VAL B 210 -5.501 -6.022 -3.839 1.00 0.00 O ATOM 1040 CB VAL B 210 -3.765 -4.772 -1.725 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.115 -6.144 -1.147 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.578 -4.153 -0.986 1.00 0.00 C ATOM 0 H VAL B 210 -4.784 -3.478 -4.122 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.431 -5.096 -3.336 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.625 -4.118 -1.582 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.306 -6.051 -0.078 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.006 -6.531 -1.642 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.283 -6.830 -1.308 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -2.801 -4.100 0.080 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.692 -4.768 -1.141 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.394 -3.149 -1.369 1.00 0.00 H new ATOM 1052 N THR B 211 -3.532 -6.871 -4.560 1.00 0.00 N ATOM 1053 CA THR B 211 -4.142 -7.990 -5.257 1.00 0.00 C ATOM 1054 C THR B 211 -3.542 -9.312 -4.773 1.00 0.00 C ATOM 1055 O THR B 211 -2.323 -9.445 -4.677 1.00 0.00 O ATOM 1056 CB THR B 211 -3.973 -7.760 -6.761 1.00 0.00 C ATOM 1057 OG1 THR B 211 -4.782 -6.620 -7.031 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.606 -8.873 -7.598 1.00 0.00 C ATOM 0 H THR B 211 -2.514 -6.837 -4.617 1.00 0.00 H new ATOM 0 HA THR B 211 -5.208 -8.056 -5.042 1.00 0.00 H new ATOM 0 HB THR B 211 -2.912 -7.685 -7.000 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.540 -6.246 -7.904 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.458 -8.661 -8.657 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.138 -9.826 -7.350 1.00 0.00 H new ATOM 0 HG23 THR B 211 -5.674 -8.926 -7.385 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.427 -10.254 -4.480 1.00 0.00 N ATOM 1067 CA ASN B 212 -3.999 -11.560 -4.008 1.00 0.00 C ATOM 1068 C ASN B 212 -3.952 -12.533 -5.187 1.00 0.00 C ATOM 1069 O ASN B 212 -4.988 -12.878 -5.755 1.00 0.00 O ATOM 1070 CB ASN B 212 -4.978 -12.119 -2.973 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.444 -11.024 -2.013 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -6.326 -11.438 -1.106 1.00 0.00 O flip ATOM 1073 ND2 ASN B 212 -5.032 -9.878 -2.089 1.00 0.00 N flip ATOM 0 H ASN B 212 -5.437 -10.139 -4.560 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.016 -11.448 -3.551 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -5.839 -12.554 -3.480 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.500 -12.921 -2.411 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -4.355 -9.626 -2.809 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -5.365 -9.172 -1.432 1.00 0.00 H new ATOM 1080 N ASN B 213 -2.740 -12.950 -5.522 1.00 0.00 N ATOM 1081 CA ASN B 213 -2.543 -13.876 -6.623 1.00 0.00 C ATOM 1082 C ASN B 213 -3.052 -15.261 -6.216 1.00 0.00 C ATOM 1083 O ASN B 213 -3.234 -16.133 -7.064 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.060 -14.003 -6.979 1.00 0.00 C ATOM 1085 CG ASN B 213 -0.789 -13.486 -8.393 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.013 -14.164 -9.383 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.296 -12.252 -8.432 1.00 0.00 N ATOM 0 H ASN B 213 -1.883 -12.663 -5.049 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.089 -13.494 -7.486 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.461 -13.442 -6.262 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -0.752 -15.046 -6.904 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.081 -11.817 -9.329 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.133 -11.740 -7.565 1.00 0.00 H new ATOM 1094 N SER B 214 -3.268 -15.418 -4.918 1.00 0.00 N ATOM 1095 CA SER B 214 -3.752 -16.682 -4.388 1.00 0.00 C ATOM 1096 C SER B 214 -5.273 -16.762 -4.535 1.00 0.00 C ATOM 1097 O SER B 214 -5.820 -17.833 -4.792 1.00 0.00 O ATOM 1098 CB SER B 214 -3.349 -16.855 -2.922 1.00 0.00 C ATOM 1099 OG SER B 214 -4.455 -16.673 -2.041 1.00 0.00 O ATOM 0 H SER B 214 -3.117 -14.692 -4.218 1.00 0.00 H new ATOM 0 HA SER B 214 -3.295 -17.490 -4.959 1.00 0.00 H new ATOM 0 HB2 SER B 214 -2.929 -17.850 -2.776 1.00 0.00 H new ATOM 0 HB3 SER B 214 -2.566 -16.139 -2.674 1.00 0.00 H new ATOM 0 HG SER B 214 -4.159 -16.793 -1.115 1.00 0.00 H new ATOM 1105 N ASN B 215 -5.913 -15.614 -4.364 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.360 -15.540 -4.474 1.00 0.00 C ATOM 1107 C ASN B 215 -7.732 -14.760 -5.735 1.00 0.00 C ATOM 1108 O ASN B 215 -8.912 -14.562 -6.022 1.00 0.00 O ATOM 1109 CB ASN B 215 -7.967 -14.815 -3.271 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.095 -15.639 -2.646 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -8.984 -16.836 -2.441 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.184 -14.932 -2.357 1.00 0.00 N ATOM 0 H ASN B 215 -5.456 -14.728 -4.150 1.00 0.00 H new ATOM 0 HA ASN B 215 -7.748 -16.558 -4.514 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.193 -14.628 -2.527 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.351 -13.844 -3.583 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -10.993 -15.390 -1.937 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.210 -13.932 -2.555 1.00 0.00 H new ATOM 1119 N GLY B 216 -6.704 -14.335 -6.456 1.00 0.00 N ATOM 1120 CA GLY B 216 -6.909 -13.580 -7.679 1.00 0.00 C ATOM 1121 C GLY B 216 -7.808 -12.366 -7.431 1.00 0.00 C ATOM 1122 O GLY B 216 -8.387 -11.816 -8.367 1.00 0.00 O ATOM 0 H GLY B 216 -5.727 -14.500 -6.216 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -5.947 -13.250 -8.072 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.360 -14.222 -8.436 1.00 0.00 H new ATOM 1126 N VAL B 217 -7.898 -11.986 -6.165 1.00 0.00 N ATOM 1127 CA VAL B 217 -8.716 -10.848 -5.783 1.00 0.00 C ATOM 1128 C VAL B 217 -7.870 -9.575 -5.836 1.00 0.00 C ATOM 1129 O VAL B 217 -6.864 -9.464 -5.135 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.343 -11.093 -4.408 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -9.885 -9.792 -3.813 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.438 -12.158 -4.487 1.00 0.00 C ATOM 0 H VAL B 217 -7.418 -12.446 -5.391 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.541 -10.718 -6.484 1.00 0.00 H new ATOM 0 HB VAL B 217 -8.562 -11.464 -3.745 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.325 -9.994 -2.836 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.071 -9.075 -3.703 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -10.646 -9.378 -4.475 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -10.867 -12.313 -3.497 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.218 -11.828 -5.173 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.010 -13.094 -4.848 1.00 0.00 H new ATOM 1142 N SER B 218 -8.308 -8.645 -6.672 1.00 0.00 N ATOM 1143 CA SER B 218 -7.603 -7.385 -6.825 1.00 0.00 C ATOM 1144 C SER B 218 -8.444 -6.241 -6.254 1.00 0.00 C ATOM 1145 O SER B 218 -9.658 -6.201 -6.451 1.00 0.00 O ATOM 1146 CB SER B 218 -7.268 -7.115 -8.293 1.00 0.00 C ATOM 1147 OG SER B 218 -8.101 -7.861 -9.176 1.00 0.00 O ATOM 0 H SER B 218 -9.143 -8.740 -7.250 1.00 0.00 H new ATOM 0 HA SER B 218 -6.666 -7.450 -6.272 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.380 -6.051 -8.501 1.00 0.00 H new ATOM 0 HB3 SER B 218 -6.224 -7.368 -8.479 1.00 0.00 H new ATOM 0 HG SER B 218 -7.857 -7.660 -10.104 1.00 0.00 H new ATOM 1153 N VAL B 219 -7.767 -5.339 -5.559 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.438 -4.199 -4.959 1.00 0.00 C ATOM 1155 C VAL B 219 -7.473 -3.011 -4.914 1.00 0.00 C ATOM 1156 O VAL B 219 -6.300 -3.173 -4.583 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.983 -4.578 -3.580 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.895 -3.480 -3.030 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -9.712 -5.923 -3.630 1.00 0.00 C ATOM 0 H VAL B 219 -6.760 -5.375 -5.398 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.296 -3.900 -5.562 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.136 -4.681 -2.901 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -10.269 -3.775 -2.049 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -9.332 -2.551 -2.940 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.735 -3.331 -3.708 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.090 -6.169 -2.638 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.545 -5.859 -4.330 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.021 -6.699 -3.958 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.005 -1.846 -5.251 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.207 -0.632 -5.253 1.00 0.00 C ATOM 1171 C ASP B 220 -7.782 0.354 -4.236 1.00 0.00 C ATOM 1172 O ASP B 220 -8.987 0.367 -3.991 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.229 0.040 -6.627 1.00 0.00 C ATOM 1174 CG ASP B 220 -7.635 -0.872 -7.787 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -8.746 -1.441 -7.700 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -6.827 -0.981 -8.734 1.00 0.00 O ATOM 0 H ASP B 220 -8.979 -1.717 -5.525 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.182 -0.903 -5.000 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -7.917 0.885 -6.591 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.238 0.445 -6.833 1.00 0.00 H new ATOM 1181 N TYR B 221 -6.894 1.157 -3.669 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.298 2.145 -2.683 1.00 0.00 C ATOM 1183 C TYR B 221 -6.576 3.474 -2.909 1.00 0.00 C ATOM 1184 O TYR B 221 -5.348 3.514 -2.973 1.00 0.00 O ATOM 1185 CB TYR B 221 -6.884 1.578 -1.324 1.00 0.00 C ATOM 1186 CG TYR B 221 -7.449 0.185 -1.032 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -7.064 -0.891 -1.806 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.342 0.006 0.005 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -7.596 -2.200 -1.531 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -8.872 -1.304 0.280 1.00 0.00 C ATOM 1191 CZ TYR B 221 -8.474 -2.343 -0.502 1.00 0.00 C ATOM 1192 OH TYR B 221 -8.974 -3.580 -0.244 1.00 0.00 O ATOM 0 H TYR B 221 -5.895 1.144 -3.874 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.369 2.336 -2.748 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -5.796 1.535 -1.276 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -7.211 2.263 -0.541 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -6.365 -0.751 -2.617 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -8.643 0.848 0.610 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -7.304 -3.051 -2.129 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.570 -1.458 1.089 1.00 0.00 H new ATOM 0 HH TYR B 221 -8.317 -4.098 0.266 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.367 4.530 -3.024 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.819 5.858 -3.241 1.00 0.00 C ATOM 1204 C GLU B 222 -6.815 6.651 -1.934 1.00 0.00 C ATOM 1205 O GLU B 222 -7.873 6.982 -1.400 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.595 6.600 -4.331 1.00 0.00 C ATOM 1207 CG GLU B 222 -7.037 8.010 -4.538 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.784 8.735 -5.658 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -7.896 8.134 -6.749 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -8.227 9.876 -5.400 1.00 0.00 O ATOM 0 H GLU B 222 -8.385 4.493 -2.971 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.789 5.753 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.539 6.042 -5.266 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.648 6.658 -4.057 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.122 8.578 -3.612 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.976 7.953 -4.781 1.00 0.00 H new ATOM 1217 N THR B 223 -5.613 6.934 -1.454 1.00 0.00 N ATOM 1218 CA THR B 223 -5.458 7.684 -0.218 1.00 0.00 C ATOM 1219 C THR B 223 -4.323 8.700 -0.351 1.00 0.00 C ATOM 1220 O THR B 223 -3.354 8.466 -1.072 1.00 0.00 O ATOM 1221 CB THR B 223 -5.245 6.681 0.919 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.606 7.405 2.092 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.768 6.340 1.131 1.00 0.00 C ATOM 0 H THR B 223 -4.737 6.658 -1.898 1.00 0.00 H new ATOM 0 HA THR B 223 -6.351 8.268 0.006 1.00 0.00 H new ATOM 0 HB THR B 223 -5.801 5.768 0.706 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.499 6.829 2.878 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.673 5.625 1.948 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.361 5.904 0.219 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.217 7.248 1.377 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.480 9.810 0.356 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.481 10.865 0.327 1.00 0.00 C ATOM 1233 C GLU B 224 -2.705 10.898 1.644 1.00 0.00 C ATOM 1234 O GLU B 224 -3.136 11.529 2.608 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.125 12.222 0.036 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.608 12.217 0.411 1.00 0.00 C ATOM 1237 CD GLU B 224 -6.261 13.561 0.082 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.715 14.256 -0.802 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -7.292 13.862 0.721 1.00 0.00 O ATOM 0 H GLU B 224 -5.285 10.002 0.953 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.780 10.652 -0.480 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.608 13.001 0.595 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -4.014 12.462 -1.022 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -6.120 11.419 -0.126 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.717 12.006 1.475 1.00 0.00 H new ATOM 1246 N THR B 225 -1.572 10.209 1.645 1.00 0.00 N ATOM 1247 CA THR B 225 -0.731 10.151 2.828 1.00 0.00 C ATOM 1248 C THR B 225 0.735 10.372 2.453 1.00 0.00 C ATOM 1249 O THR B 225 1.345 9.530 1.797 1.00 0.00 O ATOM 1250 CB THR B 225 -0.985 8.813 3.524 1.00 0.00 C ATOM 1251 OG1 THR B 225 -1.153 7.891 2.451 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.328 8.779 4.257 1.00 0.00 C ATOM 0 H THR B 225 -1.217 9.686 0.844 1.00 0.00 H new ATOM 0 HA THR B 225 -0.978 10.950 3.527 1.00 0.00 H new ATOM 0 HB THR B 225 -0.180 8.614 4.232 1.00 0.00 H new ATOM 0 HG1 THR B 225 -1.321 6.996 2.812 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.458 7.807 4.733 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.348 9.561 5.016 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.136 8.945 3.544 1.00 0.00 H new ATOM 1260 N PRO B 226 1.272 11.541 2.895 1.00 0.00 N ATOM 1261 CA PRO B 226 2.655 11.883 2.612 1.00 0.00 C ATOM 1262 C PRO B 226 3.611 11.072 3.488 1.00 0.00 C ATOM 1263 O PRO B 226 4.106 10.027 3.070 1.00 0.00 O ATOM 1264 CB PRO B 226 2.749 13.380 2.859 1.00 0.00 C ATOM 1265 CG PRO B 226 1.543 13.738 3.714 1.00 0.00 C ATOM 1266 CD PRO B 226 0.579 12.563 3.674 1.00 0.00 C ATOM 0 HA PRO B 226 2.947 11.642 1.590 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.678 13.634 3.369 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.739 13.932 1.919 1.00 0.00 H new ATOM 0 HG2 PRO B 226 1.850 13.946 4.739 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.061 14.640 3.337 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.347 12.207 4.678 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.366 12.842 3.209 1.00 0.00 H new ATOM 1274 N MET B 227 3.842 11.584 4.688 1.00 0.00 N ATOM 1275 CA MET B 227 4.731 10.919 5.627 1.00 0.00 C ATOM 1276 C MET B 227 4.070 9.672 6.218 1.00 0.00 C ATOM 1277 O MET B 227 4.754 8.718 6.585 1.00 0.00 O ATOM 1278 CB MET B 227 5.097 11.886 6.756 1.00 0.00 C ATOM 1279 CG MET B 227 5.801 13.128 6.206 1.00 0.00 C ATOM 1280 SD MET B 227 7.398 12.682 5.545 1.00 0.00 S ATOM 1281 CE MET B 227 7.101 12.954 3.806 1.00 0.00 C ATOM 0 H MET B 227 3.429 12.451 5.032 1.00 0.00 H new ATOM 0 HA MET B 227 5.630 10.613 5.093 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.196 12.182 7.293 1.00 0.00 H new ATOM 0 HB3 MET B 227 5.745 11.384 7.474 1.00 0.00 H new ATOM 0 HG2 MET B 227 5.191 13.587 5.428 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.919 13.869 6.997 1.00 0.00 H new ATOM 0 HE1 MET B 227 8.004 12.721 3.242 1.00 0.00 H new ATOM 0 HE2 MET B 227 6.288 12.310 3.471 1.00 0.00 H new ATOM 0 HE3 MET B 227 6.830 13.997 3.642 1.00 0.00 H new ATOM 1291 N THR B 228 2.748 9.720 6.291 1.00 0.00 N ATOM 1292 CA THR B 228 1.988 8.606 6.831 1.00 0.00 C ATOM 1293 C THR B 228 2.403 7.299 6.153 1.00 0.00 C ATOM 1294 O THR B 228 2.451 6.250 6.795 1.00 0.00 O ATOM 1295 CB THR B 228 0.501 8.927 6.672 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.474 9.991 5.725 1.00 0.00 O ATOM 1297 CG2 THR B 228 -0.105 9.540 7.937 1.00 0.00 C ATOM 0 H THR B 228 2.184 10.513 5.985 1.00 0.00 H new ATOM 0 HA THR B 228 2.193 8.465 7.892 1.00 0.00 H new ATOM 0 HB THR B 228 -0.040 8.017 6.414 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.430 10.366 5.681 1.00 0.00 H new ATOM 0 HG21 THR B 228 -1.162 9.749 7.770 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.000 8.841 8.767 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.414 10.468 8.177 1.00 0.00 H new ATOM 1305 N LEU B 229 2.691 7.404 4.864 1.00 0.00 N ATOM 1306 CA LEU B 229 3.101 6.243 4.092 1.00 0.00 C ATOM 1307 C LEU B 229 4.287 5.568 4.784 1.00 0.00 C ATOM 1308 O LEU B 229 4.385 4.342 4.800 1.00 0.00 O ATOM 1309 CB LEU B 229 3.377 6.636 2.639 1.00 0.00 C ATOM 1310 CG LEU B 229 2.147 6.823 1.749 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.496 7.628 0.495 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.508 5.476 1.407 1.00 0.00 C ATOM 0 H LEU B 229 2.649 8.275 4.335 1.00 0.00 H new ATOM 0 HA LEU B 229 2.296 5.509 4.051 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.947 7.565 2.637 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.012 5.872 2.191 1.00 0.00 H new ATOM 0 HG LEU B 229 1.406 7.398 2.305 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.605 7.747 -0.121 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.870 8.610 0.785 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.262 7.101 -0.074 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.636 5.637 0.774 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.231 4.854 0.878 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.202 4.975 2.325 1.00 0.00 H new ATOM 1324 N LEU B 230 5.158 6.398 5.338 1.00 0.00 N ATOM 1325 CA LEU B 230 6.334 5.897 6.029 1.00 0.00 C ATOM 1326 C LEU B 230 5.927 5.382 7.411 1.00 0.00 C ATOM 1327 O LEU B 230 6.586 4.508 7.971 1.00 0.00 O ATOM 1328 CB LEU B 230 7.428 6.966 6.069 1.00 0.00 C ATOM 1329 CG LEU B 230 7.756 7.639 4.735 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.893 8.651 4.897 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.065 6.598 3.657 1.00 0.00 C ATOM 0 H LEU B 230 5.073 7.414 5.323 1.00 0.00 H new ATOM 0 HA LEU B 230 6.764 5.054 5.488 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.129 7.737 6.779 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.339 6.511 6.458 1.00 0.00 H new ATOM 0 HG LEU B 230 6.876 8.192 4.406 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.107 9.115 3.934 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.598 9.418 5.612 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.785 8.141 5.260 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.295 7.103 2.719 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.921 5.998 3.965 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.199 5.950 3.518 1.00 0.00 H new ATOM 1343 N VAL B 231 4.841 5.946 7.922 1.00 0.00 N ATOM 1344 CA VAL B 231 4.339 5.555 9.228 1.00 0.00 C ATOM 1345 C VAL B 231 3.877 4.097 9.176 1.00 0.00 C ATOM 1346 O VAL B 231 3.182 3.695 8.244 1.00 0.00 O ATOM 1347 CB VAL B 231 3.235 6.516 9.673 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.712 6.144 11.062 1.00 0.00 C ATOM 1349 CG2 VAL B 231 3.725 7.966 9.641 1.00 0.00 C ATOM 0 H VAL B 231 4.296 6.670 7.455 1.00 0.00 H new ATOM 0 HA VAL B 231 5.129 5.620 9.976 1.00 0.00 H new ATOM 0 HB VAL B 231 2.408 6.426 8.969 1.00 0.00 H new ATOM 0 HG11 VAL B 231 1.928 6.843 11.355 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.307 5.132 11.039 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.528 6.192 11.783 1.00 0.00 H new ATOM 0 HG21 VAL B 231 2.921 8.629 9.962 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.577 8.077 10.312 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.026 8.226 8.626 1.00 0.00 H new ATOM 1359 N PRO B 232 4.292 3.325 10.215 1.00 0.00 N ATOM 1360 CA PRO B 232 3.929 1.920 10.296 1.00 0.00 C ATOM 1361 C PRO B 232 2.466 1.756 10.714 1.00 0.00 C ATOM 1362 O PRO B 232 1.747 0.930 10.156 1.00 0.00 O ATOM 1363 CB PRO B 232 4.903 1.318 11.295 1.00 0.00 C ATOM 1364 CG PRO B 232 5.471 2.490 12.082 1.00 0.00 C ATOM 1365 CD PRO B 232 5.117 3.767 11.336 1.00 0.00 C ATOM 0 HA PRO B 232 4.001 1.411 9.335 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.399 0.612 11.955 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.695 0.769 10.786 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.057 2.509 13.090 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.552 2.394 12.183 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.575 4.462 11.977 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.012 4.284 10.989 1.00 0.00 H new ATOM 1373 N GLU B 233 2.070 2.557 11.693 1.00 0.00 N ATOM 1374 CA GLU B 233 0.706 2.510 12.193 1.00 0.00 C ATOM 1375 C GLU B 233 -0.281 2.835 11.070 1.00 0.00 C ATOM 1376 O GLU B 233 -1.378 2.280 11.024 1.00 0.00 O ATOM 1377 CB GLU B 233 0.524 3.462 13.375 1.00 0.00 C ATOM 1378 CG GLU B 233 1.746 3.436 14.296 1.00 0.00 C ATOM 1379 CD GLU B 233 1.380 3.898 15.708 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.297 3.487 16.177 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.193 4.652 16.285 1.00 0.00 O ATOM 0 H GLU B 233 2.670 3.242 12.153 1.00 0.00 H new ATOM 0 HA GLU B 233 0.503 1.500 12.548 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.363 4.476 13.008 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.366 3.181 13.938 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.155 2.426 14.335 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.526 4.080 13.890 1.00 0.00 H new ATOM 1388 N VAL B 234 0.143 3.732 10.193 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.689 4.138 9.073 1.00 0.00 C ATOM 1390 C VAL B 234 -0.566 3.105 7.951 1.00 0.00 C ATOM 1391 O VAL B 234 -1.568 2.693 7.368 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.315 5.553 8.627 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -1.160 5.992 7.430 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.447 6.545 9.785 1.00 0.00 C ATOM 0 H VAL B 234 1.053 4.190 10.235 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.737 4.173 9.370 1.00 0.00 H new ATOM 0 HB VAL B 234 0.729 5.541 8.313 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.874 7.001 7.133 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.994 5.308 6.597 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.215 5.980 7.705 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.175 7.543 9.442 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.477 6.552 10.143 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.217 6.247 10.597 1.00 0.00 H new ATOM 1404 N ALA B 235 0.672 2.717 7.681 1.00 0.00 N ATOM 1405 CA ALA B 235 0.940 1.740 6.639 1.00 0.00 C ATOM 1406 C ALA B 235 0.350 0.389 7.048 1.00 0.00 C ATOM 1407 O ALA B 235 -0.250 -0.304 6.228 1.00 0.00 O ATOM 1408 CB ALA B 235 2.447 1.666 6.385 1.00 0.00 C ATOM 0 H ALA B 235 1.501 3.062 8.166 1.00 0.00 H new ATOM 0 HA ALA B 235 0.466 2.036 5.703 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.649 0.933 5.604 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.811 2.643 6.069 1.00 0.00 H new ATOM 0 HB3 ALA B 235 2.956 1.368 7.302 1.00 0.00 H new ATOM 1414 N ALA B 236 0.541 0.056 8.316 1.00 0.00 N ATOM 1415 CA ALA B 236 0.035 -1.200 8.844 1.00 0.00 C ATOM 1416 C ALA B 236 -1.480 -1.263 8.634 1.00 0.00 C ATOM 1417 O ALA B 236 -2.002 -2.266 8.150 1.00 0.00 O ATOM 1418 CB ALA B 236 0.426 -1.329 10.318 1.00 0.00 C ATOM 0 H ALA B 236 1.039 0.634 8.993 1.00 0.00 H new ATOM 0 HA ALA B 236 0.476 -2.045 8.315 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.046 -2.271 10.714 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.512 -1.308 10.410 1.00 0.00 H new ATOM 0 HB3 ALA B 236 -0.002 -0.500 10.882 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.142 -0.179 9.010 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.587 -0.098 8.869 1.00 0.00 C ATOM 1426 C GLU B 237 -3.976 -0.088 7.389 1.00 0.00 C ATOM 1427 O GLU B 237 -5.003 -0.648 7.010 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.140 1.131 9.590 1.00 0.00 C ATOM 1429 CG GLU B 237 -5.613 1.354 9.245 1.00 0.00 C ATOM 1430 CD GLU B 237 -6.446 1.574 10.509 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -6.098 2.509 11.261 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -7.412 0.802 10.694 1.00 0.00 O ATOM 0 H GLU B 237 -1.705 0.651 9.412 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.028 -0.980 9.334 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -4.030 1.005 10.667 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -3.561 2.011 9.312 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -5.709 2.218 8.587 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -5.996 0.493 8.698 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.134 0.555 6.593 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.377 0.645 5.164 1.00 0.00 C ATOM 1441 C VAL B 238 -3.276 -0.750 4.544 1.00 0.00 C ATOM 1442 O VAL B 238 -4.205 -1.208 3.882 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.413 1.652 4.531 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -2.008 1.213 3.124 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -3.021 3.056 4.515 1.00 0.00 C ATOM 0 H VAL B 238 -2.283 1.018 6.911 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.384 1.014 4.971 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.512 1.684 5.143 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.323 1.946 2.697 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.516 0.242 3.173 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.896 1.138 2.497 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.316 3.752 4.060 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.945 3.046 3.937 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.235 3.371 5.536 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.137 -1.386 4.780 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.902 -2.719 4.253 1.00 0.00 C ATOM 1457 C ILE B 239 -3.007 -3.658 4.741 1.00 0.00 C ATOM 1458 O ILE B 239 -3.625 -4.361 3.945 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.492 -3.194 4.607 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.567 -2.317 3.935 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.309 -4.674 4.267 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.669 -2.628 2.441 1.00 0.00 C ATOM 0 H ILE B 239 -1.368 -1.002 5.329 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.947 -2.711 3.164 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.359 -3.093 5.684 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.316 -1.266 4.075 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.534 -2.480 4.411 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.702 -4.985 4.529 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.029 -5.268 4.830 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.470 -4.825 3.200 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.429 -1.991 1.988 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.944 -3.674 2.305 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.293 -2.441 1.964 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.222 -3.638 6.049 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.241 -4.479 6.652 1.00 0.00 C ATOM 1476 C LYS B 240 -5.615 -4.074 6.114 1.00 0.00 C ATOM 1477 O LYS B 240 -6.430 -4.930 5.775 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.140 -4.433 8.178 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.525 -4.522 8.823 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.071 -3.130 9.146 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.560 -3.192 9.491 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.779 -4.017 10.700 1.00 0.00 N ATOM 0 H LYS B 240 -2.708 -3.053 6.707 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.085 -5.522 6.377 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.518 -5.256 8.530 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.650 -3.509 8.486 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.210 -5.038 8.151 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.467 -5.115 9.736 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.518 -2.703 9.983 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.919 -2.469 8.293 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -7.943 -2.185 9.657 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -8.116 -3.611 8.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.768 -3.925 11.008 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.575 -5.013 10.482 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.148 -3.693 11.460 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.828 -2.768 6.053 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.090 -2.238 5.562 1.00 0.00 C ATOM 1498 C ASP B 241 -7.339 -2.759 4.146 1.00 0.00 C ATOM 1499 O ASP B 241 -8.449 -3.179 3.821 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.060 -0.709 5.506 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.162 -0.072 4.658 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.342 -0.370 4.943 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -7.800 0.698 3.742 1.00 0.00 O ATOM 0 H ASP B 241 -5.149 -2.061 6.335 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.879 -2.558 6.242 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.134 -0.322 6.522 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.093 -0.394 5.115 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.288 -2.714 3.339 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.379 -3.176 1.964 1.00 0.00 C ATOM 1510 C LEU B 242 -6.797 -4.647 1.952 1.00 0.00 C ATOM 1511 O LEU B 242 -7.760 -5.017 1.283 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.072 -2.900 1.219 1.00 0.00 C ATOM 1513 CG LEU B 242 -4.935 -1.510 0.596 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -3.931 -0.656 1.373 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -4.577 -1.607 -0.889 1.00 0.00 C ATOM 0 H LEU B 242 -5.369 -2.365 3.611 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.148 -2.622 1.425 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.244 -3.049 1.912 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -4.964 -3.643 0.429 1.00 0.00 H new ATOM 0 HG LEU B 242 -5.901 -1.010 0.662 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -3.853 0.327 0.908 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.269 -0.545 2.403 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -2.955 -1.141 1.361 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -4.486 -0.605 -1.307 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -3.630 -2.135 -1.001 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -5.360 -2.151 -1.417 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.051 -5.446 2.701 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.331 -6.870 2.784 1.00 0.00 C ATOM 1529 C VAL B 243 -7.701 -7.079 3.433 1.00 0.00 C ATOM 1530 O VAL B 243 -8.503 -7.879 2.955 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.201 -7.583 3.528 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.732 -8.791 4.303 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -4.085 -7.996 2.567 1.00 0.00 C ATOM 0 H VAL B 243 -5.253 -5.135 3.256 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.373 -7.310 1.788 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.780 -6.881 4.248 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.908 -9.280 4.823 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.474 -8.460 5.029 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -6.192 -9.495 3.609 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.295 -8.501 3.123 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.487 -8.672 1.812 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.677 -7.110 2.080 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.926 -6.344 4.514 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.183 -6.439 5.234 1.00 0.00 C ATOM 1545 C ASN B 244 -10.339 -6.159 4.272 1.00 0.00 C ATOM 1546 O ASN B 244 -11.387 -6.801 4.349 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.250 -5.411 6.364 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.005 -6.073 7.722 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.807 -6.636 7.843 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -9.851 -6.071 8.603 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.258 -5.681 4.907 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.255 -7.442 5.654 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.507 -4.631 6.196 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.226 -4.926 6.362 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.752 -5.620 8.444 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.657 -6.521 9.498 1.00 0.00 H new ATOM 1557 N THR B 245 -10.111 -5.199 3.386 1.00 0.00 N ATOM 1558 CA THR B 245 -11.121 -4.827 2.410 1.00 0.00 C ATOM 1559 C THR B 245 -11.221 -5.890 1.314 1.00 0.00 C ATOM 1560 O THR B 245 -12.310 -6.176 0.821 1.00 0.00 O ATOM 1561 CB THR B 245 -10.772 -3.435 1.877 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.340 -2.545 2.834 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.508 -3.104 0.577 1.00 0.00 C ATOM 0 H THR B 245 -9.242 -4.668 3.324 1.00 0.00 H new ATOM 0 HA THR B 245 -12.111 -4.779 2.863 1.00 0.00 H new ATOM 0 HB THR B 245 -9.697 -3.369 1.712 1.00 0.00 H new ATOM 0 HG1 THR B 245 -11.159 -1.619 2.567 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.225 -2.106 0.242 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.241 -3.833 -0.188 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.584 -3.137 0.749 1.00 0.00 H new ATOM 1571 N VAL B 246 -10.069 -6.444 0.965 1.00 0.00 N ATOM 1572 CA VAL B 246 -10.014 -7.469 -0.064 1.00 0.00 C ATOM 1573 C VAL B 246 -10.852 -8.672 0.375 1.00 0.00 C ATOM 1574 O VAL B 246 -11.636 -9.206 -0.408 1.00 0.00 O ATOM 1575 CB VAL B 246 -8.558 -7.832 -0.362 1.00 0.00 C ATOM 1576 CG1 VAL B 246 -8.447 -9.265 -0.888 1.00 0.00 C ATOM 1577 CG2 VAL B 246 -7.937 -6.838 -1.345 1.00 0.00 C ATOM 0 H VAL B 246 -9.167 -6.203 1.376 1.00 0.00 H new ATOM 0 HA VAL B 246 -10.441 -7.098 -0.996 1.00 0.00 H new ATOM 0 HB VAL B 246 -7.999 -7.774 0.572 1.00 0.00 H new ATOM 0 HG11 VAL B 246 -7.402 -9.498 -1.092 1.00 0.00 H new ATOM 0 HG12 VAL B 246 -8.834 -9.958 -0.141 1.00 0.00 H new ATOM 0 HG13 VAL B 246 -9.026 -9.361 -1.806 1.00 0.00 H new ATOM 0 HG21 VAL B 246 -6.902 -7.118 -1.540 1.00 0.00 H new ATOM 0 HG22 VAL B 246 -8.499 -6.851 -2.279 1.00 0.00 H new ATOM 0 HG23 VAL B 246 -7.967 -5.836 -0.917 1.00 0.00 H new ATOM 1587 N ARG B 247 -10.658 -9.063 1.626 1.00 0.00 N ATOM 1588 CA ARG B 247 -11.387 -10.192 2.178 1.00 0.00 C ATOM 1589 C ARG B 247 -12.842 -9.806 2.445 1.00 0.00 C ATOM 1590 O ARG B 247 -13.736 -10.648 2.364 1.00 0.00 O ATOM 1591 CB ARG B 247 -10.747 -10.675 3.482 1.00 0.00 C ATOM 1592 CG ARG B 247 -10.811 -9.590 4.559 1.00 0.00 C ATOM 1593 CD ARG B 247 -10.394 -10.146 5.922 1.00 0.00 C ATOM 1594 NE ARG B 247 -11.569 -10.724 6.613 1.00 0.00 N ATOM 1595 CZ ARG B 247 -12.560 -9.998 7.147 1.00 0.00 C ATOM 1596 NH1 ARG B 247 -12.523 -8.660 7.074 1.00 0.00 N ATOM 1597 NH2 ARG B 247 -13.586 -10.607 7.755 1.00 0.00 N ATOM 0 H ARG B 247 -10.007 -8.618 2.273 1.00 0.00 H new ATOM 0 HA ARG B 247 -11.351 -11.000 1.447 1.00 0.00 H new ATOM 0 HB2 ARG B 247 -11.259 -11.571 3.833 1.00 0.00 H new ATOM 0 HB3 ARG B 247 -9.708 -10.952 3.301 1.00 0.00 H new ATOM 0 HG2 ARG B 247 -10.158 -8.761 4.285 1.00 0.00 H new ATOM 0 HG3 ARG B 247 -11.824 -9.191 4.619 1.00 0.00 H new ATOM 0 HD2 ARG B 247 -9.626 -10.908 5.794 1.00 0.00 H new ATOM 0 HD3 ARG B 247 -9.958 -9.353 6.530 1.00 0.00 H new ATOM 0 HE ARG B 247 -11.628 -11.740 6.687 1.00 0.00 H new ATOM 0 HH11 ARG B 247 -11.741 -8.196 6.612 1.00 0.00 H new ATOM 0 HH12 ARG B 247 -13.277 -8.106 7.480 1.00 0.00 H new ATOM 0 HH21 ARG B 247 -13.614 -11.625 7.812 1.00 0.00 H new ATOM 0 HH22 ARG B 247 -14.340 -10.053 8.161 1.00 0.00 H new ATOM 1611 N SER B 248 -13.036 -8.533 2.757 1.00 0.00 N ATOM 1612 CA SER B 248 -14.369 -8.025 3.036 1.00 0.00 C ATOM 1613 C SER B 248 -15.308 -8.353 1.874 1.00 0.00 C ATOM 1614 O SER B 248 -16.471 -8.694 2.088 1.00 0.00 O ATOM 1615 CB SER B 248 -14.342 -6.516 3.288 1.00 0.00 C ATOM 1616 OG SER B 248 -15.566 -6.045 3.843 1.00 0.00 O ATOM 0 H SER B 248 -12.292 -7.838 2.823 1.00 0.00 H new ATOM 0 HA SER B 248 -14.737 -8.510 3.940 1.00 0.00 H new ATOM 0 HB2 SER B 248 -13.521 -6.276 3.964 1.00 0.00 H new ATOM 0 HB3 SER B 248 -14.145 -5.996 2.351 1.00 0.00 H new ATOM 0 HG SER B 248 -15.508 -5.078 3.990 1.00 0.00 H new ATOM 1622 N TYR B 249 -14.769 -8.239 0.669 1.00 0.00 N ATOM 1623 CA TYR B 249 -15.544 -8.519 -0.527 1.00 0.00 C ATOM 1624 C TYR B 249 -15.918 -10.001 -0.604 1.00 0.00 C ATOM 1625 O TYR B 249 -16.912 -10.363 -1.231 1.00 0.00 O ATOM 1626 CB TYR B 249 -14.636 -8.173 -1.709 1.00 0.00 C ATOM 1627 CG TYR B 249 -15.371 -7.550 -2.897 1.00 0.00 C ATOM 1628 CD1 TYR B 249 -16.053 -8.356 -3.786 1.00 0.00 C ATOM 1629 CD2 TYR B 249 -15.353 -6.182 -3.081 1.00 0.00 C ATOM 1630 CE1 TYR B 249 -16.745 -7.770 -4.905 1.00 0.00 C ATOM 1631 CE2 TYR B 249 -16.045 -5.596 -4.199 1.00 0.00 C ATOM 1632 CZ TYR B 249 -16.707 -6.419 -5.056 1.00 0.00 C ATOM 1633 OH TYR B 249 -17.361 -5.866 -6.112 1.00 0.00 O ATOM 0 H TYR B 249 -13.804 -7.956 0.496 1.00 0.00 H new ATOM 0 HA TYR B 249 -16.469 -7.943 -0.528 1.00 0.00 H new ATOM 0 HB2 TYR B 249 -13.863 -7.483 -1.370 1.00 0.00 H new ATOM 0 HB3 TYR B 249 -14.130 -9.079 -2.043 1.00 0.00 H new ATOM 0 HD1 TYR B 249 -16.068 -9.426 -3.642 1.00 0.00 H new ATOM 0 HD2 TYR B 249 -14.819 -5.551 -2.386 1.00 0.00 H new ATOM 0 HE1 TYR B 249 -17.282 -8.389 -5.608 1.00 0.00 H new ATOM 0 HE2 TYR B 249 -16.039 -4.527 -4.354 1.00 0.00 H new ATOM 0 HH TYR B 249 -17.249 -4.893 -6.093 1.00 0.00 H new ATOM 1643 N ASP B 250 -15.100 -10.819 0.042 1.00 0.00 N ATOM 1644 CA ASP B 250 -15.333 -12.253 0.056 1.00 0.00 C ATOM 1645 C ASP B 250 -16.647 -12.545 0.781 1.00 0.00 C ATOM 1646 O ASP B 250 -17.381 -13.457 0.400 1.00 0.00 O ATOM 1647 CB ASP B 250 -14.211 -12.985 0.794 1.00 0.00 C ATOM 1648 CG ASP B 250 -13.878 -14.376 0.249 1.00 0.00 C ATOM 1649 OD1 ASP B 250 -14.837 -15.148 0.038 1.00 0.00 O ATOM 1650 OD2 ASP B 250 -12.670 -14.634 0.054 1.00 0.00 O ATOM 0 H ASP B 250 -14.275 -10.516 0.560 1.00 0.00 H new ATOM 0 HA ASP B 250 -15.371 -12.599 -0.977 1.00 0.00 H new ATOM 0 HB2 ASP B 250 -13.311 -12.371 0.756 1.00 0.00 H new ATOM 0 HB3 ASP B 250 -14.488 -13.079 1.844 1.00 0.00 H new ATOM 1655 N THR B 251 -16.906 -11.756 1.813 1.00 0.00 N ATOM 1656 CA THR B 251 -18.119 -11.918 2.596 1.00 0.00 C ATOM 1657 C THR B 251 -19.127 -10.821 2.249 1.00 0.00 C ATOM 1658 O THR B 251 -18.805 -9.884 1.522 1.00 0.00 O ATOM 1659 CB THR B 251 -17.729 -11.942 4.074 1.00 0.00 C ATOM 1660 OG1 THR B 251 -18.922 -11.565 4.755 1.00 0.00 O ATOM 1661 CG2 THR B 251 -16.731 -10.838 4.434 1.00 0.00 C ATOM 0 H THR B 251 -16.295 -11.001 2.126 1.00 0.00 H new ATOM 0 HA THR B 251 -18.618 -12.859 2.363 1.00 0.00 H new ATOM 0 HB THR B 251 -17.301 -12.914 4.320 1.00 0.00 H new ATOM 0 HG1 THR B 251 -18.809 -11.710 5.718 1.00 0.00 H new ATOM 0 HG21 THR B 251 -16.487 -10.900 5.495 1.00 0.00 H new ATOM 0 HG22 THR B 251 -15.822 -10.963 3.845 1.00 0.00 H new ATOM 0 HG23 THR B 251 -17.172 -9.865 4.219 1.00 0.00 H new ATOM 1669 N GLU B 252 -20.329 -10.976 2.788 1.00 0.00 N ATOM 1670 CA GLU B 252 -21.387 -10.010 2.545 1.00 0.00 C ATOM 1671 C GLU B 252 -21.532 -9.071 3.745 1.00 0.00 C ATOM 1672 O GLU B 252 -22.596 -8.490 3.957 1.00 0.00 O ATOM 1673 CB GLU B 252 -22.710 -10.713 2.235 1.00 0.00 C ATOM 1674 CG GLU B 252 -23.211 -11.501 3.446 1.00 0.00 C ATOM 1675 CD GLU B 252 -24.532 -12.205 3.134 1.00 0.00 C ATOM 1676 OE1 GLU B 252 -24.577 -12.891 2.090 1.00 0.00 O ATOM 1677 OE2 GLU B 252 -25.467 -12.043 3.948 1.00 0.00 O ATOM 0 H GLU B 252 -20.593 -11.755 3.391 1.00 0.00 H new ATOM 0 HA GLU B 252 -21.117 -9.415 1.673 1.00 0.00 H new ATOM 0 HB2 GLU B 252 -23.457 -9.976 1.942 1.00 0.00 H new ATOM 0 HB3 GLU B 252 -22.578 -11.386 1.388 1.00 0.00 H new ATOM 0 HG2 GLU B 252 -22.463 -12.237 3.740 1.00 0.00 H new ATOM 0 HG3 GLU B 252 -23.345 -10.827 4.292 1.00 0.00 H new ATOM 1684 N ASN B 253 -20.449 -8.950 4.497 1.00 0.00 N ATOM 1685 CA ASN B 253 -20.444 -8.092 5.669 1.00 0.00 C ATOM 1686 C ASN B 253 -19.798 -6.751 5.311 1.00 0.00 C ATOM 1687 O ASN B 253 -19.083 -6.649 4.315 1.00 0.00 O ATOM 1688 CB ASN B 253 -19.634 -8.718 6.806 1.00 0.00 C ATOM 1689 CG ASN B 253 -20.395 -8.635 8.131 1.00 0.00 C ATOM 1690 OD1 ASN B 253 -21.521 -8.169 8.203 1.00 0.00 O ATOM 1691 ND2 ASN B 253 -19.720 -9.112 9.173 1.00 0.00 N ATOM 0 H ASN B 253 -19.568 -9.432 4.318 1.00 0.00 H new ATOM 0 HA ASN B 253 -21.476 -7.957 5.993 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -19.417 -9.760 6.572 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -18.676 -8.206 6.900 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -20.142 -9.102 10.102 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -18.781 -9.488 9.043 1.00 0.00 H new ATOM 1698 N GLU B 254 -20.073 -5.758 6.143 1.00 0.00 N ATOM 1699 CA GLU B 254 -19.527 -4.429 5.927 1.00 0.00 C ATOM 1700 C GLU B 254 -19.785 -3.544 7.149 1.00 0.00 C ATOM 1701 O GLU B 254 -20.677 -3.827 7.947 1.00 0.00 O ATOM 1702 CB GLU B 254 -20.109 -3.796 4.660 1.00 0.00 C ATOM 1703 CG GLU B 254 -19.026 -3.611 3.595 1.00 0.00 C ATOM 1704 CD GLU B 254 -18.599 -2.144 3.498 1.00 0.00 C ATOM 1705 OE1 GLU B 254 -18.061 -1.642 4.509 1.00 0.00 O ATOM 1706 OE2 GLU B 254 -18.822 -1.558 2.416 1.00 0.00 O ATOM 0 H GLU B 254 -20.667 -5.847 6.968 1.00 0.00 H new ATOM 0 HA GLU B 254 -18.450 -4.519 5.788 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -20.907 -4.426 4.267 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -20.555 -2.831 4.902 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -18.162 -4.230 3.838 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -19.399 -3.950 2.629 1.00 0.00 H new ATOM 1713 N HIS B 255 -18.987 -2.491 7.256 1.00 0.00 N ATOM 1714 CA HIS B 255 -19.118 -1.564 8.367 1.00 0.00 C ATOM 1715 C HIS B 255 -18.223 -0.346 8.127 1.00 0.00 C ATOM 1716 O HIS B 255 -18.714 0.774 8.000 1.00 0.00 O ATOM 1717 CB HIS B 255 -18.825 -2.263 9.696 1.00 0.00 C ATOM 1718 CG HIS B 255 -19.068 -1.400 10.911 1.00 0.00 C ATOM 1719 ND1 HIS B 255 -19.186 -0.046 11.034 1.00 0.00 N flip ATOM 1720 CD2 HIS B 255 -19.217 -1.921 12.183 1.00 0.00 C flip ATOM 1721 CE1 HIS B 255 -19.397 0.242 12.311 1.00 0.00 C flip ATOM 1722 NE2 HIS B 255 -19.416 -0.919 13.026 1.00 0.00 N flip ATOM 0 H HIS B 255 -18.248 -2.260 6.592 1.00 0.00 H new ATOM 0 HA HIS B 255 -20.147 -1.209 8.430 1.00 0.00 H new ATOM 0 HB2 HIS B 255 -19.444 -3.157 9.769 1.00 0.00 H new ATOM 0 HB3 HIS B 255 -17.786 -2.593 9.700 1.00 0.00 H new ATOM 0 HD2 HIS B 255 -19.178 -2.968 12.445 1.00 0.00 H new ATOM 0 HE1 HIS B 255 -19.532 1.233 12.718 1.00 0.00 H new ATOM 0 HE2 HIS B 255 -19.558 -1.001 14.033 1.00 0.00 H new ATOM 1730 N ASP B 256 -16.925 -0.608 8.071 1.00 0.00 N ATOM 1731 CA ASP B 256 -15.957 0.452 7.849 1.00 0.00 C ATOM 1732 C ASP B 256 -15.954 0.832 6.367 1.00 0.00 C ATOM 1733 O ASP B 256 -16.287 0.012 5.513 1.00 0.00 O ATOM 1734 CB ASP B 256 -14.545 -0.005 8.222 1.00 0.00 C ATOM 1735 CG ASP B 256 -13.913 -1.008 7.255 1.00 0.00 C ATOM 1736 OD1 ASP B 256 -13.668 -0.603 6.098 1.00 0.00 O ATOM 1737 OD2 ASP B 256 -13.688 -2.155 7.695 1.00 0.00 O ATOM 0 H ASP B 256 -16.522 -1.539 8.176 1.00 0.00 H new ATOM 0 HA ASP B 256 -16.238 1.301 8.472 1.00 0.00 H new ATOM 0 HB2 ASP B 256 -13.900 0.872 8.285 1.00 0.00 H new ATOM 0 HB3 ASP B 256 -14.574 -0.451 9.216 1.00 0.00 H new ATOM 1742 N VAL B 257 -15.576 2.075 6.108 1.00 0.00 N ATOM 1743 CA VAL B 257 -15.526 2.573 4.745 1.00 0.00 C ATOM 1744 C VAL B 257 -14.083 2.521 4.239 1.00 0.00 C ATOM 1745 O VAL B 257 -13.143 2.524 5.033 1.00 0.00 O ATOM 1746 CB VAL B 257 -16.132 3.977 4.678 1.00 0.00 C ATOM 1747 CG1 VAL B 257 -15.094 5.040 5.042 1.00 0.00 C ATOM 1748 CG2 VAL B 257 -16.735 4.249 3.298 1.00 0.00 C ATOM 0 H VAL B 257 -15.301 2.752 6.820 1.00 0.00 H new ATOM 0 HA VAL B 257 -16.124 1.943 4.087 1.00 0.00 H new ATOM 0 HB VAL B 257 -16.937 4.030 5.411 1.00 0.00 H new ATOM 0 HG11 VAL B 257 -15.550 6.028 4.987 1.00 0.00 H new ATOM 0 HG12 VAL B 257 -14.732 4.864 6.055 1.00 0.00 H new ATOM 0 HG13 VAL B 257 -14.258 4.987 4.344 1.00 0.00 H new ATOM 0 HG21 VAL B 257 -17.159 5.253 3.278 1.00 0.00 H new ATOM 0 HG22 VAL B 257 -15.957 4.168 2.539 1.00 0.00 H new ATOM 0 HG23 VAL B 257 -17.519 3.520 3.094 1.00 0.00 H new ATOM 1758 N CYS B 258 -13.952 2.475 2.921 1.00 0.00 N ATOM 1759 CA CYS B 258 -12.640 2.423 2.302 1.00 0.00 C ATOM 1760 C CYS B 258 -12.313 3.811 1.749 1.00 0.00 C ATOM 1761 O CYS B 258 -11.191 4.294 1.897 1.00 0.00 O ATOM 1762 CB CYS B 258 -12.570 1.346 1.216 1.00 0.00 C ATOM 1763 SG CYS B 258 -13.557 1.857 -0.237 1.00 0.00 S ATOM 0 H CYS B 258 -14.733 2.473 2.265 1.00 0.00 H new ATOM 0 HA CYS B 258 -11.895 2.146 3.047 1.00 0.00 H new ATOM 0 HB2 CYS B 258 -11.533 1.181 0.922 1.00 0.00 H new ATOM 0 HB3 CYS B 258 -12.945 0.400 1.606 1.00 0.00 H new ATOM 0 HG CYS B 258 -13.489 0.937 -1.153 1.00 0.00 H new ATOM 1769 N GLY B 259 -13.313 4.414 1.124 1.00 0.00 N ATOM 1770 CA GLY B 259 -13.146 5.738 0.549 1.00 0.00 C ATOM 1771 C GLY B 259 -14.494 6.446 0.399 1.00 0.00 C ATOM 1772 O GLY B 259 -15.470 5.842 -0.046 1.00 0.00 O ATOM 0 H GLY B 259 -14.242 4.010 1.003 1.00 0.00 H new ATOM 0 HA2 GLY B 259 -12.488 6.333 1.182 1.00 0.00 H new ATOM 0 HA3 GLY B 259 -12.664 5.657 -0.425 1.00 0.00 H new ATOM 1776 N TRP B 260 -14.506 7.714 0.780 1.00 0.00 N ATOM 1777 CA TRP B 260 -15.719 8.510 0.694 1.00 0.00 C ATOM 1778 C TRP B 260 -15.644 9.351 -0.583 1.00 0.00 C ATOM 1779 O TRP B 260 -16.556 10.122 -0.877 1.00 0.00 O ATOM 1780 CB TRP B 260 -15.911 9.355 1.955 1.00 0.00 C ATOM 1781 CG TRP B 260 -16.689 8.647 3.066 1.00 0.00 C ATOM 1782 CD1 TRP B 260 -16.596 7.368 3.452 1.00 0.00 C ATOM 1783 CD2 TRP B 260 -17.690 9.235 3.924 1.00 0.00 C ATOM 1784 NE1 TRP B 260 -17.460 7.089 4.492 1.00 0.00 N ATOM 1785 CE2 TRP B 260 -18.146 8.261 4.788 1.00 0.00 C ATOM 1786 CE3 TRP B 260 -18.193 10.547 3.968 1.00 0.00 C ATOM 1787 CZ2 TRP B 260 -19.126 8.495 5.759 1.00 0.00 C ATOM 1788 CZ3 TRP B 260 -19.173 10.766 4.944 1.00 0.00 C ATOM 1789 CH2 TRP B 260 -19.642 9.795 5.822 1.00 0.00 C ATOM 0 H TRP B 260 -13.695 8.211 1.149 1.00 0.00 H new ATOM 0 HA TRP B 260 -16.598 7.868 0.637 1.00 0.00 H new ATOM 0 HB2 TRP B 260 -14.933 9.645 2.338 1.00 0.00 H new ATOM 0 HB3 TRP B 260 -16.433 10.274 1.688 1.00 0.00 H new ATOM 0 HD1 TRP B 260 -15.929 6.645 3.006 1.00 0.00 H new ATOM 0 HE1 TRP B 260 -17.574 6.189 4.957 1.00 0.00 H new ATOM 0 HE3 TRP B 260 -17.851 11.325 3.302 1.00 0.00 H new ATOM 0 HZ2 TRP B 260 -19.466 7.715 6.424 1.00 0.00 H new ATOM 0 HZ3 TRP B 260 -19.594 11.758 5.020 1.00 0.00 H new ATOM 0 HH2 TRP B 260 -20.401 10.043 6.549 1.00 0.00 H new TER 1800 TRP B 260