USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 972 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 115 SER OG : rot -113:sc= 0.0841 USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0.121 USER MOD Set 2.1: A 57 GLN : amide:sc= -0.688 X(o=-0.7,f=-0.83) USER MOD Set 2.2: A 93 THR OG1 : rot -99:sc= -0.0131 USER MOD Set 3.1: A 74 TYR OH : rot -166:sc= -0.0171 USER MOD Set 3.2: A 101 GLN : amide:sc= 0.354 K(o=0.34,f=-0.72) USER MOD Set 4.1: A 39 SER OG : rot 69:sc= 0.312 USER MOD Set 4.2: A 68 GLN :FLIP amide:sc= 0.288 F(o=0,f=0.6) USER MOD Set 5.1: A 25 ASN : amide:sc= -0.208 X(o=-0.21,f=-0.015) USER MOD Set 5.2: A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -140:sc= 0.0566 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc=-0.00859 USER MOD Single : A 10 TYR OH : rot -75:sc= 0.383 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 27:sc= 0.146 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0395 USER MOD Single : A 18 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0294) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 169:sc= -0.0769 (180deg=-0.305) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -148:sc= 0.901 (180deg=-0.339) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 179:sc=-0.000841 (180deg=-0.0015) USER MOD Single : A 42 THR OG1 : rot 91:sc= 0.35 USER MOD Single : A 47 MET CE :methyl 175:sc= 0 (180deg=-0.0283) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.0679 USER MOD Single : A 51 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 59 GLN : amide:sc= -0.616 X(o=-0.62,f=-0.28) USER MOD Single : A 61 ASN : amide:sc= 1.18 K(o=1.2,f=-0.11) USER MOD Single : A 62 LYS NZ :NH3+ -163:sc= -0.042 (180deg=-0.309) USER MOD Single : A 71 ASN : amide:sc= -0.34 X(o=-0.34,f=0) USER MOD Single : A 75 ASN : amide:sc= 0.75 K(o=0.75,f=-4.8e-05) USER MOD Single : A 76 ASN : amide:sc= 0.799 K(o=0.8,f=-2.1e-05) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 48:sc= 0.448 USER MOD Single : A 88 SER OG : rot 180:sc= 0.00812 USER MOD Single : A 90 TYR OH : rot 50:sc= 0.933 USER MOD Single : A 96 LYS NZ :NH3+ 167:sc= 0.242 (180deg=0.204) USER MOD Single : A 97 THR OG1 : rot 150:sc= -0.0077 USER MOD Single : A 102 MET CE :methyl 145:sc= -0.947 (180deg=-1.67) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -0.136 X(o=-0.14,f=0) USER MOD Single : A 105 TYR OH : rot 130:sc= 0.385 USER MOD Single : A 111 SER OG : rot 155:sc= 0.433 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -1.56 X(o=-1.6,f=-1.1) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 110:sc= -0.0601 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.886 K(o=-0.89,f=-3.9!) USER MOD Single : A 128 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 135 ASN : amide:sc= -0.316 X(o=-0.32,f=-0.0085) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 169:sc= 1.11 (180deg=1.01) USER MOD Single : A 150 SER OG : rot -45:sc= 0.0302 USER MOD Single : A 151 LYS NZ :NH3+ -157:sc= -0.0331 (180deg=-0.264) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.233 -22.803 -1.988 1.00 11.14 N ATOM 2 CA GLY A 1 -10.401 -23.098 -3.163 1.00 31.45 C ATOM 3 C GLY A 1 -9.081 -22.359 -3.075 1.00 73.14 C ATOM 4 O GLY A 1 -8.544 -22.219 -1.981 1.00 42.23 O ATOM 0 H1 GLY A 1 -11.715 -23.671 -1.677 1.00 11.14 H new ATOM 0 H2 GLY A 1 -10.632 -22.446 -1.218 1.00 11.14 H new ATOM 0 H3 GLY A 1 -11.942 -22.083 -2.236 1.00 11.14 H new ATOM 0 HA2 GLY A 1 -10.221 -24.171 -3.229 1.00 31.45 H new ATOM 0 HA3 GLY A 1 -10.928 -22.807 -4.072 1.00 31.45 H new ATOM 8 N MET A 2 -8.527 -21.933 -4.214 1.00 13.43 N ATOM 9 CA MET A 2 -7.232 -21.269 -4.291 1.00 41.20 C ATOM 10 C MET A 2 -7.392 -19.816 -3.831 1.00 34.01 C ATOM 11 O MET A 2 -7.868 -18.972 -4.597 1.00 54.40 O ATOM 12 CB MET A 2 -6.672 -21.328 -5.726 1.00 2.12 C ATOM 13 CG MET A 2 -6.272 -22.728 -6.213 1.00 24.21 C ATOM 14 SD MET A 2 -7.624 -23.844 -6.692 1.00 34.33 S ATOM 15 CE MET A 2 -6.651 -25.282 -7.213 1.00 40.20 C ATOM 0 H MET A 2 -8.978 -22.044 -5.122 1.00 13.43 H new ATOM 0 HA MET A 2 -6.523 -21.781 -3.640 1.00 41.20 H new ATOM 0 HB2 MET A 2 -7.420 -20.923 -6.408 1.00 2.12 H new ATOM 0 HB3 MET A 2 -5.800 -20.677 -5.786 1.00 2.12 H new ATOM 0 HG2 MET A 2 -5.607 -22.613 -7.069 1.00 24.21 H new ATOM 0 HG3 MET A 2 -5.696 -23.211 -5.424 1.00 24.21 H new ATOM 0 HE1 MET A 2 -7.322 -26.075 -7.543 1.00 40.20 H new ATOM 0 HE2 MET A 2 -5.993 -24.998 -8.034 1.00 40.20 H new ATOM 0 HE3 MET A 2 -6.052 -25.639 -6.375 1.00 40.20 H new ATOM 23 N ALA A 3 -7.008 -19.506 -2.593 1.00 43.52 N ATOM 24 CA ALA A 3 -7.149 -18.179 -2.008 1.00 3.55 C ATOM 25 C ALA A 3 -5.887 -17.840 -1.213 1.00 44.21 C ATOM 26 O ALA A 3 -5.866 -17.940 0.010 1.00 20.23 O ATOM 27 CB ALA A 3 -8.427 -18.125 -1.159 1.00 54.51 C ATOM 0 H ALA A 3 -6.583 -20.184 -1.960 1.00 43.52 H new ATOM 0 HA ALA A 3 -7.253 -17.422 -2.785 1.00 3.55 H new ATOM 0 HB1 ALA A 3 -8.532 -17.132 -0.722 1.00 54.51 H new ATOM 0 HB2 ALA A 3 -9.291 -18.337 -1.788 1.00 54.51 H new ATOM 0 HB3 ALA A 3 -8.367 -18.867 -0.363 1.00 54.51 H new ATOM 33 N LYS A 4 -4.815 -17.496 -1.929 1.00 40.52 N ATOM 34 CA LYS A 4 -3.579 -16.927 -1.397 1.00 2.54 C ATOM 35 C LYS A 4 -2.792 -16.276 -2.533 1.00 21.04 C ATOM 36 O LYS A 4 -2.064 -16.953 -3.258 1.00 52.11 O ATOM 37 CB LYS A 4 -2.757 -17.933 -0.566 1.00 73.04 C ATOM 38 CG LYS A 4 -2.065 -19.133 -1.239 1.00 71.41 C ATOM 39 CD LYS A 4 -3.016 -20.084 -1.970 1.00 24.02 C ATOM 40 CE LYS A 4 -3.259 -19.754 -3.445 1.00 14.24 C ATOM 41 NZ LYS A 4 -2.101 -20.081 -4.289 1.00 55.13 N ATOM 0 H LYS A 4 -4.785 -17.613 -2.942 1.00 40.52 H new ATOM 0 HA LYS A 4 -3.835 -16.149 -0.678 1.00 2.54 H new ATOM 0 HB2 LYS A 4 -1.983 -17.365 -0.050 1.00 73.04 H new ATOM 0 HB3 LYS A 4 -3.421 -18.334 0.199 1.00 73.04 H new ATOM 0 HG2 LYS A 4 -1.327 -18.760 -1.949 1.00 71.41 H new ATOM 0 HG3 LYS A 4 -1.521 -19.695 -0.480 1.00 71.41 H new ATOM 0 HD2 LYS A 4 -2.617 -21.096 -1.901 1.00 24.02 H new ATOM 0 HD3 LYS A 4 -3.975 -20.084 -1.451 1.00 24.02 H new ATOM 0 HE2 LYS A 4 -4.131 -20.304 -3.799 1.00 14.24 H new ATOM 0 HE3 LYS A 4 -3.490 -18.693 -3.544 1.00 14.24 H new ATOM 0 HZ1 LYS A 4 -2.313 -19.840 -5.278 1.00 55.13 H new ATOM 0 HZ2 LYS A 4 -1.274 -19.537 -3.970 1.00 55.13 H new ATOM 0 HZ3 LYS A 4 -1.895 -21.098 -4.217 1.00 55.13 H new ATOM 51 N LYS A 5 -3.008 -14.988 -2.774 1.00 12.41 N ATOM 52 CA LYS A 5 -2.277 -14.191 -3.751 1.00 40.25 C ATOM 53 C LYS A 5 -1.773 -12.923 -3.098 1.00 34.13 C ATOM 54 O LYS A 5 -2.313 -12.496 -2.076 1.00 15.22 O ATOM 55 CB LYS A 5 -3.226 -13.844 -4.887 1.00 51.14 C ATOM 56 CG LYS A 5 -3.329 -14.960 -5.909 1.00 71.31 C ATOM 57 CD LYS A 5 -2.267 -14.829 -7.013 1.00 43.21 C ATOM 58 CE LYS A 5 -2.714 -15.501 -8.308 1.00 52.10 C ATOM 59 NZ LYS A 5 -1.745 -15.270 -9.398 1.00 44.23 N ATOM 0 H LYS A 5 -3.720 -14.452 -2.278 1.00 12.41 H new ATOM 0 HA LYS A 5 -1.423 -14.751 -4.133 1.00 40.25 H new ATOM 0 HB2 LYS A 5 -4.215 -13.634 -4.480 1.00 51.14 H new ATOM 0 HB3 LYS A 5 -2.884 -12.934 -5.379 1.00 51.14 H new ATOM 0 HG2 LYS A 5 -3.215 -15.922 -5.409 1.00 71.31 H new ATOM 0 HG3 LYS A 5 -4.322 -14.950 -6.358 1.00 71.31 H new ATOM 0 HD2 LYS A 5 -2.065 -13.774 -7.201 1.00 43.21 H new ATOM 0 HD3 LYS A 5 -1.333 -15.277 -6.674 1.00 43.21 H new ATOM 0 HE2 LYS A 5 -2.829 -16.572 -8.143 1.00 52.10 H new ATOM 0 HE3 LYS A 5 -3.691 -15.117 -8.600 1.00 52.10 H new ATOM 0 HZ1 LYS A 5 -2.078 -15.740 -10.264 1.00 44.23 H new ATOM 0 HZ2 LYS A 5 -1.654 -14.249 -9.571 1.00 44.23 H new ATOM 0 HZ3 LYS A 5 -0.819 -15.659 -9.128 1.00 44.23 H new ATOM 69 N THR A 6 -0.806 -12.269 -3.731 1.00 12.30 N ATOM 70 CA THR A 6 -0.148 -11.115 -3.138 1.00 72.45 C ATOM 71 C THR A 6 0.160 -10.081 -4.218 1.00 31.32 C ATOM 72 O THR A 6 0.820 -10.410 -5.205 1.00 0.23 O ATOM 73 CB THR A 6 1.113 -11.570 -2.389 1.00 0.53 C ATOM 74 OG1 THR A 6 0.905 -12.727 -1.609 1.00 35.02 O ATOM 75 CG2 THR A 6 1.682 -10.469 -1.500 1.00 43.44 C ATOM 0 H THR A 6 -0.461 -12.521 -4.657 1.00 12.30 H new ATOM 0 HA THR A 6 -0.808 -10.638 -2.413 1.00 72.45 H new ATOM 0 HB THR A 6 1.833 -11.809 -3.172 1.00 0.53 H new ATOM 0 HG1 THR A 6 1.740 -12.971 -1.157 1.00 35.02 H new ATOM 0 HG21 THR A 6 2.573 -10.837 -0.990 1.00 43.44 H new ATOM 0 HG22 THR A 6 1.944 -9.606 -2.112 1.00 43.44 H new ATOM 0 HG23 THR A 6 0.936 -10.176 -0.761 1.00 43.44 H new ATOM 83 N LEU A 7 -0.331 -8.852 -4.049 1.00 64.45 N ATOM 84 CA LEU A 7 -0.046 -7.713 -4.934 1.00 32.13 C ATOM 85 C LEU A 7 0.820 -6.682 -4.208 1.00 32.32 C ATOM 86 O LEU A 7 0.506 -6.337 -3.065 1.00 0.10 O ATOM 87 CB LEU A 7 -1.387 -7.085 -5.341 1.00 54.22 C ATOM 88 CG LEU A 7 -1.290 -5.887 -6.297 1.00 3.11 C ATOM 89 CD1 LEU A 7 -0.807 -6.309 -7.683 1.00 73.21 C ATOM 90 CD2 LEU A 7 -2.673 -5.234 -6.414 1.00 14.43 C ATOM 0 H LEU A 7 -0.952 -8.612 -3.277 1.00 64.45 H new ATOM 0 HA LEU A 7 0.499 -8.048 -5.817 1.00 32.13 H new ATOM 0 HB2 LEU A 7 -2.001 -7.854 -5.810 1.00 54.22 H new ATOM 0 HB3 LEU A 7 -1.909 -6.767 -4.438 1.00 54.22 H new ATOM 0 HG LEU A 7 -0.564 -5.181 -5.893 1.00 3.11 H new ATOM 0 HD11 LEU A 7 -0.751 -5.434 -8.331 1.00 73.21 H new ATOM 0 HD12 LEU A 7 0.180 -6.764 -7.601 1.00 73.21 H new ATOM 0 HD13 LEU A 7 -1.505 -7.031 -8.107 1.00 73.21 H new ATOM 0 HD21 LEU A 7 -2.617 -4.381 -7.091 1.00 14.43 H new ATOM 0 HD22 LEU A 7 -3.386 -5.960 -6.804 1.00 14.43 H new ATOM 0 HD23 LEU A 7 -3.000 -4.896 -5.431 1.00 14.43 H new ATOM 101 N ILE A 8 1.888 -6.187 -4.834 1.00 62.11 N ATOM 102 CA ILE A 8 2.679 -5.056 -4.328 1.00 11.41 C ATOM 103 C ILE A 8 2.294 -3.839 -5.180 1.00 34.11 C ATOM 104 O ILE A 8 2.579 -3.833 -6.376 1.00 13.54 O ATOM 105 CB ILE A 8 4.203 -5.353 -4.403 1.00 22.10 C ATOM 106 CG1 ILE A 8 4.639 -6.627 -3.641 1.00 24.23 C ATOM 107 CG2 ILE A 8 5.015 -4.153 -3.876 1.00 71.32 C ATOM 108 CD1 ILE A 8 6.028 -7.158 -4.015 1.00 62.45 C ATOM 0 H ILE A 8 2.235 -6.562 -5.717 1.00 62.11 H new ATOM 0 HA ILE A 8 2.466 -4.870 -3.275 1.00 11.41 H new ATOM 0 HB ILE A 8 4.409 -5.528 -5.459 1.00 22.10 H new ATOM 0 HG12 ILE A 8 4.622 -6.417 -2.572 1.00 24.23 H new ATOM 0 HG13 ILE A 8 3.905 -7.411 -3.824 1.00 24.23 H new ATOM 0 HG21 ILE A 8 6.080 -4.379 -3.936 1.00 71.32 H new ATOM 0 HG22 ILE A 8 4.797 -3.272 -4.480 1.00 71.32 H new ATOM 0 HG23 ILE A 8 4.744 -3.958 -2.839 1.00 71.32 H new ATOM 0 HD11 ILE A 8 6.246 -8.052 -3.430 1.00 62.45 H new ATOM 0 HD12 ILE A 8 6.049 -7.405 -5.076 1.00 62.45 H new ATOM 0 HD13 ILE A 8 6.778 -6.395 -3.805 1.00 62.45 H new ATOM 119 N LEU A 9 1.679 -2.799 -4.602 1.00 40.45 N ATOM 120 CA LEU A 9 1.368 -1.544 -5.305 1.00 0.22 C ATOM 121 C LEU A 9 2.091 -0.402 -4.608 1.00 51.52 C ATOM 122 O LEU A 9 1.593 0.132 -3.615 1.00 60.25 O ATOM 123 CB LEU A 9 -0.139 -1.227 -5.352 1.00 12.24 C ATOM 124 CG LEU A 9 -1.039 -2.147 -6.183 1.00 15.12 C ATOM 125 CD1 LEU A 9 -2.418 -1.509 -6.335 1.00 62.25 C ATOM 126 CD2 LEU A 9 -0.489 -2.426 -7.579 1.00 11.31 C ATOM 0 H LEU A 9 1.381 -2.803 -3.627 1.00 40.45 H new ATOM 0 HA LEU A 9 1.700 -1.662 -6.336 1.00 0.22 H new ATOM 0 HB2 LEU A 9 -0.513 -1.229 -4.328 1.00 12.24 H new ATOM 0 HB3 LEU A 9 -0.256 -0.212 -5.732 1.00 12.24 H new ATOM 0 HG LEU A 9 -1.090 -3.095 -5.648 1.00 15.12 H new ATOM 0 HD11 LEU A 9 -3.058 -2.163 -6.926 1.00 62.25 H new ATOM 0 HD12 LEU A 9 -2.861 -1.361 -5.350 1.00 62.25 H new ATOM 0 HD13 LEU A 9 -2.320 -0.547 -6.837 1.00 62.25 H new ATOM 0 HD21 LEU A 9 -1.174 -3.083 -8.115 1.00 11.31 H new ATOM 0 HD22 LEU A 9 -0.386 -1.488 -8.124 1.00 11.31 H new ATOM 0 HD23 LEU A 9 0.486 -2.907 -7.497 1.00 11.31 H new ATOM 137 N TYR A 10 3.280 -0.037 -5.086 1.00 42.25 N ATOM 138 CA TYR A 10 4.070 1.050 -4.515 1.00 32.14 C ATOM 139 C TYR A 10 4.138 2.191 -5.531 1.00 4.22 C ATOM 140 O TYR A 10 4.295 1.962 -6.731 1.00 63.15 O ATOM 141 CB TYR A 10 5.494 0.570 -4.163 1.00 42.33 C ATOM 142 CG TYR A 10 5.720 -0.372 -2.982 1.00 71.13 C ATOM 143 CD1 TYR A 10 4.661 -0.999 -2.295 1.00 75.11 C ATOM 144 CD2 TYR A 10 7.043 -0.617 -2.550 1.00 40.31 C ATOM 145 CE1 TYR A 10 4.910 -1.823 -1.189 1.00 23.32 C ATOM 146 CE2 TYR A 10 7.305 -1.479 -1.469 1.00 2.44 C ATOM 147 CZ TYR A 10 6.231 -2.086 -0.781 1.00 60.42 C ATOM 148 OH TYR A 10 6.449 -2.908 0.277 1.00 35.30 O ATOM 0 H TYR A 10 3.724 -0.490 -5.885 1.00 42.25 H new ATOM 0 HA TYR A 10 3.596 1.394 -3.595 1.00 32.14 H new ATOM 0 HB2 TYR A 10 5.897 0.079 -5.049 1.00 42.33 H new ATOM 0 HB3 TYR A 10 6.100 1.459 -3.987 1.00 42.33 H new ATOM 0 HD1 TYR A 10 3.645 -0.842 -2.625 1.00 75.11 H new ATOM 0 HD2 TYR A 10 7.866 -0.135 -3.057 1.00 40.31 H new ATOM 0 HE1 TYR A 10 4.084 -2.259 -0.647 1.00 23.32 H new ATOM 0 HE2 TYR A 10 8.323 -1.676 -1.167 1.00 2.44 H new ATOM 0 HH TYR A 10 6.234 -2.435 1.108 1.00 35.30 H new ATOM 157 N TYR A 11 4.095 3.437 -5.063 1.00 11.34 N ATOM 158 CA TYR A 11 4.580 4.582 -5.831 1.00 4.52 C ATOM 159 C TYR A 11 6.135 4.556 -5.831 1.00 15.52 C ATOM 160 O TYR A 11 6.747 3.609 -5.321 1.00 24.13 O ATOM 161 CB TYR A 11 3.878 5.850 -5.281 1.00 12.40 C ATOM 162 CG TYR A 11 4.310 7.200 -5.847 1.00 61.23 C ATOM 163 CD1 TYR A 11 4.640 7.351 -7.207 1.00 63.34 C ATOM 164 CD2 TYR A 11 4.404 8.321 -5.003 1.00 73.41 C ATOM 165 CE1 TYR A 11 5.136 8.566 -7.705 1.00 72.04 C ATOM 166 CE2 TYR A 11 4.914 9.540 -5.484 1.00 53.12 C ATOM 167 CZ TYR A 11 5.303 9.661 -6.837 1.00 0.43 C ATOM 168 OH TYR A 11 5.838 10.813 -7.316 1.00 51.21 O ATOM 0 H TYR A 11 3.725 3.681 -4.144 1.00 11.34 H new ATOM 0 HA TYR A 11 4.321 4.561 -6.890 1.00 4.52 H new ATOM 0 HB2 TYR A 11 2.807 5.742 -5.452 1.00 12.40 H new ATOM 0 HB3 TYR A 11 4.028 5.875 -4.202 1.00 12.40 H new ATOM 0 HD1 TYR A 11 4.509 6.516 -7.880 1.00 63.34 H new ATOM 0 HD2 TYR A 11 4.081 8.245 -3.975 1.00 73.41 H new ATOM 0 HE1 TYR A 11 5.389 8.660 -8.751 1.00 72.04 H new ATOM 0 HE2 TYR A 11 5.009 10.385 -4.818 1.00 53.12 H new ATOM 0 HH TYR A 11 5.887 11.475 -6.595 1.00 51.21 H new ATOM 177 N SER A 12 6.809 5.536 -6.432 1.00 1.33 N ATOM 178 CA SER A 12 8.240 5.776 -6.317 1.00 41.42 C ATOM 179 C SER A 12 8.432 7.294 -6.430 1.00 55.52 C ATOM 180 O SER A 12 8.135 7.877 -7.472 1.00 15.30 O ATOM 181 CB SER A 12 9.020 4.966 -7.369 1.00 31.34 C ATOM 182 OG SER A 12 8.687 5.272 -8.705 1.00 42.44 O ATOM 0 H SER A 12 6.347 6.213 -7.039 1.00 1.33 H new ATOM 0 HA SER A 12 8.641 5.435 -5.363 1.00 41.42 H new ATOM 0 HB2 SER A 12 10.087 5.138 -7.225 1.00 31.34 H new ATOM 0 HB3 SER A 12 8.842 3.904 -7.197 1.00 31.34 H new ATOM 0 HG SER A 12 8.366 6.196 -8.759 1.00 42.44 H new ATOM 187 N TRP A 13 8.846 7.956 -5.349 1.00 72.44 N ATOM 188 CA TRP A 13 9.119 9.391 -5.338 1.00 51.34 C ATOM 189 C TRP A 13 10.323 9.656 -6.252 1.00 51.24 C ATOM 190 O TRP A 13 10.179 10.216 -7.337 1.00 35.00 O ATOM 191 CB TRP A 13 9.307 9.852 -3.899 1.00 14.52 C ATOM 192 CG TRP A 13 9.587 11.296 -3.648 1.00 43.23 C ATOM 193 CD1 TRP A 13 8.671 12.275 -3.488 1.00 22.50 C ATOM 194 CD2 TRP A 13 10.882 11.939 -3.477 1.00 11.52 C ATOM 195 NE1 TRP A 13 9.308 13.472 -3.231 1.00 14.13 N ATOM 196 CE2 TRP A 13 10.677 13.329 -3.230 1.00 73.31 C ATOM 197 CE3 TRP A 13 12.211 11.480 -3.504 1.00 72.14 C ATOM 198 CZ2 TRP A 13 11.745 14.217 -3.038 1.00 35.10 C ATOM 199 CZ3 TRP A 13 13.284 12.371 -3.350 1.00 14.10 C ATOM 200 CH2 TRP A 13 13.059 13.736 -3.110 1.00 52.35 C ATOM 0 H TRP A 13 9.002 7.505 -4.448 1.00 72.44 H new ATOM 0 HA TRP A 13 8.288 9.975 -5.732 1.00 51.34 H new ATOM 0 HB2 TRP A 13 8.406 9.587 -3.345 1.00 14.52 H new ATOM 0 HB3 TRP A 13 10.126 9.275 -3.470 1.00 14.52 H new ATOM 0 HD1 TRP A 13 7.601 12.141 -3.552 1.00 22.50 H new ATOM 0 HE1 TRP A 13 8.824 14.354 -3.063 1.00 14.13 H new ATOM 0 HE3 TRP A 13 12.408 10.428 -3.645 1.00 72.14 H new ATOM 0 HZ2 TRP A 13 11.557 15.261 -2.837 1.00 35.10 H new ATOM 0 HZ3 TRP A 13 14.297 12.002 -3.417 1.00 14.10 H new ATOM 0 HH2 TRP A 13 13.893 14.410 -2.982 1.00 52.35 H new ATOM 210 N SER A 14 11.503 9.162 -5.866 1.00 35.11 N ATOM 211 CA SER A 14 12.711 9.207 -6.682 1.00 42.11 C ATOM 212 C SER A 14 13.540 7.958 -6.361 1.00 41.41 C ATOM 213 O SER A 14 14.584 8.009 -5.708 1.00 0.34 O ATOM 214 CB SER A 14 13.442 10.545 -6.467 1.00 21.10 C ATOM 215 OG SER A 14 14.362 10.792 -7.512 1.00 11.43 O ATOM 0 H SER A 14 11.644 8.713 -4.961 1.00 35.11 H new ATOM 0 HA SER A 14 12.491 9.180 -7.749 1.00 42.11 H new ATOM 0 HB2 SER A 14 12.716 11.356 -6.417 1.00 21.10 H new ATOM 0 HB3 SER A 14 13.967 10.528 -5.512 1.00 21.10 H new ATOM 0 HG SER A 14 14.813 11.648 -7.355 1.00 11.43 H new ATOM 220 N GLY A 15 13.027 6.796 -6.773 1.00 2.32 N ATOM 221 CA GLY A 15 13.723 5.514 -6.777 1.00 22.04 C ATOM 222 C GLY A 15 13.820 4.836 -5.414 1.00 60.11 C ATOM 223 O GLY A 15 14.123 3.647 -5.361 1.00 23.40 O ATOM 0 H GLY A 15 12.073 6.724 -7.128 1.00 2.32 H new ATOM 0 HA2 GLY A 15 13.213 4.841 -7.466 1.00 22.04 H new ATOM 0 HA3 GLY A 15 14.730 5.664 -7.165 1.00 22.04 H new ATOM 227 N GLU A 16 13.569 5.543 -4.313 1.00 52.44 N ATOM 228 CA GLU A 16 13.825 5.056 -2.959 1.00 1.24 C ATOM 229 C GLU A 16 12.852 3.919 -2.628 1.00 75.01 C ATOM 230 O GLU A 16 13.251 2.815 -2.243 1.00 1.10 O ATOM 231 CB GLU A 16 13.716 6.206 -1.938 1.00 20.14 C ATOM 232 CG GLU A 16 14.383 7.513 -2.419 1.00 2.22 C ATOM 233 CD GLU A 16 14.513 8.605 -1.350 1.00 0.50 C ATOM 234 OE1 GLU A 16 14.405 8.296 -0.145 1.00 15.10 O ATOM 235 OE2 GLU A 16 14.652 9.797 -1.711 1.00 4.31 O ATOM 0 H GLU A 16 13.176 6.484 -4.337 1.00 52.44 H new ATOM 0 HA GLU A 16 14.842 4.667 -2.903 1.00 1.24 H new ATOM 0 HB2 GLU A 16 12.664 6.399 -1.729 1.00 20.14 H new ATOM 0 HB3 GLU A 16 14.176 5.895 -1.000 1.00 20.14 H new ATOM 0 HG2 GLU A 16 15.377 7.277 -2.799 1.00 2.22 H new ATOM 0 HG3 GLU A 16 13.808 7.911 -3.255 1.00 2.22 H new ATOM 240 N THR A 17 11.562 4.181 -2.831 1.00 61.43 N ATOM 241 CA THR A 17 10.470 3.240 -2.631 1.00 23.04 C ATOM 242 C THR A 17 10.696 2.010 -3.517 1.00 73.34 C ATOM 243 O THR A 17 10.567 0.876 -3.063 1.00 23.03 O ATOM 244 CB THR A 17 9.140 3.931 -2.980 1.00 12.10 C ATOM 245 OG1 THR A 17 9.113 5.290 -2.584 1.00 42.34 O ATOM 246 CG2 THR A 17 7.935 3.211 -2.382 1.00 51.32 C ATOM 0 H THR A 17 11.240 5.094 -3.153 1.00 61.43 H new ATOM 0 HA THR A 17 10.433 2.916 -1.591 1.00 23.04 H new ATOM 0 HB THR A 17 9.073 3.884 -4.067 1.00 12.10 H new ATOM 0 HG1 THR A 17 8.250 5.685 -2.828 1.00 42.34 H new ATOM 0 HG21 THR A 17 7.022 3.739 -2.658 1.00 51.32 H new ATOM 0 HG22 THR A 17 7.894 2.191 -2.764 1.00 51.32 H new ATOM 0 HG23 THR A 17 8.027 3.188 -1.296 1.00 51.32 H new ATOM 254 N LYS A 18 11.069 2.245 -4.782 1.00 54.52 N ATOM 255 CA LYS A 18 11.308 1.212 -5.782 1.00 51.43 C ATOM 256 C LYS A 18 12.405 0.264 -5.298 1.00 64.12 C ATOM 257 O LYS A 18 12.217 -0.949 -5.315 1.00 42.41 O ATOM 258 CB LYS A 18 11.649 1.885 -7.122 1.00 35.14 C ATOM 259 CG LYS A 18 11.925 0.919 -8.280 1.00 2.22 C ATOM 260 CD LYS A 18 10.729 0.033 -8.666 1.00 52.21 C ATOM 261 CE LYS A 18 11.033 -1.439 -8.364 1.00 44.12 C ATOM 262 NZ LYS A 18 9.921 -2.328 -8.768 1.00 14.51 N ATOM 0 H LYS A 18 11.215 3.188 -5.142 1.00 54.52 H new ATOM 0 HA LYS A 18 10.415 0.606 -5.933 1.00 51.43 H new ATOM 0 HB2 LYS A 18 10.824 2.539 -7.403 1.00 35.14 H new ATOM 0 HB3 LYS A 18 12.524 2.519 -6.981 1.00 35.14 H new ATOM 0 HG2 LYS A 18 12.231 1.495 -9.153 1.00 2.22 H new ATOM 0 HG3 LYS A 18 12.764 0.278 -8.010 1.00 2.22 H new ATOM 0 HD2 LYS A 18 9.843 0.348 -8.115 1.00 52.21 H new ATOM 0 HD3 LYS A 18 10.506 0.155 -9.726 1.00 52.21 H new ATOM 0 HE2 LYS A 18 11.943 -1.736 -8.886 1.00 44.12 H new ATOM 0 HE3 LYS A 18 11.224 -1.559 -7.298 1.00 44.12 H new ATOM 0 HZ1 LYS A 18 10.229 -3.319 -8.706 1.00 14.51 H new ATOM 0 HZ2 LYS A 18 9.109 -2.177 -8.136 1.00 14.51 H new ATOM 0 HZ3 LYS A 18 9.643 -2.113 -9.747 1.00 14.51 H new ATOM 272 N LYS A 19 13.536 0.808 -4.843 1.00 74.25 N ATOM 273 CA LYS A 19 14.681 0.033 -4.368 1.00 22.03 C ATOM 274 C LYS A 19 14.270 -0.938 -3.258 1.00 74.45 C ATOM 275 O LYS A 19 14.657 -2.106 -3.308 1.00 21.02 O ATOM 276 CB LYS A 19 15.831 0.988 -3.977 1.00 1.31 C ATOM 277 CG LYS A 19 17.205 0.301 -3.882 1.00 20.10 C ATOM 278 CD LYS A 19 17.561 -0.224 -2.484 1.00 33.40 C ATOM 279 CE LYS A 19 18.592 -1.356 -2.592 1.00 40.35 C ATOM 280 NZ LYS A 19 18.990 -1.885 -1.275 1.00 12.32 N ATOM 0 H LYS A 19 13.683 1.816 -4.794 1.00 74.25 H new ATOM 0 HA LYS A 19 15.059 -0.599 -5.171 1.00 22.03 H new ATOM 0 HB2 LYS A 19 15.888 1.793 -4.710 1.00 1.31 H new ATOM 0 HB3 LYS A 19 15.598 1.448 -3.017 1.00 1.31 H new ATOM 0 HG2 LYS A 19 17.230 -0.531 -4.586 1.00 20.10 H new ATOM 0 HG3 LYS A 19 17.973 1.008 -4.197 1.00 20.10 H new ATOM 0 HD2 LYS A 19 17.961 0.586 -1.874 1.00 33.40 H new ATOM 0 HD3 LYS A 19 16.663 -0.586 -1.984 1.00 33.40 H new ATOM 0 HE2 LYS A 19 18.177 -2.164 -3.194 1.00 40.35 H new ATOM 0 HE3 LYS A 19 19.475 -0.990 -3.115 1.00 40.35 H new ATOM 0 HZ1 LYS A 19 19.687 -2.646 -1.403 1.00 12.32 H new ATOM 0 HZ2 LYS A 19 19.411 -1.122 -0.707 1.00 12.32 H new ATOM 0 HZ3 LYS A 19 18.153 -2.260 -0.784 1.00 12.32 H new ATOM 290 N MET A 20 13.467 -0.493 -2.290 1.00 61.22 N ATOM 291 CA MET A 20 12.957 -1.339 -1.211 1.00 60.03 C ATOM 292 C MET A 20 12.013 -2.428 -1.708 1.00 13.33 C ATOM 293 O MET A 20 11.968 -3.497 -1.104 1.00 54.53 O ATOM 294 CB MET A 20 12.235 -0.436 -0.199 1.00 60.21 C ATOM 295 CG MET A 20 12.040 -1.118 1.154 1.00 31.11 C ATOM 296 SD MET A 20 13.537 -1.710 2.000 1.00 42.42 S ATOM 297 CE MET A 20 14.529 -0.197 1.974 1.00 54.22 C ATOM 0 H MET A 20 13.150 0.475 -2.233 1.00 61.22 H new ATOM 0 HA MET A 20 13.800 -1.853 -0.750 1.00 60.03 H new ATOM 0 HB2 MET A 20 12.808 0.481 -0.061 1.00 60.21 H new ATOM 0 HB3 MET A 20 11.264 -0.148 -0.601 1.00 60.21 H new ATOM 0 HG2 MET A 20 11.530 -0.418 1.816 1.00 31.11 H new ATOM 0 HG3 MET A 20 11.372 -1.967 1.013 1.00 31.11 H new ATOM 0 HE1 MET A 20 15.398 -0.321 2.620 1.00 54.22 H new ATOM 0 HE2 MET A 20 14.860 0.004 0.955 1.00 54.22 H new ATOM 0 HE3 MET A 20 13.927 0.639 2.331 1.00 54.22 H new ATOM 305 N ALA A 21 11.277 -2.189 -2.795 1.00 14.24 N ATOM 306 CA ALA A 21 10.257 -3.105 -3.273 1.00 71.33 C ATOM 307 C ALA A 21 10.928 -4.407 -3.665 1.00 43.42 C ATOM 308 O ALA A 21 10.385 -5.476 -3.406 1.00 23.44 O ATOM 309 CB ALA A 21 9.511 -2.512 -4.474 1.00 3.44 C ATOM 0 H ALA A 21 11.377 -1.350 -3.366 1.00 14.24 H new ATOM 0 HA ALA A 21 9.527 -3.281 -2.483 1.00 71.33 H new ATOM 0 HB1 ALA A 21 8.752 -3.216 -4.815 1.00 3.44 H new ATOM 0 HB2 ALA A 21 9.033 -1.577 -4.180 1.00 3.44 H new ATOM 0 HB3 ALA A 21 10.217 -2.320 -5.282 1.00 3.44 H new ATOM 315 N GLU A 22 12.120 -4.309 -4.261 1.00 4.21 N ATOM 316 CA GLU A 22 12.780 -5.484 -4.778 1.00 51.12 C ATOM 317 C GLU A 22 13.257 -6.410 -3.653 1.00 31.21 C ATOM 318 O GLU A 22 13.221 -7.631 -3.814 1.00 3.23 O ATOM 319 CB GLU A 22 13.921 -5.115 -5.735 1.00 51.23 C ATOM 320 CG GLU A 22 13.459 -4.262 -6.929 1.00 63.45 C ATOM 321 CD GLU A 22 14.397 -4.374 -8.139 1.00 40.54 C ATOM 322 OE1 GLU A 22 15.489 -3.767 -8.134 1.00 1.22 O ATOM 323 OE2 GLU A 22 14.012 -5.025 -9.140 1.00 15.30 O ATOM 0 H GLU A 22 12.632 -3.436 -4.390 1.00 4.21 H new ATOM 0 HA GLU A 22 12.042 -6.040 -5.356 1.00 51.12 H new ATOM 0 HB2 GLU A 22 14.688 -4.571 -5.183 1.00 51.23 H new ATOM 0 HB3 GLU A 22 14.384 -6.029 -6.107 1.00 51.23 H new ATOM 0 HG2 GLU A 22 12.456 -4.570 -7.223 1.00 63.45 H new ATOM 0 HG3 GLU A 22 13.394 -3.219 -6.621 1.00 63.45 H new ATOM 328 N LYS A 23 13.665 -5.861 -2.498 1.00 23.02 N ATOM 329 CA LYS A 23 14.054 -6.682 -1.348 1.00 1.34 C ATOM 330 C LYS A 23 12.830 -7.437 -0.833 1.00 62.04 C ATOM 331 O LYS A 23 12.847 -8.662 -0.745 1.00 12.20 O ATOM 332 CB LYS A 23 14.767 -5.834 -0.269 1.00 23.31 C ATOM 333 CG LYS A 23 15.273 -6.698 0.913 1.00 24.03 C ATOM 334 CD LYS A 23 16.619 -6.274 1.546 1.00 74.12 C ATOM 335 CE LYS A 23 16.464 -5.502 2.866 1.00 60.11 C ATOM 336 NZ LYS A 23 17.771 -5.057 3.416 1.00 61.02 N ATOM 0 H LYS A 23 13.733 -4.856 -2.339 1.00 23.02 H new ATOM 0 HA LYS A 23 14.789 -7.427 -1.652 1.00 1.34 H new ATOM 0 HB2 LYS A 23 15.609 -5.309 -0.720 1.00 23.31 H new ATOM 0 HB3 LYS A 23 14.081 -5.074 0.106 1.00 23.31 H new ATOM 0 HG2 LYS A 23 14.511 -6.691 1.693 1.00 24.03 H new ATOM 0 HG3 LYS A 23 15.367 -7.728 0.568 1.00 24.03 H new ATOM 0 HD2 LYS A 23 17.223 -7.164 1.724 1.00 74.12 H new ATOM 0 HD3 LYS A 23 17.166 -5.655 0.835 1.00 74.12 H new ATOM 0 HE2 LYS A 23 15.826 -4.633 2.703 1.00 60.11 H new ATOM 0 HE3 LYS A 23 15.961 -6.135 3.597 1.00 60.11 H new ATOM 0 HZ1 LYS A 23 17.616 -4.541 4.306 1.00 61.02 H new ATOM 0 HZ2 LYS A 23 18.372 -5.886 3.597 1.00 61.02 H new ATOM 0 HZ3 LYS A 23 18.241 -4.432 2.731 1.00 61.02 H new ATOM 346 N ILE A 24 11.742 -6.710 -0.618 1.00 75.13 N ATOM 347 CA ILE A 24 10.497 -7.249 -0.097 1.00 73.32 C ATOM 348 C ILE A 24 9.947 -8.319 -1.052 1.00 15.53 C ATOM 349 O ILE A 24 9.433 -9.342 -0.608 1.00 34.21 O ATOM 350 CB ILE A 24 9.542 -6.061 0.139 1.00 15.24 C ATOM 351 CG1 ILE A 24 10.173 -5.089 1.163 1.00 55.34 C ATOM 352 CG2 ILE A 24 8.164 -6.529 0.634 1.00 52.44 C ATOM 353 CD1 ILE A 24 9.449 -3.763 1.243 1.00 43.55 C ATOM 0 H ILE A 24 11.701 -5.708 -0.805 1.00 75.13 H new ATOM 0 HA ILE A 24 10.636 -7.761 0.855 1.00 73.32 H new ATOM 0 HB ILE A 24 9.392 -5.550 -0.812 1.00 15.24 H new ATOM 0 HG12 ILE A 24 10.173 -5.557 2.148 1.00 55.34 H new ATOM 0 HG13 ILE A 24 11.214 -4.912 0.894 1.00 55.34 H new ATOM 0 HG21 ILE A 24 7.520 -5.663 0.789 1.00 52.44 H new ATOM 0 HG22 ILE A 24 7.715 -7.188 -0.109 1.00 52.44 H new ATOM 0 HG23 ILE A 24 8.279 -7.068 1.574 1.00 52.44 H new ATOM 0 HD11 ILE A 24 9.939 -3.125 1.978 1.00 43.55 H new ATOM 0 HD12 ILE A 24 9.472 -3.277 0.268 1.00 43.55 H new ATOM 0 HD13 ILE A 24 8.414 -3.931 1.541 1.00 43.55 H new ATOM 364 N ASN A 25 10.077 -8.124 -2.368 1.00 54.14 N ATOM 365 CA ASN A 25 9.572 -9.062 -3.367 1.00 75.22 C ATOM 366 C ASN A 25 10.271 -10.430 -3.313 1.00 2.13 C ATOM 367 O ASN A 25 9.698 -11.424 -3.761 1.00 53.14 O ATOM 368 CB ASN A 25 9.690 -8.441 -4.769 1.00 2.20 C ATOM 369 CG ASN A 25 9.062 -9.296 -5.860 1.00 74.33 C ATOM 370 OD1 ASN A 25 9.627 -9.491 -6.932 1.00 15.52 O ATOM 371 ND2 ASN A 25 7.870 -9.817 -5.638 1.00 62.05 N ATOM 0 H ASN A 25 10.538 -7.307 -2.769 1.00 54.14 H new ATOM 0 HA ASN A 25 8.523 -9.249 -3.137 1.00 75.22 H new ATOM 0 HB2 ASN A 25 9.214 -7.461 -4.766 1.00 2.20 H new ATOM 0 HB3 ASN A 25 10.743 -8.283 -5.002 1.00 2.20 H new ATOM 0 HD21 ASN A 25 7.418 -10.382 -6.357 1.00 62.05 H new ATOM 0 HD22 ASN A 25 7.400 -9.655 -4.747 1.00 62.05 H new ATOM 377 N SER A 26 11.479 -10.509 -2.759 1.00 61.35 N ATOM 378 CA SER A 26 12.198 -11.732 -2.492 1.00 75.23 C ATOM 379 C SER A 26 11.765 -12.395 -1.166 1.00 2.14 C ATOM 380 O SER A 26 11.772 -13.625 -1.074 1.00 11.33 O ATOM 381 CB SER A 26 13.673 -11.334 -2.453 1.00 35.21 C ATOM 382 OG SER A 26 14.297 -11.433 -3.719 1.00 32.42 O ATOM 0 H SER A 26 11.999 -9.679 -2.475 1.00 61.35 H new ATOM 0 HA SER A 26 11.993 -12.477 -3.260 1.00 75.23 H new ATOM 0 HB2 SER A 26 13.760 -10.310 -2.088 1.00 35.21 H new ATOM 0 HB3 SER A 26 14.199 -11.971 -1.742 1.00 35.21 H new ATOM 0 HG SER A 26 15.237 -11.167 -3.642 1.00 32.42 H new ATOM 387 N GLU A 27 11.379 -11.617 -0.146 1.00 0.30 N ATOM 388 CA GLU A 27 10.972 -12.130 1.170 1.00 63.05 C ATOM 389 C GLU A 27 9.576 -12.761 1.152 1.00 52.44 C ATOM 390 O GLU A 27 9.205 -13.458 2.097 1.00 12.54 O ATOM 391 CB GLU A 27 10.967 -10.988 2.205 1.00 62.42 C ATOM 392 CG GLU A 27 12.358 -10.622 2.732 1.00 55.14 C ATOM 393 CD GLU A 27 12.903 -11.632 3.756 1.00 4.52 C ATOM 394 OE1 GLU A 27 13.488 -12.661 3.339 1.00 62.03 O ATOM 395 OE2 GLU A 27 12.883 -11.337 4.977 1.00 61.32 O ATOM 0 H GLU A 27 11.340 -10.600 -0.212 1.00 0.30 H new ATOM 0 HA GLU A 27 11.696 -12.900 1.437 1.00 63.05 H new ATOM 0 HB2 GLU A 27 10.516 -10.104 1.754 1.00 62.42 H new ATOM 0 HB3 GLU A 27 10.335 -11.275 3.045 1.00 62.42 H new ATOM 0 HG2 GLU A 27 13.051 -10.555 1.893 1.00 55.14 H new ATOM 0 HG3 GLU A 27 12.317 -9.635 3.192 1.00 55.14 H new ATOM 400 N ILE A 28 8.778 -12.508 0.116 1.00 61.32 N ATOM 401 CA ILE A 28 7.371 -12.887 0.046 1.00 63.33 C ATOM 402 C ILE A 28 7.236 -14.181 -0.766 1.00 71.11 C ATOM 403 O ILE A 28 8.167 -14.617 -1.450 1.00 40.22 O ATOM 404 CB ILE A 28 6.565 -11.662 -0.468 1.00 14.13 C ATOM 405 CG1 ILE A 28 6.543 -10.600 0.657 1.00 14.51 C ATOM 406 CG2 ILE A 28 5.115 -11.962 -0.892 1.00 62.05 C ATOM 407 CD1 ILE A 28 5.895 -9.273 0.261 1.00 54.43 C ATOM 0 H ILE A 28 9.103 -12.021 -0.719 1.00 61.32 H new ATOM 0 HA ILE A 28 6.943 -13.132 1.018 1.00 63.33 H new ATOM 0 HB ILE A 28 7.069 -11.319 -1.371 1.00 14.13 H new ATOM 0 HG12 ILE A 28 6.010 -11.009 1.515 1.00 14.51 H new ATOM 0 HG13 ILE A 28 7.567 -10.409 0.979 1.00 14.51 H new ATOM 0 HG21 ILE A 28 4.639 -11.043 -1.235 1.00 62.05 H new ATOM 0 HG22 ILE A 28 5.116 -12.693 -1.700 1.00 62.05 H new ATOM 0 HG23 ILE A 28 4.563 -12.362 -0.042 1.00 62.05 H new ATOM 0 HD11 ILE A 28 5.922 -8.588 1.108 1.00 54.43 H new ATOM 0 HD12 ILE A 28 6.440 -8.837 -0.576 1.00 54.43 H new ATOM 0 HD13 ILE A 28 4.860 -9.447 -0.032 1.00 54.43 H new ATOM 418 N LYS A 29 6.061 -14.802 -0.661 1.00 40.31 N ATOM 419 CA LYS A 29 5.528 -15.860 -1.516 1.00 42.43 C ATOM 420 C LYS A 29 5.541 -15.484 -3.011 1.00 44.21 C ATOM 421 O LYS A 29 6.165 -14.509 -3.407 1.00 53.55 O ATOM 422 CB LYS A 29 4.099 -16.163 -1.032 1.00 33.21 C ATOM 423 CG LYS A 29 3.780 -17.656 -1.142 1.00 64.31 C ATOM 424 CD LYS A 29 2.269 -17.898 -1.215 1.00 11.34 C ATOM 425 CE LYS A 29 1.820 -18.155 -2.649 1.00 34.10 C ATOM 426 NZ LYS A 29 2.202 -19.505 -3.106 1.00 43.23 N ATOM 0 H LYS A 29 5.407 -14.558 0.083 1.00 40.31 H new ATOM 0 HA LYS A 29 6.163 -16.742 -1.436 1.00 42.43 H new ATOM 0 HB2 LYS A 29 3.987 -15.840 0.003 1.00 33.21 H new ATOM 0 HB3 LYS A 29 3.384 -15.591 -1.623 1.00 33.21 H new ATOM 0 HG2 LYS A 29 4.260 -18.068 -2.030 1.00 64.31 H new ATOM 0 HG3 LYS A 29 4.194 -18.183 -0.282 1.00 64.31 H new ATOM 0 HD2 LYS A 29 2.004 -18.751 -0.590 1.00 11.34 H new ATOM 0 HD3 LYS A 29 1.740 -17.033 -0.815 1.00 11.34 H new ATOM 0 HE2 LYS A 29 0.738 -18.040 -2.718 1.00 34.10 H new ATOM 0 HE3 LYS A 29 2.263 -17.409 -3.308 1.00 34.10 H new ATOM 0 HZ1 LYS A 29 2.395 -19.484 -4.128 1.00 43.23 H new ATOM 0 HZ2 LYS A 29 3.056 -19.815 -2.599 1.00 43.23 H new ATOM 0 HZ3 LYS A 29 1.425 -20.169 -2.914 1.00 43.23 H new ATOM 436 N ASP A 30 4.805 -16.224 -3.844 1.00 23.14 N ATOM 437 CA ASP A 30 4.668 -16.195 -5.307 1.00 53.54 C ATOM 438 C ASP A 30 3.911 -14.924 -5.763 1.00 2.12 C ATOM 439 O ASP A 30 2.918 -15.006 -6.490 1.00 2.32 O ATOM 440 CB ASP A 30 3.919 -17.462 -5.825 1.00 14.23 C ATOM 441 CG ASP A 30 4.395 -18.846 -5.365 1.00 11.42 C ATOM 442 OD1 ASP A 30 5.499 -18.966 -4.797 1.00 73.04 O ATOM 443 OD2 ASP A 30 3.596 -19.810 -5.434 1.00 23.01 O ATOM 0 H ASP A 30 4.210 -16.957 -3.457 1.00 23.14 H new ATOM 0 HA ASP A 30 5.672 -16.183 -5.730 1.00 53.54 H new ATOM 0 HB2 ASP A 30 2.871 -17.364 -5.542 1.00 14.23 H new ATOM 0 HB3 ASP A 30 3.958 -17.445 -6.914 1.00 14.23 H new ATOM 447 N SER A 31 4.291 -13.754 -5.255 1.00 61.32 N ATOM 448 CA SER A 31 3.585 -12.485 -5.421 1.00 51.54 C ATOM 449 C SER A 31 3.625 -11.917 -6.850 1.00 44.53 C ATOM 450 O SER A 31 4.234 -12.486 -7.762 1.00 44.25 O ATOM 451 CB SER A 31 4.082 -11.476 -4.372 1.00 61.32 C ATOM 452 OG SER A 31 5.407 -11.023 -4.548 1.00 72.02 O ATOM 0 H SER A 31 5.136 -13.660 -4.692 1.00 61.32 H new ATOM 0 HA SER A 31 2.527 -12.685 -5.251 1.00 51.54 H new ATOM 0 HB2 SER A 31 3.417 -10.613 -4.379 1.00 61.32 H new ATOM 0 HB3 SER A 31 4.000 -11.933 -3.386 1.00 61.32 H new ATOM 0 HG SER A 31 5.632 -10.387 -3.838 1.00 72.02 H new ATOM 457 N GLU A 32 2.961 -10.774 -7.026 1.00 31.41 N ATOM 458 CA GLU A 32 3.081 -9.846 -8.136 1.00 44.15 C ATOM 459 C GLU A 32 3.703 -8.568 -7.594 1.00 11.23 C ATOM 460 O GLU A 32 3.567 -8.251 -6.404 1.00 44.44 O ATOM 461 CB GLU A 32 1.694 -9.583 -8.733 1.00 23.23 C ATOM 462 CG GLU A 32 1.667 -9.107 -10.194 1.00 32.22 C ATOM 463 CD GLU A 32 1.573 -7.592 -10.408 1.00 1.20 C ATOM 464 OE1 GLU A 32 1.820 -6.818 -9.465 1.00 23.10 O ATOM 465 OE2 GLU A 32 1.197 -7.206 -11.540 1.00 52.53 O ATOM 0 H GLU A 32 2.276 -10.455 -6.341 1.00 31.41 H new ATOM 0 HA GLU A 32 3.709 -10.250 -8.930 1.00 44.15 H new ATOM 0 HB2 GLU A 32 1.109 -10.500 -8.660 1.00 23.23 H new ATOM 0 HB3 GLU A 32 1.192 -8.835 -8.119 1.00 23.23 H new ATOM 0 HG2 GLU A 32 2.568 -9.468 -10.689 1.00 32.22 H new ATOM 0 HG3 GLU A 32 0.819 -9.577 -10.692 1.00 32.22 H new ATOM 470 N LEU A 33 4.372 -7.856 -8.487 1.00 73.03 N ATOM 471 CA LEU A 33 5.142 -6.656 -8.208 1.00 11.30 C ATOM 472 C LEU A 33 4.764 -5.579 -9.214 1.00 23.44 C ATOM 473 O LEU A 33 5.170 -5.649 -10.374 1.00 35.30 O ATOM 474 CB LEU A 33 6.650 -6.970 -8.201 1.00 0.24 C ATOM 475 CG LEU A 33 7.553 -5.723 -8.086 1.00 2.22 C ATOM 476 CD1 LEU A 33 7.301 -4.900 -6.816 1.00 60.11 C ATOM 477 CD2 LEU A 33 9.019 -6.160 -8.081 1.00 15.53 C ATOM 0 H LEU A 33 4.393 -8.113 -9.474 1.00 73.03 H new ATOM 0 HA LEU A 33 4.907 -6.279 -7.213 1.00 11.30 H new ATOM 0 HB2 LEU A 33 6.867 -7.640 -7.369 1.00 0.24 H new ATOM 0 HB3 LEU A 33 6.903 -7.505 -9.116 1.00 0.24 H new ATOM 0 HG LEU A 33 7.316 -5.092 -8.943 1.00 2.22 H new ATOM 0 HD11 LEU A 33 7.970 -4.040 -6.801 1.00 60.11 H new ATOM 0 HD12 LEU A 33 6.267 -4.556 -6.805 1.00 60.11 H new ATOM 0 HD13 LEU A 33 7.487 -5.519 -5.938 1.00 60.11 H new ATOM 0 HD21 LEU A 33 9.660 -5.282 -8.000 1.00 15.53 H new ATOM 0 HD22 LEU A 33 9.199 -6.820 -7.233 1.00 15.53 H new ATOM 0 HD23 LEU A 33 9.244 -6.689 -9.007 1.00 15.53 H new ATOM 488 N LYS A 34 4.007 -4.572 -8.771 1.00 20.13 N ATOM 489 CA LYS A 34 3.583 -3.467 -9.611 1.00 52.31 C ATOM 490 C LYS A 34 4.190 -2.168 -9.114 1.00 20.33 C ATOM 491 O LYS A 34 4.951 -2.106 -8.138 1.00 64.11 O ATOM 492 CB LYS A 34 2.044 -3.429 -9.648 1.00 23.03 C ATOM 493 CG LYS A 34 1.462 -3.740 -11.026 1.00 60.32 C ATOM 494 CD LYS A 34 1.662 -2.601 -12.021 1.00 14.20 C ATOM 495 CE LYS A 34 0.819 -2.882 -13.265 1.00 34.00 C ATOM 496 NZ LYS A 34 1.595 -3.415 -14.404 1.00 12.13 N ATOM 0 H LYS A 34 3.672 -4.507 -7.810 1.00 20.13 H new ATOM 0 HA LYS A 34 3.939 -3.605 -10.632 1.00 52.31 H new ATOM 0 HB2 LYS A 34 1.653 -4.146 -8.926 1.00 23.03 H new ATOM 0 HB3 LYS A 34 1.705 -2.442 -9.333 1.00 23.03 H new ATOM 0 HG2 LYS A 34 1.928 -4.644 -11.417 1.00 60.32 H new ATOM 0 HG3 LYS A 34 0.397 -3.948 -10.927 1.00 60.32 H new ATOM 0 HD2 LYS A 34 1.369 -1.652 -11.572 1.00 14.20 H new ATOM 0 HD3 LYS A 34 2.715 -2.515 -12.290 1.00 14.20 H new ATOM 0 HE2 LYS A 34 0.034 -3.593 -13.008 1.00 34.00 H new ATOM 0 HE3 LYS A 34 0.325 -1.961 -13.573 1.00 34.00 H new ATOM 0 HZ1 LYS A 34 0.959 -3.581 -15.210 1.00 12.13 H new ATOM 0 HZ2 LYS A 34 2.327 -2.729 -14.677 1.00 12.13 H new ATOM 0 HZ3 LYS A 34 2.046 -4.311 -14.128 1.00 12.13 H new ATOM 506 N GLU A 35 3.819 -1.093 -9.796 1.00 64.11 N ATOM 507 CA GLU A 35 4.087 0.261 -9.374 1.00 0.34 C ATOM 508 C GLU A 35 2.940 1.179 -9.809 1.00 15.32 C ATOM 509 O GLU A 35 2.103 0.794 -10.632 1.00 2.52 O ATOM 510 CB GLU A 35 5.449 0.722 -9.902 1.00 32.02 C ATOM 511 CG GLU A 35 5.546 0.753 -11.433 1.00 61.41 C ATOM 512 CD GLU A 35 6.727 1.613 -11.872 1.00 60.35 C ATOM 513 OE1 GLU A 35 6.498 2.841 -12.041 1.00 55.42 O ATOM 514 OE2 GLU A 35 7.839 1.059 -12.032 1.00 75.42 O ATOM 0 H GLU A 35 3.311 -1.148 -10.679 1.00 64.11 H new ATOM 0 HA GLU A 35 4.140 0.306 -8.286 1.00 0.34 H new ATOM 0 HB2 GLU A 35 5.659 1.719 -9.514 1.00 32.02 H new ATOM 0 HB3 GLU A 35 6.222 0.059 -9.512 1.00 32.02 H new ATOM 0 HG2 GLU A 35 5.663 -0.260 -11.817 1.00 61.41 H new ATOM 0 HG3 GLU A 35 4.622 1.149 -11.855 1.00 61.41 H new ATOM 519 N VAL A 36 2.909 2.389 -9.255 1.00 0.54 N ATOM 520 CA VAL A 36 1.876 3.410 -9.449 1.00 2.53 C ATOM 521 C VAL A 36 2.569 4.775 -9.618 1.00 73.22 C ATOM 522 O VAL A 36 3.755 4.894 -9.290 1.00 33.00 O ATOM 523 CB VAL A 36 0.915 3.381 -8.227 1.00 32.34 C ATOM 524 CG1 VAL A 36 -0.333 4.257 -8.436 1.00 63.42 C ATOM 525 CG2 VAL A 36 0.445 1.956 -7.859 1.00 71.02 C ATOM 0 H VAL A 36 3.645 2.703 -8.622 1.00 0.54 H new ATOM 0 HA VAL A 36 1.282 3.221 -10.343 1.00 2.53 H new ATOM 0 HB VAL A 36 1.511 3.782 -7.407 1.00 32.34 H new ATOM 0 HG11 VAL A 36 -0.969 4.200 -7.553 1.00 63.42 H new ATOM 0 HG12 VAL A 36 -0.029 5.291 -8.598 1.00 63.42 H new ATOM 0 HG13 VAL A 36 -0.886 3.901 -9.305 1.00 63.42 H new ATOM 0 HG21 VAL A 36 -0.223 2.004 -6.999 1.00 71.02 H new ATOM 0 HG22 VAL A 36 -0.084 1.518 -8.705 1.00 71.02 H new ATOM 0 HG23 VAL A 36 1.310 1.340 -7.613 1.00 71.02 H new ATOM 535 N LYS A 37 1.877 5.821 -10.097 1.00 32.41 N ATOM 536 CA LYS A 37 2.248 7.228 -9.915 1.00 22.33 C ATOM 537 C LYS A 37 1.026 8.152 -9.818 1.00 55.25 C ATOM 538 O LYS A 37 -0.082 7.734 -10.161 1.00 43.25 O ATOM 539 CB LYS A 37 3.185 7.662 -11.048 1.00 11.22 C ATOM 540 CG LYS A 37 2.541 7.651 -12.447 1.00 61.05 C ATOM 541 CD LYS A 37 3.035 6.517 -13.357 1.00 34.44 C ATOM 542 CE LYS A 37 4.265 6.895 -14.188 1.00 63.11 C ATOM 543 NZ LYS A 37 5.459 7.187 -13.368 1.00 15.32 N ATOM 0 H LYS A 37 1.019 5.705 -10.637 1.00 32.41 H new ATOM 0 HA LYS A 37 2.770 7.317 -8.962 1.00 22.33 H new ATOM 0 HB2 LYS A 37 3.549 8.668 -10.837 1.00 11.22 H new ATOM 0 HB3 LYS A 37 4.054 7.004 -11.056 1.00 11.22 H new ATOM 0 HG2 LYS A 37 1.460 7.569 -12.337 1.00 61.05 H new ATOM 0 HG3 LYS A 37 2.740 8.606 -12.934 1.00 61.05 H new ATOM 0 HD2 LYS A 37 3.273 5.647 -12.744 1.00 34.44 H new ATOM 0 HD3 LYS A 37 2.229 6.223 -14.029 1.00 34.44 H new ATOM 0 HE2 LYS A 37 4.495 6.080 -14.875 1.00 63.11 H new ATOM 0 HE3 LYS A 37 4.029 7.768 -14.797 1.00 63.11 H new ATOM 0 HZ1 LYS A 37 6.259 7.419 -13.990 1.00 15.32 H new ATOM 0 HZ2 LYS A 37 5.262 7.994 -12.742 1.00 15.32 H new ATOM 0 HZ3 LYS A 37 5.698 6.354 -12.793 1.00 15.32 H new ATOM 553 N VAL A 38 1.253 9.398 -9.387 1.00 60.05 N ATOM 554 CA VAL A 38 0.314 10.517 -9.500 1.00 52.25 C ATOM 555 C VAL A 38 0.510 11.215 -10.857 1.00 53.22 C ATOM 556 O VAL A 38 1.427 10.845 -11.601 1.00 72.25 O ATOM 557 CB VAL A 38 0.461 11.483 -8.299 1.00 41.52 C ATOM 558 CG1 VAL A 38 0.026 10.804 -6.990 1.00 13.33 C ATOM 559 CG2 VAL A 38 1.884 12.036 -8.098 1.00 34.42 C ATOM 0 H VAL A 38 2.127 9.663 -8.934 1.00 60.05 H new ATOM 0 HA VAL A 38 -0.710 10.145 -9.465 1.00 52.25 H new ATOM 0 HB VAL A 38 -0.189 12.323 -8.544 1.00 41.52 H new ATOM 0 HG11 VAL A 38 0.139 11.504 -6.162 1.00 13.33 H new ATOM 0 HG12 VAL A 38 -1.018 10.499 -7.068 1.00 13.33 H new ATOM 0 HG13 VAL A 38 0.648 9.927 -6.811 1.00 13.33 H new ATOM 0 HG21 VAL A 38 1.897 12.703 -7.236 1.00 34.42 H new ATOM 0 HG22 VAL A 38 2.575 11.210 -7.928 1.00 34.42 H new ATOM 0 HG23 VAL A 38 2.189 12.587 -8.988 1.00 34.42 H new ATOM 569 N SER A 39 -0.322 12.206 -11.204 1.00 43.14 N ATOM 570 CA SER A 39 -0.029 13.058 -12.346 1.00 0.14 C ATOM 571 C SER A 39 1.160 13.951 -12.011 1.00 35.32 C ATOM 572 O SER A 39 1.627 14.004 -10.873 1.00 54.43 O ATOM 573 CB SER A 39 -1.240 13.875 -12.773 1.00 21.32 C ATOM 574 OG SER A 39 -1.165 14.148 -14.162 1.00 41.22 O ATOM 0 H SER A 39 -1.188 12.429 -10.714 1.00 43.14 H new ATOM 0 HA SER A 39 0.226 12.427 -13.197 1.00 0.14 H new ATOM 0 HB2 SER A 39 -2.157 13.329 -12.549 1.00 21.32 H new ATOM 0 HB3 SER A 39 -1.278 14.808 -12.211 1.00 21.32 H new ATOM 0 HG SER A 39 -1.288 13.316 -14.666 1.00 41.22 H new ATOM 579 N GLU A 40 1.669 14.635 -13.024 1.00 22.23 N ATOM 580 CA GLU A 40 2.782 15.550 -12.856 1.00 4.54 C ATOM 581 C GLU A 40 2.307 16.889 -12.308 1.00 54.35 C ATOM 582 O GLU A 40 1.141 17.264 -12.450 1.00 64.31 O ATOM 583 CB GLU A 40 3.530 15.723 -14.174 1.00 60.12 C ATOM 584 CG GLU A 40 2.660 16.246 -15.322 1.00 52.54 C ATOM 585 CD GLU A 40 3.465 16.203 -16.613 1.00 11.33 C ATOM 586 OE1 GLU A 40 3.720 15.079 -17.112 1.00 24.22 O ATOM 587 OE2 GLU A 40 4.034 17.233 -17.035 1.00 53.52 O ATOM 0 H GLU A 40 1.322 14.570 -13.981 1.00 22.23 H new ATOM 0 HA GLU A 40 3.473 15.125 -12.128 1.00 4.54 H new ATOM 0 HB2 GLU A 40 4.362 16.411 -14.020 1.00 60.12 H new ATOM 0 HB3 GLU A 40 3.959 14.764 -14.465 1.00 60.12 H new ATOM 0 HG2 GLU A 40 1.760 15.639 -15.419 1.00 52.54 H new ATOM 0 HG3 GLU A 40 2.336 17.266 -15.114 1.00 52.54 H new ATOM 592 N GLY A 41 3.249 17.640 -11.745 1.00 54.33 N ATOM 593 CA GLY A 41 3.005 18.992 -11.292 1.00 74.51 C ATOM 594 C GLY A 41 2.244 19.059 -9.973 1.00 35.14 C ATOM 595 O GLY A 41 1.914 20.171 -9.560 1.00 23.24 O ATOM 0 H GLY A 41 4.205 17.320 -11.593 1.00 54.33 H new ATOM 0 HA2 GLY A 41 3.959 19.508 -11.180 1.00 74.51 H new ATOM 0 HA3 GLY A 41 2.441 19.527 -12.056 1.00 74.51 H new ATOM 599 N THR A 42 1.966 17.934 -9.310 1.00 12.03 N ATOM 600 CA THR A 42 1.213 17.895 -8.069 1.00 21.40 C ATOM 601 C THR A 42 1.948 18.629 -6.927 1.00 75.45 C ATOM 602 O THR A 42 1.341 19.480 -6.283 1.00 61.22 O ATOM 603 CB THR A 42 0.884 16.430 -7.717 1.00 63.44 C ATOM 604 OG1 THR A 42 0.486 15.676 -8.854 1.00 53.15 O ATOM 605 CG2 THR A 42 -0.278 16.370 -6.729 1.00 20.10 C ATOM 0 H THR A 42 2.266 17.014 -9.631 1.00 12.03 H new ATOM 0 HA THR A 42 0.275 18.433 -8.205 1.00 21.40 H new ATOM 0 HB THR A 42 1.798 16.010 -7.296 1.00 63.44 H new ATOM 0 HG1 THR A 42 1.274 15.260 -9.262 1.00 53.15 H new ATOM 0 HG21 THR A 42 -0.499 15.330 -6.490 1.00 20.10 H new ATOM 0 HG22 THR A 42 -0.008 16.903 -5.817 1.00 20.10 H new ATOM 0 HG23 THR A 42 -1.158 16.835 -7.174 1.00 20.10 H new ATOM 613 N PHE A 43 3.229 18.344 -6.660 1.00 14.03 N ATOM 614 CA PHE A 43 3.950 18.883 -5.499 1.00 4.32 C ATOM 615 C PHE A 43 5.293 19.499 -5.902 1.00 53.45 C ATOM 616 O PHE A 43 5.655 19.503 -7.081 1.00 43.34 O ATOM 617 CB PHE A 43 4.106 17.791 -4.427 1.00 40.31 C ATOM 618 CG PHE A 43 2.797 17.175 -3.974 1.00 13.41 C ATOM 619 CD1 PHE A 43 1.913 17.913 -3.165 1.00 14.11 C ATOM 620 CD2 PHE A 43 2.440 15.879 -4.391 1.00 44.05 C ATOM 621 CE1 PHE A 43 0.699 17.344 -2.742 1.00 23.44 C ATOM 622 CE2 PHE A 43 1.213 15.323 -3.986 1.00 62.53 C ATOM 623 CZ PHE A 43 0.351 16.046 -3.146 1.00 15.40 C ATOM 0 H PHE A 43 3.797 17.731 -7.245 1.00 14.03 H new ATOM 0 HA PHE A 43 3.363 19.695 -5.070 1.00 4.32 H new ATOM 0 HB2 PHE A 43 4.750 17.003 -4.818 1.00 40.31 H new ATOM 0 HB3 PHE A 43 4.613 18.217 -3.561 1.00 40.31 H new ATOM 0 HD1 PHE A 43 2.168 18.920 -2.868 1.00 14.11 H new ATOM 0 HD2 PHE A 43 3.108 15.311 -5.022 1.00 44.05 H new ATOM 0 HE1 PHE A 43 0.033 17.907 -2.105 1.00 23.44 H new ATOM 0 HE2 PHE A 43 0.933 14.336 -4.323 1.00 62.53 H new ATOM 0 HZ PHE A 43 -0.576 15.605 -2.812 1.00 15.40 H new ATOM 632 N ASP A 44 6.020 20.052 -4.931 1.00 73.43 N ATOM 633 CA ASP A 44 7.339 20.670 -5.086 1.00 72.55 C ATOM 634 C ASP A 44 8.289 19.997 -4.086 1.00 35.43 C ATOM 635 O ASP A 44 7.925 19.043 -3.396 1.00 34.53 O ATOM 636 CB ASP A 44 7.240 22.189 -4.833 1.00 43.33 C ATOM 637 CG ASP A 44 8.262 23.059 -5.573 1.00 11.31 C ATOM 638 OD1 ASP A 44 9.478 22.752 -5.531 1.00 43.11 O ATOM 639 OD2 ASP A 44 7.847 24.087 -6.153 1.00 72.15 O ATOM 0 H ASP A 44 5.689 20.083 -3.967 1.00 73.43 H new ATOM 0 HA ASP A 44 7.719 20.534 -6.099 1.00 72.55 H new ATOM 0 HB2 ASP A 44 6.240 22.520 -5.113 1.00 43.33 H new ATOM 0 HB3 ASP A 44 7.347 22.367 -3.763 1.00 43.33 H new ATOM 643 N ALA A 45 9.503 20.509 -3.950 1.00 71.33 N ATOM 644 CA ALA A 45 10.466 20.151 -2.929 1.00 34.32 C ATOM 645 C ALA A 45 10.927 21.458 -2.265 1.00 33.42 C ATOM 646 O ALA A 45 12.092 21.851 -2.383 1.00 0.44 O ATOM 647 CB ALA A 45 11.628 19.417 -3.603 1.00 31.12 C ATOM 0 H ALA A 45 9.858 21.224 -4.585 1.00 71.33 H new ATOM 0 HA ALA A 45 10.046 19.492 -2.169 1.00 34.32 H new ATOM 0 HB1 ALA A 45 12.367 19.137 -2.852 1.00 31.12 H new ATOM 0 HB2 ALA A 45 11.254 18.520 -4.096 1.00 31.12 H new ATOM 0 HB3 ALA A 45 12.092 20.071 -4.342 1.00 31.12 H new ATOM 653 N ASP A 46 10.002 22.238 -1.712 1.00 0.22 N ATOM 654 CA ASP A 46 10.281 23.435 -0.920 1.00 72.55 C ATOM 655 C ASP A 46 10.451 23.017 0.552 1.00 24.20 C ATOM 656 O ASP A 46 10.646 21.833 0.846 1.00 34.42 O ATOM 657 CB ASP A 46 9.120 24.410 -1.147 1.00 32.41 C ATOM 658 CG ASP A 46 9.399 25.840 -0.677 1.00 71.35 C ATOM 659 OD1 ASP A 46 9.910 26.658 -1.469 1.00 3.23 O ATOM 660 OD2 ASP A 46 9.052 26.138 0.488 1.00 64.54 O ATOM 0 H ASP A 46 9.004 22.049 -1.805 1.00 0.22 H new ATOM 0 HA ASP A 46 11.204 23.935 -1.213 1.00 72.55 H new ATOM 0 HB2 ASP A 46 8.880 24.430 -2.210 1.00 32.41 H new ATOM 0 HB3 ASP A 46 8.238 24.034 -0.628 1.00 32.41 H new ATOM 664 N MET A 47 10.388 23.968 1.484 1.00 74.51 N ATOM 665 CA MET A 47 10.409 23.748 2.917 1.00 13.43 C ATOM 666 C MET A 47 9.075 24.116 3.566 1.00 22.30 C ATOM 667 O MET A 47 8.724 23.538 4.595 1.00 24.23 O ATOM 668 CB MET A 47 11.578 24.548 3.512 1.00 1.04 C ATOM 669 CG MET A 47 11.501 24.689 5.035 1.00 22.42 C ATOM 670 SD MET A 47 13.021 25.232 5.863 1.00 33.11 S ATOM 671 CE MET A 47 13.450 26.716 4.918 1.00 34.20 C ATOM 0 H MET A 47 10.318 24.956 1.242 1.00 74.51 H new ATOM 0 HA MET A 47 10.556 22.688 3.122 1.00 13.43 H new ATOM 0 HB2 MET A 47 12.516 24.060 3.246 1.00 1.04 H new ATOM 0 HB3 MET A 47 11.596 25.541 3.062 1.00 1.04 H new ATOM 0 HG2 MET A 47 10.708 25.397 5.274 1.00 22.42 H new ATOM 0 HG3 MET A 47 11.207 23.727 5.454 1.00 22.42 H new ATOM 0 HE1 MET A 47 14.313 27.201 5.374 1.00 34.20 H new ATOM 0 HE2 MET A 47 13.691 26.437 3.892 1.00 34.20 H new ATOM 0 HE3 MET A 47 12.605 27.404 4.918 1.00 34.20 H new ATOM 679 N TYR A 48 8.332 25.063 3.009 1.00 43.02 N ATOM 680 CA TYR A 48 7.122 25.616 3.587 1.00 24.33 C ATOM 681 C TYR A 48 6.012 25.696 2.542 1.00 40.34 C ATOM 682 O TYR A 48 4.869 25.373 2.867 1.00 20.31 O ATOM 683 CB TYR A 48 7.475 26.968 4.219 1.00 51.35 C ATOM 684 CG TYR A 48 8.361 27.860 3.371 1.00 55.12 C ATOM 685 CD1 TYR A 48 7.793 28.647 2.358 1.00 62.45 C ATOM 686 CD2 TYR A 48 9.762 27.812 3.523 1.00 71.21 C ATOM 687 CE1 TYR A 48 8.624 29.340 1.468 1.00 64.53 C ATOM 688 CE2 TYR A 48 10.601 28.495 2.626 1.00 15.00 C ATOM 689 CZ TYR A 48 10.028 29.251 1.582 1.00 4.34 C ATOM 690 OH TYR A 48 10.825 29.917 0.706 1.00 2.32 O ATOM 0 H TYR A 48 8.567 25.480 2.109 1.00 43.02 H new ATOM 0 HA TYR A 48 6.728 24.970 4.371 1.00 24.33 H new ATOM 0 HB2 TYR A 48 6.550 27.502 4.438 1.00 51.35 H new ATOM 0 HB3 TYR A 48 7.972 26.788 5.172 1.00 51.35 H new ATOM 0 HD1 TYR A 48 6.719 28.718 2.265 1.00 62.45 H new ATOM 0 HD2 TYR A 48 10.194 27.246 4.335 1.00 71.21 H new ATOM 0 HE1 TYR A 48 8.187 29.947 0.689 1.00 64.53 H new ATOM 0 HE2 TYR A 48 11.674 28.442 2.735 1.00 15.00 H new ATOM 0 HH TYR A 48 11.765 29.749 0.926 1.00 2.32 H new ATOM 699 N LYS A 49 6.344 25.993 1.276 1.00 20.14 N ATOM 700 CA LYS A 49 5.388 25.933 0.170 1.00 64.13 C ATOM 701 C LYS A 49 4.746 24.547 0.136 1.00 42.13 C ATOM 702 O LYS A 49 3.533 24.415 -0.013 1.00 20.32 O ATOM 703 CB LYS A 49 6.106 26.229 -1.163 1.00 35.53 C ATOM 704 CG LYS A 49 5.142 26.534 -2.319 1.00 33.13 C ATOM 705 CD LYS A 49 5.083 28.022 -2.690 1.00 73.34 C ATOM 706 CE LYS A 49 4.191 28.147 -3.927 1.00 60.15 C ATOM 707 NZ LYS A 49 4.272 29.450 -4.608 1.00 55.32 N ATOM 0 H LYS A 49 7.282 26.280 0.995 1.00 20.14 H new ATOM 0 HA LYS A 49 4.611 26.683 0.315 1.00 64.13 H new ATOM 0 HB2 LYS A 49 6.777 27.077 -1.026 1.00 35.53 H new ATOM 0 HB3 LYS A 49 6.725 25.373 -1.432 1.00 35.53 H new ATOM 0 HG2 LYS A 49 5.445 25.961 -3.195 1.00 33.13 H new ATOM 0 HG3 LYS A 49 4.142 26.196 -2.047 1.00 33.13 H new ATOM 0 HD2 LYS A 49 4.680 28.608 -1.864 1.00 73.34 H new ATOM 0 HD3 LYS A 49 6.082 28.407 -2.896 1.00 73.34 H new ATOM 0 HE2 LYS A 49 4.461 27.364 -4.635 1.00 60.15 H new ATOM 0 HE3 LYS A 49 3.157 27.968 -3.633 1.00 60.15 H new ATOM 0 HZ1 LYS A 49 3.639 29.451 -5.433 1.00 55.32 H new ATOM 0 HZ2 LYS A 49 3.985 30.204 -3.951 1.00 55.32 H new ATOM 0 HZ3 LYS A 49 5.249 29.618 -4.922 1.00 55.32 H new ATOM 717 N THR A 50 5.548 23.497 0.292 1.00 64.55 N ATOM 718 CA THR A 50 5.069 22.135 0.191 1.00 23.34 C ATOM 719 C THR A 50 4.164 21.757 1.355 1.00 32.24 C ATOM 720 O THR A 50 3.180 21.036 1.159 1.00 20.44 O ATOM 721 CB THR A 50 6.284 21.216 0.123 1.00 35.42 C ATOM 722 OG1 THR A 50 7.319 21.632 1.003 1.00 3.13 O ATOM 723 CG2 THR A 50 6.872 21.235 -1.277 1.00 15.34 C ATOM 0 H THR A 50 6.545 23.574 0.491 1.00 64.55 H new ATOM 0 HA THR A 50 4.462 22.032 -0.708 1.00 23.34 H new ATOM 0 HB THR A 50 5.935 20.223 0.405 1.00 35.42 H new ATOM 0 HG1 THR A 50 8.078 21.016 0.930 1.00 3.13 H new ATOM 0 HG21 THR A 50 7.739 20.576 -1.316 1.00 15.34 H new ATOM 0 HG22 THR A 50 6.123 20.892 -1.991 1.00 15.34 H new ATOM 0 HG23 THR A 50 7.176 22.251 -1.530 1.00 15.34 H new ATOM 731 N SER A 51 4.504 22.219 2.561 1.00 74.34 N ATOM 732 CA SER A 51 3.720 21.997 3.759 1.00 53.11 C ATOM 733 C SER A 51 2.310 22.541 3.533 1.00 12.30 C ATOM 734 O SER A 51 1.340 21.856 3.858 1.00 11.23 O ATOM 735 CB SER A 51 4.410 22.675 4.949 1.00 22.22 C ATOM 736 OG SER A 51 5.790 22.347 4.962 1.00 35.34 O ATOM 0 H SER A 51 5.349 22.767 2.726 1.00 74.34 H new ATOM 0 HA SER A 51 3.644 20.933 3.981 1.00 53.11 H new ATOM 0 HB2 SER A 51 4.285 23.756 4.884 1.00 22.22 H new ATOM 0 HB3 SER A 51 3.943 22.356 5.881 1.00 22.22 H new ATOM 0 HG SER A 51 6.223 22.785 5.724 1.00 35.34 H new ATOM 741 N ASP A 52 2.222 23.731 2.932 1.00 22.14 N ATOM 742 CA ASP A 52 0.999 24.482 2.680 1.00 1.14 C ATOM 743 C ASP A 52 0.126 23.796 1.626 1.00 31.51 C ATOM 744 O ASP A 52 -1.049 23.560 1.896 1.00 34.31 O ATOM 745 CB ASP A 52 1.375 25.909 2.265 1.00 32.10 C ATOM 746 CG ASP A 52 0.174 26.851 2.268 1.00 55.21 C ATOM 747 OD1 ASP A 52 -0.289 27.208 3.377 1.00 41.05 O ATOM 748 OD2 ASP A 52 -0.218 27.282 1.157 1.00 4.23 O ATOM 0 H ASP A 52 3.050 24.219 2.591 1.00 22.14 H new ATOM 0 HA ASP A 52 0.403 24.520 3.592 1.00 1.14 H new ATOM 0 HB2 ASP A 52 2.136 26.293 2.944 1.00 32.10 H new ATOM 0 HB3 ASP A 52 1.816 25.890 1.269 1.00 32.10 H new ATOM 752 N ILE A 53 0.697 23.394 0.475 1.00 54.43 N ATOM 753 CA ILE A 53 -0.028 22.681 -0.596 1.00 24.40 C ATOM 754 C ILE A 53 -0.841 21.533 0.003 1.00 43.45 C ATOM 755 O ILE A 53 -2.063 21.466 -0.134 1.00 3.24 O ATOM 756 CB ILE A 53 0.921 22.118 -1.696 1.00 64.33 C ATOM 757 CG1 ILE A 53 1.558 23.211 -2.572 1.00 3.01 C ATOM 758 CG2 ILE A 53 0.154 21.150 -2.624 1.00 20.42 C ATOM 759 CD1 ILE A 53 2.696 22.664 -3.452 1.00 31.32 C ATOM 0 H ILE A 53 1.681 23.555 0.260 1.00 54.43 H new ATOM 0 HA ILE A 53 -0.685 23.409 -1.071 1.00 24.40 H new ATOM 0 HB ILE A 53 1.719 21.604 -1.160 1.00 64.33 H new ATOM 0 HG12 ILE A 53 0.792 23.657 -3.207 1.00 3.01 H new ATOM 0 HG13 ILE A 53 1.945 24.006 -1.934 1.00 3.01 H new ATOM 0 HG21 ILE A 53 0.830 20.765 -3.387 1.00 20.42 H new ATOM 0 HG22 ILE A 53 -0.241 20.321 -2.038 1.00 20.42 H new ATOM 0 HG23 ILE A 53 -0.669 21.681 -3.103 1.00 20.42 H new ATOM 0 HD11 ILE A 53 3.113 23.473 -4.051 1.00 31.32 H new ATOM 0 HD12 ILE A 53 3.476 22.243 -2.818 1.00 31.32 H new ATOM 0 HD13 ILE A 53 2.306 21.888 -4.111 1.00 31.32 H new ATOM 770 N ALA A 54 -0.135 20.576 0.604 1.00 3.32 N ATOM 771 CA ALA A 54 -0.747 19.314 0.968 1.00 12.12 C ATOM 772 C ALA A 54 -1.684 19.482 2.170 1.00 63.54 C ATOM 773 O ALA A 54 -2.546 18.631 2.392 1.00 14.02 O ATOM 774 CB ALA A 54 0.358 18.291 1.225 1.00 22.30 C ATOM 0 H ALA A 54 0.853 20.656 0.845 1.00 3.32 H new ATOM 0 HA ALA A 54 -1.370 18.952 0.151 1.00 12.12 H new ATOM 0 HB1 ALA A 54 -0.088 17.335 1.500 1.00 22.30 H new ATOM 0 HB2 ALA A 54 0.955 18.166 0.322 1.00 22.30 H new ATOM 0 HB3 ALA A 54 0.996 18.641 2.037 1.00 22.30 H new ATOM 780 N LEU A 55 -1.526 20.564 2.938 1.00 43.11 N ATOM 781 CA LEU A 55 -2.402 20.917 4.044 1.00 55.32 C ATOM 782 C LEU A 55 -3.735 21.479 3.544 1.00 32.21 C ATOM 783 O LEU A 55 -4.771 21.223 4.155 1.00 24.24 O ATOM 784 CB LEU A 55 -1.671 21.931 4.928 1.00 31.20 C ATOM 785 CG LEU A 55 -2.445 22.317 6.191 1.00 64.54 C ATOM 786 CD1 LEU A 55 -2.685 21.127 7.123 1.00 52.03 C ATOM 787 CD2 LEU A 55 -1.683 23.415 6.941 1.00 22.24 C ATOM 0 H LEU A 55 -0.766 21.230 2.800 1.00 43.11 H new ATOM 0 HA LEU A 55 -2.639 20.024 4.622 1.00 55.32 H new ATOM 0 HB2 LEU A 55 -0.705 21.518 5.217 1.00 31.20 H new ATOM 0 HB3 LEU A 55 -1.472 22.830 4.345 1.00 31.20 H new ATOM 0 HG LEU A 55 -3.423 22.679 5.875 1.00 64.54 H new ATOM 0 HD11 LEU A 55 -3.238 21.459 8.002 1.00 52.03 H new ATOM 0 HD12 LEU A 55 -3.261 20.365 6.599 1.00 52.03 H new ATOM 0 HD13 LEU A 55 -1.727 20.709 7.433 1.00 52.03 H new ATOM 0 HD21 LEU A 55 -2.234 23.690 7.841 1.00 22.24 H new ATOM 0 HD22 LEU A 55 -0.695 23.048 7.218 1.00 22.24 H new ATOM 0 HD23 LEU A 55 -1.578 24.289 6.298 1.00 22.24 H new ATOM 798 N ASP A 56 -3.730 22.202 2.425 1.00 40.34 N ATOM 799 CA ASP A 56 -4.940 22.768 1.812 1.00 75.22 C ATOM 800 C ASP A 56 -5.961 21.654 1.538 1.00 4.31 C ATOM 801 O ASP A 56 -7.163 21.814 1.766 1.00 71.32 O ATOM 802 CB ASP A 56 -4.569 23.492 0.496 1.00 22.41 C ATOM 803 CG ASP A 56 -5.298 24.820 0.255 1.00 13.12 C ATOM 804 OD1 ASP A 56 -5.794 25.472 1.201 1.00 75.52 O ATOM 805 OD2 ASP A 56 -5.309 25.276 -0.915 1.00 33.42 O ATOM 0 H ASP A 56 -2.877 22.416 1.909 1.00 40.34 H new ATOM 0 HA ASP A 56 -5.386 23.488 2.498 1.00 75.22 H new ATOM 0 HB2 ASP A 56 -3.495 23.679 0.493 1.00 22.41 H new ATOM 0 HB3 ASP A 56 -4.778 22.824 -0.339 1.00 22.41 H new ATOM 809 N GLN A 57 -5.455 20.498 1.093 1.00 72.23 N ATOM 810 CA GLN A 57 -6.217 19.294 0.767 1.00 24.22 C ATOM 811 C GLN A 57 -6.728 18.545 2.005 1.00 73.22 C ATOM 812 O GLN A 57 -7.573 17.658 1.870 1.00 3.14 O ATOM 813 CB GLN A 57 -5.333 18.319 -0.021 1.00 1.33 C ATOM 814 CG GLN A 57 -4.575 18.913 -1.213 1.00 3.02 C ATOM 815 CD GLN A 57 -4.011 17.802 -2.092 1.00 44.04 C ATOM 816 OE1 GLN A 57 -4.211 17.779 -3.305 1.00 33.30 O ATOM 817 NE2 GLN A 57 -3.249 16.874 -1.535 1.00 42.33 N ATOM 0 H GLN A 57 -4.454 20.374 0.944 1.00 72.23 H new ATOM 0 HA GLN A 57 -7.076 19.631 0.187 1.00 24.22 H new ATOM 0 HB2 GLN A 57 -4.607 17.882 0.665 1.00 1.33 H new ATOM 0 HB3 GLN A 57 -5.959 17.504 -0.384 1.00 1.33 H new ATOM 0 HG2 GLN A 57 -5.243 19.545 -1.798 1.00 3.02 H new ATOM 0 HG3 GLN A 57 -3.765 19.550 -0.856 1.00 3.02 H new ATOM 0 HE21 GLN A 57 -3.080 16.889 -0.529 1.00 42.33 H new ATOM 0 HE22 GLN A 57 -2.831 16.144 -2.112 1.00 42.33 H new ATOM 824 N ILE A 58 -6.183 18.821 3.193 1.00 44.15 N ATOM 825 CA ILE A 58 -6.672 18.266 4.451 1.00 55.31 C ATOM 826 C ILE A 58 -7.822 19.152 4.909 1.00 31.23 C ATOM 827 O ILE A 58 -8.907 18.653 5.206 1.00 63.23 O ATOM 828 CB ILE A 58 -5.539 18.188 5.506 1.00 12.42 C ATOM 829 CG1 ILE A 58 -4.488 17.144 5.071 1.00 2.12 C ATOM 830 CG2 ILE A 58 -6.086 17.856 6.913 1.00 64.24 C ATOM 831 CD1 ILE A 58 -3.179 17.225 5.862 1.00 15.10 C ATOM 0 H ILE A 58 -5.382 19.443 3.306 1.00 44.15 H new ATOM 0 HA ILE A 58 -7.021 17.242 4.317 1.00 55.31 H new ATOM 0 HB ILE A 58 -5.068 19.169 5.567 1.00 12.42 H new ATOM 0 HG12 ILE A 58 -4.911 16.146 5.185 1.00 2.12 H new ATOM 0 HG13 ILE A 58 -4.271 17.279 4.011 1.00 2.12 H new ATOM 0 HG21 ILE A 58 -5.260 17.810 7.623 1.00 64.24 H new ATOM 0 HG22 ILE A 58 -6.788 18.630 7.222 1.00 64.24 H new ATOM 0 HG23 ILE A 58 -6.596 16.893 6.887 1.00 64.24 H new ATOM 0 HD11 ILE A 58 -2.489 16.462 5.502 1.00 15.10 H new ATOM 0 HD12 ILE A 58 -2.733 18.211 5.728 1.00 15.10 H new ATOM 0 HD13 ILE A 58 -3.382 17.060 6.920 1.00 15.10 H new ATOM 842 N GLN A 59 -7.575 20.462 4.976 1.00 44.11 N ATOM 843 CA GLN A 59 -8.397 21.434 5.687 1.00 42.23 C ATOM 844 C GLN A 59 -9.763 21.697 5.026 1.00 61.52 C ATOM 845 O GLN A 59 -10.488 22.586 5.468 1.00 24.20 O ATOM 846 CB GLN A 59 -7.570 22.713 5.912 1.00 64.22 C ATOM 847 CG GLN A 59 -6.408 22.425 6.886 1.00 51.21 C ATOM 848 CD GLN A 59 -5.565 23.648 7.230 1.00 4.43 C ATOM 849 OE1 GLN A 59 -5.262 23.896 8.396 1.00 52.12 O ATOM 850 NE2 GLN A 59 -5.162 24.449 6.257 1.00 3.43 N ATOM 0 H GLN A 59 -6.768 20.887 4.519 1.00 44.11 H new ATOM 0 HA GLN A 59 -8.666 21.013 6.656 1.00 42.23 H new ATOM 0 HB2 GLN A 59 -7.178 23.074 4.961 1.00 64.22 H new ATOM 0 HB3 GLN A 59 -8.206 23.501 6.315 1.00 64.22 H new ATOM 0 HG2 GLN A 59 -6.815 22.007 7.807 1.00 51.21 H new ATOM 0 HG3 GLN A 59 -5.762 21.663 6.449 1.00 51.21 H new ATOM 0 HE21 GLN A 59 -5.413 24.243 5.290 1.00 3.43 H new ATOM 0 HE22 GLN A 59 -4.600 25.272 6.474 1.00 3.43 H new ATOM 857 N GLY A 60 -10.139 20.937 3.997 1.00 54.32 N ATOM 858 CA GLY A 60 -11.437 21.020 3.342 1.00 42.42 C ATOM 859 C GLY A 60 -11.465 22.051 2.219 1.00 3.42 C ATOM 860 O GLY A 60 -12.460 22.135 1.502 1.00 70.34 O ATOM 0 H GLY A 60 -9.530 20.229 3.588 1.00 54.32 H new ATOM 0 HA2 GLY A 60 -11.699 20.042 2.938 1.00 42.42 H new ATOM 0 HA3 GLY A 60 -12.197 21.273 4.081 1.00 42.42 H new ATOM 864 N ASN A 61 -10.385 22.821 2.056 1.00 11.03 N ATOM 865 CA ASN A 61 -10.308 23.904 1.088 1.00 63.45 C ATOM 866 C ASN A 61 -10.155 23.340 -0.324 1.00 71.34 C ATOM 867 O ASN A 61 -10.695 23.903 -1.279 1.00 62.21 O ATOM 868 CB ASN A 61 -9.101 24.814 1.375 1.00 23.12 C ATOM 869 CG ASN A 61 -8.979 25.332 2.807 1.00 43.22 C ATOM 870 OD1 ASN A 61 -9.929 25.390 3.583 1.00 41.01 O ATOM 871 ND2 ASN A 61 -7.767 25.680 3.188 1.00 35.12 N ATOM 0 H ASN A 61 -9.532 22.703 2.603 1.00 11.03 H new ATOM 0 HA ASN A 61 -11.229 24.482 1.168 1.00 63.45 H new ATOM 0 HB2 ASN A 61 -8.191 24.266 1.129 1.00 23.12 H new ATOM 0 HB3 ASN A 61 -9.149 25.671 0.703 1.00 23.12 H new ATOM 0 HD21 ASN A 61 -7.606 26.004 4.142 1.00 35.12 H new ATOM 0 HD22 ASN A 61 -6.990 25.625 2.529 1.00 35.12 H new ATOM 877 N LYS A 62 -9.389 22.250 -0.467 1.00 62.42 N ATOM 878 CA LYS A 62 -8.962 21.698 -1.749 1.00 24.52 C ATOM 879 C LYS A 62 -9.385 20.240 -1.891 1.00 11.04 C ATOM 880 O LYS A 62 -9.698 19.567 -0.901 1.00 33.33 O ATOM 881 CB LYS A 62 -7.433 21.896 -1.905 1.00 35.32 C ATOM 882 CG LYS A 62 -7.091 23.086 -2.810 1.00 13.44 C ATOM 883 CD LYS A 62 -7.275 22.738 -4.296 1.00 74.32 C ATOM 884 CE LYS A 62 -7.349 23.953 -5.231 1.00 4.31 C ATOM 885 NZ LYS A 62 -8.475 24.847 -4.892 1.00 51.22 N ATOM 0 H LYS A 62 -9.043 21.717 0.331 1.00 62.42 H new ATOM 0 HA LYS A 62 -9.456 22.232 -2.561 1.00 24.52 H new ATOM 0 HB2 LYS A 62 -6.986 22.049 -0.923 1.00 35.32 H new ATOM 0 HB3 LYS A 62 -6.991 20.989 -2.318 1.00 35.32 H new ATOM 0 HG2 LYS A 62 -7.726 23.934 -2.553 1.00 13.44 H new ATOM 0 HG3 LYS A 62 -6.061 23.394 -2.633 1.00 13.44 H new ATOM 0 HD2 LYS A 62 -6.448 22.102 -4.612 1.00 74.32 H new ATOM 0 HD3 LYS A 62 -8.188 22.153 -4.409 1.00 74.32 H new ATOM 0 HE2 LYS A 62 -6.414 24.511 -5.175 1.00 4.31 H new ATOM 0 HE3 LYS A 62 -7.455 23.612 -6.261 1.00 4.31 H new ATOM 0 HZ1 LYS A 62 -8.669 25.481 -5.694 1.00 51.22 H new ATOM 0 HZ2 LYS A 62 -9.321 24.278 -4.688 1.00 51.22 H new ATOM 0 HZ3 LYS A 62 -8.229 25.413 -4.055 1.00 51.22 H new ATOM 895 N ASP A 63 -9.391 19.787 -3.144 1.00 24.13 N ATOM 896 CA ASP A 63 -9.497 18.400 -3.587 1.00 30.33 C ATOM 897 C ASP A 63 -8.237 17.600 -3.222 1.00 35.11 C ATOM 898 O ASP A 63 -7.307 18.117 -2.607 1.00 75.11 O ATOM 899 CB ASP A 63 -9.726 18.367 -5.112 1.00 30.41 C ATOM 900 CG ASP A 63 -8.566 18.998 -5.889 1.00 73.11 C ATOM 901 OD1 ASP A 63 -7.545 18.325 -6.162 1.00 72.11 O ATOM 902 OD2 ASP A 63 -8.641 20.211 -6.180 1.00 10.13 O ATOM 0 H ASP A 63 -9.316 20.429 -3.933 1.00 24.13 H new ATOM 0 HA ASP A 63 -10.342 17.937 -3.078 1.00 30.33 H new ATOM 0 HB2 ASP A 63 -9.857 17.334 -5.435 1.00 30.41 H new ATOM 0 HB3 ASP A 63 -10.649 18.895 -5.350 1.00 30.41 H new ATOM 906 N PHE A 64 -8.220 16.320 -3.600 1.00 20.22 N ATOM 907 CA PHE A 64 -7.111 15.380 -3.452 1.00 4.32 C ATOM 908 C PHE A 64 -6.530 15.084 -4.846 1.00 14.20 C ATOM 909 O PHE A 64 -7.238 15.265 -5.838 1.00 43.23 O ATOM 910 CB PHE A 64 -7.622 14.100 -2.753 1.00 64.34 C ATOM 911 CG PHE A 64 -8.920 13.517 -3.297 1.00 43.12 C ATOM 912 CD1 PHE A 64 -10.152 13.986 -2.804 1.00 50.23 C ATOM 913 CD2 PHE A 64 -8.912 12.523 -4.294 1.00 30.53 C ATOM 914 CE1 PHE A 64 -11.365 13.515 -3.334 1.00 34.22 C ATOM 915 CE2 PHE A 64 -10.128 12.031 -4.808 1.00 65.14 C ATOM 916 CZ PHE A 64 -11.354 12.541 -4.345 1.00 73.44 C ATOM 0 H PHE A 64 -9.030 15.888 -4.044 1.00 20.22 H new ATOM 0 HA PHE A 64 -6.318 15.800 -2.834 1.00 4.32 H new ATOM 0 HB2 PHE A 64 -6.847 13.337 -2.823 1.00 64.34 H new ATOM 0 HB3 PHE A 64 -7.760 14.318 -1.694 1.00 64.34 H new ATOM 0 HD1 PHE A 64 -10.165 14.717 -2.009 1.00 50.23 H new ATOM 0 HD2 PHE A 64 -7.974 12.138 -4.665 1.00 30.53 H new ATOM 0 HE1 PHE A 64 -12.303 13.901 -2.965 1.00 34.22 H new ATOM 0 HE2 PHE A 64 -10.119 11.258 -5.562 1.00 65.14 H new ATOM 0 HZ PHE A 64 -12.283 12.185 -4.765 1.00 73.44 H new ATOM 925 N PRO A 65 -5.275 14.617 -4.962 1.00 64.34 N ATOM 926 CA PRO A 65 -4.659 14.298 -6.246 1.00 21.50 C ATOM 927 C PRO A 65 -5.076 12.926 -6.744 1.00 35.50 C ATOM 928 O PRO A 65 -5.565 12.097 -5.976 1.00 53.04 O ATOM 929 CB PRO A 65 -3.159 14.319 -5.975 1.00 44.42 C ATOM 930 CG PRO A 65 -3.060 13.846 -4.531 1.00 13.23 C ATOM 931 CD PRO A 65 -4.327 14.398 -3.885 1.00 22.21 C ATOM 0 HA PRO A 65 -4.962 15.007 -7.016 1.00 21.50 H new ATOM 0 HB2 PRO A 65 -2.618 13.659 -6.653 1.00 44.42 H new ATOM 0 HB3 PRO A 65 -2.741 15.318 -6.101 1.00 44.42 H new ATOM 0 HG2 PRO A 65 -3.019 12.759 -4.467 1.00 13.23 H new ATOM 0 HG3 PRO A 65 -2.163 14.228 -4.045 1.00 13.23 H new ATOM 0 HD2 PRO A 65 -4.727 13.697 -3.153 1.00 22.21 H new ATOM 0 HD3 PRO A 65 -4.119 15.328 -3.355 1.00 22.21 H new ATOM 936 N GLU A 66 -4.791 12.700 -8.023 1.00 11.40 N ATOM 937 CA GLU A 66 -5.167 11.531 -8.813 1.00 35.12 C ATOM 938 C GLU A 66 -4.004 10.552 -8.954 1.00 54.32 C ATOM 939 O GLU A 66 -2.868 10.870 -8.601 1.00 13.51 O ATOM 940 CB GLU A 66 -5.599 12.021 -10.203 1.00 2.41 C ATOM 941 CG GLU A 66 -7.022 12.583 -10.196 1.00 61.00 C ATOM 942 CD GLU A 66 -8.067 11.521 -10.572 1.00 42.53 C ATOM 943 OE1 GLU A 66 -7.954 10.909 -11.659 1.00 15.54 O ATOM 944 OE2 GLU A 66 -8.982 11.228 -9.763 1.00 45.32 O ATOM 0 H GLU A 66 -4.256 13.373 -8.572 1.00 11.40 H new ATOM 0 HA GLU A 66 -5.979 11.005 -8.311 1.00 35.12 H new ATOM 0 HB2 GLU A 66 -4.907 12.790 -10.548 1.00 2.41 H new ATOM 0 HB3 GLU A 66 -5.538 11.196 -10.913 1.00 2.41 H new ATOM 0 HG2 GLU A 66 -7.249 12.980 -9.207 1.00 61.00 H new ATOM 0 HG3 GLU A 66 -7.085 13.416 -10.896 1.00 61.00 H new ATOM 949 N ILE A 67 -4.270 9.379 -9.544 1.00 42.33 N ATOM 950 CA ILE A 67 -3.245 8.441 -10.002 1.00 64.32 C ATOM 951 C ILE A 67 -3.393 8.192 -11.506 1.00 21.11 C ATOM 952 O ILE A 67 -4.424 8.532 -12.094 1.00 44.11 O ATOM 953 CB ILE A 67 -3.258 7.138 -9.172 1.00 2.50 C ATOM 954 CG1 ILE A 67 -4.545 6.320 -9.416 1.00 74.32 C ATOM 955 CG2 ILE A 67 -3.023 7.456 -7.684 1.00 32.42 C ATOM 956 CD1 ILE A 67 -4.543 4.966 -8.707 1.00 54.32 C ATOM 0 H ILE A 67 -5.221 9.053 -9.718 1.00 42.33 H new ATOM 0 HA ILE A 67 -2.263 8.886 -9.842 1.00 64.32 H new ATOM 0 HB ILE A 67 -2.437 6.502 -9.503 1.00 2.50 H new ATOM 0 HG12 ILE A 67 -5.405 6.898 -9.078 1.00 74.32 H new ATOM 0 HG13 ILE A 67 -4.669 6.161 -10.487 1.00 74.32 H new ATOM 0 HG21 ILE A 67 -3.034 6.531 -7.108 1.00 32.42 H new ATOM 0 HG22 ILE A 67 -2.057 7.946 -7.565 1.00 32.42 H new ATOM 0 HG23 ILE A 67 -3.812 8.117 -7.324 1.00 32.42 H new ATOM 0 HD11 ILE A 67 -5.475 4.443 -8.920 1.00 54.32 H new ATOM 0 HD12 ILE A 67 -3.703 4.370 -9.063 1.00 54.32 H new ATOM 0 HD13 ILE A 67 -4.450 5.118 -7.632 1.00 54.32 H new ATOM 967 N GLN A 68 -2.380 7.572 -12.112 1.00 71.42 N ATOM 968 CA GLN A 68 -2.284 7.305 -13.555 1.00 35.00 C ATOM 969 C GLN A 68 -2.336 5.795 -13.833 1.00 53.45 C ATOM 970 O GLN A 68 -1.650 5.292 -14.730 1.00 44.31 O ATOM 971 CB GLN A 68 -0.975 7.889 -14.119 1.00 32.44 C ATOM 972 CG GLN A 68 -0.637 9.328 -13.705 1.00 32.11 C ATOM 973 CD GLN A 68 -0.716 10.298 -14.871 1.00 61.34 C ATOM 974 OE1 GLN A 68 -1.623 11.250 -14.809 1.00 44.51 O flip ATOM 975 NE2 GLN A 68 0.049 10.192 -15.831 1.00 42.22 N flip ATOM 0 H GLN A 68 -1.571 7.227 -11.595 1.00 71.42 H new ATOM 0 HA GLN A 68 -3.132 7.782 -14.046 1.00 35.00 H new ATOM 0 HB2 GLN A 68 -0.152 7.243 -13.813 1.00 32.44 H new ATOM 0 HB3 GLN A 68 -1.024 7.849 -15.207 1.00 32.44 H new ATOM 0 HG2 GLN A 68 -1.324 9.649 -12.921 1.00 32.11 H new ATOM 0 HG3 GLN A 68 0.366 9.355 -13.280 1.00 32.11 H new ATOM 0 HE21 GLN A 68 0.742 9.444 -15.851 1.00 42.22 H new ATOM 0 HE22 GLN A 68 -0.011 10.853 -16.606 1.00 42.22 H new ATOM 982 N LEU A 69 -2.992 5.035 -12.959 1.00 14.42 N ATOM 983 CA LEU A 69 -2.899 3.579 -12.949 1.00 62.24 C ATOM 984 C LEU A 69 -3.889 2.980 -13.934 1.00 31.03 C ATOM 985 O LEU A 69 -5.041 3.419 -14.024 1.00 44.40 O ATOM 986 CB LEU A 69 -3.113 3.072 -11.523 1.00 0.24 C ATOM 987 CG LEU A 69 -2.642 1.637 -11.225 1.00 4.31 C ATOM 988 CD1 LEU A 69 -1.128 1.483 -11.422 1.00 75.02 C ATOM 989 CD2 LEU A 69 -2.966 1.332 -9.755 1.00 61.45 C ATOM 0 H LEU A 69 -3.604 5.414 -12.236 1.00 14.42 H new ATOM 0 HA LEU A 69 -1.907 3.263 -13.271 1.00 62.24 H new ATOM 0 HB2 LEU A 69 -2.599 3.748 -10.840 1.00 0.24 H new ATOM 0 HB3 LEU A 69 -4.177 3.136 -11.294 1.00 0.24 H new ATOM 0 HG LEU A 69 -3.148 0.955 -11.909 1.00 4.31 H new ATOM 0 HD11 LEU A 69 -0.835 0.456 -11.202 1.00 75.02 H new ATOM 0 HD12 LEU A 69 -0.869 1.721 -12.454 1.00 75.02 H new ATOM 0 HD13 LEU A 69 -0.603 2.162 -10.750 1.00 75.02 H new ATOM 0 HD21 LEU A 69 -2.643 0.319 -9.514 1.00 61.45 H new ATOM 0 HD22 LEU A 69 -2.445 2.042 -9.113 1.00 61.45 H new ATOM 0 HD23 LEU A 69 -4.041 1.418 -9.594 1.00 61.45 H new ATOM 1000 N ASP A 70 -3.424 1.976 -14.666 1.00 1.41 N ATOM 1001 CA ASP A 70 -4.264 1.216 -15.597 1.00 51.50 C ATOM 1002 C ASP A 70 -5.206 0.323 -14.782 1.00 14.53 C ATOM 1003 O ASP A 70 -5.005 0.146 -13.583 1.00 2.32 O ATOM 1004 CB ASP A 70 -3.422 0.389 -16.588 1.00 72.44 C ATOM 1005 CG ASP A 70 -3.025 1.162 -17.849 1.00 12.43 C ATOM 1006 OD1 ASP A 70 -3.940 1.653 -18.552 1.00 51.53 O ATOM 1007 OD2 ASP A 70 -1.836 1.181 -18.227 1.00 60.21 O ATOM 0 H ASP A 70 -2.454 1.662 -14.635 1.00 1.41 H new ATOM 0 HA ASP A 70 -4.847 1.910 -16.202 1.00 51.50 H new ATOM 0 HB2 ASP A 70 -2.519 0.043 -16.085 1.00 72.44 H new ATOM 0 HB3 ASP A 70 -3.985 -0.498 -16.878 1.00 72.44 H new ATOM 1011 N ASN A 71 -6.203 -0.287 -15.424 1.00 71.23 N ATOM 1012 CA ASN A 71 -7.275 -1.049 -14.788 1.00 3.24 C ATOM 1013 C ASN A 71 -6.723 -2.264 -14.051 1.00 13.34 C ATOM 1014 O ASN A 71 -5.913 -3.009 -14.608 1.00 32.34 O ATOM 1015 CB ASN A 71 -8.268 -1.514 -15.863 1.00 4.33 C ATOM 1016 CG ASN A 71 -9.590 -2.005 -15.290 1.00 43.31 C ATOM 1017 OD1 ASN A 71 -10.602 -1.323 -15.419 1.00 43.34 O ATOM 1018 ND2 ASN A 71 -9.629 -3.165 -14.656 1.00 71.43 N ATOM 0 H ASN A 71 -6.288 -0.262 -16.440 1.00 71.23 H new ATOM 0 HA ASN A 71 -7.774 -0.406 -14.063 1.00 3.24 H new ATOM 0 HB2 ASN A 71 -8.461 -0.690 -16.550 1.00 4.33 H new ATOM 0 HB3 ASN A 71 -7.813 -2.315 -16.446 1.00 4.33 H new ATOM 0 HD21 ASN A 71 -10.509 -3.504 -14.266 1.00 71.43 H new ATOM 0 HD22 ASN A 71 -8.779 -3.721 -14.557 1.00 71.43 H new ATOM 1024 N ILE A 72 -7.164 -2.480 -12.813 1.00 60.13 N ATOM 1025 CA ILE A 72 -6.782 -3.618 -11.985 1.00 11.35 C ATOM 1026 C ILE A 72 -8.057 -4.103 -11.281 1.00 61.41 C ATOM 1027 O ILE A 72 -9.062 -3.385 -11.213 1.00 41.34 O ATOM 1028 CB ILE A 72 -5.640 -3.202 -11.012 1.00 21.05 C ATOM 1029 CG1 ILE A 72 -4.391 -2.721 -11.781 1.00 40.53 C ATOM 1030 CG2 ILE A 72 -5.202 -4.335 -10.059 1.00 31.02 C ATOM 1031 CD1 ILE A 72 -3.332 -2.033 -10.921 1.00 20.45 C ATOM 0 H ILE A 72 -7.816 -1.849 -12.347 1.00 60.13 H new ATOM 0 HA ILE A 72 -6.376 -4.445 -12.568 1.00 11.35 H new ATOM 0 HB ILE A 72 -6.062 -2.392 -10.418 1.00 21.05 H new ATOM 0 HG12 ILE A 72 -3.935 -3.578 -12.277 1.00 40.53 H new ATOM 0 HG13 ILE A 72 -4.707 -2.031 -12.563 1.00 40.53 H new ATOM 0 HG21 ILE A 72 -4.404 -3.976 -9.410 1.00 31.02 H new ATOM 0 HG22 ILE A 72 -6.051 -4.648 -9.451 1.00 31.02 H new ATOM 0 HG23 ILE A 72 -4.842 -5.182 -10.642 1.00 31.02 H new ATOM 0 HD11 ILE A 72 -2.494 -1.731 -11.549 1.00 20.45 H new ATOM 0 HD12 ILE A 72 -3.765 -1.153 -10.445 1.00 20.45 H new ATOM 0 HD13 ILE A 72 -2.981 -2.724 -10.154 1.00 20.45 H new ATOM 1042 N ASP A 73 -7.998 -5.316 -10.742 1.00 3.23 N ATOM 1043 CA ASP A 73 -9.003 -5.953 -9.907 1.00 13.24 C ATOM 1044 C ASP A 73 -8.466 -6.012 -8.486 1.00 63.21 C ATOM 1045 O ASP A 73 -7.459 -6.695 -8.283 1.00 64.24 O ATOM 1046 CB ASP A 73 -9.213 -7.384 -10.408 1.00 75.10 C ATOM 1047 CG ASP A 73 -10.346 -8.054 -9.653 1.00 30.05 C ATOM 1048 OD1 ASP A 73 -11.490 -7.962 -10.137 1.00 11.53 O ATOM 1049 OD2 ASP A 73 -10.082 -8.719 -8.624 1.00 2.44 O ATOM 0 H ASP A 73 -7.189 -5.920 -10.889 1.00 3.23 H new ATOM 0 HA ASP A 73 -9.941 -5.399 -9.941 1.00 13.24 H new ATOM 0 HB2 ASP A 73 -9.437 -7.372 -11.475 1.00 75.10 H new ATOM 0 HB3 ASP A 73 -8.295 -7.958 -10.281 1.00 75.10 H new ATOM 1053 N TYR A 74 -9.084 -5.325 -7.519 1.00 41.33 N ATOM 1054 CA TYR A 74 -8.699 -5.426 -6.126 1.00 4.22 C ATOM 1055 C TYR A 74 -9.753 -6.222 -5.369 1.00 53.40 C ATOM 1056 O TYR A 74 -10.615 -5.708 -4.652 1.00 62.22 O ATOM 1057 CB TYR A 74 -8.469 -4.055 -5.497 1.00 21.31 C ATOM 1058 CG TYR A 74 -7.913 -2.966 -6.390 1.00 75.31 C ATOM 1059 CD1 TYR A 74 -6.597 -3.030 -6.885 1.00 11.13 C ATOM 1060 CD2 TYR A 74 -8.749 -1.891 -6.741 1.00 13.12 C ATOM 1061 CE1 TYR A 74 -6.139 -2.035 -7.767 1.00 71.33 C ATOM 1062 CE2 TYR A 74 -8.304 -0.910 -7.635 1.00 51.30 C ATOM 1063 CZ TYR A 74 -7.009 -0.997 -8.182 1.00 14.23 C ATOM 1064 OH TYR A 74 -6.616 -0.104 -9.129 1.00 0.22 O ATOM 0 H TYR A 74 -9.862 -4.688 -7.690 1.00 41.33 H new ATOM 0 HA TYR A 74 -7.746 -5.952 -6.065 1.00 4.22 H new ATOM 0 HB2 TYR A 74 -9.419 -3.706 -5.091 1.00 21.31 H new ATOM 0 HB3 TYR A 74 -7.789 -4.180 -4.654 1.00 21.31 H new ATOM 0 HD1 TYR A 74 -5.944 -3.838 -6.590 1.00 11.13 H new ATOM 0 HD2 TYR A 74 -9.740 -1.822 -6.318 1.00 13.12 H new ATOM 0 HE1 TYR A 74 -5.122 -2.062 -8.129 1.00 71.33 H new ATOM 0 HE2 TYR A 74 -8.952 -0.089 -7.904 1.00 51.30 H new ATOM 0 HH TYR A 74 -7.228 0.662 -9.130 1.00 0.22 H new ATOM 1073 N ASN A 75 -9.603 -7.530 -5.470 1.00 63.31 N ATOM 1074 CA ASN A 75 -10.397 -8.524 -4.768 1.00 24.33 C ATOM 1075 C ASN A 75 -9.674 -9.863 -4.711 1.00 0.12 C ATOM 1076 O ASN A 75 -9.547 -10.439 -3.639 1.00 14.54 O ATOM 1077 CB ASN A 75 -11.716 -8.693 -5.509 1.00 42.50 C ATOM 1078 CG ASN A 75 -12.646 -9.609 -4.737 1.00 73.33 C ATOM 1079 OD1 ASN A 75 -12.884 -10.741 -5.152 1.00 43.14 O ATOM 1080 ND2 ASN A 75 -13.190 -9.166 -3.622 1.00 4.42 N ATOM 0 H ASN A 75 -8.892 -7.948 -6.071 1.00 63.31 H new ATOM 0 HA ASN A 75 -10.567 -8.188 -3.745 1.00 24.33 H new ATOM 0 HB2 ASN A 75 -12.188 -7.721 -5.650 1.00 42.50 H new ATOM 0 HB3 ASN A 75 -11.532 -9.104 -6.501 1.00 42.50 H new ATOM 0 HD21 ASN A 75 -13.820 -9.765 -3.089 1.00 4.42 H new ATOM 0 HD22 ASN A 75 -12.981 -8.224 -3.292 1.00 4.42 H new ATOM 1086 N ASN A 76 -9.168 -10.336 -5.854 1.00 3.52 N ATOM 1087 CA ASN A 76 -8.590 -11.680 -5.996 1.00 32.34 C ATOM 1088 C ASN A 76 -7.226 -11.903 -5.302 1.00 42.10 C ATOM 1089 O ASN A 76 -6.691 -13.018 -5.363 1.00 73.22 O ATOM 1090 CB ASN A 76 -8.542 -12.088 -7.473 1.00 32.33 C ATOM 1091 CG ASN A 76 -7.432 -11.383 -8.217 1.00 72.22 C ATOM 1092 OD1 ASN A 76 -6.353 -11.929 -8.426 1.00 20.43 O ATOM 1093 ND2 ASN A 76 -7.685 -10.153 -8.617 1.00 0.32 N ATOM 0 H ASN A 76 -9.147 -9.793 -6.717 1.00 3.52 H new ATOM 0 HA ASN A 76 -9.268 -12.337 -5.451 1.00 32.34 H new ATOM 0 HB2 ASN A 76 -8.401 -13.166 -7.547 1.00 32.33 H new ATOM 0 HB3 ASN A 76 -9.498 -11.858 -7.944 1.00 32.33 H new ATOM 0 HD21 ASN A 76 -6.972 -9.623 -9.118 1.00 0.32 H new ATOM 0 HD22 ASN A 76 -8.594 -9.731 -8.426 1.00 0.32 H new ATOM 1099 N TYR A 77 -6.660 -10.876 -4.661 1.00 23.33 N ATOM 1100 CA TYR A 77 -5.484 -10.964 -3.794 1.00 22.34 C ATOM 1101 C TYR A 77 -5.935 -11.332 -2.379 1.00 75.40 C ATOM 1102 O TYR A 77 -7.073 -11.061 -1.999 1.00 43.33 O ATOM 1103 CB TYR A 77 -4.715 -9.642 -3.844 1.00 72.40 C ATOM 1104 CG TYR A 77 -4.303 -9.320 -5.271 1.00 34.33 C ATOM 1105 CD1 TYR A 77 -3.318 -10.099 -5.910 1.00 52.31 C ATOM 1106 CD2 TYR A 77 -4.975 -8.323 -5.997 1.00 52.50 C ATOM 1107 CE1 TYR A 77 -3.055 -9.943 -7.284 1.00 21.22 C ATOM 1108 CE2 TYR A 77 -4.692 -8.136 -7.360 1.00 71.30 C ATOM 1109 CZ TYR A 77 -3.760 -8.965 -8.020 1.00 54.42 C ATOM 1110 OH TYR A 77 -3.557 -8.805 -9.360 1.00 35.35 O ATOM 0 H TYR A 77 -7.023 -9.926 -4.735 1.00 23.33 H new ATOM 0 HA TYR A 77 -4.804 -11.744 -4.136 1.00 22.34 H new ATOM 0 HB2 TYR A 77 -5.336 -8.838 -3.448 1.00 72.40 H new ATOM 0 HB3 TYR A 77 -3.831 -9.704 -3.209 1.00 72.40 H new ATOM 0 HD1 TYR A 77 -2.758 -10.825 -5.339 1.00 52.31 H new ATOM 0 HD2 TYR A 77 -5.709 -7.700 -5.507 1.00 52.50 H new ATOM 0 HE1 TYR A 77 -2.320 -10.566 -7.772 1.00 21.22 H new ATOM 0 HE2 TYR A 77 -5.192 -7.351 -7.908 1.00 71.30 H new ATOM 0 HH TYR A 77 -4.132 -8.085 -9.694 1.00 35.35 H new ATOM 1119 N ASP A 78 -5.057 -11.972 -1.608 1.00 73.10 N ATOM 1120 CA ASP A 78 -5.275 -12.251 -0.184 1.00 63.01 C ATOM 1121 C ASP A 78 -4.530 -11.222 0.674 1.00 32.41 C ATOM 1122 O ASP A 78 -5.014 -10.800 1.721 1.00 62.32 O ATOM 1123 CB ASP A 78 -4.815 -13.683 0.115 1.00 35.20 C ATOM 1124 CG ASP A 78 -5.322 -14.240 1.443 1.00 61.04 C ATOM 1125 OD1 ASP A 78 -6.498 -14.009 1.809 1.00 2.12 O ATOM 1126 OD2 ASP A 78 -4.648 -15.124 2.005 1.00 31.01 O ATOM 0 H ASP A 78 -4.162 -12.317 -1.956 1.00 73.10 H new ATOM 0 HA ASP A 78 -6.334 -12.169 0.061 1.00 63.01 H new ATOM 0 HB2 ASP A 78 -5.150 -14.336 -0.691 1.00 35.20 H new ATOM 0 HB3 ASP A 78 -3.725 -13.710 0.115 1.00 35.20 H new ATOM 1130 N LEU A 79 -3.387 -10.728 0.190 1.00 51.13 N ATOM 1131 CA LEU A 79 -2.542 -9.751 0.865 1.00 4.52 C ATOM 1132 C LEU A 79 -2.158 -8.672 -0.149 1.00 22.31 C ATOM 1133 O LEU A 79 -1.815 -8.997 -1.289 1.00 1.30 O ATOM 1134 CB LEU A 79 -1.331 -10.501 1.438 1.00 34.44 C ATOM 1135 CG LEU A 79 -0.264 -9.614 2.099 1.00 13.43 C ATOM 1136 CD1 LEU A 79 -0.756 -8.867 3.342 1.00 32.30 C ATOM 1137 CD2 LEU A 79 0.939 -10.464 2.510 1.00 14.30 C ATOM 0 H LEU A 79 -3.015 -11.011 -0.717 1.00 51.13 H new ATOM 0 HA LEU A 79 -3.047 -9.253 1.692 1.00 4.52 H new ATOM 0 HB2 LEU A 79 -1.686 -11.223 2.173 1.00 34.44 H new ATOM 0 HB3 LEU A 79 -0.862 -11.068 0.634 1.00 34.44 H new ATOM 0 HG LEU A 79 0.000 -8.869 1.348 1.00 13.43 H new ATOM 0 HD11 LEU A 79 0.056 -8.264 3.749 1.00 32.30 H new ATOM 0 HD12 LEU A 79 -1.589 -8.219 3.071 1.00 32.30 H new ATOM 0 HD13 LEU A 79 -1.085 -9.586 4.092 1.00 32.30 H new ATOM 0 HD21 LEU A 79 1.691 -9.828 2.978 1.00 14.30 H new ATOM 0 HD22 LEU A 79 0.619 -11.229 3.218 1.00 14.30 H new ATOM 0 HD23 LEU A 79 1.365 -10.942 1.628 1.00 14.30 H new ATOM 1148 N ILE A 80 -2.189 -7.398 0.243 1.00 23.14 N ATOM 1149 CA ILE A 80 -1.773 -6.282 -0.608 1.00 73.23 C ATOM 1150 C ILE A 80 -0.895 -5.363 0.236 1.00 11.21 C ATOM 1151 O ILE A 80 -1.260 -5.009 1.356 1.00 72.34 O ATOM 1152 CB ILE A 80 -2.978 -5.537 -1.241 1.00 20.20 C ATOM 1153 CG1 ILE A 80 -3.911 -6.509 -2.001 1.00 55.53 C ATOM 1154 CG2 ILE A 80 -2.472 -4.422 -2.183 1.00 72.05 C ATOM 1155 CD1 ILE A 80 -5.034 -5.838 -2.805 1.00 21.01 C ATOM 0 H ILE A 80 -2.506 -7.109 1.168 1.00 23.14 H new ATOM 0 HA ILE A 80 -1.205 -6.657 -1.459 1.00 73.23 H new ATOM 0 HB ILE A 80 -3.560 -5.088 -0.436 1.00 20.20 H new ATOM 0 HG12 ILE A 80 -3.308 -7.110 -2.681 1.00 55.53 H new ATOM 0 HG13 ILE A 80 -4.360 -7.195 -1.282 1.00 55.53 H new ATOM 0 HG21 ILE A 80 -3.324 -3.904 -2.624 1.00 72.05 H new ATOM 0 HG22 ILE A 80 -1.869 -3.713 -1.616 1.00 72.05 H new ATOM 0 HG23 ILE A 80 -1.866 -4.862 -2.975 1.00 72.05 H new ATOM 0 HD11 ILE A 80 -5.633 -6.602 -3.301 1.00 21.01 H new ATOM 0 HD12 ILE A 80 -5.668 -5.260 -2.132 1.00 21.01 H new ATOM 0 HD13 ILE A 80 -4.600 -5.175 -3.553 1.00 21.01 H new ATOM 1166 N LEU A 81 0.277 -5.000 -0.278 1.00 72.41 N ATOM 1167 CA LEU A 81 1.211 -4.099 0.384 1.00 52.14 C ATOM 1168 C LEU A 81 1.280 -2.773 -0.381 1.00 53.42 C ATOM 1169 O LEU A 81 1.304 -2.794 -1.616 1.00 42.55 O ATOM 1170 CB LEU A 81 2.597 -4.755 0.379 1.00 52.53 C ATOM 1171 CG LEU A 81 2.819 -5.839 1.450 1.00 53.32 C ATOM 1172 CD1 LEU A 81 1.814 -6.979 1.573 1.00 21.20 C ATOM 1173 CD2 LEU A 81 4.234 -6.400 1.294 1.00 1.12 C ATOM 0 H LEU A 81 0.609 -5.331 -1.184 1.00 72.41 H new ATOM 0 HA LEU A 81 0.883 -3.906 1.405 1.00 52.14 H new ATOM 0 HB2 LEU A 81 2.767 -5.198 -0.602 1.00 52.53 H new ATOM 0 HB3 LEU A 81 3.349 -3.977 0.512 1.00 52.53 H new ATOM 0 HG LEU A 81 2.660 -5.303 2.386 1.00 53.32 H new ATOM 0 HD11 LEU A 81 2.122 -7.651 2.374 1.00 21.20 H new ATOM 0 HD12 LEU A 81 0.828 -6.572 1.799 1.00 21.20 H new ATOM 0 HD13 LEU A 81 1.772 -7.530 0.634 1.00 21.20 H new ATOM 0 HD21 LEU A 81 4.405 -7.169 2.047 1.00 1.12 H new ATOM 0 HD22 LEU A 81 4.346 -6.833 0.300 1.00 1.12 H new ATOM 0 HD23 LEU A 81 4.960 -5.597 1.424 1.00 1.12 H new ATOM 1184 N ILE A 82 1.351 -1.632 0.325 1.00 40.33 N ATOM 1185 CA ILE A 82 1.308 -0.303 -0.296 1.00 20.33 C ATOM 1186 C ILE A 82 2.422 0.629 0.192 1.00 42.51 C ATOM 1187 O ILE A 82 2.513 0.926 1.384 1.00 14.34 O ATOM 1188 CB ILE A 82 -0.079 0.347 -0.097 1.00 15.43 C ATOM 1189 CG1 ILE A 82 -1.199 -0.448 -0.807 1.00 3.44 C ATOM 1190 CG2 ILE A 82 -0.050 1.785 -0.649 1.00 0.20 C ATOM 1191 CD1 ILE A 82 -1.918 -1.451 0.097 1.00 2.14 C ATOM 0 H ILE A 82 1.440 -1.608 1.341 1.00 40.33 H new ATOM 0 HA ILE A 82 1.481 -0.454 -1.361 1.00 20.33 H new ATOM 0 HB ILE A 82 -0.296 0.349 0.971 1.00 15.43 H new ATOM 0 HG12 ILE A 82 -1.930 0.254 -1.208 1.00 3.44 H new ATOM 0 HG13 ILE A 82 -0.770 -0.981 -1.655 1.00 3.44 H new ATOM 0 HG21 ILE A 82 -1.027 2.248 -0.511 1.00 0.20 H new ATOM 0 HG22 ILE A 82 0.704 2.364 -0.116 1.00 0.20 H new ATOM 0 HG23 ILE A 82 0.193 1.762 -1.711 1.00 0.20 H new ATOM 0 HD11 ILE A 82 -2.689 -1.968 -0.474 1.00 2.14 H new ATOM 0 HD12 ILE A 82 -1.200 -2.177 0.478 1.00 2.14 H new ATOM 0 HD13 ILE A 82 -2.378 -0.923 0.932 1.00 2.14 H new ATOM 1202 N GLY A 83 3.206 1.191 -0.732 1.00 24.34 N ATOM 1203 CA GLY A 83 4.355 2.044 -0.438 1.00 52.15 C ATOM 1204 C GLY A 83 4.180 3.463 -1.001 1.00 0.44 C ATOM 1205 O GLY A 83 3.735 3.609 -2.142 1.00 21.32 O ATOM 0 H GLY A 83 3.053 1.060 -1.732 1.00 24.34 H new ATOM 0 HA2 GLY A 83 4.499 2.098 0.641 1.00 52.15 H new ATOM 0 HA3 GLY A 83 5.256 1.596 -0.858 1.00 52.15 H new ATOM 1209 N SER A 84 4.555 4.509 -0.254 1.00 60.03 N ATOM 1210 CA SER A 84 4.477 5.917 -0.669 1.00 14.41 C ATOM 1211 C SER A 84 5.557 6.756 0.060 1.00 61.51 C ATOM 1212 O SER A 84 6.083 6.309 1.088 1.00 52.15 O ATOM 1213 CB SER A 84 3.061 6.435 -0.415 1.00 75.51 C ATOM 1214 OG SER A 84 2.578 6.276 0.895 1.00 63.32 O ATOM 0 H SER A 84 4.933 4.396 0.686 1.00 60.03 H new ATOM 0 HA SER A 84 4.682 6.007 -1.736 1.00 14.41 H new ATOM 0 HB2 SER A 84 3.031 7.495 -0.667 1.00 75.51 H new ATOM 0 HB3 SER A 84 2.380 5.926 -1.097 1.00 75.51 H new ATOM 0 HG SER A 84 3.257 6.579 1.533 1.00 63.32 H new ATOM 1219 N PRO A 85 5.922 7.958 -0.435 1.00 62.24 N ATOM 1220 CA PRO A 85 6.861 8.856 0.243 1.00 55.12 C ATOM 1221 C PRO A 85 6.226 9.515 1.479 1.00 62.25 C ATOM 1222 O PRO A 85 5.000 9.500 1.643 1.00 2.31 O ATOM 1223 CB PRO A 85 7.250 9.915 -0.805 1.00 11.42 C ATOM 1224 CG PRO A 85 6.026 9.977 -1.705 1.00 41.42 C ATOM 1225 CD PRO A 85 5.533 8.530 -1.714 1.00 33.20 C ATOM 0 HA PRO A 85 7.730 8.310 0.611 1.00 55.12 H new ATOM 0 HB2 PRO A 85 7.460 10.880 -0.344 1.00 11.42 H new ATOM 0 HB3 PRO A 85 8.143 9.625 -1.359 1.00 11.42 H new ATOM 0 HG2 PRO A 85 5.271 10.658 -1.313 1.00 41.42 H new ATOM 0 HG3 PRO A 85 6.279 10.324 -2.707 1.00 41.42 H new ATOM 0 HD2 PRO A 85 4.452 8.489 -1.846 1.00 33.20 H new ATOM 0 HD3 PRO A 85 5.976 7.973 -2.540 1.00 33.20 H new ATOM 1230 N VAL A 86 7.050 10.183 2.290 1.00 42.33 N ATOM 1231 CA VAL A 86 6.648 11.019 3.418 1.00 74.21 C ATOM 1232 C VAL A 86 7.244 12.415 3.246 1.00 60.43 C ATOM 1233 O VAL A 86 8.462 12.554 3.124 1.00 74.15 O ATOM 1234 CB VAL A 86 7.102 10.415 4.763 1.00 21.11 C ATOM 1235 CG1 VAL A 86 6.487 11.213 5.928 1.00 42.01 C ATOM 1236 CG2 VAL A 86 6.721 8.948 4.911 1.00 74.31 C ATOM 0 H VAL A 86 8.062 10.153 2.170 1.00 42.33 H new ATOM 0 HA VAL A 86 5.560 11.076 3.433 1.00 74.21 H new ATOM 0 HB VAL A 86 8.190 10.477 4.784 1.00 21.11 H new ATOM 0 HG11 VAL A 86 6.811 10.782 6.875 1.00 42.01 H new ATOM 0 HG12 VAL A 86 6.814 12.251 5.871 1.00 42.01 H new ATOM 0 HG13 VAL A 86 5.400 11.171 5.864 1.00 42.01 H new ATOM 0 HG21 VAL A 86 7.066 8.578 5.876 1.00 74.31 H new ATOM 0 HG22 VAL A 86 5.638 8.845 4.850 1.00 74.31 H new ATOM 0 HG23 VAL A 86 7.186 8.369 4.113 1.00 74.31 H new ATOM 1246 N TRP A 87 6.379 13.429 3.267 1.00 44.14 N ATOM 1247 CA TRP A 87 6.720 14.835 3.413 1.00 21.23 C ATOM 1248 C TRP A 87 6.968 15.180 4.892 1.00 42.41 C ATOM 1249 O TRP A 87 6.988 14.316 5.772 1.00 33.32 O ATOM 1250 CB TRP A 87 5.607 15.696 2.766 1.00 22.20 C ATOM 1251 CG TRP A 87 5.992 16.288 1.445 1.00 71.35 C ATOM 1252 CD1 TRP A 87 6.287 17.586 1.199 1.00 42.13 C ATOM 1253 CD2 TRP A 87 6.083 15.608 0.157 1.00 1.42 C ATOM 1254 NE1 TRP A 87 6.610 17.740 -0.139 1.00 73.35 N ATOM 1255 CE2 TRP A 87 6.487 16.556 -0.826 1.00 13.12 C ATOM 1256 CE3 TRP A 87 5.812 14.297 -0.290 1.00 2.12 C ATOM 1257 CZ2 TRP A 87 6.634 16.219 -2.175 1.00 63.52 C ATOM 1258 CZ3 TRP A 87 5.928 13.955 -1.652 1.00 1.24 C ATOM 1259 CH2 TRP A 87 6.342 14.914 -2.594 1.00 73.31 C ATOM 0 H TRP A 87 5.374 13.280 3.178 1.00 44.14 H new ATOM 0 HA TRP A 87 7.652 15.055 2.892 1.00 21.23 H new ATOM 0 HB2 TRP A 87 4.717 15.082 2.633 1.00 22.20 H new ATOM 0 HB3 TRP A 87 5.339 16.501 3.450 1.00 22.20 H new ATOM 0 HD1 TRP A 87 6.273 18.379 1.932 1.00 42.13 H new ATOM 0 HE1 TRP A 87 6.902 18.621 -0.561 1.00 73.35 H new ATOM 0 HE3 TRP A 87 5.511 13.544 0.423 1.00 2.12 H new ATOM 0 HZ2 TRP A 87 6.970 16.958 -2.888 1.00 63.52 H new ATOM 0 HZ3 TRP A 87 5.698 12.950 -1.975 1.00 1.24 H new ATOM 0 HH2 TRP A 87 6.434 14.646 -3.636 1.00 73.31 H new ATOM 1269 N SER A 88 7.143 16.466 5.181 1.00 55.04 N ATOM 1270 CA SER A 88 7.447 17.088 6.467 1.00 11.23 C ATOM 1271 C SER A 88 6.369 16.936 7.561 1.00 54.11 C ATOM 1272 O SER A 88 6.433 17.602 8.598 1.00 54.45 O ATOM 1273 CB SER A 88 7.763 18.554 6.172 1.00 71.51 C ATOM 1274 OG SER A 88 8.714 18.594 5.120 1.00 43.41 O ATOM 0 H SER A 88 7.068 17.170 4.446 1.00 55.04 H new ATOM 0 HA SER A 88 8.294 16.562 6.908 1.00 11.23 H new ATOM 0 HB2 SER A 88 6.857 19.089 5.887 1.00 71.51 H new ATOM 0 HB3 SER A 88 8.158 19.045 7.061 1.00 71.51 H new ATOM 0 HG SER A 88 8.932 19.526 4.911 1.00 43.41 H new ATOM 1279 N GLY A 89 5.420 16.019 7.384 1.00 42.11 N ATOM 1280 CA GLY A 89 4.506 15.539 8.408 1.00 52.15 C ATOM 1281 C GLY A 89 3.767 14.318 7.884 1.00 34.41 C ATOM 1282 O GLY A 89 3.713 13.283 8.552 1.00 23.24 O ATOM 0 H GLY A 89 5.264 15.573 6.480 1.00 42.11 H new ATOM 0 HA2 GLY A 89 5.056 15.285 9.314 1.00 52.15 H new ATOM 0 HA3 GLY A 89 3.796 16.322 8.675 1.00 52.15 H new ATOM 1286 N TYR A 90 3.237 14.433 6.670 1.00 52.05 N ATOM 1287 CA TYR A 90 2.251 13.532 6.095 1.00 54.45 C ATOM 1288 C TYR A 90 2.750 12.955 4.770 1.00 75.12 C ATOM 1289 O TYR A 90 3.704 13.474 4.188 1.00 52.35 O ATOM 1290 CB TYR A 90 0.914 14.287 5.930 1.00 22.22 C ATOM 1291 CG TYR A 90 0.982 15.806 5.806 1.00 20.12 C ATOM 1292 CD1 TYR A 90 1.736 16.439 4.794 1.00 31.44 C ATOM 1293 CD2 TYR A 90 0.309 16.593 6.758 1.00 13.20 C ATOM 1294 CE1 TYR A 90 1.869 17.843 4.785 1.00 22.24 C ATOM 1295 CE2 TYR A 90 0.436 17.989 6.755 1.00 22.12 C ATOM 1296 CZ TYR A 90 1.232 18.624 5.780 1.00 23.32 C ATOM 1297 OH TYR A 90 1.460 19.966 5.882 1.00 13.30 O ATOM 0 H TYR A 90 3.495 15.189 6.036 1.00 52.05 H new ATOM 0 HA TYR A 90 2.091 12.686 6.764 1.00 54.45 H new ATOM 0 HB2 TYR A 90 0.413 13.898 5.043 1.00 22.22 H new ATOM 0 HB3 TYR A 90 0.282 14.046 6.785 1.00 22.22 H new ATOM 0 HD1 TYR A 90 2.212 15.847 4.026 1.00 31.44 H new ATOM 0 HD2 TYR A 90 -0.313 16.116 7.501 1.00 13.20 H new ATOM 0 HE1 TYR A 90 2.458 18.324 4.018 1.00 22.24 H new ATOM 0 HE2 TYR A 90 -0.077 18.579 7.501 1.00 22.12 H new ATOM 0 HH TYR A 90 1.347 20.385 5.003 1.00 13.30 H new ATOM 1306 N PRO A 91 2.130 11.875 4.267 1.00 44.04 N ATOM 1307 CA PRO A 91 2.246 11.522 2.863 1.00 44.15 C ATOM 1308 C PRO A 91 1.621 12.611 1.989 1.00 40.13 C ATOM 1309 O PRO A 91 0.689 13.295 2.397 1.00 21.54 O ATOM 1310 CB PRO A 91 1.526 10.182 2.711 1.00 33.14 C ATOM 1311 CG PRO A 91 0.592 10.091 3.923 1.00 24.11 C ATOM 1312 CD PRO A 91 1.246 10.968 4.984 1.00 23.20 C ATOM 0 HA PRO A 91 3.284 11.437 2.543 1.00 44.15 H new ATOM 0 HB2 PRO A 91 0.965 10.139 1.777 1.00 33.14 H new ATOM 0 HB3 PRO A 91 2.234 9.353 2.696 1.00 33.14 H new ATOM 0 HG2 PRO A 91 -0.409 10.446 3.679 1.00 24.11 H new ATOM 0 HG3 PRO A 91 0.490 9.062 4.268 1.00 24.11 H new ATOM 0 HD2 PRO A 91 0.496 11.521 5.550 1.00 23.20 H new ATOM 0 HD3 PRO A 91 1.804 10.364 5.700 1.00 23.20 H new ATOM 1317 N ALA A 92 2.070 12.685 0.739 1.00 35.42 N ATOM 1318 CA ALA A 92 1.560 13.523 -0.346 1.00 72.14 C ATOM 1319 C ALA A 92 0.229 12.968 -0.904 1.00 61.23 C ATOM 1320 O ALA A 92 0.027 12.897 -2.115 1.00 2.12 O ATOM 1321 CB ALA A 92 2.674 13.586 -1.400 1.00 40.02 C ATOM 0 H ALA A 92 2.861 12.118 0.433 1.00 35.42 H new ATOM 0 HA ALA A 92 1.319 14.528 -0.001 1.00 72.14 H new ATOM 0 HB1 ALA A 92 2.348 14.202 -2.238 1.00 40.02 H new ATOM 0 HB2 ALA A 92 3.570 14.021 -0.957 1.00 40.02 H new ATOM 0 HB3 ALA A 92 2.897 12.580 -1.754 1.00 40.02 H new ATOM 1327 N THR A 93 -0.589 12.385 -0.027 1.00 35.20 N ATOM 1328 CA THR A 93 -1.921 11.831 -0.280 1.00 51.05 C ATOM 1329 C THR A 93 -2.010 11.005 -1.597 1.00 42.23 C ATOM 1330 O THR A 93 -2.883 11.297 -2.413 1.00 44.25 O ATOM 1331 CB THR A 93 -2.957 12.979 -0.188 1.00 31.23 C ATOM 1332 OG1 THR A 93 -2.650 13.977 -1.141 1.00 24.32 O ATOM 1333 CG2 THR A 93 -3.007 13.630 1.203 1.00 22.32 C ATOM 0 H THR A 93 -0.319 12.280 0.951 1.00 35.20 H new ATOM 0 HA THR A 93 -2.151 11.093 0.489 1.00 51.05 H new ATOM 0 HB THR A 93 -3.933 12.535 -0.384 1.00 31.23 H new ATOM 0 HG1 THR A 93 -2.169 14.710 -0.703 1.00 24.32 H new ATOM 0 HG21 THR A 93 -3.751 14.427 1.205 1.00 22.32 H new ATOM 0 HG22 THR A 93 -3.277 12.880 1.946 1.00 22.32 H new ATOM 0 HG23 THR A 93 -2.029 14.046 1.445 1.00 22.32 H new ATOM 1341 N PRO A 94 -1.158 9.987 -1.853 1.00 55.35 N ATOM 1342 CA PRO A 94 -1.114 9.289 -3.150 1.00 40.22 C ATOM 1343 C PRO A 94 -1.986 8.042 -3.201 1.00 13.30 C ATOM 1344 O PRO A 94 -2.162 7.467 -4.274 1.00 21.30 O ATOM 1345 CB PRO A 94 0.362 8.875 -3.316 1.00 44.02 C ATOM 1346 CG PRO A 94 0.772 8.587 -1.882 1.00 72.13 C ATOM 1347 CD PRO A 94 -0.021 9.578 -1.042 1.00 40.43 C ATOM 0 HA PRO A 94 -1.491 9.942 -3.937 1.00 40.22 H new ATOM 0 HB2 PRO A 94 0.471 7.999 -3.955 1.00 44.02 H new ATOM 0 HB3 PRO A 94 0.961 9.670 -3.760 1.00 44.02 H new ATOM 0 HG2 PRO A 94 0.540 7.559 -1.604 1.00 72.13 H new ATOM 0 HG3 PRO A 94 1.845 8.721 -1.743 1.00 72.13 H new ATOM 0 HD2 PRO A 94 -0.353 9.119 -0.111 1.00 40.43 H new ATOM 0 HD3 PRO A 94 0.593 10.437 -0.773 1.00 40.43 H new ATOM 1352 N ILE A 95 -2.477 7.574 -2.054 1.00 21.53 N ATOM 1353 CA ILE A 95 -3.219 6.328 -1.975 1.00 34.20 C ATOM 1354 C ILE A 95 -4.722 6.650 -1.904 1.00 53.04 C ATOM 1355 O ILE A 95 -5.531 5.768 -2.151 1.00 54.04 O ATOM 1356 CB ILE A 95 -2.659 5.433 -0.828 1.00 72.15 C ATOM 1357 CG1 ILE A 95 -1.109 5.356 -0.764 1.00 52.21 C ATOM 1358 CG2 ILE A 95 -3.187 3.998 -0.954 1.00 15.21 C ATOM 1359 CD1 ILE A 95 -0.368 4.985 -2.066 1.00 2.31 C ATOM 0 H ILE A 95 -2.369 8.051 -1.159 1.00 21.53 H new ATOM 0 HA ILE A 95 -3.088 5.721 -2.871 1.00 34.20 H new ATOM 0 HB ILE A 95 -3.005 5.916 0.086 1.00 72.15 H new ATOM 0 HG12 ILE A 95 -0.736 6.323 -0.427 1.00 52.21 H new ATOM 0 HG13 ILE A 95 -0.838 4.626 -0.001 1.00 52.21 H new ATOM 0 HG21 ILE A 95 -2.784 3.390 -0.144 1.00 15.21 H new ATOM 0 HG22 ILE A 95 -4.275 4.004 -0.896 1.00 15.21 H new ATOM 0 HG23 ILE A 95 -2.877 3.579 -1.911 1.00 15.21 H new ATOM 0 HD11 ILE A 95 0.706 4.967 -1.881 1.00 2.31 H new ATOM 0 HD12 ILE A 95 -0.695 4.001 -2.403 1.00 2.31 H new ATOM 0 HD13 ILE A 95 -0.591 5.724 -2.835 1.00 2.31 H new ATOM 1370 N LYS A 96 -5.131 7.904 -1.657 1.00 3.13 N ATOM 1371 CA LYS A 96 -6.530 8.312 -1.496 1.00 52.41 C ATOM 1372 C LYS A 96 -7.378 7.919 -2.714 1.00 41.35 C ATOM 1373 O LYS A 96 -8.427 7.309 -2.516 1.00 61.34 O ATOM 1374 CB LYS A 96 -6.572 9.816 -1.149 1.00 32.34 C ATOM 1375 CG LYS A 96 -7.955 10.485 -1.109 1.00 52.12 C ATOM 1376 CD LYS A 96 -8.928 9.879 -0.083 1.00 41.04 C ATOM 1377 CE LYS A 96 -9.883 10.913 0.539 1.00 24.42 C ATOM 1378 NZ LYS A 96 -10.728 11.618 -0.439 1.00 52.24 N ATOM 0 H LYS A 96 -4.478 8.681 -1.562 1.00 3.13 H new ATOM 0 HA LYS A 96 -6.988 7.774 -0.666 1.00 52.41 H new ATOM 0 HB2 LYS A 96 -6.102 9.952 -0.175 1.00 32.34 H new ATOM 0 HB3 LYS A 96 -5.959 10.349 -1.876 1.00 32.34 H new ATOM 0 HG2 LYS A 96 -7.826 11.544 -0.887 1.00 52.12 H new ATOM 0 HG3 LYS A 96 -8.405 10.420 -2.100 1.00 52.12 H new ATOM 0 HD2 LYS A 96 -9.515 9.098 -0.567 1.00 41.04 H new ATOM 0 HD3 LYS A 96 -8.355 9.401 0.711 1.00 41.04 H new ATOM 0 HE2 LYS A 96 -10.525 10.409 1.261 1.00 24.42 H new ATOM 0 HE3 LYS A 96 -9.296 11.647 1.091 1.00 24.42 H new ATOM 0 HZ1 LYS A 96 -11.486 12.127 0.060 1.00 52.24 H new ATOM 0 HZ2 LYS A 96 -10.149 12.297 -0.973 1.00 52.24 H new ATOM 0 HZ3 LYS A 96 -11.148 10.929 -1.096 1.00 52.24 H new ATOM 1388 N THR A 97 -6.918 8.171 -3.945 1.00 60.13 N ATOM 1389 CA THR A 97 -7.683 7.813 -5.153 1.00 74.14 C ATOM 1390 C THR A 97 -7.977 6.313 -5.204 1.00 35.43 C ATOM 1391 O THR A 97 -9.038 5.885 -5.666 1.00 62.21 O ATOM 1392 CB THR A 97 -6.869 8.179 -6.407 1.00 23.31 C ATOM 1393 OG1 THR A 97 -6.338 9.471 -6.277 1.00 15.23 O ATOM 1394 CG2 THR A 97 -7.645 8.057 -7.720 1.00 0.31 C ATOM 0 H THR A 97 -6.022 8.620 -4.134 1.00 60.13 H new ATOM 0 HA THR A 97 -8.624 8.363 -5.122 1.00 74.14 H new ATOM 0 HB THR A 97 -6.067 7.443 -6.467 1.00 23.31 H new ATOM 0 HG1 THR A 97 -5.494 9.529 -6.771 1.00 15.23 H new ATOM 0 HG21 THR A 97 -6.998 8.333 -8.552 1.00 0.31 H new ATOM 0 HG22 THR A 97 -7.983 7.029 -7.849 1.00 0.31 H new ATOM 0 HG23 THR A 97 -8.508 8.722 -7.696 1.00 0.31 H new ATOM 1402 N LEU A 98 -6.998 5.514 -4.779 1.00 33.12 N ATOM 1403 CA LEU A 98 -6.967 4.069 -4.915 1.00 62.34 C ATOM 1404 C LEU A 98 -7.720 3.414 -3.766 1.00 72.14 C ATOM 1405 O LEU A 98 -8.444 2.447 -3.967 1.00 12.15 O ATOM 1406 CB LEU A 98 -5.494 3.650 -4.929 1.00 64.34 C ATOM 1407 CG LEU A 98 -5.250 2.226 -5.439 1.00 43.54 C ATOM 1408 CD1 LEU A 98 -5.896 1.956 -6.798 1.00 41.24 C ATOM 1409 CD2 LEU A 98 -3.741 2.046 -5.581 1.00 23.30 C ATOM 0 H LEU A 98 -6.170 5.880 -4.310 1.00 33.12 H new ATOM 0 HA LEU A 98 -7.456 3.749 -5.835 1.00 62.34 H new ATOM 0 HB2 LEU A 98 -4.935 4.348 -5.553 1.00 64.34 H new ATOM 0 HB3 LEU A 98 -5.094 3.735 -3.919 1.00 64.34 H new ATOM 0 HG LEU A 98 -5.696 1.530 -4.728 1.00 43.54 H new ATOM 0 HD11 LEU A 98 -5.686 0.931 -7.103 1.00 41.24 H new ATOM 0 HD12 LEU A 98 -6.974 2.099 -6.723 1.00 41.24 H new ATOM 0 HD13 LEU A 98 -5.489 2.645 -7.538 1.00 41.24 H new ATOM 0 HD21 LEU A 98 -3.527 1.040 -5.943 1.00 23.30 H new ATOM 0 HD22 LEU A 98 -3.352 2.777 -6.290 1.00 23.30 H new ATOM 0 HD23 LEU A 98 -3.264 2.191 -4.612 1.00 23.30 H new ATOM 1420 N LEU A 99 -7.613 3.988 -2.572 1.00 14.32 N ATOM 1421 CA LEU A 99 -8.377 3.608 -1.400 1.00 43.43 C ATOM 1422 C LEU A 99 -9.861 3.749 -1.687 1.00 74.44 C ATOM 1423 O LEU A 99 -10.629 2.882 -1.279 1.00 22.11 O ATOM 1424 CB LEU A 99 -7.978 4.495 -0.209 1.00 11.12 C ATOM 1425 CG LEU A 99 -6.811 3.866 0.557 1.00 31.54 C ATOM 1426 CD1 LEU A 99 -6.030 4.924 1.338 1.00 61.14 C ATOM 1427 CD2 LEU A 99 -7.324 2.767 1.491 1.00 3.10 C ATOM 0 H LEU A 99 -6.968 4.757 -2.393 1.00 14.32 H new ATOM 0 HA LEU A 99 -8.164 2.568 -1.151 1.00 43.43 H new ATOM 0 HB2 LEU A 99 -7.696 5.486 -0.564 1.00 11.12 H new ATOM 0 HB3 LEU A 99 -8.831 4.625 0.457 1.00 11.12 H new ATOM 0 HG LEU A 99 -6.128 3.418 -0.165 1.00 31.54 H new ATOM 0 HD11 LEU A 99 -5.207 4.448 1.872 1.00 61.14 H new ATOM 0 HD12 LEU A 99 -5.632 5.667 0.647 1.00 61.14 H new ATOM 0 HD13 LEU A 99 -6.693 5.412 2.053 1.00 61.14 H new ATOM 0 HD21 LEU A 99 -6.485 2.327 2.030 1.00 3.10 H new ATOM 0 HD22 LEU A 99 -8.029 3.195 2.204 1.00 3.10 H new ATOM 0 HD23 LEU A 99 -7.823 1.995 0.905 1.00 3.10 H new ATOM 1438 N ASP A 100 -10.292 4.797 -2.383 1.00 44.33 N ATOM 1439 CA ASP A 100 -11.714 4.977 -2.679 1.00 53.02 C ATOM 1440 C ASP A 100 -12.262 3.831 -3.537 1.00 33.15 C ATOM 1441 O ASP A 100 -13.387 3.374 -3.334 1.00 70.44 O ATOM 1442 CB ASP A 100 -11.959 6.336 -3.335 1.00 63.10 C ATOM 1443 CG ASP A 100 -13.361 6.826 -2.975 1.00 5.12 C ATOM 1444 OD1 ASP A 100 -13.509 7.359 -1.848 1.00 1.23 O ATOM 1445 OD2 ASP A 100 -14.295 6.632 -3.784 1.00 23.53 O ATOM 0 H ASP A 100 -9.685 5.530 -2.751 1.00 44.33 H new ATOM 0 HA ASP A 100 -12.259 4.955 -1.735 1.00 53.02 H new ATOM 0 HB2 ASP A 100 -11.212 7.055 -2.998 1.00 63.10 H new ATOM 0 HB3 ASP A 100 -11.857 6.254 -4.417 1.00 63.10 H new ATOM 1449 N GLN A 101 -11.418 3.277 -4.409 1.00 52.23 N ATOM 1450 CA GLN A 101 -11.752 2.204 -5.346 1.00 70.23 C ATOM 1451 C GLN A 101 -11.370 0.820 -4.791 1.00 30.31 C ATOM 1452 O GLN A 101 -11.520 -0.184 -5.482 1.00 51.21 O ATOM 1453 CB GLN A 101 -11.186 2.525 -6.746 1.00 53.51 C ATOM 1454 CG GLN A 101 -9.684 2.696 -6.741 1.00 71.22 C ATOM 1455 CD GLN A 101 -9.101 3.169 -8.073 1.00 50.21 C ATOM 1456 OE1 GLN A 101 -8.726 2.386 -8.943 1.00 15.53 O ATOM 1457 NE2 GLN A 101 -8.950 4.475 -8.237 1.00 43.30 N ATOM 0 H GLN A 101 -10.446 3.575 -4.484 1.00 52.23 H new ATOM 0 HA GLN A 101 -12.834 2.150 -5.467 1.00 70.23 H new ATOM 0 HB2 GLN A 101 -11.454 1.724 -7.435 1.00 53.51 H new ATOM 0 HB3 GLN A 101 -11.650 3.437 -7.121 1.00 53.51 H new ATOM 0 HG2 GLN A 101 -9.414 3.412 -5.965 1.00 71.22 H new ATOM 0 HG3 GLN A 101 -9.223 1.746 -6.473 1.00 71.22 H new ATOM 0 HE21 GLN A 101 -9.263 5.120 -7.511 1.00 43.30 H new ATOM 0 HE22 GLN A 101 -8.521 4.836 -9.089 1.00 43.30 H new ATOM 1464 N MET A 102 -10.916 0.725 -3.536 1.00 51.21 N ATOM 1465 CA MET A 102 -10.444 -0.510 -2.897 1.00 63.31 C ATOM 1466 C MET A 102 -11.500 -1.196 -2.014 1.00 22.25 C ATOM 1467 O MET A 102 -11.214 -2.249 -1.448 1.00 25.44 O ATOM 1468 CB MET A 102 -9.175 -0.188 -2.078 1.00 4.51 C ATOM 1469 CG MET A 102 -7.874 -0.472 -2.849 1.00 52.43 C ATOM 1470 SD MET A 102 -6.719 -1.655 -2.094 1.00 31.41 S ATOM 1471 CE MET A 102 -7.839 -3.000 -1.656 1.00 14.13 C ATOM 0 H MET A 102 -10.865 1.533 -2.916 1.00 51.21 H new ATOM 0 HA MET A 102 -10.223 -1.225 -3.690 1.00 63.31 H new ATOM 0 HB2 MET A 102 -9.195 0.862 -1.785 1.00 4.51 H new ATOM 0 HB3 MET A 102 -9.183 -0.776 -1.160 1.00 4.51 H new ATOM 0 HG2 MET A 102 -8.139 -0.841 -3.840 1.00 52.43 H new ATOM 0 HG3 MET A 102 -7.349 0.473 -2.990 1.00 52.43 H new ATOM 0 HE1 MET A 102 -7.327 -3.954 -1.778 1.00 14.13 H new ATOM 0 HE2 MET A 102 -8.154 -2.888 -0.619 1.00 14.13 H new ATOM 0 HE3 MET A 102 -8.713 -2.972 -2.306 1.00 14.13 H new ATOM 1479 N LYS A 103 -12.712 -0.642 -1.880 1.00 42.14 N ATOM 1480 CA LYS A 103 -13.661 -1.040 -0.833 1.00 30.13 C ATOM 1481 C LYS A 103 -14.029 -2.524 -0.854 1.00 22.23 C ATOM 1482 O LYS A 103 -14.371 -3.076 0.193 1.00 70.34 O ATOM 1483 CB LYS A 103 -14.938 -0.184 -0.947 1.00 73.23 C ATOM 1484 CG LYS A 103 -14.784 1.276 -0.491 1.00 32.12 C ATOM 1485 CD LYS A 103 -14.782 1.388 1.040 1.00 34.12 C ATOM 1486 CE LYS A 103 -14.330 2.777 1.495 1.00 24.35 C ATOM 1487 NZ LYS A 103 -14.384 2.907 2.967 1.00 34.43 N ATOM 0 H LYS A 103 -13.062 0.094 -2.494 1.00 42.14 H new ATOM 0 HA LYS A 103 -13.159 -0.869 0.119 1.00 30.13 H new ATOM 0 HB2 LYS A 103 -15.271 -0.192 -1.985 1.00 73.23 H new ATOM 0 HB3 LYS A 103 -15.725 -0.652 -0.356 1.00 73.23 H new ATOM 0 HG2 LYS A 103 -13.856 1.687 -0.888 1.00 32.12 H new ATOM 0 HG3 LYS A 103 -15.598 1.874 -0.900 1.00 32.12 H new ATOM 0 HD2 LYS A 103 -15.782 1.185 1.423 1.00 34.12 H new ATOM 0 HD3 LYS A 103 -14.120 0.632 1.461 1.00 34.12 H new ATOM 0 HE2 LYS A 103 -13.313 2.962 1.149 1.00 24.35 H new ATOM 0 HE3 LYS A 103 -14.965 3.536 1.038 1.00 24.35 H new ATOM 0 HZ1 LYS A 103 -14.072 3.860 3.243 1.00 34.43 H new ATOM 0 HZ2 LYS A 103 -15.360 2.754 3.293 1.00 34.43 H new ATOM 0 HZ3 LYS A 103 -13.759 2.198 3.401 1.00 34.43 H new ATOM 1497 N ASN A 104 -13.953 -3.165 -2.021 1.00 3.55 N ATOM 1498 CA ASN A 104 -14.376 -4.547 -2.268 1.00 24.03 C ATOM 1499 C ASN A 104 -13.286 -5.562 -1.893 1.00 65.21 C ATOM 1500 O ASN A 104 -13.400 -6.736 -2.249 1.00 10.55 O ATOM 1501 CB ASN A 104 -14.830 -4.727 -3.737 1.00 73.03 C ATOM 1502 CG ASN A 104 -16.150 -4.019 -4.014 1.00 54.14 C ATOM 1503 OD1 ASN A 104 -17.199 -4.641 -4.172 1.00 71.43 O ATOM 1504 ND2 ASN A 104 -16.134 -2.702 -4.033 1.00 34.03 N ATOM 0 H ASN A 104 -13.579 -2.717 -2.857 1.00 3.55 H new ATOM 0 HA ASN A 104 -15.229 -4.747 -1.619 1.00 24.03 H new ATOM 0 HB2 ASN A 104 -14.062 -4.337 -4.405 1.00 73.03 H new ATOM 0 HB3 ASN A 104 -14.935 -5.789 -3.957 1.00 73.03 H new ATOM 0 HD21 ASN A 104 -17.000 -2.184 -4.180 1.00 34.03 H new ATOM 0 HD22 ASN A 104 -15.256 -2.201 -3.900 1.00 34.03 H new ATOM 1510 N TYR A 105 -12.210 -5.138 -1.224 1.00 11.13 N ATOM 1511 CA TYR A 105 -11.140 -6.028 -0.790 1.00 54.31 C ATOM 1512 C TYR A 105 -11.625 -7.110 0.179 1.00 51.32 C ATOM 1513 O TYR A 105 -12.674 -6.981 0.817 1.00 32.12 O ATOM 1514 CB TYR A 105 -10.010 -5.218 -0.137 1.00 61.13 C ATOM 1515 CG TYR A 105 -10.122 -5.043 1.367 1.00 52.12 C ATOM 1516 CD1 TYR A 105 -11.286 -4.496 1.944 1.00 45.31 C ATOM 1517 CD2 TYR A 105 -9.084 -5.510 2.196 1.00 41.34 C ATOM 1518 CE1 TYR A 105 -11.426 -4.447 3.341 1.00 72.33 C ATOM 1519 CE2 TYR A 105 -9.214 -5.445 3.591 1.00 52.31 C ATOM 1520 CZ TYR A 105 -10.396 -4.939 4.167 1.00 13.55 C ATOM 1521 OH TYR A 105 -10.543 -4.943 5.515 1.00 24.11 O ATOM 0 H TYR A 105 -12.060 -4.162 -0.969 1.00 11.13 H new ATOM 0 HA TYR A 105 -10.770 -6.534 -1.682 1.00 54.31 H new ATOM 0 HB2 TYR A 105 -9.061 -5.705 -0.360 1.00 61.13 H new ATOM 0 HB3 TYR A 105 -9.978 -4.232 -0.600 1.00 61.13 H new ATOM 0 HD1 TYR A 105 -12.072 -4.113 1.310 1.00 45.31 H new ATOM 0 HD2 TYR A 105 -8.186 -5.919 1.757 1.00 41.34 H new ATOM 0 HE1 TYR A 105 -12.321 -4.033 3.781 1.00 72.33 H new ATOM 0 HE2 TYR A 105 -8.407 -5.783 4.224 1.00 52.31 H new ATOM 0 HH TYR A 105 -10.322 -5.831 5.866 1.00 24.11 H new ATOM 1530 N ARG A 106 -10.811 -8.158 0.310 1.00 22.32 N ATOM 1531 CA ARG A 106 -10.943 -9.286 1.222 1.00 65.34 C ATOM 1532 C ARG A 106 -9.516 -9.704 1.571 1.00 52.34 C ATOM 1533 O ARG A 106 -8.861 -10.260 0.687 1.00 61.42 O ATOM 1534 CB ARG A 106 -11.720 -10.416 0.556 1.00 54.44 C ATOM 1535 CG ARG A 106 -13.124 -9.915 0.204 1.00 11.32 C ATOM 1536 CD ARG A 106 -13.933 -11.066 -0.331 1.00 1.42 C ATOM 1537 NE ARG A 106 -15.111 -10.573 -1.060 1.00 12.24 N ATOM 1538 CZ ARG A 106 -15.716 -11.158 -2.094 1.00 70.33 C ATOM 1539 NH1 ARG A 106 -15.172 -12.218 -2.686 1.00 61.30 N ATOM 1540 NH2 ARG A 106 -16.855 -10.658 -2.549 1.00 65.13 N ATOM 0 H ARG A 106 -9.975 -8.243 -0.268 1.00 22.32 H new ATOM 0 HA ARG A 106 -11.499 -9.026 2.123 1.00 65.34 H new ATOM 0 HB2 ARG A 106 -11.203 -10.750 -0.344 1.00 54.44 H new ATOM 0 HB3 ARG A 106 -11.783 -11.275 1.224 1.00 54.44 H new ATOM 0 HG2 ARG A 106 -13.606 -9.494 1.086 1.00 11.32 H new ATOM 0 HG3 ARG A 106 -13.065 -9.119 -0.538 1.00 11.32 H new ATOM 0 HD2 ARG A 106 -13.317 -11.675 -0.993 1.00 1.42 H new ATOM 0 HD3 ARG A 106 -14.249 -11.709 0.491 1.00 1.42 H new ATOM 0 HE ARG A 106 -15.508 -9.689 -0.741 1.00 12.24 H new ATOM 0 HH11 ARG A 106 -14.284 -12.590 -2.349 1.00 61.30 H new ATOM 0 HH12 ARG A 106 -15.643 -12.658 -3.476 1.00 61.30 H new ATOM 0 HH21 ARG A 106 -17.262 -9.833 -2.109 1.00 65.13 H new ATOM 0 HH22 ARG A 106 -17.326 -11.098 -3.340 1.00 65.13 H new ATOM 1551 N GLY A 107 -8.985 -9.365 2.749 1.00 33.11 N ATOM 1552 CA GLY A 107 -7.604 -9.718 3.068 1.00 60.14 C ATOM 1553 C GLY A 107 -6.936 -8.813 4.099 1.00 20.34 C ATOM 1554 O GLY A 107 -7.605 -8.060 4.812 1.00 44.24 O ATOM 0 H GLY A 107 -9.480 -8.857 3.482 1.00 33.11 H new ATOM 0 HA2 GLY A 107 -7.581 -10.744 3.436 1.00 60.14 H new ATOM 0 HA3 GLY A 107 -7.016 -9.696 2.150 1.00 60.14 H new ATOM 1558 N GLU A 108 -5.607 -8.888 4.184 1.00 63.43 N ATOM 1559 CA GLU A 108 -4.758 -8.035 5.020 1.00 1.20 C ATOM 1560 C GLU A 108 -4.104 -6.955 4.149 1.00 20.34 C ATOM 1561 O GLU A 108 -3.847 -7.230 2.970 1.00 21.00 O ATOM 1562 CB GLU A 108 -3.664 -8.893 5.667 1.00 54.42 C ATOM 1563 CG GLU A 108 -4.145 -9.855 6.764 1.00 44.25 C ATOM 1564 CD GLU A 108 -4.733 -11.173 6.247 1.00 41.23 C ATOM 1565 OE1 GLU A 108 -3.992 -11.930 5.584 1.00 15.13 O ATOM 1566 OE2 GLU A 108 -5.916 -11.450 6.571 1.00 22.14 O ATOM 0 H GLU A 108 -5.070 -9.572 3.651 1.00 63.43 H new ATOM 0 HA GLU A 108 -5.363 -7.563 5.794 1.00 1.20 H new ATOM 0 HB2 GLU A 108 -3.173 -9.475 4.887 1.00 54.42 H new ATOM 0 HB3 GLU A 108 -2.910 -8.231 6.093 1.00 54.42 H new ATOM 0 HG2 GLU A 108 -3.307 -10.081 7.423 1.00 44.25 H new ATOM 0 HG3 GLU A 108 -4.898 -9.349 7.368 1.00 44.25 H new ATOM 1571 N VAL A 109 -3.825 -5.746 4.677 1.00 20.11 N ATOM 1572 CA VAL A 109 -3.377 -4.651 3.813 1.00 1.14 C ATOM 1573 C VAL A 109 -2.346 -3.740 4.505 1.00 33.04 C ATOM 1574 O VAL A 109 -2.661 -2.655 4.994 1.00 71.12 O ATOM 1575 CB VAL A 109 -4.604 -3.868 3.302 1.00 24.02 C ATOM 1576 CG1 VAL A 109 -4.112 -2.986 2.150 1.00 71.01 C ATOM 1577 CG2 VAL A 109 -5.774 -4.701 2.756 1.00 13.44 C ATOM 0 H VAL A 109 -3.901 -5.513 5.667 1.00 20.11 H new ATOM 0 HA VAL A 109 -2.854 -5.077 2.956 1.00 1.14 H new ATOM 0 HB VAL A 109 -5.000 -3.339 4.168 1.00 24.02 H new ATOM 0 HG11 VAL A 109 -4.946 -2.409 1.752 1.00 71.01 H new ATOM 0 HG12 VAL A 109 -3.342 -2.306 2.515 1.00 71.01 H new ATOM 0 HG13 VAL A 109 -3.697 -3.615 1.362 1.00 71.01 H new ATOM 0 HG21 VAL A 109 -6.573 -4.036 2.429 1.00 13.44 H new ATOM 0 HG22 VAL A 109 -5.432 -5.299 1.912 1.00 13.44 H new ATOM 0 HG23 VAL A 109 -6.148 -5.360 3.539 1.00 13.44 H new ATOM 1587 N ALA A 110 -1.086 -4.161 4.564 1.00 72.15 N ATOM 1588 CA ALA A 110 -0.059 -3.432 5.321 1.00 14.51 C ATOM 1589 C ALA A 110 0.479 -2.225 4.537 1.00 35.00 C ATOM 1590 O ALA A 110 0.449 -2.238 3.300 1.00 62.22 O ATOM 1591 CB ALA A 110 1.061 -4.370 5.753 1.00 74.14 C ATOM 0 H ALA A 110 -0.746 -5.003 4.099 1.00 72.15 H new ATOM 0 HA ALA A 110 -0.528 -3.036 6.222 1.00 14.51 H new ATOM 0 HB1 ALA A 110 1.810 -3.809 6.312 1.00 74.14 H new ATOM 0 HB2 ALA A 110 0.652 -5.158 6.385 1.00 74.14 H new ATOM 0 HB3 ALA A 110 1.523 -4.815 4.872 1.00 74.14 H new ATOM 1597 N SER A 111 1.012 -1.202 5.228 1.00 73.32 N ATOM 1598 CA SER A 111 1.464 0.020 4.559 1.00 32.32 C ATOM 1599 C SER A 111 2.922 0.351 4.913 1.00 33.42 C ATOM 1600 O SER A 111 3.413 0.034 5.991 1.00 64.23 O ATOM 1601 CB SER A 111 0.463 1.134 4.894 1.00 51.12 C ATOM 1602 OG SER A 111 -0.198 1.593 3.732 1.00 32.53 O ATOM 0 H SER A 111 1.138 -1.201 6.240 1.00 73.32 H new ATOM 0 HA SER A 111 1.478 -0.108 3.477 1.00 32.32 H new ATOM 0 HB2 SER A 111 -0.270 0.764 5.611 1.00 51.12 H new ATOM 0 HB3 SER A 111 0.984 1.964 5.371 1.00 51.12 H new ATOM 0 HG SER A 111 -1.062 1.983 3.980 1.00 32.53 H new ATOM 1607 N PHE A 112 3.648 0.986 3.999 1.00 61.44 N ATOM 1608 CA PHE A 112 5.104 1.105 4.037 1.00 43.35 C ATOM 1609 C PHE A 112 5.468 2.502 3.597 1.00 74.03 C ATOM 1610 O PHE A 112 4.820 3.083 2.720 1.00 40.44 O ATOM 1611 CB PHE A 112 5.765 0.167 3.020 1.00 61.03 C ATOM 1612 CG PHE A 112 5.406 -1.289 3.149 1.00 63.25 C ATOM 1613 CD1 PHE A 112 4.124 -1.714 2.783 1.00 0.44 C ATOM 1614 CD2 PHE A 112 6.338 -2.215 3.635 1.00 35.14 C ATOM 1615 CE1 PHE A 112 3.718 -3.021 3.057 1.00 54.21 C ATOM 1616 CE2 PHE A 112 5.978 -3.568 3.753 1.00 4.54 C ATOM 1617 CZ PHE A 112 4.651 -3.955 3.531 1.00 73.41 C ATOM 0 H PHE A 112 3.230 1.445 3.189 1.00 61.44 H new ATOM 0 HA PHE A 112 5.438 0.866 5.047 1.00 43.35 H new ATOM 0 HB2 PHE A 112 5.498 0.501 2.017 1.00 61.03 H new ATOM 0 HB3 PHE A 112 6.847 0.266 3.111 1.00 61.03 H new ATOM 0 HD1 PHE A 112 3.449 -1.031 2.289 1.00 0.44 H new ATOM 0 HD2 PHE A 112 7.329 -1.890 3.918 1.00 35.14 H new ATOM 0 HE1 PHE A 112 2.689 -3.312 2.905 1.00 54.21 H new ATOM 0 HE2 PHE A 112 6.722 -4.306 4.014 1.00 4.54 H new ATOM 0 HZ PHE A 112 4.346 -4.973 3.725 1.00 73.41 H new ATOM 1626 N PHE A 113 6.524 3.045 4.181 1.00 21.53 N ATOM 1627 CA PHE A 113 6.995 4.369 3.840 1.00 35.33 C ATOM 1628 C PHE A 113 8.510 4.390 4.010 1.00 43.25 C ATOM 1629 O PHE A 113 9.091 3.511 4.642 1.00 74.13 O ATOM 1630 CB PHE A 113 6.310 5.400 4.750 1.00 44.21 C ATOM 1631 CG PHE A 113 4.791 5.484 4.644 1.00 62.23 C ATOM 1632 CD1 PHE A 113 3.968 4.518 5.262 1.00 74.35 C ATOM 1633 CD2 PHE A 113 4.187 6.535 3.931 1.00 60.15 C ATOM 1634 CE1 PHE A 113 2.570 4.605 5.189 1.00 35.40 C ATOM 1635 CE2 PHE A 113 2.787 6.616 3.859 1.00 74.23 C ATOM 1636 CZ PHE A 113 1.978 5.655 4.480 1.00 41.42 C ATOM 0 H PHE A 113 7.074 2.579 4.902 1.00 21.53 H new ATOM 0 HA PHE A 113 6.751 4.622 2.808 1.00 35.33 H new ATOM 0 HB2 PHE A 113 6.570 5.171 5.784 1.00 44.21 H new ATOM 0 HB3 PHE A 113 6.724 6.383 4.527 1.00 44.21 H new ATOM 0 HD1 PHE A 113 4.422 3.699 5.800 1.00 74.35 H new ATOM 0 HD2 PHE A 113 4.798 7.278 3.440 1.00 60.15 H new ATOM 0 HE1 PHE A 113 1.954 3.865 5.678 1.00 35.40 H new ATOM 0 HE2 PHE A 113 2.328 7.430 3.318 1.00 74.23 H new ATOM 0 HZ PHE A 113 0.902 5.725 4.411 1.00 41.42 H new ATOM 1645 N THR A 114 9.149 5.439 3.513 1.00 24.42 N ATOM 1646 CA THR A 114 10.563 5.709 3.719 1.00 20.10 C ATOM 1647 C THR A 114 10.663 7.211 3.998 1.00 35.43 C ATOM 1648 O THR A 114 9.910 7.996 3.411 1.00 34.32 O ATOM 1649 CB THR A 114 11.371 5.239 2.489 1.00 60.15 C ATOM 1650 OG1 THR A 114 10.843 5.789 1.300 1.00 75.25 O ATOM 1651 CG2 THR A 114 11.348 3.716 2.299 1.00 60.02 C ATOM 0 H THR A 114 8.685 6.144 2.940 1.00 24.42 H new ATOM 0 HA THR A 114 10.990 5.162 4.560 1.00 20.10 H new ATOM 0 HB THR A 114 12.391 5.573 2.679 1.00 60.15 H new ATOM 0 HG1 THR A 114 11.371 5.480 0.534 1.00 75.25 H new ATOM 0 HG21 THR A 114 11.933 3.450 1.419 1.00 60.02 H new ATOM 0 HG22 THR A 114 11.775 3.233 3.178 1.00 60.02 H new ATOM 0 HG23 THR A 114 10.319 3.382 2.165 1.00 60.02 H new ATOM 1659 N SER A 115 11.530 7.625 4.917 1.00 64.51 N ATOM 1660 CA SER A 115 11.813 9.025 5.177 1.00 13.02 C ATOM 1661 C SER A 115 13.201 9.156 5.802 1.00 71.31 C ATOM 1662 O SER A 115 13.943 8.182 5.925 1.00 54.15 O ATOM 1663 CB SER A 115 10.726 9.631 6.078 1.00 33.11 C ATOM 1664 OG SER A 115 10.521 10.994 5.746 1.00 61.35 O ATOM 0 H SER A 115 12.061 6.985 5.508 1.00 64.51 H new ATOM 0 HA SER A 115 11.806 9.581 4.239 1.00 13.02 H new ATOM 0 HB2 SER A 115 9.795 9.076 5.961 1.00 33.11 H new ATOM 0 HB3 SER A 115 11.020 9.544 7.124 1.00 33.11 H new ATOM 0 HG SER A 115 10.810 11.560 6.492 1.00 61.35 H new ATOM 1669 N ALA A 116 13.531 10.374 6.218 1.00 4.23 N ATOM 1670 CA ALA A 116 14.828 10.791 6.728 1.00 71.54 C ATOM 1671 C ALA A 116 14.884 10.693 8.256 1.00 34.51 C ATOM 1672 O ALA A 116 15.535 11.506 8.922 1.00 72.42 O ATOM 1673 CB ALA A 116 15.069 12.222 6.258 1.00 63.12 C ATOM 0 H ALA A 116 12.858 11.141 6.207 1.00 4.23 H new ATOM 0 HA ALA A 116 15.609 10.132 6.349 1.00 71.54 H new ATOM 0 HB1 ALA A 116 16.036 12.567 6.624 1.00 63.12 H new ATOM 0 HB2 ALA A 116 15.061 12.253 5.168 1.00 63.12 H new ATOM 0 HB3 ALA A 116 14.282 12.870 6.645 1.00 63.12 H new ATOM 1679 N GLY A 117 14.123 9.768 8.844 1.00 72.31 N ATOM 1680 CA GLY A 117 14.016 9.667 10.289 1.00 74.13 C ATOM 1681 C GLY A 117 13.133 10.754 10.886 1.00 42.45 C ATOM 1682 O GLY A 117 13.176 10.998 12.092 1.00 33.34 O ATOM 0 H GLY A 117 13.572 9.078 8.333 1.00 72.31 H new ATOM 0 HA2 GLY A 117 13.612 8.690 10.553 1.00 74.13 H new ATOM 0 HA3 GLY A 117 15.011 9.730 10.729 1.00 74.13 H new ATOM 1686 N THR A 118 12.348 11.444 10.065 1.00 3.21 N ATOM 1687 CA THR A 118 11.365 12.429 10.475 1.00 22.43 C ATOM 1688 C THR A 118 9.994 11.754 10.609 1.00 63.15 C ATOM 1689 O THR A 118 9.774 10.671 10.056 1.00 21.44 O ATOM 1690 CB THR A 118 11.372 13.552 9.421 1.00 24.32 C ATOM 1691 OG1 THR A 118 11.375 13.006 8.113 1.00 54.03 O ATOM 1692 CG2 THR A 118 12.627 14.417 9.575 1.00 52.23 C ATOM 0 H THR A 118 12.385 11.323 9.053 1.00 3.21 H new ATOM 0 HA THR A 118 11.599 12.860 11.448 1.00 22.43 H new ATOM 0 HB THR A 118 10.476 14.155 9.572 1.00 24.32 H new ATOM 0 HG1 THR A 118 11.378 13.732 7.455 1.00 54.03 H new ATOM 0 HG21 THR A 118 12.619 15.207 8.824 1.00 52.23 H new ATOM 0 HG22 THR A 118 12.642 14.862 10.570 1.00 52.23 H new ATOM 0 HG23 THR A 118 13.514 13.798 9.441 1.00 52.23 H new ATOM 1700 N ASN A 119 9.055 12.415 11.292 1.00 4.34 N ATOM 1701 CA ASN A 119 7.599 12.219 11.257 1.00 44.23 C ATOM 1702 C ASN A 119 7.132 10.782 11.503 1.00 1.31 C ATOM 1703 O ASN A 119 6.045 10.403 11.069 1.00 44.13 O ATOM 1704 CB ASN A 119 7.029 12.845 9.964 1.00 60.43 C ATOM 1705 CG ASN A 119 7.357 14.322 9.936 1.00 1.32 C ATOM 1706 OD1 ASN A 119 7.067 15.035 10.891 1.00 72.41 O ATOM 1707 ND2 ASN A 119 8.028 14.793 8.907 1.00 75.45 N ATOM 0 H ASN A 119 9.312 13.162 11.937 1.00 4.34 H new ATOM 0 HA ASN A 119 7.182 12.746 12.115 1.00 44.23 H new ATOM 0 HB2 ASN A 119 7.452 12.350 9.090 1.00 60.43 H new ATOM 0 HB3 ASN A 119 5.950 12.700 9.921 1.00 60.43 H new ATOM 0 HD21 ASN A 119 8.319 15.771 8.892 1.00 75.45 H new ATOM 0 HD22 ASN A 119 8.258 14.181 8.124 1.00 75.45 H new ATOM 1713 N HIS A 120 7.915 9.970 12.219 1.00 23.50 N ATOM 1714 CA HIS A 120 7.694 8.528 12.326 1.00 62.41 C ATOM 1715 C HIS A 120 6.493 8.132 13.192 1.00 52.05 C ATOM 1716 O HIS A 120 6.166 6.962 13.344 1.00 33.33 O ATOM 1717 CB HIS A 120 8.956 7.832 12.829 1.00 40.11 C ATOM 1718 CG HIS A 120 9.103 7.692 14.327 1.00 42.23 C ATOM 1719 ND1 HIS A 120 9.189 8.725 15.232 1.00 41.43 N ATOM 1720 CD2 HIS A 120 9.187 6.510 15.019 1.00 53.25 C ATOM 1721 CE1 HIS A 120 9.386 8.170 16.439 1.00 64.41 C ATOM 1722 NE2 HIS A 120 9.371 6.834 16.364 1.00 15.12 N ATOM 0 H HIS A 120 8.725 10.299 12.744 1.00 23.50 H new ATOM 0 HA HIS A 120 7.455 8.194 11.316 1.00 62.41 H new ATOM 0 HB2 HIS A 120 8.993 6.836 12.389 1.00 40.11 H new ATOM 0 HB3 HIS A 120 9.820 8.380 12.452 1.00 40.11 H new ATOM 0 HD2 HIS A 120 9.123 5.516 14.601 1.00 53.25 H new ATOM 0 HE1 HIS A 120 9.537 8.729 17.351 1.00 64.41 H new ATOM 0 HE2 HIS A 120 9.474 6.179 17.139 1.00 15.12 H new ATOM 1729 N LYS A 121 5.823 9.105 13.785 1.00 73.41 N ATOM 1730 CA LYS A 121 4.538 8.954 14.451 1.00 32.42 C ATOM 1731 C LYS A 121 3.415 9.425 13.527 1.00 4.02 C ATOM 1732 O LYS A 121 2.368 8.790 13.380 1.00 23.10 O ATOM 1733 CB LYS A 121 4.665 9.796 15.733 1.00 15.20 C ATOM 1734 CG LYS A 121 3.331 10.207 16.337 1.00 72.11 C ATOM 1735 CD LYS A 121 3.506 10.865 17.706 1.00 40.02 C ATOM 1736 CE LYS A 121 2.160 11.025 18.420 1.00 75.42 C ATOM 1737 NZ LYS A 121 1.334 12.114 17.869 1.00 40.32 N ATOM 0 H LYS A 121 6.173 10.062 13.818 1.00 73.41 H new ATOM 0 HA LYS A 121 4.289 7.922 14.698 1.00 32.42 H new ATOM 0 HB2 LYS A 121 5.228 9.229 16.474 1.00 15.20 H new ATOM 0 HB3 LYS A 121 5.243 10.693 15.511 1.00 15.20 H new ATOM 0 HG2 LYS A 121 2.825 10.898 15.663 1.00 72.11 H new ATOM 0 HG3 LYS A 121 2.691 9.330 16.434 1.00 72.11 H new ATOM 0 HD2 LYS A 121 4.176 10.263 18.319 1.00 40.02 H new ATOM 0 HD3 LYS A 121 3.975 11.841 17.586 1.00 40.02 H new ATOM 0 HE2 LYS A 121 1.607 10.088 18.352 1.00 75.42 H new ATOM 0 HE3 LYS A 121 2.338 11.213 19.479 1.00 75.42 H new ATOM 0 HZ1 LYS A 121 0.438 12.170 18.394 1.00 40.32 H new ATOM 0 HZ2 LYS A 121 1.844 13.016 17.958 1.00 40.32 H new ATOM 0 HZ3 LYS A 121 1.136 11.926 16.866 1.00 40.32 H new ATOM 1747 N ALA A 122 3.644 10.597 12.954 1.00 2.24 N ATOM 1748 CA ALA A 122 2.706 11.339 12.135 1.00 15.22 C ATOM 1749 C ALA A 122 2.280 10.530 10.906 1.00 73.53 C ATOM 1750 O ALA A 122 1.091 10.463 10.619 1.00 20.41 O ATOM 1751 CB ALA A 122 3.348 12.676 11.751 1.00 40.22 C ATOM 0 H ALA A 122 4.537 11.079 13.055 1.00 2.24 H new ATOM 0 HA ALA A 122 1.794 11.533 12.700 1.00 15.22 H new ATOM 0 HB1 ALA A 122 2.655 13.248 11.134 1.00 40.22 H new ATOM 0 HB2 ALA A 122 3.581 13.240 12.654 1.00 40.22 H new ATOM 0 HB3 ALA A 122 4.265 12.492 11.192 1.00 40.22 H new ATOM 1757 N TYR A 123 3.221 9.890 10.204 1.00 11.23 N ATOM 1758 CA TYR A 123 2.984 9.119 8.981 1.00 33.42 C ATOM 1759 C TYR A 123 1.981 7.994 9.220 1.00 61.11 C ATOM 1760 O TYR A 123 1.048 7.830 8.443 1.00 35.53 O ATOM 1761 CB TYR A 123 4.332 8.593 8.460 1.00 75.45 C ATOM 1762 CG TYR A 123 4.789 7.213 8.876 1.00 75.42 C ATOM 1763 CD1 TYR A 123 5.459 7.035 10.092 1.00 24.10 C ATOM 1764 CD2 TYR A 123 4.593 6.116 8.030 1.00 34.12 C ATOM 1765 CE1 TYR A 123 5.973 5.777 10.450 1.00 35.31 C ATOM 1766 CE2 TYR A 123 5.098 4.852 8.384 1.00 71.24 C ATOM 1767 CZ TYR A 123 5.768 4.672 9.605 1.00 55.43 C ATOM 1768 OH TYR A 123 6.228 3.444 9.948 1.00 44.11 O ATOM 0 H TYR A 123 4.202 9.895 10.482 1.00 11.23 H new ATOM 0 HA TYR A 123 2.540 9.763 8.221 1.00 33.42 H new ATOM 0 HB2 TYR A 123 4.295 8.613 7.371 1.00 75.45 H new ATOM 0 HB3 TYR A 123 5.102 9.301 8.766 1.00 75.45 H new ATOM 0 HD1 TYR A 123 5.582 7.873 10.762 1.00 24.10 H new ATOM 0 HD2 TYR A 123 4.053 6.240 7.103 1.00 34.12 H new ATOM 0 HE1 TYR A 123 6.524 5.659 11.371 1.00 35.31 H new ATOM 0 HE2 TYR A 123 4.970 4.015 7.713 1.00 71.24 H new ATOM 0 HH TYR A 123 5.471 2.860 10.166 1.00 44.11 H new ATOM 1777 N VAL A 124 2.146 7.264 10.324 1.00 12.44 N ATOM 1778 CA VAL A 124 1.317 6.135 10.719 1.00 54.35 C ATOM 1779 C VAL A 124 -0.131 6.637 10.832 1.00 14.43 C ATOM 1780 O VAL A 124 -1.044 6.078 10.220 1.00 40.01 O ATOM 1781 CB VAL A 124 1.814 5.627 12.096 1.00 52.12 C ATOM 1782 CG1 VAL A 124 1.136 4.337 12.539 1.00 52.42 C ATOM 1783 CG2 VAL A 124 3.324 5.385 12.121 1.00 14.42 C ATOM 0 H VAL A 124 2.893 7.455 10.992 1.00 12.44 H new ATOM 0 HA VAL A 124 1.371 5.322 9.994 1.00 54.35 H new ATOM 0 HB VAL A 124 1.552 6.430 12.785 1.00 52.12 H new ATOM 0 HG11 VAL A 124 1.528 4.035 13.510 1.00 52.42 H new ATOM 0 HG12 VAL A 124 0.061 4.499 12.616 1.00 52.42 H new ATOM 0 HG13 VAL A 124 1.333 3.553 11.808 1.00 52.42 H new ATOM 0 HG21 VAL A 124 3.619 5.030 13.108 1.00 14.42 H new ATOM 0 HG22 VAL A 124 3.585 4.636 11.373 1.00 14.42 H new ATOM 0 HG23 VAL A 124 3.845 6.316 11.899 1.00 14.42 H new ATOM 1793 N SER A 125 -0.334 7.710 11.609 1.00 4.03 N ATOM 1794 CA SER A 125 -1.668 8.240 11.881 1.00 52.24 C ATOM 1795 C SER A 125 -2.269 8.848 10.607 1.00 20.22 C ATOM 1796 O SER A 125 -3.440 8.627 10.308 1.00 32.13 O ATOM 1797 CB SER A 125 -1.574 9.216 13.068 1.00 14.32 C ATOM 1798 OG SER A 125 -2.322 10.401 12.928 1.00 60.43 O ATOM 0 H SER A 125 0.419 8.228 12.062 1.00 4.03 H new ATOM 0 HA SER A 125 -2.359 7.449 12.172 1.00 52.24 H new ATOM 0 HB2 SER A 125 -1.905 8.700 13.969 1.00 14.32 H new ATOM 0 HB3 SER A 125 -0.527 9.481 13.218 1.00 14.32 H new ATOM 0 HG SER A 125 -2.205 10.958 13.726 1.00 60.43 H new ATOM 1803 N HIS A 126 -1.477 9.589 9.831 1.00 23.20 N ATOM 1804 CA HIS A 126 -1.977 10.296 8.663 1.00 72.22 C ATOM 1805 C HIS A 126 -2.226 9.359 7.477 1.00 21.54 C ATOM 1806 O HIS A 126 -2.888 9.746 6.517 1.00 22.24 O ATOM 1807 CB HIS A 126 -1.013 11.416 8.277 1.00 14.43 C ATOM 1808 CG HIS A 126 -1.744 12.539 7.603 1.00 52.15 C ATOM 1809 ND1 HIS A 126 -2.343 12.504 6.363 1.00 31.21 N ATOM 1810 CD2 HIS A 126 -2.059 13.732 8.187 1.00 32.23 C ATOM 1811 CE1 HIS A 126 -2.981 13.671 6.187 1.00 34.54 C ATOM 1812 NE2 HIS A 126 -2.851 14.437 7.283 1.00 22.11 N ATOM 0 H HIS A 126 -0.478 9.712 9.997 1.00 23.20 H new ATOM 0 HA HIS A 126 -2.942 10.729 8.928 1.00 72.22 H new ATOM 0 HB2 HIS A 126 -0.506 11.788 9.167 1.00 14.43 H new ATOM 0 HB3 HIS A 126 -0.243 11.026 7.611 1.00 14.43 H new ATOM 0 HD1 HIS A 126 -2.308 11.731 5.699 1.00 31.21 H new ATOM 0 HD2 HIS A 126 -1.752 14.067 9.167 1.00 32.23 H new ATOM 0 HE1 HIS A 126 -3.520 13.953 5.295 1.00 34.54 H new ATOM 1819 N PHE A 127 -1.704 8.134 7.501 1.00 31.43 N ATOM 1820 CA PHE A 127 -2.232 7.090 6.646 1.00 51.05 C ATOM 1821 C PHE A 127 -3.619 6.700 7.157 1.00 52.03 C ATOM 1822 O PHE A 127 -4.588 6.788 6.408 1.00 40.24 O ATOM 1823 CB PHE A 127 -1.284 5.891 6.600 1.00 42.33 C ATOM 1824 CG PHE A 127 -1.916 4.722 5.875 1.00 20.24 C ATOM 1825 CD1 PHE A 127 -2.220 4.808 4.499 1.00 2.10 C ATOM 1826 CD2 PHE A 127 -2.307 3.587 6.614 1.00 41.31 C ATOM 1827 CE1 PHE A 127 -2.911 3.763 3.871 1.00 33.31 C ATOM 1828 CE2 PHE A 127 -3.014 2.554 5.981 1.00 20.31 C ATOM 1829 CZ PHE A 127 -3.321 2.652 4.619 1.00 42.34 C ATOM 0 H PHE A 127 -0.927 7.849 8.097 1.00 31.43 H new ATOM 0 HA PHE A 127 -2.320 7.455 5.623 1.00 51.05 H new ATOM 0 HB2 PHE A 127 -0.358 6.175 6.100 1.00 42.33 H new ATOM 0 HB3 PHE A 127 -1.020 5.593 7.615 1.00 42.33 H new ATOM 0 HD1 PHE A 127 -1.921 5.677 3.932 1.00 2.10 H new ATOM 0 HD2 PHE A 127 -2.063 3.513 7.664 1.00 41.31 H new ATOM 0 HE1 PHE A 127 -3.127 3.814 2.814 1.00 33.31 H new ATOM 0 HE2 PHE A 127 -3.321 1.685 6.544 1.00 20.31 H new ATOM 0 HZ PHE A 127 -3.880 1.862 4.139 1.00 42.34 H new ATOM 1838 N ASN A 128 -3.707 6.304 8.435 1.00 44.32 N ATOM 1839 CA ASN A 128 -4.928 5.783 9.044 1.00 12.22 C ATOM 1840 C ASN A 128 -6.114 6.720 8.817 1.00 71.22 C ATOM 1841 O ASN A 128 -7.148 6.249 8.365 1.00 33.24 O ATOM 1842 CB ASN A 128 -4.742 5.474 10.540 1.00 11.12 C ATOM 1843 CG ASN A 128 -4.132 4.099 10.777 1.00 75.23 C ATOM 1844 OD1 ASN A 128 -4.849 3.104 10.854 1.00 64.53 O ATOM 1845 ND2 ASN A 128 -2.819 3.990 10.870 1.00 31.30 N ATOM 0 H ASN A 128 -2.917 6.339 9.080 1.00 44.32 H new ATOM 0 HA ASN A 128 -5.150 4.840 8.545 1.00 12.22 H new ATOM 0 HB2 ASN A 128 -4.103 6.234 10.989 1.00 11.12 H new ATOM 0 HB3 ASN A 128 -5.707 5.532 11.043 1.00 11.12 H new ATOM 0 HD21 ASN A 128 -2.392 3.074 11.007 1.00 31.30 H new ATOM 0 HD22 ASN A 128 -2.232 4.822 10.805 1.00 31.30 H new ATOM 1851 N GLU A 129 -5.981 8.029 9.044 1.00 64.44 N ATOM 1852 CA GLU A 129 -7.050 9.020 8.841 1.00 43.34 C ATOM 1853 C GLU A 129 -7.710 8.942 7.457 1.00 13.43 C ATOM 1854 O GLU A 129 -8.901 9.235 7.302 1.00 35.42 O ATOM 1855 CB GLU A 129 -6.461 10.432 8.985 1.00 61.43 C ATOM 1856 CG GLU A 129 -6.436 10.944 10.417 1.00 62.32 C ATOM 1857 CD GLU A 129 -5.812 12.339 10.512 1.00 12.44 C ATOM 1858 OE1 GLU A 129 -6.035 13.198 9.623 1.00 42.35 O ATOM 1859 OE2 GLU A 129 -5.074 12.593 11.491 1.00 24.34 O ATOM 0 H GLU A 129 -5.111 8.442 9.381 1.00 64.44 H new ATOM 0 HA GLU A 129 -7.811 8.802 9.591 1.00 43.34 H new ATOM 0 HB2 GLU A 129 -5.445 10.434 8.591 1.00 61.43 H new ATOM 0 HB3 GLU A 129 -7.042 11.122 8.373 1.00 61.43 H new ATOM 0 HG2 GLU A 129 -7.452 10.973 10.810 1.00 62.32 H new ATOM 0 HG3 GLU A 129 -5.872 10.251 11.041 1.00 62.32 H new ATOM 1864 N TRP A 130 -6.930 8.573 6.444 1.00 53.34 N ATOM 1865 CA TRP A 130 -7.314 8.614 5.038 1.00 40.23 C ATOM 1866 C TRP A 130 -7.600 7.208 4.500 1.00 21.52 C ATOM 1867 O TRP A 130 -7.991 7.077 3.342 1.00 73.41 O ATOM 1868 CB TRP A 130 -6.234 9.387 4.262 1.00 53.42 C ATOM 1869 CG TRP A 130 -6.170 10.835 4.665 1.00 2.14 C ATOM 1870 CD1 TRP A 130 -5.621 11.307 5.806 1.00 60.22 C ATOM 1871 CD2 TRP A 130 -6.783 11.995 4.027 1.00 34.23 C ATOM 1872 NE1 TRP A 130 -5.942 12.638 5.975 1.00 14.34 N ATOM 1873 CE2 TRP A 130 -6.653 13.117 4.899 1.00 3.43 C ATOM 1874 CE3 TRP A 130 -7.461 12.201 2.810 1.00 71.12 C ATOM 1875 CZ2 TRP A 130 -7.206 14.368 4.595 1.00 51.42 C ATOM 1876 CZ3 TRP A 130 -8.004 13.458 2.484 1.00 35.34 C ATOM 1877 CH2 TRP A 130 -7.882 14.538 3.376 1.00 40.01 C ATOM 0 H TRP A 130 -5.981 8.226 6.586 1.00 53.34 H new ATOM 0 HA TRP A 130 -8.254 9.149 4.907 1.00 40.23 H new ATOM 0 HB2 TRP A 130 -5.263 8.921 4.432 1.00 53.42 H new ATOM 0 HB3 TRP A 130 -6.438 9.318 3.193 1.00 53.42 H new ATOM 0 HD1 TRP A 130 -5.018 10.726 6.488 1.00 60.22 H new ATOM 0 HE1 TRP A 130 -5.686 13.194 6.791 1.00 14.34 H new ATOM 0 HE3 TRP A 130 -7.566 11.381 2.115 1.00 71.12 H new ATOM 0 HZ2 TRP A 130 -7.114 15.190 5.289 1.00 51.42 H new ATOM 0 HZ3 TRP A 130 -8.517 13.594 1.543 1.00 35.34 H new ATOM 0 HH2 TRP A 130 -8.308 15.498 3.124 1.00 40.01 H new ATOM 1887 N ALA A 131 -7.450 6.170 5.334 1.00 21.24 N ATOM 1888 CA ALA A 131 -7.611 4.762 4.987 1.00 21.22 C ATOM 1889 C ALA A 131 -8.478 3.997 5.991 1.00 20.20 C ATOM 1890 O ALA A 131 -8.642 2.784 5.860 1.00 15.22 O ATOM 1891 CB ALA A 131 -6.223 4.125 4.881 1.00 33.44 C ATOM 0 H ALA A 131 -7.201 6.302 6.314 1.00 21.24 H new ATOM 0 HA ALA A 131 -8.133 4.705 4.032 1.00 21.22 H new ATOM 0 HB1 ALA A 131 -6.325 3.071 4.622 1.00 33.44 H new ATOM 0 HB2 ALA A 131 -5.647 4.634 4.109 1.00 33.44 H new ATOM 0 HB3 ALA A 131 -5.707 4.215 5.837 1.00 33.44 H new ATOM 1897 N ASP A 132 -9.005 4.682 7.005 1.00 14.20 N ATOM 1898 CA ASP A 132 -9.851 4.116 8.042 1.00 32.10 C ATOM 1899 C ASP A 132 -11.099 3.543 7.387 1.00 62.14 C ATOM 1900 O ASP A 132 -11.876 4.283 6.786 1.00 73.13 O ATOM 1901 CB ASP A 132 -10.224 5.180 9.072 1.00 32.12 C ATOM 1902 CG ASP A 132 -11.010 4.566 10.221 1.00 72.34 C ATOM 1903 OD1 ASP A 132 -10.363 4.077 11.174 1.00 12.42 O ATOM 1904 OD2 ASP A 132 -12.258 4.636 10.195 1.00 31.10 O ATOM 0 H ASP A 132 -8.846 5.682 7.127 1.00 14.20 H new ATOM 0 HA ASP A 132 -9.314 3.325 8.565 1.00 32.10 H new ATOM 0 HB2 ASP A 132 -9.321 5.654 9.456 1.00 32.12 H new ATOM 0 HB3 ASP A 132 -10.817 5.961 8.596 1.00 32.12 H new ATOM 1908 N GLY A 133 -11.225 2.221 7.403 1.00 21.32 N ATOM 1909 CA GLY A 133 -12.180 1.493 6.582 1.00 12.03 C ATOM 1910 C GLY A 133 -11.561 0.319 5.816 1.00 24.43 C ATOM 1911 O GLY A 133 -12.292 -0.348 5.088 1.00 51.03 O ATOM 0 H GLY A 133 -10.657 1.617 7.997 1.00 21.32 H new ATOM 0 HA2 GLY A 133 -12.982 1.118 7.218 1.00 12.03 H new ATOM 0 HA3 GLY A 133 -12.634 2.182 5.870 1.00 12.03 H new ATOM 1915 N LEU A 134 -10.248 0.068 5.933 1.00 34.42 N ATOM 1916 CA LEU A 134 -9.544 -1.068 5.327 1.00 51.21 C ATOM 1917 C LEU A 134 -8.589 -1.651 6.372 1.00 53.42 C ATOM 1918 O LEU A 134 -7.912 -0.890 7.076 1.00 0.22 O ATOM 1919 CB LEU A 134 -8.724 -0.625 4.093 1.00 14.12 C ATOM 1920 CG LEU A 134 -9.475 -0.266 2.799 1.00 12.32 C ATOM 1921 CD1 LEU A 134 -10.340 -1.424 2.312 1.00 72.44 C ATOM 1922 CD2 LEU A 134 -10.258 1.052 2.896 1.00 22.45 C ATOM 0 H LEU A 134 -9.627 0.673 6.471 1.00 34.42 H new ATOM 0 HA LEU A 134 -10.277 -1.807 5.004 1.00 51.21 H new ATOM 0 HB2 LEU A 134 -8.132 0.243 4.383 1.00 14.12 H new ATOM 0 HB3 LEU A 134 -8.022 -1.425 3.857 1.00 14.12 H new ATOM 0 HG LEU A 134 -8.712 -0.092 2.041 1.00 12.32 H new ATOM 0 HD11 LEU A 134 -10.855 -1.133 1.396 1.00 72.44 H new ATOM 0 HD12 LEU A 134 -9.710 -2.291 2.114 1.00 72.44 H new ATOM 0 HD13 LEU A 134 -11.074 -1.676 3.077 1.00 72.44 H new ATOM 0 HD21 LEU A 134 -10.764 1.245 1.950 1.00 22.45 H new ATOM 0 HD22 LEU A 134 -10.997 0.978 3.694 1.00 22.45 H new ATOM 0 HD23 LEU A 134 -9.570 1.869 3.113 1.00 22.45 H new ATOM 1933 N ASN A 135 -8.517 -2.978 6.485 1.00 35.20 N ATOM 1934 CA ASN A 135 -7.702 -3.682 7.478 1.00 14.01 C ATOM 1935 C ASN A 135 -6.201 -3.598 7.189 1.00 42.31 C ATOM 1936 O ASN A 135 -5.662 -4.388 6.412 1.00 75.43 O ATOM 1937 CB ASN A 135 -8.097 -5.157 7.562 1.00 72.51 C ATOM 1938 CG ASN A 135 -7.192 -5.883 8.548 1.00 11.01 C ATOM 1939 OD1 ASN A 135 -6.994 -5.442 9.675 1.00 15.30 O ATOM 1940 ND2 ASN A 135 -6.585 -6.974 8.123 1.00 14.12 N ATOM 0 H ASN A 135 -9.036 -3.609 5.874 1.00 35.20 H new ATOM 0 HA ASN A 135 -7.896 -3.181 8.426 1.00 14.01 H new ATOM 0 HB2 ASN A 135 -9.137 -5.246 7.876 1.00 72.51 H new ATOM 0 HB3 ASN A 135 -8.021 -5.619 6.578 1.00 72.51 H new ATOM 0 HD21 ASN A 135 -5.936 -7.468 8.736 1.00 14.12 H new ATOM 0 HD22 ASN A 135 -6.764 -7.324 7.182 1.00 14.12 H new ATOM 1946 N VAL A 136 -5.506 -2.679 7.851 1.00 21.43 N ATOM 1947 CA VAL A 136 -4.052 -2.576 7.823 1.00 14.32 C ATOM 1948 C VAL A 136 -3.506 -3.276 9.062 1.00 34.31 C ATOM 1949 O VAL A 136 -3.636 -2.807 10.193 1.00 52.42 O ATOM 1950 CB VAL A 136 -3.599 -1.113 7.622 1.00 55.44 C ATOM 1951 CG1 VAL A 136 -4.262 -0.210 8.644 1.00 60.21 C ATOM 1952 CG2 VAL A 136 -2.086 -0.889 7.734 1.00 72.35 C ATOM 0 H VAL A 136 -5.948 -1.969 8.435 1.00 21.43 H new ATOM 0 HA VAL A 136 -3.627 -3.089 6.960 1.00 14.32 H new ATOM 0 HB VAL A 136 -3.897 -0.874 6.601 1.00 55.44 H new ATOM 0 HG11 VAL A 136 -3.933 0.818 8.489 1.00 60.21 H new ATOM 0 HG12 VAL A 136 -5.345 -0.265 8.530 1.00 60.21 H new ATOM 0 HG13 VAL A 136 -3.986 -0.532 9.648 1.00 60.21 H new ATOM 0 HG21 VAL A 136 -1.862 0.166 7.579 1.00 72.35 H new ATOM 0 HG22 VAL A 136 -1.746 -1.190 8.725 1.00 72.35 H new ATOM 0 HG23 VAL A 136 -1.573 -1.484 6.978 1.00 72.35 H new ATOM 1962 N ILE A 137 -2.894 -4.430 8.842 1.00 51.42 N ATOM 1963 CA ILE A 137 -2.291 -5.224 9.911 1.00 21.24 C ATOM 1964 C ILE A 137 -1.039 -4.556 10.505 1.00 20.24 C ATOM 1965 O ILE A 137 -0.668 -4.832 11.645 1.00 4.14 O ATOM 1966 CB ILE A 137 -2.001 -6.653 9.421 1.00 62.22 C ATOM 1967 CG1 ILE A 137 -1.048 -6.670 8.207 1.00 64.21 C ATOM 1968 CG2 ILE A 137 -3.337 -7.351 9.110 1.00 21.42 C ATOM 1969 CD1 ILE A 137 -0.553 -8.073 7.873 1.00 1.42 C ATOM 0 H ILE A 137 -2.799 -4.846 7.916 1.00 51.42 H new ATOM 0 HA ILE A 137 -3.014 -5.283 10.725 1.00 21.24 H new ATOM 0 HB ILE A 137 -1.484 -7.200 10.210 1.00 62.22 H new ATOM 0 HG12 ILE A 137 -1.561 -6.253 7.340 1.00 64.21 H new ATOM 0 HG13 ILE A 137 -0.193 -6.026 8.411 1.00 64.21 H new ATOM 0 HG21 ILE A 137 -3.145 -8.366 8.761 1.00 21.42 H new ATOM 0 HG22 ILE A 137 -3.947 -7.387 10.012 1.00 21.42 H new ATOM 0 HG23 ILE A 137 -3.866 -6.795 8.336 1.00 21.42 H new ATOM 0 HD11 ILE A 137 0.114 -8.028 7.012 1.00 1.42 H new ATOM 0 HD12 ILE A 137 -0.014 -8.482 8.728 1.00 1.42 H new ATOM 0 HD13 ILE A 137 -1.404 -8.713 7.640 1.00 1.42 H new ATOM 1980 N GLY A 138 -0.394 -3.655 9.761 1.00 64.14 N ATOM 1981 CA GLY A 138 0.764 -2.936 10.244 1.00 74.13 C ATOM 1982 C GLY A 138 1.215 -1.892 9.242 1.00 31.31 C ATOM 1983 O GLY A 138 0.860 -1.925 8.062 1.00 3.21 O ATOM 0 H GLY A 138 -0.667 -3.411 8.809 1.00 64.14 H new ATOM 0 HA2 GLY A 138 0.528 -2.455 11.193 1.00 74.13 H new ATOM 0 HA3 GLY A 138 1.577 -3.636 10.435 1.00 74.13 H new ATOM 1987 N VAL A 139 1.997 -0.956 9.744 1.00 24.40 N ATOM 1988 CA VAL A 139 2.691 0.097 9.045 1.00 43.12 C ATOM 1989 C VAL A 139 4.070 0.317 9.647 1.00 72.45 C ATOM 1990 O VAL A 139 4.222 0.484 10.862 1.00 72.33 O ATOM 1991 CB VAL A 139 1.789 1.335 8.854 1.00 4.12 C ATOM 1992 CG1 VAL A 139 0.970 1.653 10.083 1.00 61.25 C ATOM 1993 CG2 VAL A 139 2.573 2.579 8.423 1.00 1.24 C ATOM 0 H VAL A 139 2.176 -0.914 10.747 1.00 24.40 H new ATOM 0 HA VAL A 139 2.907 -0.197 8.018 1.00 43.12 H new ATOM 0 HB VAL A 139 1.108 1.064 8.047 1.00 4.12 H new ATOM 0 HG11 VAL A 139 0.355 2.532 9.893 1.00 61.25 H new ATOM 0 HG12 VAL A 139 0.328 0.805 10.322 1.00 61.25 H new ATOM 0 HG13 VAL A 139 1.636 1.851 10.923 1.00 61.25 H new ATOM 0 HG21 VAL A 139 1.887 3.418 8.304 1.00 1.24 H new ATOM 0 HG22 VAL A 139 3.316 2.822 9.183 1.00 1.24 H new ATOM 0 HG23 VAL A 139 3.074 2.383 7.475 1.00 1.24 H new ATOM 2003 N ALA A 140 5.085 0.275 8.784 1.00 33.33 N ATOM 2004 CA ALA A 140 6.491 0.373 9.132 1.00 52.14 C ATOM 2005 C ALA A 140 7.255 1.099 8.037 1.00 74.51 C ATOM 2006 O ALA A 140 6.687 1.531 7.029 1.00 54.43 O ATOM 2007 CB ALA A 140 7.092 -1.015 9.435 1.00 35.20 C ATOM 0 H ALA A 140 4.937 0.167 7.781 1.00 33.33 H new ATOM 0 HA ALA A 140 6.582 0.959 10.046 1.00 52.14 H new ATOM 0 HB1 ALA A 140 8.146 -0.907 9.692 1.00 35.20 H new ATOM 0 HB2 ALA A 140 6.559 -1.468 10.271 1.00 35.20 H new ATOM 0 HB3 ALA A 140 6.996 -1.653 8.556 1.00 35.20 H new ATOM 2013 N ARG A 141 8.562 1.231 8.242 1.00 33.40 N ATOM 2014 CA ARG A 141 9.491 1.552 7.179 1.00 1.14 C ATOM 2015 C ARG A 141 10.463 0.408 7.051 1.00 54.22 C ATOM 2016 O ARG A 141 10.727 -0.301 8.026 1.00 14.42 O ATOM 2017 CB ARG A 141 10.272 2.833 7.470 1.00 35.12 C ATOM 2018 CG ARG A 141 9.350 4.038 7.674 1.00 33.54 C ATOM 2019 CD ARG A 141 9.338 4.482 9.143 1.00 52.01 C ATOM 2020 NE ARG A 141 10.151 5.689 9.349 1.00 61.33 N ATOM 2021 CZ ARG A 141 9.696 6.942 9.250 1.00 1.13 C ATOM 2022 NH1 ARG A 141 8.418 7.183 8.976 1.00 3.04 N ATOM 2023 NH2 ARG A 141 10.525 7.960 9.426 1.00 3.22 N ATOM 0 H ARG A 141 9.002 1.117 9.155 1.00 33.40 H new ATOM 0 HA ARG A 141 8.927 1.708 6.259 1.00 1.14 H new ATOM 0 HB2 ARG A 141 10.883 2.690 8.361 1.00 35.12 H new ATOM 0 HB3 ARG A 141 10.955 3.036 6.645 1.00 35.12 H new ATOM 0 HG2 ARG A 141 9.681 4.864 7.044 1.00 33.54 H new ATOM 0 HG3 ARG A 141 8.338 3.783 7.360 1.00 33.54 H new ATOM 0 HD2 ARG A 141 8.312 4.675 9.457 1.00 52.01 H new ATOM 0 HD3 ARG A 141 9.717 3.676 9.771 1.00 52.01 H new ATOM 0 HE ARG A 141 11.135 5.561 9.585 1.00 61.33 H new ATOM 0 HH11 ARG A 141 7.771 6.407 8.838 1.00 3.04 H new ATOM 0 HH12 ARG A 141 8.084 8.144 8.903 1.00 3.04 H new ATOM 0 HH21 ARG A 141 11.508 7.787 9.636 1.00 3.22 H new ATOM 0 HH22 ARG A 141 10.180 8.917 9.351 1.00 3.22 H new ATOM 2034 N ASP A 142 11.037 0.348 5.857 1.00 31.03 N ATOM 2035 CA ASP A 142 12.036 -0.630 5.438 1.00 51.13 C ATOM 2036 C ASP A 142 11.543 -2.062 5.664 1.00 12.50 C ATOM 2037 O ASP A 142 10.394 -2.305 6.046 1.00 15.42 O ATOM 2038 CB ASP A 142 13.408 -0.355 6.088 1.00 73.24 C ATOM 2039 CG ASP A 142 14.068 0.953 5.648 1.00 53.43 C ATOM 2040 OD1 ASP A 142 13.501 1.688 4.807 1.00 64.11 O ATOM 2041 OD2 ASP A 142 15.147 1.286 6.187 1.00 55.14 O ATOM 0 H ASP A 142 10.808 1.012 5.117 1.00 31.03 H new ATOM 0 HA ASP A 142 12.183 -0.521 4.363 1.00 51.13 H new ATOM 0 HB2 ASP A 142 13.286 -0.339 7.171 1.00 73.24 H new ATOM 0 HB3 ASP A 142 14.079 -1.182 5.855 1.00 73.24 H new ATOM 2045 N ASP A 143 12.380 -3.038 5.331 1.00 34.12 N ATOM 2046 CA ASP A 143 12.069 -4.463 5.342 1.00 62.03 C ATOM 2047 C ASP A 143 12.261 -5.011 6.766 1.00 52.44 C ATOM 2048 O ASP A 143 13.144 -5.822 7.043 1.00 0.54 O ATOM 2049 CB ASP A 143 12.902 -5.128 4.237 1.00 1.52 C ATOM 2050 CG ASP A 143 12.445 -6.546 3.897 1.00 13.50 C ATOM 2051 OD1 ASP A 143 12.285 -7.378 4.818 1.00 32.04 O ATOM 2052 OD2 ASP A 143 12.287 -6.807 2.695 1.00 55.43 O ATOM 0 H ASP A 143 13.337 -2.849 5.033 1.00 34.12 H new ATOM 0 HA ASP A 143 11.028 -4.685 5.107 1.00 62.03 H new ATOM 0 HB2 ASP A 143 12.854 -4.514 3.338 1.00 1.52 H new ATOM 0 HB3 ASP A 143 13.946 -5.156 4.548 1.00 1.52 H new ATOM 2056 N SER A 144 11.473 -4.502 7.712 1.00 3.23 N ATOM 2057 CA SER A 144 11.638 -4.651 9.135 1.00 14.23 C ATOM 2058 C SER A 144 10.578 -5.529 9.816 1.00 31.21 C ATOM 2059 O SER A 144 10.831 -5.971 10.938 1.00 34.14 O ATOM 2060 CB SER A 144 11.531 -3.220 9.645 1.00 71.43 C ATOM 2061 OG SER A 144 12.728 -2.492 9.444 1.00 55.21 O ATOM 0 H SER A 144 10.654 -3.941 7.477 1.00 3.23 H new ATOM 0 HA SER A 144 12.577 -5.157 9.360 1.00 14.23 H new ATOM 0 HB2 SER A 144 10.710 -2.715 9.136 1.00 71.43 H new ATOM 0 HB3 SER A 144 11.288 -3.232 10.708 1.00 71.43 H new ATOM 0 HG SER A 144 12.617 -1.579 9.783 1.00 55.21 H new ATOM 2066 N GLU A 145 9.420 -5.763 9.190 1.00 23.10 N ATOM 2067 CA GLU A 145 8.302 -6.529 9.748 1.00 0.11 C ATOM 2068 C GLU A 145 7.624 -7.412 8.680 1.00 4.21 C ATOM 2069 O GLU A 145 6.563 -7.967 8.945 1.00 53.51 O ATOM 2070 CB GLU A 145 7.266 -5.593 10.425 1.00 55.11 C ATOM 2071 CG GLU A 145 7.797 -4.806 11.637 1.00 64.54 C ATOM 2072 CD GLU A 145 6.674 -4.371 12.589 1.00 1.01 C ATOM 2073 OE1 GLU A 145 5.993 -3.360 12.320 1.00 42.34 O ATOM 2074 OE2 GLU A 145 6.449 -5.041 13.630 1.00 2.44 O ATOM 0 H GLU A 145 9.229 -5.413 8.251 1.00 23.10 H new ATOM 0 HA GLU A 145 8.714 -7.191 10.510 1.00 0.11 H new ATOM 0 HB2 GLU A 145 6.899 -4.884 9.683 1.00 55.11 H new ATOM 0 HB3 GLU A 145 6.412 -6.191 10.744 1.00 55.11 H new ATOM 0 HG2 GLU A 145 8.513 -5.422 12.181 1.00 64.54 H new ATOM 0 HG3 GLU A 145 8.335 -3.925 11.287 1.00 64.54 H new ATOM 2079 N VAL A 146 8.189 -7.577 7.479 1.00 52.54 N ATOM 2080 CA VAL A 146 7.530 -8.320 6.395 1.00 35.11 C ATOM 2081 C VAL A 146 7.210 -9.755 6.845 1.00 61.32 C ATOM 2082 O VAL A 146 6.135 -10.282 6.567 1.00 43.15 O ATOM 2083 CB VAL A 146 8.411 -8.304 5.122 1.00 62.31 C ATOM 2084 CG1 VAL A 146 7.659 -8.869 3.910 1.00 64.13 C ATOM 2085 CG2 VAL A 146 8.892 -6.886 4.758 1.00 73.05 C ATOM 0 H VAL A 146 9.106 -7.205 7.231 1.00 52.54 H new ATOM 0 HA VAL A 146 6.586 -7.833 6.153 1.00 35.11 H new ATOM 0 HB VAL A 146 9.273 -8.929 5.357 1.00 62.31 H new ATOM 0 HG11 VAL A 146 8.308 -8.842 3.034 1.00 64.13 H new ATOM 0 HG12 VAL A 146 7.365 -9.899 4.112 1.00 64.13 H new ATOM 0 HG13 VAL A 146 6.770 -8.268 3.721 1.00 64.13 H new ATOM 0 HG21 VAL A 146 9.506 -6.930 3.858 1.00 73.05 H new ATOM 0 HG22 VAL A 146 8.030 -6.244 4.578 1.00 73.05 H new ATOM 0 HG23 VAL A 146 9.481 -6.480 5.580 1.00 73.05 H new ATOM 2095 N ASP A 147 8.114 -10.350 7.623 1.00 40.12 N ATOM 2096 CA ASP A 147 8.038 -11.724 8.099 1.00 55.34 C ATOM 2097 C ASP A 147 6.908 -11.974 9.104 1.00 64.22 C ATOM 2098 O ASP A 147 6.613 -13.128 9.406 1.00 63.13 O ATOM 2099 CB ASP A 147 9.383 -12.106 8.715 1.00 13.14 C ATOM 2100 CG ASP A 147 9.384 -13.537 9.244 1.00 42.11 C ATOM 2101 OD1 ASP A 147 9.136 -14.480 8.456 1.00 41.21 O ATOM 2102 OD2 ASP A 147 9.610 -13.693 10.462 1.00 23.40 O ATOM 0 H ASP A 147 8.950 -9.866 7.950 1.00 40.12 H new ATOM 0 HA ASP A 147 7.808 -12.349 7.236 1.00 55.34 H new ATOM 0 HB2 ASP A 147 10.169 -11.995 7.967 1.00 13.14 H new ATOM 0 HB3 ASP A 147 9.618 -11.419 9.528 1.00 13.14 H new ATOM 2106 N LYS A 148 6.236 -10.943 9.630 1.00 3.24 N ATOM 2107 CA LYS A 148 4.984 -11.136 10.359 1.00 75.21 C ATOM 2108 C LYS A 148 3.772 -10.886 9.475 1.00 61.03 C ATOM 2109 O LYS A 148 2.703 -11.427 9.760 1.00 20.22 O ATOM 2110 CB LYS A 148 4.942 -10.309 11.649 1.00 43.31 C ATOM 2111 CG LYS A 148 5.509 -8.897 11.569 1.00 22.33 C ATOM 2112 CD LYS A 148 5.390 -8.169 12.907 1.00 44.22 C ATOM 2113 CE LYS A 148 4.040 -7.459 13.006 1.00 75.22 C ATOM 2114 NZ LYS A 148 4.041 -6.479 14.105 1.00 64.11 N ATOM 0 H LYS A 148 6.539 -9.971 9.563 1.00 3.24 H new ATOM 0 HA LYS A 148 4.944 -12.183 10.658 1.00 75.21 H new ATOM 0 HB2 LYS A 148 3.905 -10.242 11.978 1.00 43.31 H new ATOM 0 HB3 LYS A 148 5.487 -10.852 12.421 1.00 43.31 H new ATOM 0 HG2 LYS A 148 6.556 -8.941 11.269 1.00 22.33 H new ATOM 0 HG3 LYS A 148 4.980 -8.335 10.799 1.00 22.33 H new ATOM 0 HD2 LYS A 148 5.496 -8.880 13.726 1.00 44.22 H new ATOM 0 HD3 LYS A 148 6.198 -7.444 13.008 1.00 44.22 H new ATOM 0 HE2 LYS A 148 3.820 -6.956 12.065 1.00 75.22 H new ATOM 0 HE3 LYS A 148 3.250 -8.192 13.168 1.00 75.22 H new ATOM 0 HZ1 LYS A 148 3.192 -5.882 14.039 1.00 64.11 H new ATOM 0 HZ2 LYS A 148 4.042 -6.980 15.017 1.00 64.11 H new ATOM 0 HZ3 LYS A 148 4.890 -5.882 14.037 1.00 64.11 H new ATOM 2124 N TRP A 149 3.908 -10.094 8.414 1.00 41.45 N ATOM 2125 CA TRP A 149 2.768 -9.611 7.650 1.00 62.24 C ATOM 2126 C TRP A 149 2.262 -10.593 6.582 1.00 33.02 C ATOM 2127 O TRP A 149 1.190 -10.356 6.027 1.00 53.33 O ATOM 2128 CB TRP A 149 3.111 -8.232 7.077 1.00 11.12 C ATOM 2129 CG TRP A 149 3.281 -7.125 8.087 1.00 0.12 C ATOM 2130 CD1 TRP A 149 2.843 -7.122 9.371 1.00 74.31 C ATOM 2131 CD2 TRP A 149 3.905 -5.823 7.896 1.00 35.41 C ATOM 2132 NE1 TRP A 149 3.172 -5.930 9.979 1.00 22.22 N ATOM 2133 CE2 TRP A 149 3.800 -5.080 9.109 1.00 40.24 C ATOM 2134 CE3 TRP A 149 4.531 -5.184 6.808 1.00 31.03 C ATOM 2135 CZ2 TRP A 149 4.264 -3.767 9.233 1.00 2.41 C ATOM 2136 CZ3 TRP A 149 4.955 -3.849 6.912 1.00 43.52 C ATOM 2137 CH2 TRP A 149 4.798 -3.142 8.105 1.00 52.12 C ATOM 0 H TRP A 149 4.810 -9.772 8.063 1.00 41.45 H new ATOM 0 HA TRP A 149 1.921 -9.522 8.330 1.00 62.24 H new ATOM 0 HB2 TRP A 149 4.033 -8.318 6.501 1.00 11.12 H new ATOM 0 HB3 TRP A 149 2.325 -7.944 6.379 1.00 11.12 H new ATOM 0 HD1 TRP A 149 2.314 -7.935 9.847 1.00 74.31 H new ATOM 0 HE1 TRP A 149 2.973 -5.709 10.955 1.00 22.22 H new ATOM 0 HE3 TRP A 149 4.686 -5.725 5.886 1.00 31.03 H new ATOM 0 HZ2 TRP A 149 4.211 -3.249 10.179 1.00 2.41 H new ATOM 0 HZ3 TRP A 149 5.407 -3.364 6.059 1.00 43.52 H new ATOM 0 HH2 TRP A 149 5.092 -2.104 8.156 1.00 52.12 H new ATOM 2147 N SER A 150 2.962 -11.703 6.313 1.00 23.24 N ATOM 2148 CA SER A 150 2.532 -12.716 5.340 1.00 64.45 C ATOM 2149 C SER A 150 2.472 -14.128 5.960 1.00 13.12 C ATOM 2150 O SER A 150 2.429 -15.129 5.241 1.00 13.43 O ATOM 2151 CB SER A 150 3.423 -12.600 4.088 1.00 0.24 C ATOM 2152 OG SER A 150 2.828 -13.198 2.946 1.00 0.44 O ATOM 0 H SER A 150 3.848 -11.925 6.767 1.00 23.24 H new ATOM 0 HA SER A 150 1.504 -12.531 5.029 1.00 64.45 H new ATOM 0 HB2 SER A 150 3.622 -11.548 3.883 1.00 0.24 H new ATOM 0 HB3 SER A 150 4.385 -13.074 4.284 1.00 0.24 H new ATOM 0 HG SER A 150 2.450 -14.068 3.192 1.00 0.44 H new ATOM 2157 N LYS A 151 2.477 -14.248 7.294 1.00 63.21 N ATOM 2158 CA LYS A 151 2.382 -15.546 7.970 1.00 63.24 C ATOM 2159 C LYS A 151 1.021 -16.183 7.766 1.00 11.23 C ATOM 2160 O LYS A 151 0.941 -17.431 7.872 1.00 35.33 O ATOM 2161 CB LYS A 151 2.666 -15.419 9.459 1.00 51.22 C ATOM 2162 CG LYS A 151 4.076 -14.893 9.725 1.00 44.51 C ATOM 2163 CD LYS A 151 4.530 -15.161 11.168 1.00 0.41 C ATOM 2164 CE LYS A 151 5.978 -15.651 11.254 1.00 33.32 C ATOM 2165 NZ LYS A 151 6.170 -16.958 10.600 1.00 51.43 N ATOM 0 H LYS A 151 2.547 -13.454 7.930 1.00 63.21 H new ATOM 0 HA LYS A 151 3.139 -16.189 7.521 1.00 63.24 H new ATOM 0 HB2 LYS A 151 1.936 -14.748 9.912 1.00 51.22 H new ATOM 0 HB3 LYS A 151 2.545 -16.391 9.936 1.00 51.22 H new ATOM 0 HG2 LYS A 151 4.774 -15.363 9.032 1.00 44.51 H new ATOM 0 HG3 LYS A 151 4.106 -13.821 9.529 1.00 44.51 H new ATOM 0 HD2 LYS A 151 4.425 -14.247 11.752 1.00 0.41 H new ATOM 0 HD3 LYS A 151 3.872 -15.904 11.619 1.00 0.41 H new ATOM 0 HE2 LYS A 151 6.635 -14.916 10.790 1.00 33.32 H new ATOM 0 HE3 LYS A 151 6.272 -15.725 12.301 1.00 33.32 H new ATOM 0 HZ1 LYS A 151 7.011 -17.425 10.997 1.00 51.43 H new ATOM 0 HZ2 LYS A 151 5.334 -17.554 10.763 1.00 51.43 H new ATOM 0 HZ3 LYS A 151 6.301 -16.819 9.578 1.00 51.43 H new TER 2175 LYS A 151