USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=41 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 84 SER OG : rot -119:sc= 0.4 USER MOD Set 1.2: A 123 TYR OH : rot 48:sc= 1.41 USER MOD Set 2.1: A 25 ASN : amide:sc= -0.82 X(o=0.079,f=0.49) USER MOD Set 2.2: A 31 SER OG : rot -111:sc= 0.899 USER MOD Single : A 1 GLY N :NH3+ -138:sc= 0.0514 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0425) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 141:sc= -0.367 USER MOD Single : A 11 TYR OH : rot 30:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -81:sc= 1.19 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 168:sc= -0.0342 (180deg=-0.308) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl 176:sc= 0 (180deg=-0.0331) 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 100:sc= 0.176 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.116 K(o=-0.12,f=-1.1) USER MOD Single : A 59 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 61 ASN : amide:sc= 1.06 K(o=1.1,f=-0.32) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.0797 X(o=-0.08,f=-0.51) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN :FLIP amide:sc= 0.285 F(o=-0.59,f=0.29) USER MOD Single : A 77 TYR OH : rot -48:sc= 1.17 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0809 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 149:sc= 0.24 USER MOD Single : A 96 LYS NZ :NH3+ 160:sc= 0.193 (180deg=0.0775) USER MOD Single : A 97 THR OG1 : rot -169:sc= 1.37 USER MOD Single : A 101 GLN : amide:sc= -0.0265 K(o=-0.027,f=-1) USER MOD Single : A 102 MET CE :methyl 164:sc=-0.00843 (180deg=-0.188) USER MOD Single : A 103 LYS NZ :NH3+ 168:sc=-0.00171 (180deg=-0.0907) USER MOD Single : A 104 ASN : amide:sc= -0.507 K(o=-0.51,f=-3.7!) USER MOD Single : A 105 TYR OH : rot -82:sc= 1.2 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot -129:sc= -0.367 USER MOD Single : A 115 SER OG : rot -160:sc= -0.175 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.0767 USER MOD Single : A 119 ASN :FLIP amide:sc= -0.804 F(o=-2.1,f=-0.8) USER MOD Single : A 120 HIS : no HD1:sc= -0.407 X(o=-0.41,f=-0.41) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.43) USER MOD Single : A 128 ASN : amide:sc= 1.22 K(o=1.2,f=-0.065) USER MOD Single : A 135 ASN : amide:sc= 1.08 K(o=1.1,f=-0.11) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.312) USER MOD Single : A 150 SER OG : rot 120:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ -115:sc= 0.0265 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.118 -23.747 0.807 1.00 33.32 N ATOM 2 CA GLY A 1 -9.070 -24.185 -0.595 1.00 30.32 C ATOM 3 C GLY A 1 -8.298 -23.212 -1.476 1.00 51.24 C ATOM 4 O GLY A 1 -7.506 -22.401 -0.987 1.00 73.33 O ATOM 0 H1 GLY A 1 -8.964 -24.564 1.431 1.00 33.32 H new ATOM 0 H2 GLY A 1 -8.375 -23.039 0.975 1.00 33.32 H new ATOM 0 H3 GLY A 1 -10.048 -23.328 1.008 1.00 33.32 H new ATOM 0 HA2 GLY A 1 -8.606 -25.170 -0.650 1.00 30.32 H new ATOM 0 HA3 GLY A 1 -10.086 -24.290 -0.976 1.00 30.32 H new ATOM 8 N MET A 2 -8.478 -23.314 -2.794 1.00 65.33 N ATOM 9 CA MET A 2 -7.699 -22.592 -3.803 1.00 22.05 C ATOM 10 C MET A 2 -8.175 -21.140 -3.979 1.00 45.41 C ATOM 11 O MET A 2 -8.824 -20.808 -4.971 1.00 5.25 O ATOM 12 CB MET A 2 -7.652 -23.404 -5.116 1.00 10.45 C ATOM 13 CG MET A 2 -8.985 -23.748 -5.797 1.00 50.21 C ATOM 14 SD MET A 2 -8.764 -24.754 -7.291 1.00 31.34 S ATOM 15 CE MET A 2 -10.431 -24.646 -7.991 1.00 33.42 C ATOM 0 H MET A 2 -9.191 -23.919 -3.201 1.00 65.33 H new ATOM 0 HA MET A 2 -6.671 -22.497 -3.453 1.00 22.05 H new ATOM 0 HB2 MET A 2 -7.045 -22.849 -5.831 1.00 10.45 H new ATOM 0 HB3 MET A 2 -7.130 -24.339 -4.912 1.00 10.45 H new ATOM 0 HG2 MET A 2 -9.621 -24.284 -5.093 1.00 50.21 H new ATOM 0 HG3 MET A 2 -9.505 -22.826 -6.058 1.00 50.21 H new ATOM 0 HE1 MET A 2 -10.473 -25.213 -8.921 1.00 33.42 H new ATOM 0 HE2 MET A 2 -11.150 -25.057 -7.283 1.00 33.42 H new ATOM 0 HE3 MET A 2 -10.675 -23.603 -8.192 1.00 33.42 H new ATOM 23 N ALA A 3 -7.874 -20.261 -3.018 1.00 24.25 N ATOM 24 CA ALA A 3 -8.129 -18.825 -3.124 1.00 13.11 C ATOM 25 C ALA A 3 -7.185 -18.051 -2.197 1.00 4.24 C ATOM 26 O ALA A 3 -7.544 -17.775 -1.049 1.00 22.44 O ATOM 27 CB ALA A 3 -9.601 -18.520 -2.794 1.00 5.54 C ATOM 0 H ALA A 3 -7.441 -20.532 -2.135 1.00 24.25 H new ATOM 0 HA ALA A 3 -7.938 -18.505 -4.148 1.00 13.11 H new ATOM 0 HB1 ALA A 3 -9.778 -17.448 -2.877 1.00 5.54 H new ATOM 0 HB2 ALA A 3 -10.248 -19.049 -3.494 1.00 5.54 H new ATOM 0 HB3 ALA A 3 -9.821 -18.847 -1.778 1.00 5.54 H new ATOM 33 N LYS A 4 -5.987 -17.692 -2.667 1.00 54.33 N ATOM 34 CA LYS A 4 -5.143 -16.648 -2.069 1.00 64.41 C ATOM 35 C LYS A 4 -4.163 -16.087 -3.106 1.00 12.24 C ATOM 36 O LYS A 4 -3.845 -16.802 -4.057 1.00 12.21 O ATOM 37 CB LYS A 4 -4.428 -17.145 -0.789 1.00 22.14 C ATOM 38 CG LYS A 4 -3.315 -18.195 -0.925 1.00 4.15 C ATOM 39 CD LYS A 4 -3.757 -19.572 -1.443 1.00 62.04 C ATOM 40 CE LYS A 4 -3.406 -19.779 -2.921 1.00 34.43 C ATOM 41 NZ LYS A 4 -1.960 -19.963 -3.137 1.00 53.53 N ATOM 0 H LYS A 4 -5.567 -18.126 -3.489 1.00 54.33 H new ATOM 0 HA LYS A 4 -5.791 -15.830 -1.754 1.00 64.41 H new ATOM 0 HB2 LYS A 4 -4.002 -16.275 -0.290 1.00 22.14 H new ATOM 0 HB3 LYS A 4 -5.188 -17.554 -0.124 1.00 22.14 H new ATOM 0 HG2 LYS A 4 -2.551 -17.803 -1.596 1.00 4.15 H new ATOM 0 HG3 LYS A 4 -2.845 -18.328 0.050 1.00 4.15 H new ATOM 0 HD2 LYS A 4 -3.282 -20.351 -0.847 1.00 62.04 H new ATOM 0 HD3 LYS A 4 -4.833 -19.679 -1.309 1.00 62.04 H new ATOM 0 HE2 LYS A 4 -3.940 -20.650 -3.299 1.00 34.43 H new ATOM 0 HE3 LYS A 4 -3.750 -18.920 -3.497 1.00 34.43 H new ATOM 0 HZ1 LYS A 4 -1.793 -20.282 -4.113 1.00 53.53 H new ATOM 0 HZ2 LYS A 4 -1.468 -19.061 -2.978 1.00 53.53 H new ATOM 0 HZ3 LYS A 4 -1.598 -20.676 -2.473 1.00 53.53 H new ATOM 51 N LYS A 5 -3.659 -14.858 -2.917 1.00 51.43 N ATOM 52 CA LYS A 5 -2.526 -14.249 -3.637 1.00 5.34 C ATOM 53 C LYS A 5 -1.932 -13.117 -2.818 1.00 31.44 C ATOM 54 O LYS A 5 -2.623 -12.575 -1.958 1.00 3.14 O ATOM 55 CB LYS A 5 -2.924 -13.628 -4.988 1.00 23.34 C ATOM 56 CG LYS A 5 -3.281 -14.657 -6.036 1.00 41.44 C ATOM 57 CD LYS A 5 -3.043 -14.124 -7.464 1.00 21.22 C ATOM 58 CE LYS A 5 -3.165 -15.198 -8.551 1.00 10.45 C ATOM 59 NZ LYS A 5 -4.476 -15.870 -8.559 1.00 34.42 N ATOM 0 H LYS A 5 -4.052 -14.226 -2.219 1.00 51.43 H new ATOM 0 HA LYS A 5 -1.822 -15.064 -3.803 1.00 5.34 H new ATOM 0 HB2 LYS A 5 -3.774 -12.962 -4.838 1.00 23.34 H new ATOM 0 HB3 LYS A 5 -2.100 -13.016 -5.355 1.00 23.34 H new ATOM 0 HG2 LYS A 5 -2.686 -15.557 -5.880 1.00 41.44 H new ATOM 0 HG3 LYS A 5 -4.327 -14.943 -5.924 1.00 41.44 H new ATOM 0 HD2 LYS A 5 -3.759 -13.329 -7.670 1.00 21.22 H new ATOM 0 HD3 LYS A 5 -2.049 -13.679 -7.515 1.00 21.22 H new ATOM 0 HE2 LYS A 5 -2.993 -14.741 -9.525 1.00 10.45 H new ATOM 0 HE3 LYS A 5 -2.383 -15.943 -8.406 1.00 10.45 H new ATOM 0 HZ1 LYS A 5 -4.496 -16.584 -9.315 1.00 34.42 H new ATOM 0 HZ2 LYS A 5 -4.634 -16.333 -7.641 1.00 34.42 H new ATOM 0 HZ3 LYS A 5 -5.225 -15.168 -8.726 1.00 34.42 H new ATOM 69 N THR A 6 -0.740 -12.679 -3.204 1.00 21.43 N ATOM 70 CA THR A 6 0.010 -11.624 -2.529 1.00 74.14 C ATOM 71 C THR A 6 0.482 -10.580 -3.550 1.00 73.44 C ATOM 72 O THR A 6 1.429 -10.813 -4.299 1.00 23.40 O ATOM 73 CB THR A 6 1.159 -12.261 -1.719 1.00 73.23 C ATOM 74 OG1 THR A 6 0.651 -13.266 -0.853 1.00 51.52 O ATOM 75 CG2 THR A 6 1.887 -11.195 -0.900 1.00 70.02 C ATOM 0 H THR A 6 -0.254 -13.057 -4.017 1.00 21.43 H new ATOM 0 HA THR A 6 -0.623 -11.089 -1.821 1.00 74.14 H new ATOM 0 HB THR A 6 1.863 -12.714 -2.417 1.00 73.23 H new ATOM 0 HG1 THR A 6 1.389 -13.664 -0.346 1.00 51.52 H new ATOM 0 HG21 THR A 6 2.695 -11.659 -0.334 1.00 70.02 H new ATOM 0 HG22 THR A 6 2.300 -10.441 -1.570 1.00 70.02 H new ATOM 0 HG23 THR A 6 1.186 -10.724 -0.211 1.00 70.02 H new ATOM 83 N LEU A 7 -0.190 -9.429 -3.628 1.00 1.14 N ATOM 84 CA LEU A 7 0.273 -8.281 -4.428 1.00 2.30 C ATOM 85 C LEU A 7 1.119 -7.326 -3.576 1.00 71.41 C ATOM 86 O LEU A 7 1.121 -7.417 -2.344 1.00 33.24 O ATOM 87 CB LEU A 7 -0.964 -7.604 -5.036 1.00 13.54 C ATOM 88 CG LEU A 7 -0.763 -6.433 -6.013 1.00 32.21 C ATOM 89 CD1 LEU A 7 0.147 -6.784 -7.195 1.00 14.40 C ATOM 90 CD2 LEU A 7 -2.136 -6.019 -6.558 1.00 2.51 C ATOM 0 H LEU A 7 -1.070 -9.262 -3.141 1.00 1.14 H new ATOM 0 HA LEU A 7 0.927 -8.608 -5.236 1.00 2.30 H new ATOM 0 HB2 LEU A 7 -1.539 -8.371 -5.554 1.00 13.54 H new ATOM 0 HB3 LEU A 7 -1.582 -7.245 -4.213 1.00 13.54 H new ATOM 0 HG LEU A 7 -0.279 -5.626 -5.463 1.00 32.21 H new ATOM 0 HD11 LEU A 7 0.248 -5.916 -7.847 1.00 14.40 H new ATOM 0 HD12 LEU A 7 1.129 -7.076 -6.824 1.00 14.40 H new ATOM 0 HD13 LEU A 7 -0.289 -7.610 -7.757 1.00 14.40 H new ATOM 0 HD21 LEU A 7 -2.016 -5.189 -7.254 1.00 2.51 H new ATOM 0 HD22 LEU A 7 -2.592 -6.863 -7.076 1.00 2.51 H new ATOM 0 HD23 LEU A 7 -2.777 -5.711 -5.732 1.00 2.51 H new ATOM 101 N ILE A 8 1.846 -6.422 -4.238 1.00 34.21 N ATOM 102 CA ILE A 8 2.656 -5.373 -3.642 1.00 43.33 C ATOM 103 C ILE A 8 2.397 -4.100 -4.456 1.00 12.52 C ATOM 104 O ILE A 8 2.457 -4.156 -5.689 1.00 53.25 O ATOM 105 CB ILE A 8 4.162 -5.741 -3.694 1.00 30.40 C ATOM 106 CG1 ILE A 8 4.503 -7.185 -3.250 1.00 61.43 C ATOM 107 CG2 ILE A 8 4.849 -4.789 -2.695 1.00 42.45 C ATOM 108 CD1 ILE A 8 5.946 -7.598 -3.558 1.00 51.13 C ATOM 0 H ILE A 8 1.883 -6.407 -5.257 1.00 34.21 H new ATOM 0 HA ILE A 8 2.393 -5.234 -2.593 1.00 43.33 H new ATOM 0 HB ILE A 8 4.489 -5.658 -4.731 1.00 30.40 H new ATOM 0 HG12 ILE A 8 4.329 -7.277 -2.178 1.00 61.43 H new ATOM 0 HG13 ILE A 8 3.822 -7.878 -3.744 1.00 61.43 H new ATOM 0 HG21 ILE A 8 5.920 -4.991 -2.677 1.00 42.45 H new ATOM 0 HG22 ILE A 8 4.679 -3.757 -3.001 1.00 42.45 H new ATOM 0 HG23 ILE A 8 4.434 -4.945 -1.699 1.00 42.45 H new ATOM 0 HD11 ILE A 8 6.112 -8.621 -3.219 1.00 51.13 H new ATOM 0 HD12 ILE A 8 6.120 -7.539 -4.632 1.00 51.13 H new ATOM 0 HD13 ILE A 8 6.634 -6.929 -3.042 1.00 51.13 H new ATOM 119 N LEU A 9 2.138 -2.957 -3.802 1.00 45.53 N ATOM 120 CA LEU A 9 2.087 -1.647 -4.452 1.00 3.41 C ATOM 121 C LEU A 9 2.846 -0.610 -3.642 1.00 1.50 C ATOM 122 O LEU A 9 2.847 -0.616 -2.418 1.00 32.31 O ATOM 123 CB LEU A 9 0.655 -1.124 -4.647 1.00 44.15 C ATOM 124 CG LEU A 9 -0.155 -1.936 -5.668 1.00 2.21 C ATOM 125 CD1 LEU A 9 -1.071 -2.928 -4.959 1.00 54.33 C ATOM 126 CD2 LEU A 9 -0.983 -1.021 -6.571 1.00 12.41 C ATOM 0 H LEU A 9 1.957 -2.920 -2.799 1.00 45.53 H new ATOM 0 HA LEU A 9 2.544 -1.794 -5.431 1.00 3.41 H new ATOM 0 HB2 LEU A 9 0.137 -1.139 -3.688 1.00 44.15 H new ATOM 0 HB3 LEU A 9 0.696 -0.084 -4.971 1.00 44.15 H new ATOM 0 HG LEU A 9 0.553 -2.485 -6.289 1.00 2.21 H new ATOM 0 HD11 LEU A 9 -1.637 -3.494 -5.699 1.00 54.33 H new ATOM 0 HD12 LEU A 9 -0.471 -3.613 -4.359 1.00 54.33 H new ATOM 0 HD13 LEU A 9 -1.761 -2.387 -4.311 1.00 54.33 H new ATOM 0 HD21 LEU A 9 -1.545 -1.625 -7.283 1.00 12.41 H new ATOM 0 HD22 LEU A 9 -1.675 -0.439 -5.963 1.00 12.41 H new ATOM 0 HD23 LEU A 9 -0.319 -0.346 -7.112 1.00 12.41 H new ATOM 137 N TYR A 10 3.412 0.374 -4.328 1.00 65.34 N ATOM 138 CA TYR A 10 4.112 1.499 -3.722 1.00 33.12 C ATOM 139 C TYR A 10 4.218 2.658 -4.689 1.00 62.04 C ATOM 140 O TYR A 10 4.196 2.486 -5.912 1.00 61.32 O ATOM 141 CB TYR A 10 5.471 1.093 -3.125 1.00 33.10 C ATOM 142 CG TYR A 10 6.118 -0.162 -3.665 1.00 22.24 C ATOM 143 CD1 TYR A 10 6.119 -0.480 -5.037 1.00 63.41 C ATOM 144 CD2 TYR A 10 6.568 -1.101 -2.732 1.00 5.32 C ATOM 145 CE1 TYR A 10 6.458 -1.781 -5.437 1.00 42.11 C ATOM 146 CE2 TYR A 10 6.932 -2.385 -3.129 1.00 30.43 C ATOM 147 CZ TYR A 10 6.851 -2.747 -4.480 1.00 73.02 C ATOM 148 OH TYR A 10 7.230 -4.005 -4.831 1.00 2.32 O ATOM 0 H TYR A 10 3.397 0.413 -5.347 1.00 65.34 H new ATOM 0 HA TYR A 10 3.514 1.841 -2.878 1.00 33.12 H new ATOM 0 HB2 TYR A 10 6.165 1.921 -3.272 1.00 33.10 H new ATOM 0 HB3 TYR A 10 5.344 0.971 -2.049 1.00 33.10 H new ATOM 0 HD1 TYR A 10 5.862 0.268 -5.772 1.00 63.41 H new ATOM 0 HD2 TYR A 10 6.634 -0.827 -1.689 1.00 5.32 H new ATOM 0 HE1 TYR A 10 6.419 -2.048 -6.483 1.00 42.11 H new ATOM 0 HE2 TYR A 10 7.276 -3.101 -2.397 1.00 30.43 H new ATOM 0 HH TYR A 10 7.983 -4.288 -4.271 1.00 2.32 H new ATOM 157 N TYR A 11 4.396 3.844 -4.119 1.00 52.21 N ATOM 158 CA TYR A 11 4.873 5.004 -4.850 1.00 45.33 C ATOM 159 C TYR A 11 6.374 5.188 -4.560 1.00 51.41 C ATOM 160 O TYR A 11 6.982 4.403 -3.821 1.00 4.31 O ATOM 161 CB TYR A 11 3.968 6.211 -4.529 1.00 64.24 C ATOM 162 CG TYR A 11 4.274 7.453 -5.352 1.00 13.44 C ATOM 163 CD1 TYR A 11 4.357 7.351 -6.752 1.00 3.24 C ATOM 164 CD2 TYR A 11 4.553 8.684 -4.735 1.00 1.11 C ATOM 165 CE1 TYR A 11 4.715 8.454 -7.537 1.00 3.10 C ATOM 166 CE2 TYR A 11 4.964 9.792 -5.509 1.00 52.13 C ATOM 167 CZ TYR A 11 5.050 9.674 -6.920 1.00 10.22 C ATOM 168 OH TYR A 11 5.456 10.705 -7.708 1.00 65.05 O ATOM 0 H TYR A 11 4.212 4.025 -3.132 1.00 52.21 H new ATOM 0 HA TYR A 11 4.802 4.880 -5.931 1.00 45.33 H new ATOM 0 HB2 TYR A 11 2.929 5.926 -4.694 1.00 64.24 H new ATOM 0 HB3 TYR A 11 4.068 6.455 -3.471 1.00 64.24 H new ATOM 0 HD1 TYR A 11 4.141 6.407 -7.230 1.00 3.24 H new ATOM 0 HD2 TYR A 11 4.453 8.784 -3.664 1.00 1.11 H new ATOM 0 HE1 TYR A 11 4.734 8.369 -8.613 1.00 3.10 H new ATOM 0 HE2 TYR A 11 5.212 10.726 -5.028 1.00 52.13 H new ATOM 0 HH TYR A 11 5.029 10.633 -8.587 1.00 65.05 H new ATOM 177 N SER A 12 6.995 6.185 -5.174 1.00 21.03 N ATOM 178 CA SER A 12 8.412 6.496 -5.035 1.00 72.11 C ATOM 179 C SER A 12 8.563 7.940 -4.539 1.00 52.23 C ATOM 180 O SER A 12 7.579 8.640 -4.295 1.00 11.43 O ATOM 181 CB SER A 12 9.119 6.203 -6.373 1.00 70.21 C ATOM 182 OG SER A 12 8.358 6.649 -7.484 1.00 53.44 O ATOM 0 H SER A 12 6.510 6.823 -5.805 1.00 21.03 H new ATOM 0 HA SER A 12 8.897 5.868 -4.287 1.00 72.11 H new ATOM 0 HB2 SER A 12 10.094 6.690 -6.382 1.00 70.21 H new ATOM 0 HB3 SER A 12 9.297 5.131 -6.462 1.00 70.21 H new ATOM 0 HG SER A 12 8.840 6.447 -8.313 1.00 53.44 H new ATOM 187 N TRP A 13 9.807 8.389 -4.400 1.00 52.14 N ATOM 188 CA TRP A 13 10.129 9.776 -4.156 1.00 34.11 C ATOM 189 C TRP A 13 11.334 10.078 -5.037 1.00 13.52 C ATOM 190 O TRP A 13 11.145 10.426 -6.200 1.00 65.04 O ATOM 191 CB TRP A 13 10.315 10.012 -2.649 1.00 43.33 C ATOM 192 CG TRP A 13 10.195 11.438 -2.221 1.00 51.25 C ATOM 193 CD1 TRP A 13 9.073 12.180 -2.340 1.00 3.33 C ATOM 194 CD2 TRP A 13 11.172 12.285 -1.542 1.00 10.00 C ATOM 195 NE1 TRP A 13 9.287 13.428 -1.796 1.00 21.53 N ATOM 196 CE2 TRP A 13 10.568 13.555 -1.296 1.00 2.33 C ATOM 197 CE3 TRP A 13 12.490 12.098 -1.072 1.00 65.44 C ATOM 198 CZ2 TRP A 13 11.245 14.589 -0.634 1.00 64.52 C ATOM 199 CZ3 TRP A 13 13.172 13.124 -0.391 1.00 2.02 C ATOM 200 CH2 TRP A 13 12.551 14.366 -0.167 1.00 13.14 C ATOM 0 H TRP A 13 10.626 7.784 -4.456 1.00 52.14 H new ATOM 0 HA TRP A 13 9.337 10.475 -4.424 1.00 34.11 H new ATOM 0 HB2 TRP A 13 9.575 9.421 -2.109 1.00 43.33 H new ATOM 0 HB3 TRP A 13 11.297 9.640 -2.355 1.00 43.33 H new ATOM 0 HD1 TRP A 13 8.150 11.847 -2.792 1.00 3.33 H new ATOM 0 HE1 TRP A 13 8.585 14.167 -1.766 1.00 21.53 H new ATOM 0 HE3 TRP A 13 12.983 11.152 -1.238 1.00 65.44 H new ATOM 0 HZ2 TRP A 13 10.768 15.546 -0.485 1.00 64.52 H new ATOM 0 HZ3 TRP A 13 14.179 12.956 -0.038 1.00 2.02 H new ATOM 0 HH2 TRP A 13 13.077 15.146 0.363 1.00 13.14 H new ATOM 210 N SER A 14 12.549 9.793 -4.564 1.00 34.00 N ATOM 211 CA SER A 14 13.775 10.029 -5.309 1.00 25.30 C ATOM 212 C SER A 14 14.673 8.789 -5.232 1.00 24.20 C ATOM 213 O SER A 14 15.825 8.858 -4.802 1.00 30.41 O ATOM 214 CB SER A 14 14.404 11.352 -4.823 1.00 2.21 C ATOM 215 OG SER A 14 14.782 12.138 -5.938 1.00 74.25 O ATOM 0 H SER A 14 12.705 9.387 -3.641 1.00 34.00 H new ATOM 0 HA SER A 14 13.593 10.167 -6.375 1.00 25.30 H new ATOM 0 HB2 SER A 14 13.692 11.899 -4.205 1.00 2.21 H new ATOM 0 HB3 SER A 14 15.274 11.145 -4.200 1.00 2.21 H new ATOM 0 HG SER A 14 15.179 12.978 -5.627 1.00 74.25 H new ATOM 220 N GLY A 15 14.153 7.630 -5.641 1.00 22.10 N ATOM 221 CA GLY A 15 14.934 6.397 -5.741 1.00 50.24 C ATOM 222 C GLY A 15 15.213 5.746 -4.385 1.00 3.11 C ATOM 223 O GLY A 15 16.064 4.859 -4.295 1.00 61.24 O ATOM 0 H GLY A 15 13.176 7.521 -5.913 1.00 22.10 H new ATOM 0 HA2 GLY A 15 14.401 5.688 -6.374 1.00 50.24 H new ATOM 0 HA3 GLY A 15 15.882 6.614 -6.234 1.00 50.24 H new ATOM 227 N GLU A 16 14.502 6.186 -3.341 1.00 34.20 N ATOM 228 CA GLU A 16 14.531 5.591 -2.009 1.00 74.01 C ATOM 229 C GLU A 16 13.659 4.347 -2.030 1.00 10.22 C ATOM 230 O GLU A 16 14.098 3.207 -2.163 1.00 21.34 O ATOM 231 CB GLU A 16 14.045 6.571 -0.906 1.00 10.10 C ATOM 232 CG GLU A 16 13.114 7.722 -1.319 1.00 22.41 C ATOM 233 CD GLU A 16 12.103 8.020 -0.209 1.00 1.13 C ATOM 234 OE1 GLU A 16 11.037 7.365 -0.241 1.00 62.31 O ATOM 235 OE2 GLU A 16 12.346 8.911 0.639 1.00 64.43 O ATOM 0 H GLU A 16 13.875 6.988 -3.406 1.00 34.20 H new ATOM 0 HA GLU A 16 15.563 5.341 -1.762 1.00 74.01 H new ATOM 0 HB2 GLU A 16 13.533 5.986 -0.142 1.00 10.10 H new ATOM 0 HB3 GLU A 16 14.926 7.007 -0.436 1.00 10.10 H new ATOM 0 HG2 GLU A 16 13.702 8.615 -1.532 1.00 22.41 H new ATOM 0 HG3 GLU A 16 12.588 7.460 -2.237 1.00 22.41 H new ATOM 240 N THR A 17 12.368 4.623 -1.981 1.00 74.14 N ATOM 241 CA THR A 17 11.234 3.748 -1.912 1.00 2.34 C ATOM 242 C THR A 17 11.322 2.707 -3.031 1.00 61.34 C ATOM 243 O THR A 17 10.895 1.569 -2.863 1.00 43.45 O ATOM 244 CB THR A 17 9.996 4.664 -2.041 1.00 73.03 C ATOM 245 OG1 THR A 17 10.277 6.039 -2.292 1.00 11.20 O ATOM 246 CG2 THR A 17 8.971 4.574 -0.921 1.00 54.12 C ATOM 0 H THR A 17 12.063 5.596 -1.991 1.00 74.14 H new ATOM 0 HA THR A 17 11.183 3.184 -0.981 1.00 2.34 H new ATOM 0 HB THR A 17 9.546 4.230 -2.934 1.00 73.03 H new ATOM 0 HG1 THR A 17 10.512 6.484 -1.451 1.00 11.20 H new ATOM 0 HG21 THR A 17 8.150 5.262 -1.123 1.00 54.12 H new ATOM 0 HG22 THR A 17 8.585 3.556 -0.862 1.00 54.12 H new ATOM 0 HG23 THR A 17 9.442 4.839 0.026 1.00 54.12 H new ATOM 254 N LYS A 18 11.927 3.082 -4.169 1.00 74.01 N ATOM 255 CA LYS A 18 12.107 2.208 -5.314 1.00 2.33 C ATOM 256 C LYS A 18 13.031 1.026 -5.021 1.00 45.54 C ATOM 257 O LYS A 18 12.813 -0.067 -5.544 1.00 70.25 O ATOM 258 CB LYS A 18 12.608 3.043 -6.496 1.00 72.24 C ATOM 259 CG LYS A 18 12.638 2.260 -7.815 1.00 54.45 C ATOM 260 CD LYS A 18 11.227 2.062 -8.383 1.00 3.31 C ATOM 261 CE LYS A 18 10.565 0.795 -7.829 1.00 72.41 C ATOM 262 NZ LYS A 18 9.107 0.968 -7.645 1.00 62.43 N ATOM 0 H LYS A 18 12.307 4.018 -4.311 1.00 74.01 H new ATOM 0 HA LYS A 18 11.144 1.762 -5.563 1.00 2.33 H new ATOM 0 HB2 LYS A 18 11.967 3.917 -6.613 1.00 72.24 H new ATOM 0 HB3 LYS A 18 13.610 3.410 -6.275 1.00 72.24 H new ATOM 0 HG2 LYS A 18 13.252 2.792 -8.541 1.00 54.45 H new ATOM 0 HG3 LYS A 18 13.106 1.289 -7.652 1.00 54.45 H new ATOM 0 HD2 LYS A 18 10.612 2.929 -8.141 1.00 3.31 H new ATOM 0 HD3 LYS A 18 11.278 2.000 -9.470 1.00 3.31 H new ATOM 0 HE2 LYS A 18 10.749 -0.037 -8.509 1.00 72.41 H new ATOM 0 HE3 LYS A 18 11.023 0.534 -6.875 1.00 72.41 H new ATOM 0 HZ1 LYS A 18 8.698 0.089 -7.269 1.00 62.43 H new ATOM 0 HZ2 LYS A 18 8.931 1.745 -6.977 1.00 62.43 H new ATOM 0 HZ3 LYS A 18 8.666 1.192 -8.560 1.00 62.43 H new ATOM 272 N LYS A 19 14.070 1.232 -4.221 1.00 45.35 N ATOM 273 CA LYS A 19 14.911 0.154 -3.703 1.00 24.43 C ATOM 274 C LYS A 19 14.040 -0.816 -2.934 1.00 13.50 C ATOM 275 O LYS A 19 14.013 -2.007 -3.241 1.00 1.24 O ATOM 276 CB LYS A 19 16.062 0.720 -2.837 1.00 73.15 C ATOM 277 CG LYS A 19 17.381 -0.052 -3.015 1.00 75.44 C ATOM 278 CD LYS A 19 18.270 0.524 -4.128 1.00 20.10 C ATOM 279 CE LYS A 19 17.533 0.588 -5.463 1.00 55.14 C ATOM 280 NZ LYS A 19 18.260 1.343 -6.487 1.00 53.54 N ATOM 0 H LYS A 19 14.357 2.160 -3.909 1.00 45.35 H new ATOM 0 HA LYS A 19 15.382 -0.381 -4.528 1.00 24.43 H new ATOM 0 HB2 LYS A 19 16.222 1.767 -3.094 1.00 73.15 H new ATOM 0 HB3 LYS A 19 15.769 0.691 -1.788 1.00 73.15 H new ATOM 0 HG2 LYS A 19 17.932 -0.040 -2.075 1.00 75.44 H new ATOM 0 HG3 LYS A 19 17.157 -1.095 -3.240 1.00 75.44 H new ATOM 0 HD2 LYS A 19 18.602 1.523 -3.848 1.00 20.10 H new ATOM 0 HD3 LYS A 19 19.164 -0.091 -4.235 1.00 20.10 H new ATOM 0 HE2 LYS A 19 17.358 -0.426 -5.823 1.00 55.14 H new ATOM 0 HE3 LYS A 19 16.555 1.045 -5.310 1.00 55.14 H new ATOM 0 HZ1 LYS A 19 17.709 1.351 -7.369 1.00 53.54 H new ATOM 0 HZ2 LYS A 19 18.405 2.320 -6.161 1.00 53.54 H new ATOM 0 HZ3 LYS A 19 19.183 0.895 -6.659 1.00 53.54 H new ATOM 290 N MET A 20 13.265 -0.281 -1.999 1.00 64.22 N ATOM 291 CA MET A 20 12.377 -1.008 -1.111 1.00 44.35 C ATOM 292 C MET A 20 11.114 -1.539 -1.809 1.00 43.21 C ATOM 293 O MET A 20 10.072 -1.679 -1.174 1.00 34.02 O ATOM 294 CB MET A 20 12.063 -0.075 0.075 1.00 13.53 C ATOM 295 CG MET A 20 11.984 -0.837 1.400 1.00 5.44 C ATOM 296 SD MET A 20 13.468 -1.777 1.846 1.00 71.34 S ATOM 297 CE MET A 20 14.676 -0.432 1.909 1.00 43.32 C ATOM 0 H MET A 20 13.240 0.725 -1.834 1.00 64.22 H new ATOM 0 HA MET A 20 12.869 -1.914 -0.758 1.00 44.35 H new ATOM 0 HB2 MET A 20 12.832 0.694 0.145 1.00 13.53 H new ATOM 0 HB3 MET A 20 11.117 0.436 -0.106 1.00 13.53 H new ATOM 0 HG2 MET A 20 11.773 -0.124 2.197 1.00 5.44 H new ATOM 0 HG3 MET A 20 11.139 -1.524 1.355 1.00 5.44 H new ATOM 0 HE1 MET A 20 15.595 -0.790 2.374 1.00 43.32 H new ATOM 0 HE2 MET A 20 14.891 -0.088 0.897 1.00 43.32 H new ATOM 0 HE3 MET A 20 14.271 0.394 2.494 1.00 43.32 H new ATOM 305 N ALA A 21 11.191 -1.853 -3.106 1.00 73.24 N ATOM 306 CA ALA A 21 10.139 -2.443 -3.886 1.00 11.31 C ATOM 307 C ALA A 21 10.649 -3.747 -4.471 1.00 25.44 C ATOM 308 O ALA A 21 10.208 -4.828 -4.083 1.00 2.53 O ATOM 309 CB ALA A 21 9.705 -1.445 -4.967 1.00 65.15 C ATOM 0 H ALA A 21 12.037 -1.688 -3.652 1.00 73.24 H new ATOM 0 HA ALA A 21 9.264 -2.668 -3.276 1.00 11.31 H new ATOM 0 HB1 ALA A 21 8.906 -1.882 -5.566 1.00 65.15 H new ATOM 0 HB2 ALA A 21 9.346 -0.531 -4.495 1.00 65.15 H new ATOM 0 HB3 ALA A 21 10.554 -1.212 -5.609 1.00 65.15 H new ATOM 315 N GLU A 22 11.602 -3.649 -5.394 1.00 73.25 N ATOM 316 CA GLU A 22 12.064 -4.803 -6.157 1.00 52.34 C ATOM 317 C GLU A 22 12.901 -5.768 -5.323 1.00 61.25 C ATOM 318 O GLU A 22 12.962 -6.955 -5.644 1.00 64.25 O ATOM 319 CB GLU A 22 12.759 -4.357 -7.449 1.00 62.22 C ATOM 320 CG GLU A 22 13.599 -3.078 -7.369 1.00 50.45 C ATOM 321 CD GLU A 22 14.362 -2.771 -8.666 1.00 21.43 C ATOM 322 OE1 GLU A 22 15.059 -3.652 -9.213 1.00 4.54 O ATOM 323 OE2 GLU A 22 14.295 -1.594 -9.106 1.00 14.41 O ATOM 0 H GLU A 22 12.072 -2.775 -5.632 1.00 73.25 H new ATOM 0 HA GLU A 22 11.186 -5.379 -6.448 1.00 52.34 H new ATOM 0 HB2 GLU A 22 13.404 -5.168 -7.786 1.00 62.22 H new ATOM 0 HB3 GLU A 22 11.997 -4.217 -8.215 1.00 62.22 H new ATOM 0 HG2 GLU A 22 12.947 -2.237 -7.131 1.00 50.45 H new ATOM 0 HG3 GLU A 22 14.312 -3.170 -6.549 1.00 50.45 H new ATOM 328 N LYS A 23 13.470 -5.295 -4.213 1.00 34.34 N ATOM 329 CA LYS A 23 14.114 -6.143 -3.234 1.00 23.34 C ATOM 330 C LYS A 23 13.083 -7.053 -2.581 1.00 12.20 C ATOM 331 O LYS A 23 13.184 -8.274 -2.713 1.00 54.45 O ATOM 332 CB LYS A 23 14.832 -5.256 -2.208 1.00 13.20 C ATOM 333 CG LYS A 23 16.351 -5.283 -2.406 1.00 1.52 C ATOM 334 CD LYS A 23 16.732 -4.349 -3.566 1.00 15.40 C ATOM 335 CE LYS A 23 18.110 -4.650 -4.146 1.00 43.14 C ATOM 336 NZ LYS A 23 19.217 -4.300 -3.239 1.00 34.44 N ATOM 0 H LYS A 23 13.492 -4.303 -3.975 1.00 34.34 H new ATOM 0 HA LYS A 23 14.855 -6.785 -3.710 1.00 23.34 H new ATOM 0 HB2 LYS A 23 14.471 -4.231 -2.296 1.00 13.20 H new ATOM 0 HB3 LYS A 23 14.590 -5.594 -1.201 1.00 13.20 H new ATOM 0 HG2 LYS A 23 16.854 -4.968 -1.491 1.00 1.52 H new ATOM 0 HG3 LYS A 23 16.683 -6.299 -2.619 1.00 1.52 H new ATOM 0 HD2 LYS A 23 15.985 -4.436 -4.355 1.00 15.40 H new ATOM 0 HD3 LYS A 23 16.709 -3.317 -3.217 1.00 15.40 H new ATOM 0 HE2 LYS A 23 18.170 -5.711 -4.388 1.00 43.14 H new ATOM 0 HE3 LYS A 23 18.230 -4.103 -5.081 1.00 43.14 H new ATOM 0 HZ1 LYS A 23 20.124 -4.529 -3.693 1.00 34.44 H new ATOM 0 HZ2 LYS A 23 19.184 -3.282 -3.027 1.00 34.44 H new ATOM 0 HZ3 LYS A 23 19.126 -4.841 -2.355 1.00 34.44 H new ATOM 346 N ILE A 24 12.087 -6.460 -1.918 1.00 30.42 N ATOM 347 CA ILE A 24 11.068 -7.193 -1.186 1.00 14.13 C ATOM 348 C ILE A 24 10.282 -8.089 -2.145 1.00 73.15 C ATOM 349 O ILE A 24 9.928 -9.197 -1.766 1.00 72.45 O ATOM 350 CB ILE A 24 10.161 -6.218 -0.402 1.00 50.42 C ATOM 351 CG1 ILE A 24 10.981 -5.391 0.617 1.00 54.23 C ATOM 352 CG2 ILE A 24 9.066 -7.014 0.329 1.00 41.41 C ATOM 353 CD1 ILE A 24 10.187 -4.235 1.233 1.00 41.24 C ATOM 0 H ILE A 24 11.970 -5.448 -1.878 1.00 30.42 H new ATOM 0 HA ILE A 24 11.540 -7.843 -0.449 1.00 14.13 H new ATOM 0 HB ILE A 24 9.704 -5.525 -1.109 1.00 50.42 H new ATOM 0 HG12 ILE A 24 11.329 -6.049 1.413 1.00 54.23 H new ATOM 0 HG13 ILE A 24 11.867 -4.992 0.123 1.00 54.23 H new ATOM 0 HG21 ILE A 24 8.425 -6.328 0.883 1.00 41.41 H new ATOM 0 HG22 ILE A 24 8.467 -7.562 -0.399 1.00 41.41 H new ATOM 0 HG23 ILE A 24 9.528 -7.717 1.022 1.00 41.41 H new ATOM 0 HD11 ILE A 24 10.819 -3.695 1.938 1.00 41.24 H new ATOM 0 HD12 ILE A 24 9.861 -3.556 0.445 1.00 41.24 H new ATOM 0 HD13 ILE A 24 9.315 -4.630 1.755 1.00 41.24 H new ATOM 364 N ASN A 25 10.043 -7.664 -3.393 1.00 50.32 N ATOM 365 CA ASN A 25 9.371 -8.506 -4.380 1.00 30.24 C ATOM 366 C ASN A 25 10.043 -9.872 -4.519 1.00 74.34 C ATOM 367 O ASN A 25 9.351 -10.886 -4.477 1.00 11.34 O ATOM 368 CB ASN A 25 9.300 -7.821 -5.739 1.00 52.32 C ATOM 369 CG ASN A 25 8.855 -8.812 -6.811 1.00 72.35 C ATOM 370 OD1 ASN A 25 9.626 -9.139 -7.706 1.00 5.11 O ATOM 371 ND2 ASN A 25 7.648 -9.346 -6.748 1.00 24.34 N ATOM 0 H ASN A 25 10.307 -6.741 -3.739 1.00 50.32 H new ATOM 0 HA ASN A 25 8.356 -8.663 -4.014 1.00 30.24 H new ATOM 0 HB2 ASN A 25 8.602 -6.985 -5.696 1.00 52.32 H new ATOM 0 HB3 ASN A 25 10.276 -7.409 -5.997 1.00 52.32 H new ATOM 0 HD21 ASN A 25 7.357 -10.032 -7.445 1.00 24.34 H new ATOM 0 HD22 ASN A 25 7.008 -9.073 -6.003 1.00 24.34 H new ATOM 377 N SER A 26 11.369 -9.890 -4.680 1.00 51.34 N ATOM 378 CA SER A 26 12.147 -11.117 -4.783 1.00 42.33 C ATOM 379 C SER A 26 12.015 -11.957 -3.506 1.00 12.50 C ATOM 380 O SER A 26 12.038 -13.184 -3.577 1.00 21.40 O ATOM 381 CB SER A 26 13.606 -10.718 -5.049 1.00 33.12 C ATOM 382 OG SER A 26 14.444 -11.819 -5.332 1.00 34.01 O ATOM 0 H SER A 26 11.933 -9.043 -4.743 1.00 51.34 H new ATOM 0 HA SER A 26 11.778 -11.738 -5.600 1.00 42.33 H new ATOM 0 HB2 SER A 26 13.638 -10.021 -5.887 1.00 33.12 H new ATOM 0 HB3 SER A 26 13.995 -10.189 -4.179 1.00 33.12 H new ATOM 0 HG SER A 26 15.357 -11.502 -5.494 1.00 34.01 H new ATOM 387 N GLU A 27 11.878 -11.317 -2.344 1.00 63.25 N ATOM 388 CA GLU A 27 11.865 -11.971 -1.041 1.00 65.32 C ATOM 389 C GLU A 27 10.461 -12.405 -0.590 1.00 21.00 C ATOM 390 O GLU A 27 10.344 -13.092 0.427 1.00 24.01 O ATOM 391 CB GLU A 27 12.504 -11.028 -0.013 1.00 72.21 C ATOM 392 CG GLU A 27 14.022 -10.828 -0.212 1.00 44.11 C ATOM 393 CD GLU A 27 14.888 -11.261 0.981 1.00 10.23 C ATOM 394 OE1 GLU A 27 14.581 -12.248 1.697 1.00 70.15 O ATOM 395 OE2 GLU A 27 15.944 -10.625 1.206 1.00 1.23 O ATOM 0 H GLU A 27 11.771 -10.304 -2.285 1.00 63.25 H new ATOM 0 HA GLU A 27 12.441 -12.893 -1.123 1.00 65.32 H new ATOM 0 HB2 GLU A 27 12.009 -10.058 -0.066 1.00 72.21 H new ATOM 0 HB3 GLU A 27 12.327 -11.422 0.988 1.00 72.21 H new ATOM 0 HG2 GLU A 27 14.336 -11.387 -1.093 1.00 44.11 H new ATOM 0 HG3 GLU A 27 14.212 -9.775 -0.418 1.00 44.11 H new ATOM 400 N ILE A 28 9.400 -12.059 -1.325 1.00 73.45 N ATOM 401 CA ILE A 28 8.045 -12.537 -1.071 1.00 4.12 C ATOM 402 C ILE A 28 7.729 -13.561 -2.150 1.00 3.23 C ATOM 403 O ILE A 28 7.999 -13.341 -3.334 1.00 42.55 O ATOM 404 CB ILE A 28 7.041 -11.364 -1.034 1.00 44.13 C ATOM 405 CG1 ILE A 28 7.331 -10.505 0.218 1.00 62.35 C ATOM 406 CG2 ILE A 28 5.581 -11.866 -1.009 1.00 52.45 C ATOM 407 CD1 ILE A 28 6.299 -9.403 0.460 1.00 42.23 C ATOM 0 H ILE A 28 9.463 -11.429 -2.125 1.00 73.45 H new ATOM 0 HA ILE A 28 7.964 -13.008 -0.092 1.00 4.12 H new ATOM 0 HB ILE A 28 7.163 -10.768 -1.938 1.00 44.13 H new ATOM 0 HG12 ILE A 28 7.368 -11.154 1.093 1.00 62.35 H new ATOM 0 HG13 ILE A 28 8.317 -10.051 0.116 1.00 62.35 H new ATOM 0 HG21 ILE A 28 4.903 -11.013 -0.983 1.00 52.45 H new ATOM 0 HG22 ILE A 28 5.385 -12.459 -1.903 1.00 52.45 H new ATOM 0 HG23 ILE A 28 5.423 -12.482 -0.124 1.00 52.45 H new ATOM 0 HD11 ILE A 28 6.568 -8.842 1.355 1.00 42.23 H new ATOM 0 HD12 ILE A 28 6.278 -8.730 -0.397 1.00 42.23 H new ATOM 0 HD13 ILE A 28 5.314 -9.850 0.595 1.00 42.23 H new ATOM 418 N LYS A 29 7.149 -14.693 -1.753 1.00 64.15 N ATOM 419 CA LYS A 29 6.729 -15.721 -2.683 1.00 1.51 C ATOM 420 C LYS A 29 5.336 -15.387 -3.179 1.00 65.03 C ATOM 421 O LYS A 29 4.516 -14.838 -2.444 1.00 34.44 O ATOM 422 CB LYS A 29 6.765 -17.086 -1.983 1.00 21.13 C ATOM 423 CG LYS A 29 7.248 -18.208 -2.906 1.00 43.24 C ATOM 424 CD LYS A 29 6.247 -19.357 -3.096 1.00 51.43 C ATOM 425 CE LYS A 29 5.245 -19.027 -4.201 1.00 42.32 C ATOM 426 NZ LYS A 29 4.172 -20.027 -4.305 1.00 10.41 N ATOM 0 H LYS A 29 6.960 -14.916 -0.776 1.00 64.15 H new ATOM 0 HA LYS A 29 7.402 -15.766 -3.540 1.00 1.51 H new ATOM 0 HB2 LYS A 29 7.421 -17.028 -1.114 1.00 21.13 H new ATOM 0 HB3 LYS A 29 5.768 -17.328 -1.614 1.00 21.13 H new ATOM 0 HG2 LYS A 29 7.481 -17.782 -3.882 1.00 43.24 H new ATOM 0 HG3 LYS A 29 8.176 -18.615 -2.506 1.00 43.24 H new ATOM 0 HD2 LYS A 29 6.782 -20.273 -3.346 1.00 51.43 H new ATOM 0 HD3 LYS A 29 5.717 -19.542 -2.162 1.00 51.43 H new ATOM 0 HE2 LYS A 29 4.807 -18.047 -4.009 1.00 42.32 H new ATOM 0 HE3 LYS A 29 5.769 -18.961 -5.154 1.00 42.32 H new ATOM 0 HZ1 LYS A 29 3.519 -19.758 -5.068 1.00 10.41 H new ATOM 0 HZ2 LYS A 29 4.585 -20.958 -4.515 1.00 10.41 H new ATOM 0 HZ3 LYS A 29 3.652 -20.073 -3.405 1.00 10.41 H new ATOM 436 N ASP A 30 5.051 -15.809 -4.404 1.00 51.25 N ATOM 437 CA ASP A 30 3.778 -15.585 -5.116 1.00 70.20 C ATOM 438 C ASP A 30 3.525 -14.098 -5.405 1.00 65.23 C ATOM 439 O ASP A 30 2.434 -13.718 -5.829 1.00 33.04 O ATOM 440 CB ASP A 30 2.599 -16.209 -4.347 1.00 70.44 C ATOM 441 CG ASP A 30 1.400 -16.508 -5.238 1.00 72.31 C ATOM 442 OD1 ASP A 30 1.456 -17.522 -5.961 1.00 72.42 O ATOM 443 OD2 ASP A 30 0.358 -15.815 -5.159 1.00 33.03 O ATOM 0 H ASP A 30 5.721 -16.340 -4.960 1.00 51.25 H new ATOM 0 HA ASP A 30 3.860 -16.085 -6.081 1.00 70.20 H new ATOM 0 HB2 ASP A 30 2.930 -17.132 -3.871 1.00 70.44 H new ATOM 0 HB3 ASP A 30 2.293 -15.531 -3.550 1.00 70.44 H new ATOM 447 N SER A 31 4.532 -13.240 -5.210 1.00 10.13 N ATOM 448 CA SER A 31 4.432 -11.804 -5.295 1.00 10.44 C ATOM 449 C SER A 31 4.086 -11.352 -6.715 1.00 2.14 C ATOM 450 O SER A 31 4.503 -11.966 -7.702 1.00 25.24 O ATOM 451 CB SER A 31 5.779 -11.244 -4.827 1.00 23.32 C ATOM 452 OG SER A 31 6.848 -11.893 -5.496 1.00 41.35 O ATOM 0 H SER A 31 5.474 -13.555 -4.979 1.00 10.13 H new ATOM 0 HA SER A 31 3.625 -11.430 -4.665 1.00 10.44 H new ATOM 0 HB2 SER A 31 5.820 -10.172 -5.019 1.00 23.32 H new ATOM 0 HB3 SER A 31 5.881 -11.379 -3.750 1.00 23.32 H new ATOM 0 HG SER A 31 7.339 -12.455 -4.860 1.00 41.35 H new ATOM 457 N GLU A 32 3.393 -10.228 -6.831 1.00 54.31 N ATOM 458 CA GLU A 32 3.410 -9.369 -8.001 1.00 53.53 C ATOM 459 C GLU A 32 3.870 -7.992 -7.538 1.00 13.20 C ATOM 460 O GLU A 32 4.073 -7.763 -6.343 1.00 43.24 O ATOM 461 CB GLU A 32 2.038 -9.362 -8.685 1.00 4.50 C ATOM 462 CG GLU A 32 1.974 -10.465 -9.747 1.00 11.33 C ATOM 463 CD GLU A 32 0.646 -10.562 -10.494 1.00 61.20 C ATOM 464 OE1 GLU A 32 -0.373 -9.963 -10.085 1.00 10.35 O ATOM 465 OE2 GLU A 32 0.580 -11.342 -11.474 1.00 62.40 O ATOM 0 H GLU A 32 2.785 -9.880 -6.089 1.00 54.31 H new ATOM 0 HA GLU A 32 4.102 -9.731 -8.761 1.00 53.53 H new ATOM 0 HB2 GLU A 32 1.253 -9.513 -7.944 1.00 4.50 H new ATOM 0 HB3 GLU A 32 1.858 -8.391 -9.146 1.00 4.50 H new ATOM 0 HG2 GLU A 32 2.771 -10.298 -10.472 1.00 11.33 H new ATOM 0 HG3 GLU A 32 2.175 -11.423 -9.268 1.00 11.33 H new ATOM 470 N LEU A 33 4.101 -7.105 -8.493 1.00 11.51 N ATOM 471 CA LEU A 33 4.932 -5.931 -8.370 1.00 43.44 C ATOM 472 C LEU A 33 4.274 -4.818 -9.176 1.00 13.53 C ATOM 473 O LEU A 33 4.388 -4.773 -10.401 1.00 65.44 O ATOM 474 CB LEU A 33 6.360 -6.246 -8.876 1.00 33.42 C ATOM 475 CG LEU A 33 7.431 -5.586 -8.004 1.00 65.11 C ATOM 476 CD1 LEU A 33 8.841 -5.768 -8.588 1.00 11.13 C ATOM 477 CD2 LEU A 33 7.239 -4.104 -7.763 1.00 73.15 C ATOM 0 H LEU A 33 3.689 -7.195 -9.422 1.00 11.51 H new ATOM 0 HA LEU A 33 5.025 -5.615 -7.331 1.00 43.44 H new ATOM 0 HB2 LEU A 33 6.513 -7.325 -8.885 1.00 33.42 H new ATOM 0 HB3 LEU A 33 6.465 -5.901 -9.905 1.00 33.42 H new ATOM 0 HG LEU A 33 7.321 -6.104 -7.051 1.00 65.11 H new ATOM 0 HD11 LEU A 33 9.570 -5.284 -7.937 1.00 11.13 H new ATOM 0 HD12 LEU A 33 9.070 -6.831 -8.662 1.00 11.13 H new ATOM 0 HD13 LEU A 33 8.885 -5.318 -9.580 1.00 11.13 H new ATOM 0 HD21 LEU A 33 8.048 -3.730 -7.135 1.00 73.15 H new ATOM 0 HD22 LEU A 33 7.246 -3.576 -8.717 1.00 73.15 H new ATOM 0 HD23 LEU A 33 6.285 -3.937 -7.263 1.00 73.15 H new ATOM 488 N LYS A 34 3.559 -3.928 -8.495 1.00 45.44 N ATOM 489 CA LYS A 34 2.907 -2.788 -9.146 1.00 73.35 C ATOM 490 C LYS A 34 3.338 -1.510 -8.448 1.00 42.44 C ATOM 491 O LYS A 34 3.915 -1.523 -7.361 1.00 71.33 O ATOM 492 CB LYS A 34 1.376 -2.983 -9.155 1.00 21.01 C ATOM 493 CG LYS A 34 0.848 -3.928 -10.253 1.00 31.42 C ATOM 494 CD LYS A 34 0.854 -3.359 -11.683 1.00 12.41 C ATOM 495 CE LYS A 34 -0.119 -2.181 -11.845 1.00 43.14 C ATOM 496 NZ LYS A 34 -0.359 -1.834 -13.265 1.00 73.34 N ATOM 0 H LYS A 34 3.414 -3.972 -7.486 1.00 45.44 H new ATOM 0 HA LYS A 34 3.213 -2.715 -10.190 1.00 73.35 H new ATOM 0 HB2 LYS A 34 1.068 -3.370 -8.184 1.00 21.01 H new ATOM 0 HB3 LYS A 34 0.901 -2.009 -9.275 1.00 21.01 H new ATOM 0 HG2 LYS A 34 1.447 -4.839 -10.242 1.00 31.42 H new ATOM 0 HG3 LYS A 34 -0.173 -4.215 -10.000 1.00 31.42 H new ATOM 0 HD2 LYS A 34 1.862 -3.032 -11.938 1.00 12.41 H new ATOM 0 HD3 LYS A 34 0.587 -4.147 -12.387 1.00 12.41 H new ATOM 0 HE2 LYS A 34 -1.068 -2.430 -11.370 1.00 43.14 H new ATOM 0 HE3 LYS A 34 0.280 -1.310 -11.324 1.00 43.14 H new ATOM 0 HZ1 LYS A 34 -1.022 -1.034 -13.320 1.00 73.34 H new ATOM 0 HZ2 LYS A 34 0.541 -1.570 -13.715 1.00 73.34 H new ATOM 0 HZ3 LYS A 34 -0.765 -2.654 -13.759 1.00 73.34 H new ATOM 506 N GLU A 35 3.056 -0.377 -9.072 1.00 12.34 N ATOM 507 CA GLU A 35 3.332 0.936 -8.540 1.00 31.30 C ATOM 508 C GLU A 35 2.264 1.909 -9.016 1.00 51.35 C ATOM 509 O GLU A 35 1.417 1.580 -9.851 1.00 74.22 O ATOM 510 CB GLU A 35 4.757 1.395 -8.904 1.00 71.44 C ATOM 511 CG GLU A 35 5.090 1.472 -10.399 1.00 52.35 C ATOM 512 CD GLU A 35 5.260 0.096 -11.045 1.00 21.44 C ATOM 513 OE1 GLU A 35 6.355 -0.504 -10.890 1.00 3.33 O ATOM 514 OE2 GLU A 35 4.304 -0.382 -11.688 1.00 44.12 O ATOM 0 H GLU A 35 2.615 -0.352 -9.991 1.00 12.34 H new ATOM 0 HA GLU A 35 3.295 0.903 -7.451 1.00 31.30 H new ATOM 0 HB2 GLU A 35 4.920 2.380 -8.467 1.00 71.44 H new ATOM 0 HB3 GLU A 35 5.466 0.715 -8.431 1.00 71.44 H new ATOM 0 HG2 GLU A 35 4.297 2.014 -10.915 1.00 52.35 H new ATOM 0 HG3 GLU A 35 6.007 2.046 -10.532 1.00 52.35 H new ATOM 519 N VAL A 36 2.297 3.118 -8.473 1.00 42.53 N ATOM 520 CA VAL A 36 1.321 4.172 -8.704 1.00 70.12 C ATOM 521 C VAL A 36 2.082 5.373 -9.291 1.00 73.44 C ATOM 522 O VAL A 36 3.309 5.440 -9.188 1.00 70.02 O ATOM 523 CB VAL A 36 0.598 4.481 -7.369 1.00 43.34 C ATOM 524 CG1 VAL A 36 -0.714 5.239 -7.619 1.00 50.53 C ATOM 525 CG2 VAL A 36 0.251 3.225 -6.543 1.00 34.11 C ATOM 0 H VAL A 36 3.037 3.403 -7.832 1.00 42.53 H new ATOM 0 HA VAL A 36 0.544 3.888 -9.414 1.00 70.12 H new ATOM 0 HB VAL A 36 1.308 5.084 -6.802 1.00 43.34 H new ATOM 0 HG11 VAL A 36 -1.203 5.444 -6.667 1.00 50.53 H new ATOM 0 HG12 VAL A 36 -0.500 6.179 -8.127 1.00 50.53 H new ATOM 0 HG13 VAL A 36 -1.372 4.632 -8.241 1.00 50.53 H new ATOM 0 HG21 VAL A 36 -0.253 3.522 -5.623 1.00 34.11 H new ATOM 0 HG22 VAL A 36 -0.406 2.578 -7.124 1.00 34.11 H new ATOM 0 HG23 VAL A 36 1.166 2.687 -6.297 1.00 34.11 H new ATOM 535 N LYS A 37 1.366 6.307 -9.914 1.00 41.35 N ATOM 536 CA LYS A 37 1.829 7.629 -10.329 1.00 30.33 C ATOM 537 C LYS A 37 0.682 8.575 -10.007 1.00 42.52 C ATOM 538 O LYS A 37 -0.471 8.131 -10.040 1.00 45.25 O ATOM 539 CB LYS A 37 2.112 7.670 -11.831 1.00 54.45 C ATOM 540 CG LYS A 37 3.317 6.822 -12.252 1.00 50.34 C ATOM 541 CD LYS A 37 3.327 6.593 -13.769 1.00 22.14 C ATOM 542 CE LYS A 37 3.948 7.745 -14.589 1.00 45.32 C ATOM 543 NZ LYS A 37 3.097 8.233 -15.699 1.00 72.43 N ATOM 0 H LYS A 37 0.388 6.151 -10.157 1.00 41.35 H new ATOM 0 HA LYS A 37 2.755 7.897 -9.820 1.00 30.33 H new ATOM 0 HB2 LYS A 37 1.229 7.323 -12.368 1.00 54.45 H new ATOM 0 HB3 LYS A 37 2.283 8.704 -12.132 1.00 54.45 H new ATOM 0 HG2 LYS A 37 4.239 7.319 -11.950 1.00 50.34 H new ATOM 0 HG3 LYS A 37 3.288 5.862 -11.736 1.00 50.34 H new ATOM 0 HD2 LYS A 37 3.877 5.676 -13.981 1.00 22.14 H new ATOM 0 HD3 LYS A 37 2.302 6.436 -14.106 1.00 22.14 H new ATOM 0 HE2 LYS A 37 4.163 8.577 -13.919 1.00 45.32 H new ATOM 0 HE3 LYS A 37 4.902 7.411 -14.998 1.00 45.32 H new ATOM 0 HZ1 LYS A 37 3.585 9.004 -16.198 1.00 72.43 H new ATOM 0 HZ2 LYS A 37 2.912 7.454 -16.363 1.00 72.43 H new ATOM 0 HZ3 LYS A 37 2.196 8.584 -15.317 1.00 72.43 H new ATOM 553 N VAL A 38 0.966 9.855 -9.783 1.00 13.21 N ATOM 554 CA VAL A 38 -0.050 10.888 -9.622 1.00 63.01 C ATOM 555 C VAL A 38 -0.102 11.737 -10.892 1.00 71.04 C ATOM 556 O VAL A 38 0.590 11.458 -11.875 1.00 74.45 O ATOM 557 CB VAL A 38 0.173 11.734 -8.347 1.00 13.41 C ATOM 558 CG1 VAL A 38 0.000 10.900 -7.074 1.00 2.12 C ATOM 559 CG2 VAL A 38 1.535 12.432 -8.306 1.00 51.33 C ATOM 0 H VAL A 38 1.920 10.207 -9.707 1.00 13.21 H new ATOM 0 HA VAL A 38 -1.021 10.414 -9.481 1.00 63.01 H new ATOM 0 HB VAL A 38 -0.595 12.506 -8.388 1.00 13.41 H new ATOM 0 HG11 VAL A 38 0.165 11.531 -6.201 1.00 2.12 H new ATOM 0 HG12 VAL A 38 -1.010 10.491 -7.041 1.00 2.12 H new ATOM 0 HG13 VAL A 38 0.722 10.083 -7.073 1.00 2.12 H new ATOM 0 HG21 VAL A 38 1.622 13.007 -7.384 1.00 51.33 H new ATOM 0 HG22 VAL A 38 2.328 11.685 -8.344 1.00 51.33 H new ATOM 0 HG23 VAL A 38 1.626 13.102 -9.161 1.00 51.33 H new ATOM 569 N SER A 39 -0.940 12.768 -10.879 1.00 73.35 N ATOM 570 CA SER A 39 -1.023 13.778 -11.896 1.00 41.21 C ATOM 571 C SER A 39 0.243 14.645 -11.901 1.00 10.00 C ATOM 572 O SER A 39 1.165 14.470 -11.098 1.00 11.03 O ATOM 573 CB SER A 39 -2.274 14.591 -11.578 1.00 14.41 C ATOM 574 OG SER A 39 -3.330 14.248 -12.456 1.00 12.34 O ATOM 0 H SER A 39 -1.604 12.918 -10.120 1.00 73.35 H new ATOM 0 HA SER A 39 -1.092 13.347 -12.895 1.00 41.21 H new ATOM 0 HB2 SER A 39 -2.579 14.411 -10.547 1.00 14.41 H new ATOM 0 HB3 SER A 39 -2.054 15.655 -11.664 1.00 14.41 H new ATOM 0 HG SER A 39 -4.124 14.778 -12.236 1.00 12.34 H new ATOM 579 N GLU A 40 0.291 15.600 -12.822 1.00 12.10 N ATOM 580 CA GLU A 40 1.265 16.670 -12.768 1.00 11.03 C ATOM 581 C GLU A 40 0.774 17.747 -11.818 1.00 14.03 C ATOM 582 O GLU A 40 -0.367 18.206 -11.917 1.00 62.44 O ATOM 583 CB GLU A 40 1.505 17.262 -14.157 1.00 54.02 C ATOM 584 CG GLU A 40 2.552 16.409 -14.869 1.00 13.13 C ATOM 585 CD GLU A 40 2.991 17.043 -16.181 1.00 64.12 C ATOM 586 OE1 GLU A 40 2.243 16.888 -17.174 1.00 52.35 O ATOM 587 OE2 GLU A 40 4.072 17.673 -16.175 1.00 21.34 O ATOM 0 H GLU A 40 -0.342 15.650 -13.620 1.00 12.10 H new ATOM 0 HA GLU A 40 2.211 16.267 -12.407 1.00 11.03 H new ATOM 0 HB2 GLU A 40 0.577 17.278 -14.728 1.00 54.02 H new ATOM 0 HB3 GLU A 40 1.847 18.294 -14.076 1.00 54.02 H new ATOM 0 HG2 GLU A 40 3.418 16.277 -14.220 1.00 13.13 H new ATOM 0 HG3 GLU A 40 2.144 15.417 -15.062 1.00 13.13 H new ATOM 592 N GLY A 41 1.675 18.182 -10.944 1.00 44.21 N ATOM 593 CA GLY A 41 1.547 19.409 -10.191 1.00 65.42 C ATOM 594 C GLY A 41 1.295 19.184 -8.710 1.00 32.14 C ATOM 595 O GLY A 41 1.132 20.167 -7.985 1.00 33.24 O ATOM 0 H GLY A 41 2.535 17.672 -10.740 1.00 44.21 H new ATOM 0 HA2 GLY A 41 2.456 19.997 -10.312 1.00 65.42 H new ATOM 0 HA3 GLY A 41 0.729 19.998 -10.606 1.00 65.42 H new ATOM 599 N THR A 42 1.254 17.941 -8.229 1.00 22.14 N ATOM 600 CA THR A 42 0.866 17.657 -6.867 1.00 4.12 C ATOM 601 C THR A 42 2.047 17.933 -5.936 1.00 45.14 C ATOM 602 O THR A 42 1.828 18.287 -4.784 1.00 33.43 O ATOM 603 CB THR A 42 0.369 16.205 -6.762 1.00 34.11 C ATOM 604 OG1 THR A 42 -0.347 15.803 -7.917 1.00 43.34 O ATOM 605 CG2 THR A 42 -0.544 16.017 -5.546 1.00 73.55 C ATOM 0 H THR A 42 1.489 17.114 -8.777 1.00 22.14 H new ATOM 0 HA THR A 42 0.044 18.306 -6.563 1.00 4.12 H new ATOM 0 HB THR A 42 1.262 15.588 -6.659 1.00 34.11 H new ATOM 0 HG1 THR A 42 -0.644 14.875 -7.811 1.00 43.34 H new ATOM 0 HG21 THR A 42 -0.879 14.981 -5.499 1.00 73.55 H new ATOM 0 HG22 THR A 42 0.005 16.262 -4.637 1.00 73.55 H new ATOM 0 HG23 THR A 42 -1.409 16.674 -5.635 1.00 73.55 H new ATOM 613 N PHE A 43 3.302 17.768 -6.380 1.00 53.01 N ATOM 614 CA PHE A 43 4.460 17.948 -5.522 1.00 13.11 C ATOM 615 C PHE A 43 5.778 17.909 -6.275 1.00 4.02 C ATOM 616 O PHE A 43 5.836 17.470 -7.425 1.00 74.33 O ATOM 617 CB PHE A 43 4.440 16.923 -4.402 1.00 62.25 C ATOM 618 CG PHE A 43 3.861 15.579 -4.742 1.00 45.05 C ATOM 619 CD1 PHE A 43 4.564 14.676 -5.545 1.00 51.12 C ATOM 620 CD2 PHE A 43 2.562 15.290 -4.308 1.00 43.05 C ATOM 621 CE1 PHE A 43 4.008 13.420 -5.829 1.00 2.41 C ATOM 622 CE2 PHE A 43 2.001 14.030 -4.594 1.00 1.33 C ATOM 623 CZ PHE A 43 2.739 13.085 -5.326 1.00 13.30 C ATOM 0 H PHE A 43 3.531 17.508 -7.339 1.00 53.01 H new ATOM 0 HA PHE A 43 4.390 18.950 -5.098 1.00 13.11 H new ATOM 0 HB2 PHE A 43 5.462 16.777 -4.053 1.00 62.25 H new ATOM 0 HB3 PHE A 43 3.875 17.338 -3.568 1.00 62.25 H new ATOM 0 HD1 PHE A 43 5.531 14.944 -5.945 1.00 51.12 H new ATOM 0 HD2 PHE A 43 1.995 16.027 -3.759 1.00 43.05 H new ATOM 0 HE1 PHE A 43 4.554 12.711 -6.433 1.00 2.41 H new ATOM 0 HE2 PHE A 43 1.005 13.791 -4.251 1.00 1.33 H new ATOM 0 HZ PHE A 43 2.331 12.101 -5.502 1.00 13.30 H new ATOM 632 N ASP A 44 6.837 18.373 -5.598 1.00 30.51 N ATOM 633 CA ASP A 44 8.073 18.756 -6.291 1.00 4.20 C ATOM 634 C ASP A 44 9.339 18.393 -5.519 1.00 42.42 C ATOM 635 O ASP A 44 10.423 18.872 -5.840 1.00 71.24 O ATOM 636 CB ASP A 44 8.040 20.266 -6.573 1.00 44.45 C ATOM 637 CG ASP A 44 8.723 20.654 -7.894 1.00 62.14 C ATOM 638 OD1 ASP A 44 9.097 19.772 -8.702 1.00 45.35 O ATOM 639 OD2 ASP A 44 8.815 21.870 -8.187 1.00 21.23 O ATOM 0 H ASP A 44 6.863 18.491 -4.585 1.00 30.51 H new ATOM 0 HA ASP A 44 8.113 18.189 -7.221 1.00 4.20 H new ATOM 0 HB2 ASP A 44 7.003 20.601 -6.596 1.00 44.45 H new ATOM 0 HB3 ASP A 44 8.527 20.792 -5.752 1.00 44.45 H new ATOM 643 N ALA A 45 9.195 17.537 -4.508 1.00 74.45 N ATOM 644 CA ALA A 45 10.232 17.113 -3.560 1.00 22.43 C ATOM 645 C ALA A 45 10.816 18.279 -2.744 1.00 61.53 C ATOM 646 O ALA A 45 11.899 18.153 -2.169 1.00 21.54 O ATOM 647 CB ALA A 45 11.318 16.302 -4.280 1.00 43.05 C ATOM 0 H ALA A 45 8.298 17.092 -4.315 1.00 74.45 H new ATOM 0 HA ALA A 45 9.755 16.463 -2.827 1.00 22.43 H new ATOM 0 HB1 ALA A 45 12.079 15.996 -3.562 1.00 43.05 H new ATOM 0 HB2 ALA A 45 10.871 15.418 -4.734 1.00 43.05 H new ATOM 0 HB3 ALA A 45 11.777 16.916 -5.055 1.00 43.05 H new ATOM 653 N ASP A 46 10.110 19.413 -2.698 1.00 25.52 N ATOM 654 CA ASP A 46 10.506 20.602 -1.961 1.00 74.22 C ATOM 655 C ASP A 46 10.201 20.437 -0.454 1.00 44.21 C ATOM 656 O ASP A 46 10.108 19.316 0.056 1.00 33.24 O ATOM 657 CB ASP A 46 9.831 21.825 -2.592 1.00 63.51 C ATOM 658 CG ASP A 46 10.483 23.099 -2.074 1.00 31.44 C ATOM 659 OD1 ASP A 46 11.715 23.257 -2.228 1.00 34.12 O ATOM 660 OD2 ASP A 46 9.784 23.804 -1.322 1.00 62.15 O ATOM 0 H ASP A 46 9.223 19.525 -3.189 1.00 25.52 H new ATOM 0 HA ASP A 46 11.584 20.752 -2.027 1.00 74.22 H new ATOM 0 HB2 ASP A 46 9.915 21.778 -3.678 1.00 63.51 H new ATOM 0 HB3 ASP A 46 8.767 21.828 -2.354 1.00 63.51 H new ATOM 664 N MET A 47 10.071 21.542 0.280 1.00 3.44 N ATOM 665 CA MET A 47 9.904 21.645 1.709 1.00 52.41 C ATOM 666 C MET A 47 8.807 22.658 2.045 1.00 41.03 C ATOM 667 O MET A 47 7.983 22.392 2.925 1.00 45.13 O ATOM 668 CB MET A 47 11.250 22.100 2.282 1.00 22.30 C ATOM 669 CG MET A 47 11.167 22.367 3.778 1.00 64.12 C ATOM 670 SD MET A 47 12.772 22.481 4.610 1.00 70.33 S ATOM 671 CE MET A 47 13.468 23.920 3.768 1.00 3.01 C ATOM 0 H MET A 47 10.082 22.462 -0.160 1.00 3.44 H new ATOM 0 HA MET A 47 9.605 20.688 2.137 1.00 52.41 H new ATOM 0 HB2 MET A 47 12.003 21.336 2.091 1.00 22.30 H new ATOM 0 HB3 MET A 47 11.576 23.005 1.769 1.00 22.30 H new ATOM 0 HG2 MET A 47 10.622 23.297 3.939 1.00 64.12 H new ATOM 0 HG3 MET A 47 10.586 21.572 4.245 1.00 64.12 H new ATOM 0 HE1 MET A 47 14.431 24.171 4.213 1.00 3.01 H new ATOM 0 HE2 MET A 47 13.605 23.692 2.711 1.00 3.01 H new ATOM 0 HE3 MET A 47 12.789 24.766 3.872 1.00 3.01 H new ATOM 679 N TYR A 48 8.776 23.802 1.357 1.00 41.02 N ATOM 680 CA TYR A 48 7.769 24.842 1.505 1.00 1.40 C ATOM 681 C TYR A 48 6.728 24.746 0.388 1.00 5.32 C ATOM 682 O TYR A 48 5.540 24.875 0.672 1.00 10.01 O ATOM 683 CB TYR A 48 8.432 26.224 1.569 1.00 54.25 C ATOM 684 CG TYR A 48 9.390 26.549 0.440 1.00 33.10 C ATOM 685 CD1 TYR A 48 10.741 26.162 0.540 1.00 10.20 C ATOM 686 CD2 TYR A 48 8.936 27.223 -0.710 1.00 31.22 C ATOM 687 CE1 TYR A 48 11.619 26.382 -0.534 1.00 30.40 C ATOM 688 CE2 TYR A 48 9.817 27.466 -1.780 1.00 10.11 C ATOM 689 CZ TYR A 48 11.153 27.017 -1.708 1.00 31.51 C ATOM 690 OH TYR A 48 11.995 27.201 -2.760 1.00 64.14 O ATOM 0 H TYR A 48 9.481 24.033 0.657 1.00 41.02 H new ATOM 0 HA TYR A 48 7.240 24.695 2.447 1.00 1.40 H new ATOM 0 HB2 TYR A 48 7.648 26.982 1.585 1.00 54.25 H new ATOM 0 HB3 TYR A 48 8.972 26.304 2.513 1.00 54.25 H new ATOM 0 HD1 TYR A 48 11.102 25.695 1.444 1.00 10.20 H new ATOM 0 HD2 TYR A 48 7.910 27.554 -0.771 1.00 31.22 H new ATOM 0 HE1 TYR A 48 12.649 26.066 -0.463 1.00 30.40 H new ATOM 0 HE2 TYR A 48 9.471 27.996 -2.655 1.00 10.11 H new ATOM 0 HH TYR A 48 11.516 27.651 -3.487 1.00 64.14 H new ATOM 699 N LYS A 49 7.106 24.409 -0.852 1.00 21.13 N ATOM 700 CA LYS A 49 6.135 24.236 -1.937 1.00 41.24 C ATOM 701 C LYS A 49 5.155 23.137 -1.554 1.00 74.53 C ATOM 702 O LYS A 49 3.937 23.308 -1.570 1.00 73.45 O ATOM 703 CB LYS A 49 6.877 23.884 -3.241 1.00 13.03 C ATOM 704 CG LYS A 49 6.052 24.159 -4.500 1.00 21.12 C ATOM 705 CD LYS A 49 6.043 25.657 -4.807 1.00 41.24 C ATOM 706 CE LYS A 49 5.588 25.897 -6.241 1.00 64.11 C ATOM 707 NZ LYS A 49 5.672 27.322 -6.605 1.00 45.31 N ATOM 0 H LYS A 49 8.075 24.251 -1.127 1.00 21.13 H new ATOM 0 HA LYS A 49 5.580 25.160 -2.099 1.00 41.24 H new ATOM 0 HB2 LYS A 49 7.803 24.457 -3.290 1.00 13.03 H new ATOM 0 HB3 LYS A 49 7.154 22.830 -3.220 1.00 13.03 H new ATOM 0 HG2 LYS A 49 6.469 23.610 -5.344 1.00 21.12 H new ATOM 0 HG3 LYS A 49 5.031 23.803 -4.360 1.00 21.12 H new ATOM 0 HD2 LYS A 49 5.378 26.173 -4.115 1.00 41.24 H new ATOM 0 HD3 LYS A 49 7.040 26.072 -4.660 1.00 41.24 H new ATOM 0 HE2 LYS A 49 6.204 25.310 -6.922 1.00 64.11 H new ATOM 0 HE3 LYS A 49 4.562 25.550 -6.361 1.00 64.11 H new ATOM 0 HZ1 LYS A 49 5.355 27.449 -7.587 1.00 45.31 H new ATOM 0 HZ2 LYS A 49 5.065 27.879 -5.970 1.00 45.31 H new ATOM 0 HZ3 LYS A 49 6.656 27.646 -6.515 1.00 45.31 H new ATOM 717 N THR A 50 5.698 21.994 -1.151 1.00 11.22 N ATOM 718 CA THR A 50 4.933 20.854 -0.691 1.00 72.35 C ATOM 719 C THR A 50 4.434 21.023 0.763 1.00 42.14 C ATOM 720 O THR A 50 3.795 20.111 1.290 1.00 24.14 O ATOM 721 CB THR A 50 5.789 19.603 -0.932 1.00 12.20 C ATOM 722 OG1 THR A 50 7.094 19.739 -0.412 1.00 41.45 O ATOM 723 CG2 THR A 50 6.050 19.372 -2.422 1.00 33.44 C ATOM 0 H THR A 50 6.706 21.836 -1.137 1.00 11.22 H new ATOM 0 HA THR A 50 4.006 20.755 -1.256 1.00 72.35 H new ATOM 0 HB THR A 50 5.222 18.801 -0.459 1.00 12.20 H new ATOM 0 HG1 THR A 50 7.152 19.279 0.452 1.00 41.45 H new ATOM 0 HG21 THR A 50 6.659 18.477 -2.550 1.00 33.44 H new ATOM 0 HG22 THR A 50 5.101 19.242 -2.942 1.00 33.44 H new ATOM 0 HG23 THR A 50 6.576 20.232 -2.837 1.00 33.44 H new ATOM 731 N SER A 51 4.661 22.176 1.411 1.00 32.42 N ATOM 732 CA SER A 51 3.954 22.598 2.622 1.00 42.22 C ATOM 733 C SER A 51 2.583 23.156 2.238 1.00 54.01 C ATOM 734 O SER A 51 1.663 23.041 3.048 1.00 65.54 O ATOM 735 CB SER A 51 4.736 23.664 3.407 1.00 31.33 C ATOM 736 OG SER A 51 4.273 23.790 4.742 1.00 10.24 O ATOM 0 H SER A 51 5.357 22.853 1.098 1.00 32.42 H new ATOM 0 HA SER A 51 3.846 21.725 3.266 1.00 42.22 H new ATOM 0 HB2 SER A 51 5.795 23.405 3.414 1.00 31.33 H new ATOM 0 HB3 SER A 51 4.647 24.625 2.900 1.00 31.33 H new ATOM 0 HG SER A 51 4.797 24.476 5.206 1.00 10.24 H new ATOM 741 N ASP A 52 2.386 23.599 0.990 1.00 21.24 N ATOM 742 CA ASP A 52 1.127 24.170 0.518 1.00 74.11 C ATOM 743 C ASP A 52 0.232 23.160 -0.208 1.00 5.13 C ATOM 744 O ASP A 52 -0.916 22.981 0.183 1.00 50.23 O ATOM 745 CB ASP A 52 1.438 25.365 -0.392 1.00 14.14 C ATOM 746 CG ASP A 52 0.281 26.357 -0.384 1.00 32.22 C ATOM 747 OD1 ASP A 52 0.212 27.138 0.595 1.00 62.12 O ATOM 748 OD2 ASP A 52 -0.506 26.398 -1.355 1.00 4.42 O ATOM 0 H ASP A 52 3.110 23.569 0.272 1.00 21.24 H new ATOM 0 HA ASP A 52 0.561 24.489 1.394 1.00 74.11 H new ATOM 0 HB2 ASP A 52 2.350 25.858 -0.056 1.00 14.14 H new ATOM 0 HB3 ASP A 52 1.620 25.018 -1.409 1.00 14.14 H new ATOM 752 N ILE A 53 0.742 22.480 -1.241 1.00 50.33 N ATOM 753 CA ILE A 53 -0.078 21.686 -2.169 1.00 32.12 C ATOM 754 C ILE A 53 -0.864 20.600 -1.428 1.00 45.33 C ATOM 755 O ILE A 53 -2.079 20.475 -1.567 1.00 61.53 O ATOM 756 CB ILE A 53 0.791 21.030 -3.277 1.00 5.03 C ATOM 757 CG1 ILE A 53 1.694 22.031 -4.037 1.00 2.23 C ATOM 758 CG2 ILE A 53 -0.154 20.305 -4.258 1.00 71.23 C ATOM 759 CD1 ILE A 53 2.856 21.331 -4.758 1.00 43.22 C ATOM 0 H ILE A 53 1.738 22.463 -1.459 1.00 50.33 H new ATOM 0 HA ILE A 53 -0.781 22.375 -2.637 1.00 32.12 H new ATOM 0 HB ILE A 53 1.476 20.332 -2.795 1.00 5.03 H new ATOM 0 HG12 ILE A 53 1.095 22.579 -4.764 1.00 2.23 H new ATOM 0 HG13 ILE A 53 2.092 22.764 -3.335 1.00 2.23 H new ATOM 0 HG21 ILE A 53 0.432 19.835 -5.048 1.00 71.23 H new ATOM 0 HG22 ILE A 53 -0.719 19.542 -3.722 1.00 71.23 H new ATOM 0 HG23 ILE A 53 -0.844 21.025 -4.698 1.00 71.23 H new ATOM 0 HD11 ILE A 53 3.462 22.073 -5.277 1.00 43.22 H new ATOM 0 HD12 ILE A 53 3.472 20.805 -4.029 1.00 43.22 H new ATOM 0 HD13 ILE A 53 2.459 20.617 -5.480 1.00 43.22 H new ATOM 770 N ALA A 54 -0.163 19.782 -0.650 1.00 3.20 N ATOM 771 CA ALA A 54 -0.762 18.687 0.080 1.00 22.13 C ATOM 772 C ALA A 54 -1.748 19.201 1.145 1.00 51.04 C ATOM 773 O ALA A 54 -2.759 18.555 1.428 1.00 4.21 O ATOM 774 CB ALA A 54 0.360 17.812 0.670 1.00 45.33 C ATOM 0 H ALA A 54 0.844 19.867 -0.512 1.00 3.20 H new ATOM 0 HA ALA A 54 -1.356 18.069 -0.593 1.00 22.13 H new ATOM 0 HB1 ALA A 54 -0.079 16.982 1.224 1.00 45.33 H new ATOM 0 HB2 ALA A 54 0.980 17.422 -0.137 1.00 45.33 H new ATOM 0 HB3 ALA A 54 0.974 18.412 1.342 1.00 45.33 H new ATOM 780 N LEU A 55 -1.463 20.360 1.744 1.00 53.43 N ATOM 781 CA LEU A 55 -2.278 20.994 2.773 1.00 3.32 C ATOM 782 C LEU A 55 -3.580 21.508 2.179 1.00 14.43 C ATOM 783 O LEU A 55 -4.619 21.394 2.819 1.00 51.34 O ATOM 784 CB LEU A 55 -1.516 22.167 3.412 1.00 43.01 C ATOM 785 CG LEU A 55 -2.202 22.755 4.656 1.00 54.24 C ATOM 786 CD1 LEU A 55 -2.481 21.716 5.748 1.00 73.54 C ATOM 787 CD2 LEU A 55 -1.305 23.842 5.254 1.00 52.11 C ATOM 0 H LEU A 55 -0.628 20.899 1.515 1.00 53.43 H new ATOM 0 HA LEU A 55 -2.500 20.248 3.536 1.00 3.32 H new ATOM 0 HB2 LEU A 55 -0.516 21.831 3.686 1.00 43.01 H new ATOM 0 HB3 LEU A 55 -1.395 22.956 2.670 1.00 43.01 H new ATOM 0 HG LEU A 55 -3.162 23.150 4.324 1.00 54.24 H new ATOM 0 HD11 LEU A 55 -2.966 22.200 6.596 1.00 73.54 H new ATOM 0 HD12 LEU A 55 -3.134 20.938 5.352 1.00 73.54 H new ATOM 0 HD13 LEU A 55 -1.542 21.269 6.074 1.00 73.54 H new ATOM 0 HD21 LEU A 55 -1.785 24.264 6.137 1.00 52.11 H new ATOM 0 HD22 LEU A 55 -0.345 23.408 5.535 1.00 52.11 H new ATOM 0 HD23 LEU A 55 -1.146 24.629 4.517 1.00 52.11 H new ATOM 798 N ASP A 56 -3.531 22.040 0.963 1.00 45.32 N ATOM 799 CA ASP A 56 -4.688 22.518 0.219 1.00 43.44 C ATOM 800 C ASP A 56 -5.682 21.373 0.030 1.00 74.25 C ATOM 801 O ASP A 56 -6.880 21.552 0.256 1.00 24.23 O ATOM 802 CB ASP A 56 -4.231 23.076 -1.146 1.00 21.51 C ATOM 803 CG ASP A 56 -3.944 24.572 -1.150 1.00 2.04 C ATOM 804 OD1 ASP A 56 -3.887 25.193 -0.069 1.00 32.20 O ATOM 805 OD2 ASP A 56 -3.785 25.147 -2.249 1.00 50.32 O ATOM 0 H ASP A 56 -2.656 22.154 0.452 1.00 45.32 H new ATOM 0 HA ASP A 56 -5.179 23.317 0.774 1.00 43.44 H new ATOM 0 HB2 ASP A 56 -3.332 22.545 -1.459 1.00 21.51 H new ATOM 0 HB3 ASP A 56 -5.001 22.864 -1.888 1.00 21.51 H new ATOM 809 N GLN A 57 -5.194 20.186 -0.350 1.00 13.23 N ATOM 810 CA GLN A 57 -6.021 18.991 -0.523 1.00 63.35 C ATOM 811 C GLN A 57 -6.638 18.574 0.818 1.00 13.22 C ATOM 812 O GLN A 57 -7.821 18.248 0.873 1.00 12.41 O ATOM 813 CB GLN A 57 -5.210 17.843 -1.162 1.00 74.45 C ATOM 814 CG GLN A 57 -4.617 18.256 -2.525 1.00 64.31 C ATOM 815 CD GLN A 57 -3.850 17.155 -3.257 1.00 52.15 C ATOM 816 OE1 GLN A 57 -4.102 16.876 -4.418 1.00 72.25 O ATOM 817 NE2 GLN A 57 -2.885 16.498 -2.636 1.00 34.43 N ATOM 0 H GLN A 57 -4.206 20.029 -0.547 1.00 13.23 H new ATOM 0 HA GLN A 57 -6.836 19.226 -1.208 1.00 63.35 H new ATOM 0 HB2 GLN A 57 -4.405 17.547 -0.489 1.00 74.45 H new ATOM 0 HB3 GLN A 57 -5.852 16.972 -1.293 1.00 74.45 H new ATOM 0 HG2 GLN A 57 -5.427 18.602 -3.167 1.00 64.31 H new ATOM 0 HG3 GLN A 57 -3.948 19.103 -2.372 1.00 64.31 H new ATOM 0 HE21 GLN A 57 -2.661 16.718 -1.666 1.00 34.43 H new ATOM 0 HE22 GLN A 57 -2.365 15.771 -3.127 1.00 34.43 H new ATOM 824 N ILE A 58 -5.861 18.614 1.906 1.00 34.52 N ATOM 825 CA ILE A 58 -6.328 18.260 3.249 1.00 74.53 C ATOM 826 C ILE A 58 -7.431 19.235 3.689 1.00 51.03 C ATOM 827 O ILE A 58 -8.526 18.809 4.070 1.00 42.25 O ATOM 828 CB ILE A 58 -5.124 18.208 4.227 1.00 32.21 C ATOM 829 CG1 ILE A 58 -4.207 17.011 3.879 1.00 64.51 C ATOM 830 CG2 ILE A 58 -5.559 18.108 5.702 1.00 34.12 C ATOM 831 CD1 ILE A 58 -2.810 17.099 4.514 1.00 61.25 C ATOM 0 H ILE A 58 -4.881 18.896 1.878 1.00 34.52 H new ATOM 0 HA ILE A 58 -6.773 17.265 3.249 1.00 74.53 H new ATOM 0 HB ILE A 58 -4.582 19.146 4.108 1.00 32.21 H new ATOM 0 HG12 ILE A 58 -4.688 16.089 4.206 1.00 64.51 H new ATOM 0 HG13 ILE A 58 -4.101 16.948 2.796 1.00 64.51 H new ATOM 0 HG21 ILE A 58 -4.676 18.075 6.340 1.00 34.12 H new ATOM 0 HG22 ILE A 58 -6.163 18.977 5.963 1.00 34.12 H new ATOM 0 HG23 ILE A 58 -6.146 17.201 5.848 1.00 34.12 H new ATOM 0 HD11 ILE A 58 -2.224 16.226 4.226 1.00 61.25 H new ATOM 0 HD12 ILE A 58 -2.309 18.003 4.168 1.00 61.25 H new ATOM 0 HD13 ILE A 58 -2.905 17.130 5.599 1.00 61.25 H new ATOM 842 N GLN A 59 -7.149 20.541 3.674 1.00 12.32 N ATOM 843 CA GLN A 59 -8.058 21.561 4.186 1.00 63.45 C ATOM 844 C GLN A 59 -9.283 21.763 3.290 1.00 24.30 C ATOM 845 O GLN A 59 -10.286 22.299 3.771 1.00 32.10 O ATOM 846 CB GLN A 59 -7.318 22.884 4.432 1.00 62.23 C ATOM 847 CG GLN A 59 -6.270 22.741 5.549 1.00 45.11 C ATOM 848 CD GLN A 59 -5.989 24.080 6.219 1.00 65.53 C ATOM 849 OE1 GLN A 59 -4.866 24.720 5.913 1.00 52.03 O flip ATOM 850 NE2 GLN A 59 -6.795 24.550 7.014 1.00 74.25 N flip ATOM 0 H GLN A 59 -6.277 20.919 3.303 1.00 12.32 H new ATOM 0 HA GLN A 59 -8.434 21.198 5.143 1.00 63.45 H new ATOM 0 HB2 GLN A 59 -6.830 23.206 3.512 1.00 62.23 H new ATOM 0 HB3 GLN A 59 -8.035 23.659 4.701 1.00 62.23 H new ATOM 0 HG2 GLN A 59 -6.623 22.027 6.293 1.00 45.11 H new ATOM 0 HG3 GLN A 59 -5.346 22.338 5.134 1.00 45.11 H new ATOM 0 HE21 GLN A 59 -7.651 24.041 7.234 1.00 74.25 H new ATOM 0 HE22 GLN A 59 -6.610 25.451 7.456 1.00 74.25 H new ATOM 857 N GLY A 60 -9.278 21.239 2.063 1.00 72.12 N ATOM 858 CA GLY A 60 -10.421 21.291 1.160 1.00 21.40 C ATOM 859 C GLY A 60 -10.411 22.556 0.306 1.00 32.12 C ATOM 860 O GLY A 60 -11.472 22.998 -0.128 1.00 3.30 O ATOM 0 H GLY A 60 -8.468 20.761 1.667 1.00 72.12 H new ATOM 0 HA2 GLY A 60 -10.412 20.415 0.512 1.00 21.40 H new ATOM 0 HA3 GLY A 60 -11.344 21.250 1.739 1.00 21.40 H new ATOM 864 N ASN A 61 -9.227 23.134 0.085 1.00 64.23 N ATOM 865 CA ASN A 61 -8.980 24.145 -0.940 1.00 43.43 C ATOM 866 C ASN A 61 -8.873 23.477 -2.308 1.00 63.53 C ATOM 867 O ASN A 61 -9.084 24.129 -3.331 1.00 61.34 O ATOM 868 CB ASN A 61 -7.638 24.865 -0.703 1.00 31.34 C ATOM 869 CG ASN A 61 -7.500 25.503 0.673 1.00 21.40 C ATOM 870 OD1 ASN A 61 -8.477 25.768 1.367 1.00 23.40 O ATOM 871 ND2 ASN A 61 -6.289 25.718 1.138 1.00 43.14 N ATOM 0 H ASN A 61 -8.395 22.904 0.629 1.00 64.23 H new ATOM 0 HA ASN A 61 -9.806 24.855 -0.896 1.00 43.43 H new ATOM 0 HB2 ASN A 61 -6.827 24.150 -0.841 1.00 31.34 H new ATOM 0 HB3 ASN A 61 -7.515 25.638 -1.462 1.00 31.34 H new ATOM 0 HD21 ASN A 61 -6.163 26.104 2.074 1.00 43.14 H new ATOM 0 HD22 ASN A 61 -5.476 25.499 0.563 1.00 43.14 H new ATOM 877 N LYS A 62 -8.479 22.198 -2.338 1.00 62.12 N ATOM 878 CA LYS A 62 -8.243 21.426 -3.548 1.00 65.43 C ATOM 879 C LYS A 62 -8.915 20.076 -3.451 1.00 1.31 C ATOM 880 O LYS A 62 -9.372 19.642 -2.388 1.00 2.31 O ATOM 881 CB LYS A 62 -6.732 21.283 -3.808 1.00 23.11 C ATOM 882 CG LYS A 62 -6.203 22.487 -4.596 1.00 41.32 C ATOM 883 CD LYS A 62 -6.543 22.397 -6.095 1.00 2.11 C ATOM 884 CE LYS A 62 -5.368 21.873 -6.926 1.00 12.22 C ATOM 885 NZ LYS A 62 -4.394 22.933 -7.265 1.00 71.51 N ATOM 0 H LYS A 62 -8.312 21.660 -1.487 1.00 62.12 H new ATOM 0 HA LYS A 62 -8.679 21.956 -4.395 1.00 65.43 H new ATOM 0 HB2 LYS A 62 -6.201 21.200 -2.860 1.00 23.11 H new ATOM 0 HB3 LYS A 62 -6.538 20.365 -4.363 1.00 23.11 H new ATOM 0 HG2 LYS A 62 -6.626 23.403 -4.184 1.00 41.32 H new ATOM 0 HG3 LYS A 62 -5.122 22.552 -4.474 1.00 41.32 H new ATOM 0 HD2 LYS A 62 -7.403 21.741 -6.232 1.00 2.11 H new ATOM 0 HD3 LYS A 62 -6.832 23.383 -6.460 1.00 2.11 H new ATOM 0 HE2 LYS A 62 -4.861 21.082 -6.373 1.00 12.22 H new ATOM 0 HE3 LYS A 62 -5.748 21.427 -7.845 1.00 12.22 H new ATOM 0 HZ1 LYS A 62 -3.620 22.526 -7.827 1.00 71.51 H new ATOM 0 HZ2 LYS A 62 -4.868 23.677 -7.816 1.00 71.51 H new ATOM 0 HZ3 LYS A 62 -4.008 23.343 -6.390 1.00 71.51 H new ATOM 895 N ASP A 63 -9.025 19.448 -4.603 1.00 14.14 N ATOM 896 CA ASP A 63 -9.509 18.095 -4.835 1.00 3.41 C ATOM 897 C ASP A 63 -8.335 17.127 -4.697 1.00 43.43 C ATOM 898 O ASP A 63 -7.177 17.549 -4.729 1.00 14.00 O ATOM 899 CB ASP A 63 -10.180 18.005 -6.219 1.00 43.04 C ATOM 900 CG ASP A 63 -9.534 18.822 -7.346 1.00 32.11 C ATOM 901 OD1 ASP A 63 -8.329 19.153 -7.279 1.00 4.14 O ATOM 902 OD2 ASP A 63 -10.286 19.182 -8.281 1.00 25.53 O ATOM 0 H ASP A 63 -8.757 19.905 -5.475 1.00 14.14 H new ATOM 0 HA ASP A 63 -10.265 17.825 -4.098 1.00 3.41 H new ATOM 0 HB2 ASP A 63 -10.197 16.958 -6.523 1.00 43.04 H new ATOM 0 HB3 ASP A 63 -11.217 18.324 -6.117 1.00 43.04 H new ATOM 906 N PHE A 64 -8.612 15.837 -4.474 1.00 1.12 N ATOM 907 CA PHE A 64 -7.556 14.849 -4.289 1.00 61.21 C ATOM 908 C PHE A 64 -6.839 14.485 -5.577 1.00 64.21 C ATOM 909 O PHE A 64 -7.401 14.684 -6.661 1.00 62.15 O ATOM 910 CB PHE A 64 -8.106 13.594 -3.604 1.00 63.12 C ATOM 911 CG PHE A 64 -8.105 13.781 -2.112 1.00 11.32 C ATOM 912 CD1 PHE A 64 -6.893 14.089 -1.472 1.00 73.41 C ATOM 913 CD2 PHE A 64 -9.310 13.790 -1.398 1.00 30.42 C ATOM 914 CE1 PHE A 64 -6.889 14.404 -0.101 1.00 41.41 C ATOM 915 CE2 PHE A 64 -9.310 14.117 -0.035 1.00 31.42 C ATOM 916 CZ PHE A 64 -8.100 14.418 0.619 1.00 23.40 C ATOM 0 H PHE A 64 -9.558 15.459 -4.418 1.00 1.12 H new ATOM 0 HA PHE A 64 -6.810 15.314 -3.645 1.00 61.21 H new ATOM 0 HB2 PHE A 64 -9.119 13.393 -3.953 1.00 63.12 H new ATOM 0 HB3 PHE A 64 -7.500 12.728 -3.871 1.00 63.12 H new ATOM 0 HD1 PHE A 64 -5.968 14.084 -2.030 1.00 73.41 H new ATOM 0 HD2 PHE A 64 -10.237 13.546 -1.896 1.00 30.42 H new ATOM 0 HE1 PHE A 64 -5.960 14.635 0.399 1.00 41.41 H new ATOM 0 HE2 PHE A 64 -10.240 14.138 0.514 1.00 31.42 H new ATOM 0 HZ PHE A 64 -8.100 14.659 1.672 1.00 23.40 H new ATOM 925 N PRO A 65 -5.601 13.954 -5.471 1.00 42.24 N ATOM 926 CA PRO A 65 -4.788 13.846 -6.639 1.00 21.14 C ATOM 927 C PRO A 65 -5.095 12.557 -7.391 1.00 13.21 C ATOM 928 O PRO A 65 -5.006 11.452 -6.837 1.00 1.14 O ATOM 929 CB PRO A 65 -3.344 13.908 -6.193 1.00 61.55 C ATOM 930 CG PRO A 65 -3.389 13.321 -4.782 1.00 43.14 C ATOM 931 CD PRO A 65 -4.791 13.688 -4.291 1.00 70.41 C ATOM 0 HA PRO A 65 -4.993 14.662 -7.332 1.00 21.14 H new ATOM 0 HB2 PRO A 65 -2.695 13.329 -6.850 1.00 61.55 H new ATOM 0 HB3 PRO A 65 -2.966 14.930 -6.192 1.00 61.55 H new ATOM 0 HG2 PRO A 65 -3.236 12.242 -4.790 1.00 43.14 H new ATOM 0 HG3 PRO A 65 -2.615 13.748 -4.144 1.00 43.14 H new ATOM 0 HD2 PRO A 65 -5.219 12.875 -3.705 1.00 70.41 H new ATOM 0 HD3 PRO A 65 -4.755 14.564 -3.643 1.00 70.41 H new ATOM 936 N GLU A 66 -5.387 12.695 -8.674 1.00 63.21 N ATOM 937 CA GLU A 66 -5.733 11.579 -9.540 1.00 42.35 C ATOM 938 C GLU A 66 -4.502 10.707 -9.763 1.00 25.31 C ATOM 939 O GLU A 66 -3.366 11.201 -9.743 1.00 22.11 O ATOM 940 CB GLU A 66 -6.266 12.104 -10.876 1.00 12.50 C ATOM 941 CG GLU A 66 -7.655 12.719 -10.696 1.00 25.42 C ATOM 942 CD GLU A 66 -8.186 13.330 -11.988 1.00 21.01 C ATOM 943 OE1 GLU A 66 -8.258 12.648 -13.031 1.00 65.04 O ATOM 944 OE2 GLU A 66 -8.618 14.505 -11.956 1.00 25.52 O ATOM 0 H GLU A 66 -5.391 13.597 -9.150 1.00 63.21 H new ATOM 0 HA GLU A 66 -6.511 10.978 -9.068 1.00 42.35 H new ATOM 0 HB2 GLU A 66 -5.581 12.850 -11.279 1.00 12.50 H new ATOM 0 HB3 GLU A 66 -6.313 11.291 -11.600 1.00 12.50 H new ATOM 0 HG2 GLU A 66 -8.347 11.953 -10.347 1.00 25.42 H new ATOM 0 HG3 GLU A 66 -7.613 13.487 -9.923 1.00 25.42 H new ATOM 949 N ILE A 67 -4.726 9.426 -10.046 1.00 54.33 N ATOM 950 CA ILE A 67 -3.672 8.450 -10.282 1.00 61.42 C ATOM 951 C ILE A 67 -3.661 8.035 -11.746 1.00 52.14 C ATOM 952 O ILE A 67 -4.692 8.034 -12.419 1.00 34.41 O ATOM 953 CB ILE A 67 -3.790 7.239 -9.330 1.00 30.14 C ATOM 954 CG1 ILE A 67 -5.120 6.465 -9.481 1.00 65.33 C ATOM 955 CG2 ILE A 67 -3.568 7.710 -7.887 1.00 74.13 C ATOM 956 CD1 ILE A 67 -5.192 5.205 -8.611 1.00 65.03 C ATOM 0 H ILE A 67 -5.664 9.033 -10.118 1.00 54.33 H new ATOM 0 HA ILE A 67 -2.713 8.917 -10.060 1.00 61.42 H new ATOM 0 HB ILE A 67 -3.015 6.523 -9.605 1.00 30.14 H new ATOM 0 HG12 ILE A 67 -5.948 7.125 -9.221 1.00 65.33 H new ATOM 0 HG13 ILE A 67 -5.252 6.184 -10.526 1.00 65.33 H new ATOM 0 HG21 ILE A 67 -3.650 6.860 -7.210 1.00 74.13 H new ATOM 0 HG22 ILE A 67 -2.575 8.151 -7.797 1.00 74.13 H new ATOM 0 HG23 ILE A 67 -4.321 8.454 -7.627 1.00 74.13 H new ATOM 0 HD11 ILE A 67 -6.151 4.710 -8.766 1.00 65.03 H new ATOM 0 HD12 ILE A 67 -4.385 4.526 -8.886 1.00 65.03 H new ATOM 0 HD13 ILE A 67 -5.091 5.481 -7.561 1.00 65.03 H new ATOM 967 N GLN A 68 -2.497 7.623 -12.239 1.00 73.44 N ATOM 968 CA GLN A 68 -2.307 7.193 -13.627 1.00 45.22 C ATOM 969 C GLN A 68 -2.332 5.657 -13.737 1.00 62.15 C ATOM 970 O GLN A 68 -1.815 5.087 -14.696 1.00 71.12 O ATOM 971 CB GLN A 68 -0.998 7.772 -14.202 1.00 73.32 C ATOM 972 CG GLN A 68 -0.585 9.198 -13.776 1.00 4.50 C ATOM 973 CD GLN A 68 -1.162 10.338 -14.619 1.00 30.04 C ATOM 974 OE1 GLN A 68 -2.037 10.160 -15.461 1.00 42.44 O ATOM 975 NE2 GLN A 68 -0.625 11.538 -14.440 1.00 42.55 N ATOM 0 H GLN A 68 -1.645 7.577 -11.680 1.00 73.44 H new ATOM 0 HA GLN A 68 -3.136 7.580 -14.220 1.00 45.22 H new ATOM 0 HB2 GLN A 68 -0.187 7.095 -13.932 1.00 73.32 H new ATOM 0 HB3 GLN A 68 -1.076 7.758 -15.289 1.00 73.32 H new ATOM 0 HG2 GLN A 68 -0.887 9.349 -12.740 1.00 4.50 H new ATOM 0 HG3 GLN A 68 0.503 9.265 -13.804 1.00 4.50 H new ATOM 0 HE21 GLN A 68 0.101 11.672 -13.737 1.00 42.55 H new ATOM 0 HE22 GLN A 68 -0.939 12.327 -15.006 1.00 42.55 H new ATOM 982 N LEU A 69 -2.845 4.978 -12.709 1.00 23.13 N ATOM 983 CA LEU A 69 -2.990 3.526 -12.702 1.00 5.14 C ATOM 984 C LEU A 69 -4.194 3.148 -13.555 1.00 4.41 C ATOM 985 O LEU A 69 -5.166 3.896 -13.642 1.00 4.20 O ATOM 986 CB LEU A 69 -3.235 2.995 -11.274 1.00 24.11 C ATOM 987 CG LEU A 69 -2.030 2.350 -10.577 1.00 62.43 C ATOM 988 CD1 LEU A 69 -2.433 1.920 -9.161 1.00 34.41 C ATOM 989 CD2 LEU A 69 -1.510 1.126 -11.335 1.00 43.42 C ATOM 0 H LEU A 69 -3.173 5.426 -11.853 1.00 23.13 H new ATOM 0 HA LEU A 69 -2.070 3.090 -13.092 1.00 5.14 H new ATOM 0 HB2 LEU A 69 -3.586 3.822 -10.656 1.00 24.11 H new ATOM 0 HB3 LEU A 69 -4.041 2.262 -11.314 1.00 24.11 H new ATOM 0 HG LEU A 69 -1.233 3.092 -10.547 1.00 62.43 H new ATOM 0 HD11 LEU A 69 -1.579 1.461 -8.663 1.00 34.41 H new ATOM 0 HD12 LEU A 69 -2.758 2.793 -8.594 1.00 34.41 H new ATOM 0 HD13 LEU A 69 -3.249 1.200 -9.218 1.00 34.41 H new ATOM 0 HD21 LEU A 69 -0.657 0.704 -10.803 1.00 43.42 H new ATOM 0 HD22 LEU A 69 -2.300 0.378 -11.405 1.00 43.42 H new ATOM 0 HD23 LEU A 69 -1.202 1.423 -12.337 1.00 43.42 H new ATOM 1000 N ASP A 70 -4.167 1.932 -14.081 1.00 3.11 N ATOM 1001 CA ASP A 70 -5.259 1.354 -14.864 1.00 74.21 C ATOM 1002 C ASP A 70 -6.365 0.887 -13.907 1.00 21.42 C ATOM 1003 O ASP A 70 -6.125 0.757 -12.700 1.00 31.03 O ATOM 1004 CB ASP A 70 -4.751 0.171 -15.716 1.00 51.34 C ATOM 1005 CG ASP A 70 -3.703 0.510 -16.790 1.00 31.42 C ATOM 1006 OD1 ASP A 70 -3.015 1.553 -16.701 1.00 62.12 O ATOM 1007 OD2 ASP A 70 -3.521 -0.289 -17.734 1.00 41.10 O ATOM 0 H ASP A 70 -3.371 1.304 -13.975 1.00 3.11 H new ATOM 0 HA ASP A 70 -5.656 2.109 -15.542 1.00 74.21 H new ATOM 0 HB2 ASP A 70 -4.326 -0.576 -15.046 1.00 51.34 H new ATOM 0 HB3 ASP A 70 -5.608 -0.291 -16.207 1.00 51.34 H new ATOM 1011 N ASN A 71 -7.576 0.606 -14.409 1.00 63.01 N ATOM 1012 CA ASN A 71 -8.608 -0.029 -13.584 1.00 44.14 C ATOM 1013 C ASN A 71 -8.239 -1.501 -13.464 1.00 44.50 C ATOM 1014 O ASN A 71 -8.325 -2.257 -14.438 1.00 2.11 O ATOM 1015 CB ASN A 71 -10.027 0.101 -14.146 1.00 74.22 C ATOM 1016 CG ASN A 71 -11.067 0.007 -13.035 1.00 51.43 C ATOM 1017 OD1 ASN A 71 -11.558 1.031 -12.575 1.00 25.25 O ATOM 1018 ND2 ASN A 71 -11.422 -1.170 -12.545 1.00 2.23 N ATOM 0 H ASN A 71 -7.860 0.806 -15.368 1.00 63.01 H new ATOM 0 HA ASN A 71 -8.631 0.480 -12.620 1.00 44.14 H new ATOM 0 HB2 ASN A 71 -10.130 1.054 -14.665 1.00 74.22 H new ATOM 0 HB3 ASN A 71 -10.204 -0.684 -14.881 1.00 74.22 H new ATOM 0 HD21 ASN A 71 -12.102 -1.223 -11.787 1.00 2.23 H new ATOM 0 HD22 ASN A 71 -11.015 -2.025 -12.926 1.00 2.23 H new ATOM 1024 N ILE A 72 -7.786 -1.892 -12.290 1.00 22.44 N ATOM 1025 CA ILE A 72 -7.289 -3.225 -11.961 1.00 43.10 C ATOM 1026 C ILE A 72 -8.167 -3.737 -10.829 1.00 23.01 C ATOM 1027 O ILE A 72 -8.803 -2.943 -10.126 1.00 51.53 O ATOM 1028 CB ILE A 72 -5.781 -3.148 -11.617 1.00 61.34 C ATOM 1029 CG1 ILE A 72 -5.002 -2.769 -12.902 1.00 24.34 C ATOM 1030 CG2 ILE A 72 -5.215 -4.462 -11.036 1.00 1.52 C ATOM 1031 CD1 ILE A 72 -3.610 -2.209 -12.619 1.00 14.33 C ATOM 0 H ILE A 72 -7.750 -1.258 -11.492 1.00 22.44 H new ATOM 0 HA ILE A 72 -7.352 -3.927 -12.792 1.00 43.10 H new ATOM 0 HB ILE A 72 -5.661 -2.393 -10.840 1.00 61.34 H new ATOM 0 HG12 ILE A 72 -4.910 -3.651 -13.536 1.00 24.34 H new ATOM 0 HG13 ILE A 72 -5.576 -2.031 -13.463 1.00 24.34 H new ATOM 0 HG21 ILE A 72 -4.154 -4.336 -10.818 1.00 1.52 H new ATOM 0 HG22 ILE A 72 -5.747 -4.713 -10.118 1.00 1.52 H new ATOM 0 HG23 ILE A 72 -5.344 -5.266 -11.761 1.00 1.52 H new ATOM 0 HD11 ILE A 72 -3.118 -1.964 -13.560 1.00 14.33 H new ATOM 0 HD12 ILE A 72 -3.697 -1.309 -12.010 1.00 14.33 H new ATOM 0 HD13 ILE A 72 -3.020 -2.954 -12.085 1.00 14.33 H new ATOM 1042 N ASP A 73 -8.220 -5.057 -10.668 1.00 45.34 N ATOM 1043 CA ASP A 73 -9.045 -5.696 -9.665 1.00 2.42 C ATOM 1044 C ASP A 73 -8.155 -6.247 -8.575 1.00 42.44 C ATOM 1045 O ASP A 73 -7.332 -7.136 -8.802 1.00 10.15 O ATOM 1046 CB ASP A 73 -9.934 -6.774 -10.282 1.00 42.50 C ATOM 1047 CG ASP A 73 -11.375 -6.410 -9.984 1.00 73.12 C ATOM 1048 OD1 ASP A 73 -11.770 -6.408 -8.797 1.00 73.11 O ATOM 1049 OD2 ASP A 73 -12.055 -5.986 -10.950 1.00 33.13 O ATOM 0 H ASP A 73 -7.685 -5.712 -11.238 1.00 45.34 H new ATOM 0 HA ASP A 73 -9.719 -4.961 -9.226 1.00 2.42 H new ATOM 0 HB2 ASP A 73 -9.770 -6.835 -11.358 1.00 42.50 H new ATOM 0 HB3 ASP A 73 -9.693 -7.752 -9.866 1.00 42.50 H new ATOM 1053 N TYR A 74 -8.299 -5.681 -7.387 1.00 22.05 N ATOM 1054 CA TYR A 74 -7.537 -6.059 -6.213 1.00 71.43 C ATOM 1055 C TYR A 74 -8.298 -7.081 -5.373 1.00 1.32 C ATOM 1056 O TYR A 74 -7.722 -7.726 -4.497 1.00 25.41 O ATOM 1057 CB TYR A 74 -7.254 -4.787 -5.417 1.00 62.33 C ATOM 1058 CG TYR A 74 -6.656 -3.676 -6.259 1.00 14.44 C ATOM 1059 CD1 TYR A 74 -5.400 -3.839 -6.873 1.00 21.15 C ATOM 1060 CD2 TYR A 74 -7.387 -2.496 -6.469 1.00 30.32 C ATOM 1061 CE1 TYR A 74 -4.879 -2.824 -7.691 1.00 12.34 C ATOM 1062 CE2 TYR A 74 -6.857 -1.459 -7.247 1.00 64.14 C ATOM 1063 CZ TYR A 74 -5.612 -1.633 -7.898 1.00 64.02 C ATOM 1064 OH TYR A 74 -5.105 -0.672 -8.719 1.00 34.41 O ATOM 0 H TYR A 74 -8.965 -4.929 -7.211 1.00 22.05 H new ATOM 0 HA TYR A 74 -6.600 -6.533 -6.506 1.00 71.43 H new ATOM 0 HB2 TYR A 74 -8.182 -4.434 -4.967 1.00 62.33 H new ATOM 0 HB3 TYR A 74 -6.572 -5.022 -4.600 1.00 62.33 H new ATOM 0 HD1 TYR A 74 -4.836 -4.746 -6.715 1.00 21.15 H new ATOM 0 HD2 TYR A 74 -8.366 -2.387 -6.027 1.00 30.32 H new ATOM 0 HE1 TYR A 74 -3.916 -2.953 -8.163 1.00 12.34 H new ATOM 0 HE2 TYR A 74 -7.397 -0.529 -7.350 1.00 64.14 H new ATOM 0 HH TYR A 74 -5.726 0.085 -8.759 1.00 34.41 H new ATOM 1073 N ASN A 75 -9.595 -7.266 -5.638 1.00 52.33 N ATOM 1074 CA ASN A 75 -10.477 -8.049 -4.781 1.00 11.13 C ATOM 1075 C ASN A 75 -10.091 -9.530 -4.753 1.00 31.13 C ATOM 1076 O ASN A 75 -10.345 -10.230 -3.773 1.00 52.32 O ATOM 1077 CB ASN A 75 -11.923 -7.871 -5.241 1.00 12.32 C ATOM 1078 CG ASN A 75 -12.909 -8.713 -4.457 1.00 13.14 C ATOM 1079 OD1 ASN A 75 -13.698 -9.432 -5.058 1.00 44.44 O ATOM 1080 ND2 ASN A 75 -12.914 -8.652 -3.138 1.00 42.41 N ATOM 0 H ASN A 75 -10.060 -6.874 -6.457 1.00 52.33 H new ATOM 0 HA ASN A 75 -10.372 -7.681 -3.760 1.00 11.13 H new ATOM 0 HB2 ASN A 75 -12.199 -6.821 -5.149 1.00 12.32 H new ATOM 0 HB3 ASN A 75 -11.995 -8.129 -6.298 1.00 12.32 H new ATOM 0 HD21 ASN A 75 -13.582 -9.209 -2.604 1.00 42.41 H new ATOM 0 HD22 ASN A 75 -12.250 -8.048 -2.653 1.00 42.41 H new ATOM 1086 N ASN A 76 -9.435 -10.016 -5.801 1.00 41.23 N ATOM 1087 CA ASN A 76 -8.952 -11.385 -5.901 1.00 2.12 C ATOM 1088 C ASN A 76 -7.631 -11.643 -5.159 1.00 44.43 C ATOM 1089 O ASN A 76 -7.219 -12.799 -5.092 1.00 70.40 O ATOM 1090 CB ASN A 76 -8.842 -11.796 -7.367 1.00 44.52 C ATOM 1091 CG ASN A 76 -7.780 -10.983 -8.077 1.00 13.34 C ATOM 1092 OD1 ASN A 76 -8.153 -9.819 -8.566 1.00 12.34 O flip ATOM 1093 ND2 ASN A 76 -6.638 -11.409 -8.196 1.00 32.14 N flip ATOM 0 H ASN A 76 -9.220 -9.453 -6.624 1.00 41.23 H new ATOM 0 HA ASN A 76 -9.692 -12.006 -5.397 1.00 2.12 H new ATOM 0 HB2 ASN A 76 -8.600 -12.857 -7.434 1.00 44.52 H new ATOM 0 HB3 ASN A 76 -9.803 -11.657 -7.861 1.00 44.52 H new ATOM 0 HD21 ASN A 76 -6.389 -12.316 -7.803 1.00 32.14 H new ATOM 0 HD22 ASN A 76 -5.936 -10.856 -8.689 1.00 32.14 H new ATOM 1099 N TYR A 77 -6.965 -10.630 -4.597 1.00 34.24 N ATOM 1100 CA TYR A 77 -5.762 -10.826 -3.789 1.00 34.42 C ATOM 1101 C TYR A 77 -6.169 -11.127 -2.350 1.00 44.40 C ATOM 1102 O TYR A 77 -7.159 -10.575 -1.860 1.00 14.22 O ATOM 1103 CB TYR A 77 -4.828 -9.620 -3.933 1.00 41.51 C ATOM 1104 CG TYR A 77 -4.166 -9.654 -5.299 1.00 3.31 C ATOM 1105 CD1 TYR A 77 -2.966 -10.368 -5.469 1.00 23.24 C ATOM 1106 CD2 TYR A 77 -4.829 -9.133 -6.427 1.00 24.21 C ATOM 1107 CE1 TYR A 77 -2.431 -10.580 -6.753 1.00 43.23 C ATOM 1108 CE2 TYR A 77 -4.317 -9.360 -7.716 1.00 45.11 C ATOM 1109 CZ TYR A 77 -3.125 -10.095 -7.885 1.00 33.31 C ATOM 1110 OH TYR A 77 -2.689 -10.395 -9.137 1.00 61.20 O ATOM 0 H TYR A 77 -7.245 -9.654 -4.690 1.00 34.24 H new ATOM 0 HA TYR A 77 -5.192 -11.686 -4.142 1.00 34.42 H new ATOM 0 HB2 TYR A 77 -5.391 -8.694 -3.812 1.00 41.51 H new ATOM 0 HB3 TYR A 77 -4.071 -9.637 -3.149 1.00 41.51 H new ATOM 0 HD1 TYR A 77 -2.450 -10.758 -4.604 1.00 23.24 H new ATOM 0 HD2 TYR A 77 -5.734 -8.557 -6.301 1.00 24.21 H new ATOM 0 HE1 TYR A 77 -1.497 -11.109 -6.873 1.00 43.23 H new ATOM 0 HE2 TYR A 77 -4.837 -8.971 -8.579 1.00 45.11 H new ATOM 0 HH TYR A 77 -1.726 -10.222 -9.198 1.00 61.20 H new ATOM 1119 N ASP A 78 -5.437 -12.036 -1.700 1.00 13.32 N ATOM 1120 CA ASP A 78 -5.576 -12.298 -0.255 1.00 42.11 C ATOM 1121 C ASP A 78 -5.028 -11.102 0.518 1.00 30.35 C ATOM 1122 O ASP A 78 -5.736 -10.490 1.318 1.00 33.11 O ATOM 1123 CB ASP A 78 -4.819 -13.581 0.123 1.00 1.32 C ATOM 1124 CG ASP A 78 -5.189 -14.198 1.473 1.00 24.13 C ATOM 1125 OD1 ASP A 78 -6.299 -14.778 1.558 1.00 31.33 O ATOM 1126 OD2 ASP A 78 -4.291 -14.314 2.341 1.00 50.24 O ATOM 0 H ASP A 78 -4.730 -12.613 -2.156 1.00 13.32 H new ATOM 0 HA ASP A 78 -6.627 -12.439 -0.003 1.00 42.11 H new ATOM 0 HB2 ASP A 78 -4.992 -14.325 -0.655 1.00 1.32 H new ATOM 0 HB3 ASP A 78 -3.751 -13.363 0.125 1.00 1.32 H new ATOM 1130 N LEU A 79 -3.785 -10.732 0.201 1.00 3.51 N ATOM 1131 CA LEU A 79 -2.933 -9.780 0.908 1.00 10.21 C ATOM 1132 C LEU A 79 -2.380 -8.763 -0.099 1.00 10.51 C ATOM 1133 O LEU A 79 -2.016 -9.146 -1.218 1.00 71.30 O ATOM 1134 CB LEU A 79 -1.795 -10.607 1.546 1.00 52.10 C ATOM 1135 CG LEU A 79 -0.647 -9.796 2.174 1.00 73.15 C ATOM 1136 CD1 LEU A 79 -1.116 -8.989 3.384 1.00 30.10 C ATOM 1137 CD2 LEU A 79 0.481 -10.726 2.617 1.00 44.42 C ATOM 0 H LEU A 79 -3.316 -11.120 -0.617 1.00 3.51 H new ATOM 0 HA LEU A 79 -3.475 -9.227 1.675 1.00 10.21 H new ATOM 0 HB2 LEU A 79 -2.225 -11.248 2.316 1.00 52.10 H new ATOM 0 HB3 LEU A 79 -1.376 -11.263 0.783 1.00 52.10 H new ATOM 0 HG LEU A 79 -0.290 -9.106 1.409 1.00 73.15 H new ATOM 0 HD11 LEU A 79 -0.276 -8.431 3.797 1.00 30.10 H new ATOM 0 HD12 LEU A 79 -1.897 -8.294 3.077 1.00 30.10 H new ATOM 0 HD13 LEU A 79 -1.510 -9.666 4.142 1.00 30.10 H new ATOM 0 HD21 LEU A 79 1.285 -10.138 3.059 1.00 44.42 H new ATOM 0 HD22 LEU A 79 0.101 -11.433 3.354 1.00 44.42 H new ATOM 0 HD23 LEU A 79 0.863 -11.272 1.754 1.00 44.42 H new ATOM 1148 N ILE A 80 -2.283 -7.487 0.290 1.00 53.51 N ATOM 1149 CA ILE A 80 -1.710 -6.417 -0.528 1.00 51.45 C ATOM 1150 C ILE A 80 -0.909 -5.491 0.381 1.00 50.13 C ATOM 1151 O ILE A 80 -1.488 -4.734 1.154 1.00 21.20 O ATOM 1152 CB ILE A 80 -2.800 -5.607 -1.267 1.00 51.14 C ATOM 1153 CG1 ILE A 80 -3.773 -6.479 -2.083 1.00 45.50 C ATOM 1154 CG2 ILE A 80 -2.124 -4.578 -2.195 1.00 72.31 C ATOM 1155 CD1 ILE A 80 -4.935 -5.650 -2.620 1.00 10.22 C ATOM 0 H ILE A 80 -2.608 -7.165 1.202 1.00 53.51 H new ATOM 0 HA ILE A 80 -1.069 -6.866 -1.287 1.00 51.45 H new ATOM 0 HB ILE A 80 -3.399 -5.113 -0.502 1.00 51.14 H new ATOM 0 HG12 ILE A 80 -3.241 -6.945 -2.912 1.00 45.50 H new ATOM 0 HG13 ILE A 80 -4.156 -7.285 -1.457 1.00 45.50 H new ATOM 0 HG21 ILE A 80 -2.888 -4.004 -2.719 1.00 72.31 H new ATOM 0 HG22 ILE A 80 -1.506 -3.904 -1.602 1.00 72.31 H new ATOM 0 HG23 ILE A 80 -1.499 -5.098 -2.921 1.00 72.31 H new ATOM 0 HD11 ILE A 80 -5.606 -6.291 -3.192 1.00 10.22 H new ATOM 0 HD12 ILE A 80 -5.480 -5.206 -1.787 1.00 10.22 H new ATOM 0 HD13 ILE A 80 -4.551 -4.860 -3.265 1.00 10.22 H new ATOM 1166 N LEU A 81 0.419 -5.522 0.314 1.00 33.02 N ATOM 1167 CA LEU A 81 1.254 -4.554 1.025 1.00 71.15 C ATOM 1168 C LEU A 81 1.284 -3.231 0.247 1.00 63.13 C ATOM 1169 O LEU A 81 1.263 -3.263 -0.989 1.00 3.41 O ATOM 1170 CB LEU A 81 2.645 -5.166 1.211 1.00 4.52 C ATOM 1171 CG LEU A 81 2.730 -6.016 2.500 1.00 54.33 C ATOM 1172 CD1 LEU A 81 1.632 -7.070 2.671 1.00 21.13 C ATOM 1173 CD2 LEU A 81 4.076 -6.733 2.624 1.00 1.10 C ATOM 0 H LEU A 81 0.943 -6.209 -0.227 1.00 33.02 H new ATOM 0 HA LEU A 81 0.849 -4.328 2.012 1.00 71.15 H new ATOM 0 HB2 LEU A 81 2.887 -5.788 0.349 1.00 4.52 H new ATOM 0 HB3 LEU A 81 3.390 -4.371 1.250 1.00 4.52 H new ATOM 0 HG LEU A 81 2.598 -5.272 3.285 1.00 54.33 H new ATOM 0 HD11 LEU A 81 1.787 -7.608 3.606 1.00 21.13 H new ATOM 0 HD12 LEU A 81 0.658 -6.581 2.690 1.00 21.13 H new ATOM 0 HD13 LEU A 81 1.669 -7.772 1.838 1.00 21.13 H new ATOM 0 HD21 LEU A 81 4.093 -7.318 3.543 1.00 1.10 H new ATOM 0 HD22 LEU A 81 4.216 -7.395 1.769 1.00 1.10 H new ATOM 0 HD23 LEU A 81 4.880 -5.997 2.648 1.00 1.10 H new ATOM 1184 N ILE A 82 1.274 -2.084 0.953 1.00 4.13 N ATOM 1185 CA ILE A 82 1.141 -0.757 0.344 1.00 41.53 C ATOM 1186 C ILE A 82 2.083 0.291 0.950 1.00 21.30 C ATOM 1187 O ILE A 82 1.872 0.792 2.057 1.00 63.42 O ATOM 1188 CB ILE A 82 -0.322 -0.257 0.345 1.00 50.43 C ATOM 1189 CG1 ILE A 82 -1.240 -1.277 -0.369 1.00 52.22 C ATOM 1190 CG2 ILE A 82 -0.391 1.115 -0.368 1.00 61.13 C ATOM 1191 CD1 ILE A 82 -2.692 -0.829 -0.528 1.00 34.43 C ATOM 0 H ILE A 82 1.359 -2.058 1.969 1.00 4.13 H new ATOM 0 HA ILE A 82 1.450 -0.887 -0.693 1.00 41.53 H new ATOM 0 HB ILE A 82 -0.666 -0.150 1.374 1.00 50.43 H new ATOM 0 HG12 ILE A 82 -0.829 -1.486 -1.356 1.00 52.22 H new ATOM 0 HG13 ILE A 82 -1.222 -2.213 0.189 1.00 52.22 H new ATOM 0 HG21 ILE A 82 -1.421 1.472 -0.370 1.00 61.13 H new ATOM 0 HG22 ILE A 82 0.240 1.831 0.158 1.00 61.13 H new ATOM 0 HG23 ILE A 82 -0.041 1.009 -1.395 1.00 61.13 H new ATOM 0 HD11 ILE A 82 -3.259 -1.607 -1.039 1.00 34.43 H new ATOM 0 HD12 ILE A 82 -3.127 -0.649 0.455 1.00 34.43 H new ATOM 0 HD13 ILE A 82 -2.727 0.089 -1.114 1.00 34.43 H new ATOM 1202 N GLY A 83 3.046 0.762 0.164 1.00 51.14 N ATOM 1203 CA GLY A 83 3.950 1.843 0.552 1.00 61.32 C ATOM 1204 C GLY A 83 3.459 3.235 0.151 1.00 24.31 C ATOM 1205 O GLY A 83 2.638 3.355 -0.770 1.00 30.20 O ATOM 0 H GLY A 83 3.224 0.400 -0.773 1.00 51.14 H new ATOM 0 HA2 GLY A 83 4.091 1.815 1.632 1.00 61.32 H new ATOM 0 HA3 GLY A 83 4.926 1.668 0.099 1.00 61.32 H new ATOM 1209 N SER A 84 4.017 4.291 0.767 1.00 21.43 N ATOM 1210 CA SER A 84 4.036 5.644 0.205 1.00 34.42 C ATOM 1211 C SER A 84 5.211 6.450 0.806 1.00 34.04 C ATOM 1212 O SER A 84 5.769 6.010 1.815 1.00 65.42 O ATOM 1213 CB SER A 84 2.671 6.303 0.420 1.00 41.55 C ATOM 1214 OG SER A 84 2.446 6.760 1.728 1.00 22.10 O ATOM 0 H SER A 84 4.471 4.224 1.678 1.00 21.43 H new ATOM 0 HA SER A 84 4.207 5.611 -0.871 1.00 34.42 H new ATOM 0 HB2 SER A 84 2.575 7.144 -0.267 1.00 41.55 H new ATOM 0 HB3 SER A 84 1.891 5.588 0.159 1.00 41.55 H new ATOM 0 HG SER A 84 1.670 6.297 2.107 1.00 22.10 H new ATOM 1219 N PRO A 85 5.609 7.603 0.229 1.00 43.25 N ATOM 1220 CA PRO A 85 6.593 8.495 0.844 1.00 50.23 C ATOM 1221 C PRO A 85 6.029 9.206 2.071 1.00 62.32 C ATOM 1222 O PRO A 85 4.837 9.524 2.111 1.00 52.14 O ATOM 1223 CB PRO A 85 6.945 9.536 -0.230 1.00 73.42 C ATOM 1224 CG PRO A 85 5.739 9.538 -1.159 1.00 34.32 C ATOM 1225 CD PRO A 85 5.205 8.112 -1.075 1.00 13.30 C ATOM 0 HA PRO A 85 7.460 7.926 1.180 1.00 50.23 H new ATOM 0 HB2 PRO A 85 7.111 10.520 0.209 1.00 73.42 H new ATOM 0 HB3 PRO A 85 7.857 9.266 -0.762 1.00 73.42 H new ATOM 0 HG2 PRO A 85 4.991 10.264 -0.840 1.00 34.32 H new ATOM 0 HG3 PRO A 85 6.021 9.799 -2.179 1.00 34.32 H new ATOM 0 HD2 PRO A 85 4.120 8.096 -1.180 1.00 13.30 H new ATOM 0 HD3 PRO A 85 5.612 7.496 -1.877 1.00 13.30 H new ATOM 1230 N VAL A 86 6.902 9.564 3.022 1.00 71.21 N ATOM 1231 CA VAL A 86 6.520 10.450 4.117 1.00 4.01 C ATOM 1232 C VAL A 86 7.012 11.857 3.729 1.00 5.41 C ATOM 1233 O VAL A 86 8.182 11.998 3.362 1.00 42.41 O ATOM 1234 CB VAL A 86 7.138 9.983 5.446 1.00 34.20 C ATOM 1235 CG1 VAL A 86 6.759 10.889 6.611 1.00 22.43 C ATOM 1236 CG2 VAL A 86 6.696 8.566 5.810 1.00 72.24 C ATOM 0 H VAL A 86 7.873 9.252 3.051 1.00 71.21 H new ATOM 0 HA VAL A 86 5.441 10.447 4.269 1.00 4.01 H new ATOM 0 HB VAL A 86 8.216 10.016 5.287 1.00 34.20 H new ATOM 0 HG11 VAL A 86 7.220 10.517 7.526 1.00 22.43 H new ATOM 0 HG12 VAL A 86 7.110 11.902 6.414 1.00 22.43 H new ATOM 0 HG13 VAL A 86 5.675 10.897 6.728 1.00 22.43 H new ATOM 0 HG21 VAL A 86 7.154 8.273 6.755 1.00 72.24 H new ATOM 0 HG22 VAL A 86 5.611 8.537 5.909 1.00 72.24 H new ATOM 0 HG23 VAL A 86 7.007 7.875 5.027 1.00 72.24 H new ATOM 1246 N TRP A 87 6.171 12.895 3.810 1.00 54.22 N ATOM 1247 CA TRP A 87 6.593 14.291 3.633 1.00 61.11 C ATOM 1248 C TRP A 87 6.792 14.951 5.007 1.00 51.31 C ATOM 1249 O TRP A 87 6.881 14.265 6.029 1.00 70.44 O ATOM 1250 CB TRP A 87 5.604 15.046 2.720 1.00 4.44 C ATOM 1251 CG TRP A 87 6.175 15.550 1.428 1.00 50.33 C ATOM 1252 CD1 TRP A 87 6.793 16.730 1.198 1.00 30.53 C ATOM 1253 CD2 TRP A 87 6.120 14.881 0.138 1.00 10.04 C ATOM 1254 NE1 TRP A 87 7.155 16.817 -0.139 1.00 51.42 N ATOM 1255 CE2 TRP A 87 6.759 15.697 -0.839 1.00 32.54 C ATOM 1256 CE3 TRP A 87 5.525 13.685 -0.303 1.00 30.40 C ATOM 1257 CZ2 TRP A 87 6.841 15.314 -2.186 1.00 41.34 C ATOM 1258 CZ3 TRP A 87 5.535 13.330 -1.660 1.00 24.30 C ATOM 1259 CH2 TRP A 87 6.216 14.124 -2.598 1.00 45.01 C ATOM 0 H TRP A 87 5.174 12.791 4.001 1.00 54.22 H new ATOM 0 HA TRP A 87 7.556 14.329 3.123 1.00 61.11 H new ATOM 0 HB2 TRP A 87 4.768 14.385 2.494 1.00 4.44 H new ATOM 0 HB3 TRP A 87 5.200 15.893 3.274 1.00 4.44 H new ATOM 0 HD1 TRP A 87 6.977 17.490 1.942 1.00 30.53 H new ATOM 0 HE1 TRP A 87 7.650 17.608 -0.551 1.00 51.42 H new ATOM 0 HE3 TRP A 87 5.053 13.030 0.414 1.00 30.40 H new ATOM 0 HZ2 TRP A 87 7.377 15.925 -2.897 1.00 41.34 H new ATOM 0 HZ3 TRP A 87 5.016 12.441 -1.986 1.00 24.30 H new ATOM 0 HH2 TRP A 87 6.259 13.821 -3.634 1.00 45.01 H new ATOM 1269 N SER A 88 6.894 16.281 5.033 1.00 63.33 N ATOM 1270 CA SER A 88 6.969 17.137 6.207 1.00 13.13 C ATOM 1271 C SER A 88 5.707 16.986 7.070 1.00 10.23 C ATOM 1272 O SER A 88 4.763 17.775 6.983 1.00 52.45 O ATOM 1273 CB SER A 88 7.222 18.580 5.739 1.00 4.30 C ATOM 1274 OG SER A 88 6.477 18.884 4.563 1.00 31.33 O ATOM 0 H SER A 88 6.928 16.822 4.169 1.00 63.33 H new ATOM 0 HA SER A 88 7.798 16.843 6.850 1.00 13.13 H new ATOM 0 HB2 SER A 88 6.950 19.275 6.534 1.00 4.30 H new ATOM 0 HB3 SER A 88 8.285 18.720 5.544 1.00 4.30 H new ATOM 0 HG SER A 88 6.657 19.808 4.291 1.00 31.33 H new ATOM 1279 N GLY A 89 5.696 15.939 7.889 1.00 54.23 N ATOM 1280 CA GLY A 89 4.666 15.600 8.857 1.00 44.22 C ATOM 1281 C GLY A 89 3.661 14.602 8.309 1.00 34.14 C ATOM 1282 O GLY A 89 3.308 13.658 9.017 1.00 51.35 O ATOM 0 H GLY A 89 6.459 15.262 7.892 1.00 54.23 H new ATOM 0 HA2 GLY A 89 5.133 15.187 9.751 1.00 44.22 H new ATOM 0 HA3 GLY A 89 4.144 16.507 9.161 1.00 44.22 H new ATOM 1286 N TYR A 90 3.237 14.744 7.056 1.00 53.05 N ATOM 1287 CA TYR A 90 2.211 13.913 6.437 1.00 73.31 C ATOM 1288 C TYR A 90 2.621 13.537 5.030 1.00 21.33 C ATOM 1289 O TYR A 90 3.428 14.253 4.442 1.00 24.42 O ATOM 1290 CB TYR A 90 0.786 14.520 6.506 1.00 51.35 C ATOM 1291 CG TYR A 90 0.639 16.025 6.645 1.00 4.20 C ATOM 1292 CD1 TYR A 90 1.554 16.908 6.048 1.00 3.23 C ATOM 1293 CD2 TYR A 90 -0.403 16.543 7.445 1.00 33.30 C ATOM 1294 CE1 TYR A 90 1.512 18.275 6.353 1.00 34.52 C ATOM 1295 CE2 TYR A 90 -0.486 17.926 7.693 1.00 53.43 C ATOM 1296 CZ TYR A 90 0.479 18.802 7.161 1.00 65.41 C ATOM 1297 OH TYR A 90 0.405 20.139 7.399 1.00 52.25 O ATOM 0 H TYR A 90 3.607 15.458 6.429 1.00 53.05 H new ATOM 0 HA TYR A 90 2.140 13.000 7.028 1.00 73.31 H new ATOM 0 HB2 TYR A 90 0.254 14.218 5.604 1.00 51.35 H new ATOM 0 HB3 TYR A 90 0.271 14.059 7.349 1.00 51.35 H new ATOM 0 HD1 TYR A 90 2.291 16.533 5.353 1.00 3.23 H new ATOM 0 HD2 TYR A 90 -1.139 15.875 7.868 1.00 33.30 H new ATOM 0 HE1 TYR A 90 2.277 18.933 5.967 1.00 34.52 H new ATOM 0 HE2 TYR A 90 -1.294 18.317 8.294 1.00 53.43 H new ATOM 0 HH TYR A 90 -0.367 20.327 7.973 1.00 52.25 H new ATOM 1306 N PRO A 91 2.115 12.429 4.476 1.00 61.11 N ATOM 1307 CA PRO A 91 2.325 12.101 3.079 1.00 62.44 C ATOM 1308 C PRO A 91 1.542 13.071 2.199 1.00 2.24 C ATOM 1309 O PRO A 91 0.624 13.759 2.648 1.00 54.13 O ATOM 1310 CB PRO A 91 1.807 10.674 2.927 1.00 2.40 C ATOM 1311 CG PRO A 91 0.673 10.623 3.950 1.00 30.14 C ATOM 1312 CD PRO A 91 1.265 11.424 5.102 1.00 4.00 C ATOM 0 HA PRO A 91 3.370 12.178 2.778 1.00 62.44 H new ATOM 0 HB2 PRO A 91 1.451 10.477 1.916 1.00 2.40 H new ATOM 0 HB3 PRO A 91 2.580 9.937 3.141 1.00 2.40 H new ATOM 0 HG2 PRO A 91 -0.244 11.071 3.568 1.00 30.14 H new ATOM 0 HG3 PRO A 91 0.431 9.601 4.243 1.00 30.14 H new ATOM 0 HD2 PRO A 91 0.482 11.889 5.701 1.00 4.00 H new ATOM 0 HD3 PRO A 91 1.840 10.784 5.771 1.00 4.00 H new ATOM 1317 N ALA A 92 1.828 13.028 0.903 1.00 33.54 N ATOM 1318 CA ALA A 92 1.195 13.851 -0.119 1.00 70.43 C ATOM 1319 C ALA A 92 -0.246 13.400 -0.471 1.00 51.31 C ATOM 1320 O ALA A 92 -0.699 13.560 -1.603 1.00 42.43 O ATOM 1321 CB ALA A 92 2.116 13.799 -1.326 1.00 63.22 C ATOM 0 H ALA A 92 2.532 12.396 0.522 1.00 33.54 H new ATOM 0 HA ALA A 92 1.068 14.870 0.247 1.00 70.43 H new ATOM 0 HB1 ALA A 92 1.694 14.400 -2.132 1.00 63.22 H new ATOM 0 HB2 ALA A 92 3.095 14.193 -1.054 1.00 63.22 H new ATOM 0 HB3 ALA A 92 2.220 12.767 -1.660 1.00 63.22 H new ATOM 1327 N THR A 93 -0.889 12.673 0.447 1.00 22.42 N ATOM 1328 CA THR A 93 -2.114 11.890 0.301 1.00 53.41 C ATOM 1329 C THR A 93 -2.145 11.066 -1.012 1.00 65.41 C ATOM 1330 O THR A 93 -3.150 11.121 -1.719 1.00 2.12 O ATOM 1331 CB THR A 93 -3.370 12.771 0.521 1.00 23.51 C ATOM 1332 OG1 THR A 93 -3.498 13.761 -0.473 1.00 65.43 O ATOM 1333 CG2 THR A 93 -3.374 13.490 1.877 1.00 52.45 C ATOM 0 H THR A 93 -0.529 12.614 1.400 1.00 22.42 H new ATOM 0 HA THR A 93 -2.124 11.141 1.092 1.00 53.41 H new ATOM 0 HB THR A 93 -4.204 12.070 0.479 1.00 23.51 H new ATOM 0 HG1 THR A 93 -4.447 13.952 -0.624 1.00 65.43 H new ATOM 0 HG21 THR A 93 -4.280 14.090 1.968 1.00 52.45 H new ATOM 0 HG22 THR A 93 -3.344 12.753 2.680 1.00 52.45 H new ATOM 0 HG23 THR A 93 -2.501 14.139 1.947 1.00 52.45 H new ATOM 1341 N PRO A 94 -1.127 10.234 -1.328 1.00 72.23 N ATOM 1342 CA PRO A 94 -1.163 9.369 -2.503 1.00 33.34 C ATOM 1343 C PRO A 94 -2.251 8.302 -2.352 1.00 24.41 C ATOM 1344 O PRO A 94 -3.112 8.136 -3.215 1.00 42.14 O ATOM 1345 CB PRO A 94 0.255 8.775 -2.632 1.00 1.21 C ATOM 1346 CG PRO A 94 0.851 8.915 -1.238 1.00 72.33 C ATOM 1347 CD PRO A 94 0.172 10.151 -0.683 1.00 44.02 C ATOM 0 HA PRO A 94 -1.422 9.911 -3.412 1.00 33.34 H new ATOM 0 HB2 PRO A 94 0.222 7.732 -2.947 1.00 1.21 H new ATOM 0 HB3 PRO A 94 0.846 9.314 -3.373 1.00 1.21 H new ATOM 0 HG2 PRO A 94 0.648 8.037 -0.625 1.00 72.33 H new ATOM 0 HG3 PRO A 94 1.934 9.035 -1.275 1.00 72.33 H new ATOM 0 HD2 PRO A 94 0.064 10.081 0.399 1.00 44.02 H new ATOM 0 HD3 PRO A 94 0.764 11.043 -0.887 1.00 44.02 H new ATOM 1352 N ILE A 95 -2.224 7.533 -1.262 1.00 72.04 N ATOM 1353 CA ILE A 95 -2.973 6.278 -1.168 1.00 71.11 C ATOM 1354 C ILE A 95 -4.480 6.536 -1.014 1.00 63.33 C ATOM 1355 O ILE A 95 -5.279 5.655 -1.323 1.00 53.21 O ATOM 1356 CB ILE A 95 -2.355 5.394 -0.056 1.00 14.11 C ATOM 1357 CG1 ILE A 95 -0.813 5.282 -0.167 1.00 61.34 C ATOM 1358 CG2 ILE A 95 -2.947 3.976 -0.022 1.00 44.52 C ATOM 1359 CD1 ILE A 95 -0.279 4.950 -1.572 1.00 64.44 C ATOM 0 H ILE A 95 -1.687 7.760 -0.425 1.00 72.04 H new ATOM 0 HA ILE A 95 -2.886 5.717 -2.099 1.00 71.11 H new ATOM 0 HB ILE A 95 -2.610 5.907 0.872 1.00 14.11 H new ATOM 0 HG12 ILE A 95 -0.372 6.224 0.158 1.00 61.34 H new ATOM 0 HG13 ILE A 95 -0.470 4.513 0.526 1.00 61.34 H new ATOM 0 HG21 ILE A 95 -2.475 3.404 0.777 1.00 44.52 H new ATOM 0 HG22 ILE A 95 -4.020 4.034 0.158 1.00 44.52 H new ATOM 0 HG23 ILE A 95 -2.766 3.483 -0.977 1.00 44.52 H new ATOM 0 HD11 ILE A 95 0.809 4.894 -1.544 1.00 64.44 H new ATOM 0 HD12 ILE A 95 -0.683 3.992 -1.898 1.00 64.44 H new ATOM 0 HD13 ILE A 95 -0.584 5.729 -2.271 1.00 64.44 H new ATOM 1370 N LYS A 96 -4.873 7.760 -0.643 1.00 23.32 N ATOM 1371 CA LYS A 96 -6.250 8.210 -0.526 1.00 13.32 C ATOM 1372 C LYS A 96 -7.066 7.838 -1.765 1.00 63.22 C ATOM 1373 O LYS A 96 -8.119 7.223 -1.625 1.00 54.25 O ATOM 1374 CB LYS A 96 -6.226 9.724 -0.247 1.00 24.23 C ATOM 1375 CG LYS A 96 -7.608 10.370 -0.105 1.00 50.04 C ATOM 1376 CD LYS A 96 -8.504 9.601 0.873 1.00 62.33 C ATOM 1377 CE LYS A 96 -9.591 10.486 1.477 1.00 42.04 C ATOM 1378 NZ LYS A 96 -10.559 9.673 2.237 1.00 52.13 N ATOM 0 H LYS A 96 -4.203 8.492 -0.407 1.00 23.32 H new ATOM 0 HA LYS A 96 -6.751 7.708 0.302 1.00 13.32 H new ATOM 0 HB2 LYS A 96 -5.661 9.902 0.668 1.00 24.23 H new ATOM 0 HB3 LYS A 96 -5.689 10.220 -1.055 1.00 24.23 H new ATOM 0 HG2 LYS A 96 -7.494 11.398 0.239 1.00 50.04 H new ATOM 0 HG3 LYS A 96 -8.090 10.413 -1.082 1.00 50.04 H new ATOM 0 HD2 LYS A 96 -8.968 8.761 0.355 1.00 62.33 H new ATOM 0 HD3 LYS A 96 -7.892 9.184 1.672 1.00 62.33 H new ATOM 0 HE2 LYS A 96 -9.139 11.230 2.133 1.00 42.04 H new ATOM 0 HE3 LYS A 96 -10.107 11.030 0.685 1.00 42.04 H new ATOM 0 HZ1 LYS A 96 -11.075 10.281 2.904 1.00 52.13 H new ATOM 0 HZ2 LYS A 96 -11.232 9.230 1.580 1.00 52.13 H new ATOM 0 HZ3 LYS A 96 -10.053 8.933 2.764 1.00 52.13 H new ATOM 1388 N THR A 97 -6.572 8.172 -2.952 1.00 32.20 N ATOM 1389 CA THR A 97 -7.256 7.917 -4.208 1.00 13.22 C ATOM 1390 C THR A 97 -7.487 6.415 -4.405 1.00 73.25 C ATOM 1391 O THR A 97 -8.620 5.977 -4.585 1.00 22.44 O ATOM 1392 CB THR A 97 -6.443 8.556 -5.345 1.00 2.11 C ATOM 1393 OG1 THR A 97 -5.937 9.810 -4.909 1.00 30.42 O ATOM 1394 CG2 THR A 97 -7.303 8.720 -6.595 1.00 33.02 C ATOM 0 H THR A 97 -5.670 8.635 -3.067 1.00 32.20 H new ATOM 0 HA THR A 97 -8.247 8.371 -4.204 1.00 13.22 H new ATOM 0 HB THR A 97 -5.608 7.905 -5.603 1.00 2.11 H new ATOM 0 HG1 THR A 97 -5.568 10.298 -5.675 1.00 30.42 H new ATOM 0 HG21 THR A 97 -6.709 9.174 -7.388 1.00 33.02 H new ATOM 0 HG22 THR A 97 -7.659 7.743 -6.922 1.00 33.02 H new ATOM 0 HG23 THR A 97 -8.156 9.360 -6.369 1.00 33.02 H new ATOM 1402 N LEU A 98 -6.428 5.604 -4.313 1.00 41.24 N ATOM 1403 CA LEU A 98 -6.515 4.165 -4.539 1.00 71.22 C ATOM 1404 C LEU A 98 -7.520 3.504 -3.591 1.00 54.32 C ATOM 1405 O LEU A 98 -8.288 2.648 -4.024 1.00 22.23 O ATOM 1406 CB LEU A 98 -5.115 3.548 -4.398 1.00 43.25 C ATOM 1407 CG LEU A 98 -5.054 2.038 -4.690 1.00 33.12 C ATOM 1408 CD1 LEU A 98 -5.423 1.725 -6.143 1.00 41.31 C ATOM 1409 CD2 LEU A 98 -3.629 1.543 -4.414 1.00 71.35 C ATOM 0 H LEU A 98 -5.490 5.930 -4.080 1.00 41.24 H new ATOM 0 HA LEU A 98 -6.882 3.986 -5.550 1.00 71.22 H new ATOM 0 HB2 LEU A 98 -4.434 4.064 -5.074 1.00 43.25 H new ATOM 0 HB3 LEU A 98 -4.754 3.725 -3.385 1.00 43.25 H new ATOM 0 HG LEU A 98 -5.775 1.534 -4.046 1.00 33.12 H new ATOM 0 HD11 LEU A 98 -5.368 0.649 -6.309 1.00 41.31 H new ATOM 0 HD12 LEU A 98 -6.437 2.072 -6.344 1.00 41.31 H new ATOM 0 HD13 LEU A 98 -4.727 2.231 -6.812 1.00 41.31 H new ATOM 0 HD21 LEU A 98 -3.570 0.474 -4.617 1.00 71.35 H new ATOM 0 HD22 LEU A 98 -2.928 2.074 -5.058 1.00 71.35 H new ATOM 0 HD23 LEU A 98 -3.375 1.729 -3.371 1.00 71.35 H new ATOM 1420 N LEU A 99 -7.549 3.910 -2.317 1.00 22.01 N ATOM 1421 CA LEU A 99 -8.455 3.370 -1.298 1.00 13.51 C ATOM 1422 C LEU A 99 -9.921 3.542 -1.686 1.00 34.04 C ATOM 1423 O LEU A 99 -10.738 2.669 -1.400 1.00 10.11 O ATOM 1424 CB LEU A 99 -8.225 4.086 0.043 1.00 32.30 C ATOM 1425 CG LEU A 99 -6.951 3.613 0.757 1.00 52.32 C ATOM 1426 CD1 LEU A 99 -6.485 4.675 1.758 1.00 13.43 C ATOM 1427 CD2 LEU A 99 -7.213 2.295 1.486 1.00 65.15 C ATOM 0 H LEU A 99 -6.931 4.638 -1.958 1.00 22.01 H new ATOM 0 HA LEU A 99 -8.238 2.305 -1.212 1.00 13.51 H new ATOM 0 HB2 LEU A 99 -8.162 5.160 -0.130 1.00 32.30 H new ATOM 0 HB3 LEU A 99 -9.084 3.917 0.692 1.00 32.30 H new ATOM 0 HG LEU A 99 -6.170 3.457 0.012 1.00 52.32 H new ATOM 0 HD11 LEU A 99 -5.581 4.330 2.260 1.00 13.43 H new ATOM 0 HD12 LEU A 99 -6.275 5.605 1.230 1.00 13.43 H new ATOM 0 HD13 LEU A 99 -7.267 4.846 2.498 1.00 13.43 H new ATOM 0 HD21 LEU A 99 -6.302 1.970 1.988 1.00 65.15 H new ATOM 0 HD22 LEU A 99 -8.003 2.438 2.223 1.00 65.15 H new ATOM 0 HD23 LEU A 99 -7.521 1.536 0.767 1.00 65.15 H new ATOM 1438 N ASP A 100 -10.265 4.651 -2.342 1.00 25.04 N ATOM 1439 CA ASP A 100 -11.631 4.913 -2.789 1.00 74.40 C ATOM 1440 C ASP A 100 -12.096 3.869 -3.811 1.00 4.13 C ATOM 1441 O ASP A 100 -13.279 3.518 -3.880 1.00 21.02 O ATOM 1442 CB ASP A 100 -11.695 6.311 -3.411 1.00 25.44 C ATOM 1443 CG ASP A 100 -13.113 6.650 -3.844 1.00 32.24 C ATOM 1444 OD1 ASP A 100 -14.001 6.700 -2.955 1.00 74.20 O ATOM 1445 OD2 ASP A 100 -13.312 6.889 -5.053 1.00 63.40 O ATOM 0 H ASP A 100 -9.604 5.391 -2.578 1.00 25.04 H new ATOM 0 HA ASP A 100 -12.295 4.854 -1.926 1.00 74.40 H new ATOM 0 HB2 ASP A 100 -11.344 7.050 -2.691 1.00 25.44 H new ATOM 0 HB3 ASP A 100 -11.026 6.362 -4.270 1.00 25.44 H new ATOM 1449 N GLN A 101 -11.150 3.348 -4.588 1.00 4.25 N ATOM 1450 CA GLN A 101 -11.396 2.418 -5.678 1.00 51.32 C ATOM 1451 C GLN A 101 -11.472 1.014 -5.095 1.00 1.15 C ATOM 1452 O GLN A 101 -12.507 0.356 -5.186 1.00 51.52 O ATOM 1453 CB GLN A 101 -10.287 2.562 -6.735 1.00 64.31 C ATOM 1454 CG GLN A 101 -10.274 3.979 -7.336 1.00 25.31 C ATOM 1455 CD GLN A 101 -9.065 4.261 -8.219 1.00 31.15 C ATOM 1456 OE1 GLN A 101 -8.386 3.354 -8.699 1.00 4.32 O ATOM 1457 NE2 GLN A 101 -8.764 5.532 -8.441 1.00 21.02 N ATOM 0 H GLN A 101 -10.162 3.571 -4.470 1.00 4.25 H new ATOM 0 HA GLN A 101 -12.340 2.631 -6.179 1.00 51.32 H new ATOM 0 HB2 GLN A 101 -9.319 2.347 -6.282 1.00 64.31 H new ATOM 0 HB3 GLN A 101 -10.438 1.829 -7.527 1.00 64.31 H new ATOM 0 HG2 GLN A 101 -11.182 4.123 -7.922 1.00 25.31 H new ATOM 0 HG3 GLN A 101 -10.298 4.708 -6.526 1.00 25.31 H new ATOM 0 HE21 GLN A 101 -9.338 6.271 -8.035 1.00 21.02 H new ATOM 0 HE22 GLN A 101 -7.958 5.772 -9.018 1.00 21.02 H new ATOM 1464 N MET A 102 -10.403 0.579 -4.419 1.00 33.01 N ATOM 1465 CA MET A 102 -10.268 -0.756 -3.847 1.00 62.02 C ATOM 1466 C MET A 102 -11.211 -1.045 -2.668 1.00 43.33 C ATOM 1467 O MET A 102 -11.146 -2.139 -2.120 1.00 64.23 O ATOM 1468 CB MET A 102 -8.800 -1.046 -3.492 1.00 23.31 C ATOM 1469 CG MET A 102 -8.154 -0.129 -2.469 1.00 1.44 C ATOM 1470 SD MET A 102 -8.227 -0.698 -0.749 1.00 62.34 S ATOM 1471 CE MET A 102 -7.075 -2.104 -0.816 1.00 22.42 C ATOM 0 H MET A 102 -9.586 1.167 -4.252 1.00 33.01 H new ATOM 0 HA MET A 102 -10.588 -1.449 -4.626 1.00 62.02 H new ATOM 0 HB2 MET A 102 -8.735 -2.069 -3.122 1.00 23.31 H new ATOM 0 HB3 MET A 102 -8.212 -1.001 -4.409 1.00 23.31 H new ATOM 0 HG2 MET A 102 -7.108 0.011 -2.742 1.00 1.44 H new ATOM 0 HG3 MET A 102 -8.633 0.848 -2.530 1.00 1.44 H new ATOM 0 HE1 MET A 102 -6.786 -2.386 0.196 1.00 22.42 H new ATOM 0 HE2 MET A 102 -7.560 -2.949 -1.304 1.00 22.42 H new ATOM 0 HE3 MET A 102 -6.187 -1.820 -1.381 1.00 22.42 H new ATOM 1479 N LYS A 103 -12.121 -0.129 -2.304 1.00 44.40 N ATOM 1480 CA LYS A 103 -12.953 -0.139 -1.102 1.00 22.45 C ATOM 1481 C LYS A 103 -13.582 -1.491 -0.779 1.00 33.44 C ATOM 1482 O LYS A 103 -13.674 -1.867 0.385 1.00 44.40 O ATOM 1483 CB LYS A 103 -14.006 0.984 -1.274 1.00 45.34 C ATOM 1484 CG LYS A 103 -15.232 0.909 -0.351 1.00 65.22 C ATOM 1485 CD LYS A 103 -14.916 1.054 1.146 1.00 13.45 C ATOM 1486 CE LYS A 103 -14.672 2.500 1.587 1.00 25.31 C ATOM 1487 NZ LYS A 103 -15.896 3.326 1.525 1.00 22.05 N ATOM 0 H LYS A 103 -12.304 0.691 -2.883 1.00 44.40 H new ATOM 0 HA LYS A 103 -12.323 0.047 -0.232 1.00 22.45 H new ATOM 0 HB2 LYS A 103 -13.514 1.943 -1.113 1.00 45.34 H new ATOM 0 HB3 LYS A 103 -14.353 0.973 -2.307 1.00 45.34 H new ATOM 0 HG2 LYS A 103 -15.935 1.691 -0.638 1.00 65.22 H new ATOM 0 HG3 LYS A 103 -15.734 -0.045 -0.512 1.00 65.22 H new ATOM 0 HD2 LYS A 103 -15.743 0.642 1.724 1.00 13.45 H new ATOM 0 HD3 LYS A 103 -14.034 0.458 1.381 1.00 13.45 H new ATOM 0 HE2 LYS A 103 -14.286 2.505 2.606 1.00 25.31 H new ATOM 0 HE3 LYS A 103 -13.905 2.945 0.953 1.00 25.31 H new ATOM 0 HZ1 LYS A 103 -15.732 4.227 2.018 1.00 22.05 H new ATOM 0 HZ2 LYS A 103 -16.138 3.515 0.531 1.00 22.05 H new ATOM 0 HZ3 LYS A 103 -16.681 2.819 1.982 1.00 22.05 H new ATOM 1497 N ASN A 104 -14.000 -2.227 -1.800 1.00 65.20 N ATOM 1498 CA ASN A 104 -14.657 -3.526 -1.671 1.00 63.02 C ATOM 1499 C ASN A 104 -13.749 -4.675 -1.192 1.00 63.42 C ATOM 1500 O ASN A 104 -14.249 -5.792 -1.057 1.00 25.41 O ATOM 1501 CB ASN A 104 -15.316 -3.894 -3.009 1.00 42.31 C ATOM 1502 CG ASN A 104 -14.288 -4.253 -4.069 1.00 53.33 C ATOM 1503 OD1 ASN A 104 -13.680 -5.312 -4.027 1.00 2.53 O ATOM 1504 ND2 ASN A 104 -14.010 -3.378 -5.018 1.00 61.32 N ATOM 0 H ASN A 104 -13.889 -1.931 -2.770 1.00 65.20 H new ATOM 0 HA ASN A 104 -15.399 -3.409 -0.882 1.00 63.02 H new ATOM 0 HB2 ASN A 104 -15.993 -4.735 -2.861 1.00 42.31 H new ATOM 0 HB3 ASN A 104 -15.920 -3.057 -3.358 1.00 42.31 H new ATOM 0 HD21 ASN A 104 -13.291 -3.588 -5.711 1.00 61.32 H new ATOM 0 HD22 ASN A 104 -14.514 -2.492 -5.058 1.00 61.32 H new ATOM 1510 N TYR A 105 -12.450 -4.435 -1.005 1.00 14.52 N ATOM 1511 CA TYR A 105 -11.416 -5.424 -0.702 1.00 23.23 C ATOM 1512 C TYR A 105 -11.686 -6.192 0.611 1.00 12.13 C ATOM 1513 O TYR A 105 -12.575 -5.872 1.405 1.00 70.10 O ATOM 1514 CB TYR A 105 -10.057 -4.677 -0.704 1.00 30.14 C ATOM 1515 CG TYR A 105 -8.808 -5.485 -0.405 1.00 63.40 C ATOM 1516 CD1 TYR A 105 -8.346 -6.446 -1.321 1.00 52.22 C ATOM 1517 CD2 TYR A 105 -8.101 -5.276 0.792 1.00 31.03 C ATOM 1518 CE1 TYR A 105 -7.264 -7.283 -0.993 1.00 64.14 C ATOM 1519 CE2 TYR A 105 -6.998 -6.082 1.110 1.00 33.43 C ATOM 1520 CZ TYR A 105 -6.594 -7.109 0.237 1.00 30.05 C ATOM 1521 OH TYR A 105 -5.548 -7.898 0.589 1.00 25.25 O ATOM 0 H TYR A 105 -12.070 -3.490 -1.065 1.00 14.52 H new ATOM 0 HA TYR A 105 -11.410 -6.206 -1.461 1.00 23.23 H new ATOM 0 HB2 TYR A 105 -9.930 -4.214 -1.682 1.00 30.14 H new ATOM 0 HB3 TYR A 105 -10.117 -3.870 0.026 1.00 30.14 H new ATOM 0 HD1 TYR A 105 -8.825 -6.542 -2.284 1.00 52.22 H new ATOM 0 HD2 TYR A 105 -8.408 -4.492 1.469 1.00 31.03 H new ATOM 0 HE1 TYR A 105 -6.948 -8.055 -1.679 1.00 64.14 H new ATOM 0 HE2 TYR A 105 -6.456 -5.914 2.029 1.00 33.43 H new ATOM 0 HH TYR A 105 -5.884 -8.740 0.962 1.00 25.25 H new ATOM 1530 N ARG A 106 -10.865 -7.217 0.851 1.00 42.23 N ATOM 1531 CA ARG A 106 -10.521 -7.820 2.143 1.00 4.43 C ATOM 1532 C ARG A 106 -9.971 -6.745 3.096 1.00 45.12 C ATOM 1533 O ARG A 106 -10.220 -5.549 2.953 1.00 24.04 O ATOM 1534 CB ARG A 106 -9.448 -8.897 1.857 1.00 11.52 C ATOM 1535 CG ARG A 106 -9.945 -10.161 1.163 1.00 74.33 C ATOM 1536 CD ARG A 106 -10.218 -11.293 2.150 1.00 61.23 C ATOM 1537 NE ARG A 106 -10.109 -12.574 1.451 1.00 21.34 N ATOM 1538 CZ ARG A 106 -10.740 -13.707 1.725 1.00 10.53 C ATOM 1539 NH1 ARG A 106 -11.663 -13.761 2.685 1.00 33.15 N ATOM 1540 NH2 ARG A 106 -10.474 -14.764 0.976 1.00 24.02 N ATOM 0 H ARG A 106 -10.383 -7.686 0.084 1.00 42.23 H new ATOM 0 HA ARG A 106 -11.395 -8.263 2.621 1.00 4.43 H new ATOM 0 HB2 ARG A 106 -8.667 -8.450 1.242 1.00 11.52 H new ATOM 0 HB3 ARG A 106 -8.985 -9.182 2.802 1.00 11.52 H new ATOM 0 HG2 ARG A 106 -10.857 -9.935 0.611 1.00 74.33 H new ATOM 0 HG3 ARG A 106 -9.204 -10.488 0.434 1.00 74.33 H new ATOM 0 HD2 ARG A 106 -9.506 -11.253 2.975 1.00 61.23 H new ATOM 0 HD3 ARG A 106 -11.213 -11.184 2.582 1.00 61.23 H new ATOM 0 HE ARG A 106 -9.470 -12.598 0.656 1.00 21.34 H new ATOM 0 HH11 ARG A 106 -11.892 -12.923 3.220 1.00 33.15 H new ATOM 0 HH12 ARG A 106 -12.140 -14.640 2.885 1.00 33.15 H new ATOM 0 HH21 ARG A 106 -9.800 -14.692 0.214 1.00 24.02 H new ATOM 0 HH22 ARG A 106 -10.943 -15.651 1.161 1.00 24.02 H new ATOM 1551 N GLY A 107 -9.163 -7.155 4.066 1.00 4.33 N ATOM 1552 CA GLY A 107 -8.206 -6.269 4.681 1.00 3.51 C ATOM 1553 C GLY A 107 -7.114 -7.103 5.305 1.00 50.43 C ATOM 1554 O GLY A 107 -7.205 -7.416 6.490 1.00 45.10 O ATOM 0 H GLY A 107 -9.159 -8.104 4.440 1.00 4.33 H new ATOM 0 HA2 GLY A 107 -7.787 -5.590 3.939 1.00 3.51 H new ATOM 0 HA3 GLY A 107 -8.692 -5.653 5.438 1.00 3.51 H new ATOM 1558 N GLU A 108 -6.098 -7.465 4.531 1.00 23.11 N ATOM 1559 CA GLU A 108 -4.789 -7.793 5.047 1.00 65.13 C ATOM 1560 C GLU A 108 -3.875 -6.923 4.189 1.00 1.52 C ATOM 1561 O GLU A 108 -3.816 -7.082 2.971 1.00 33.10 O ATOM 1562 CB GLU A 108 -4.465 -9.285 4.944 1.00 30.32 C ATOM 1563 CG GLU A 108 -5.399 -10.159 5.788 1.00 14.35 C ATOM 1564 CD GLU A 108 -5.146 -11.651 5.560 1.00 25.32 C ATOM 1565 OE1 GLU A 108 -3.966 -12.082 5.650 1.00 11.23 O ATOM 1566 OE2 GLU A 108 -6.127 -12.407 5.383 1.00 14.33 O ATOM 0 H GLU A 108 -6.168 -7.538 3.516 1.00 23.11 H new ATOM 0 HA GLU A 108 -4.686 -7.601 6.115 1.00 65.13 H new ATOM 0 HB2 GLU A 108 -4.531 -9.594 3.901 1.00 30.32 H new ATOM 0 HB3 GLU A 108 -3.436 -9.451 5.262 1.00 30.32 H new ATOM 0 HG2 GLU A 108 -5.260 -9.924 6.843 1.00 14.35 H new ATOM 0 HG3 GLU A 108 -6.435 -9.925 5.543 1.00 14.35 H new ATOM 1571 N VAL A 109 -3.295 -5.905 4.804 1.00 33.02 N ATOM 1572 CA VAL A 109 -2.568 -4.811 4.208 1.00 62.04 C ATOM 1573 C VAL A 109 -1.571 -4.373 5.271 1.00 5.43 C ATOM 1574 O VAL A 109 -1.983 -4.065 6.390 1.00 10.52 O ATOM 1575 CB VAL A 109 -3.521 -3.641 3.876 1.00 1.13 C ATOM 1576 CG1 VAL A 109 -2.739 -2.439 3.323 1.00 42.12 C ATOM 1577 CG2 VAL A 109 -4.632 -4.012 2.886 1.00 73.41 C ATOM 0 H VAL A 109 -3.327 -5.822 5.820 1.00 33.02 H new ATOM 0 HA VAL A 109 -2.085 -5.108 3.277 1.00 62.04 H new ATOM 0 HB VAL A 109 -4.000 -3.382 4.820 1.00 1.13 H new ATOM 0 HG11 VAL A 109 -3.431 -1.628 3.097 1.00 42.12 H new ATOM 0 HG12 VAL A 109 -2.016 -2.102 4.066 1.00 42.12 H new ATOM 0 HG13 VAL A 109 -2.215 -2.733 2.414 1.00 42.12 H new ATOM 0 HG21 VAL A 109 -5.261 -3.141 2.701 1.00 73.41 H new ATOM 0 HG22 VAL A 109 -4.187 -4.344 1.948 1.00 73.41 H new ATOM 0 HG23 VAL A 109 -5.239 -4.815 3.304 1.00 73.41 H new ATOM 1587 N ALA A 110 -0.281 -4.312 4.960 1.00 50.31 N ATOM 1588 CA ALA A 110 0.650 -3.560 5.789 1.00 72.15 C ATOM 1589 C ALA A 110 1.083 -2.314 5.029 1.00 23.04 C ATOM 1590 O ALA A 110 0.826 -2.187 3.829 1.00 61.34 O ATOM 1591 CB ALA A 110 1.826 -4.426 6.218 1.00 24.33 C ATOM 0 H ALA A 110 0.139 -4.768 4.150 1.00 50.31 H new ATOM 0 HA ALA A 110 0.161 -3.247 6.711 1.00 72.15 H new ATOM 0 HB1 ALA A 110 2.505 -3.838 6.836 1.00 24.33 H new ATOM 0 HB2 ALA A 110 1.460 -5.278 6.791 1.00 24.33 H new ATOM 0 HB3 ALA A 110 2.356 -4.783 5.335 1.00 24.33 H new ATOM 1597 N SER A 111 1.704 -1.381 5.742 1.00 23.41 N ATOM 1598 CA SER A 111 1.944 -0.035 5.271 1.00 62.01 C ATOM 1599 C SER A 111 3.355 0.352 5.703 1.00 34.30 C ATOM 1600 O SER A 111 3.715 0.168 6.871 1.00 70.22 O ATOM 1601 CB SER A 111 0.826 0.853 5.840 1.00 22.02 C ATOM 1602 OG SER A 111 0.502 1.946 5.008 1.00 13.51 O ATOM 0 H SER A 111 2.060 -1.550 6.683 1.00 23.41 H new ATOM 0 HA SER A 111 1.909 0.075 4.187 1.00 62.01 H new ATOM 0 HB2 SER A 111 -0.066 0.247 5.995 1.00 22.02 H new ATOM 0 HB3 SER A 111 1.131 1.227 6.817 1.00 22.02 H new ATOM 0 HG SER A 111 -0.215 2.471 5.422 1.00 13.51 H new ATOM 1607 N PHE A 112 4.184 0.832 4.775 1.00 51.55 N ATOM 1608 CA PHE A 112 5.577 1.136 5.079 1.00 62.15 C ATOM 1609 C PHE A 112 6.054 2.396 4.362 1.00 51.21 C ATOM 1610 O PHE A 112 5.460 2.850 3.379 1.00 43.43 O ATOM 1611 CB PHE A 112 6.478 -0.072 4.766 1.00 3.33 C ATOM 1612 CG PHE A 112 7.069 -0.007 3.379 1.00 54.44 C ATOM 1613 CD1 PHE A 112 6.244 -0.181 2.259 1.00 33.23 C ATOM 1614 CD2 PHE A 112 8.415 0.350 3.198 1.00 25.41 C ATOM 1615 CE1 PHE A 112 6.766 0.000 0.973 1.00 73.24 C ATOM 1616 CE2 PHE A 112 8.928 0.535 1.907 1.00 32.04 C ATOM 1617 CZ PHE A 112 8.115 0.337 0.783 1.00 71.12 C ATOM 0 H PHE A 112 3.913 1.017 3.809 1.00 51.55 H new ATOM 0 HA PHE A 112 5.647 1.339 6.148 1.00 62.15 H new ATOM 0 HB2 PHE A 112 7.283 -0.120 5.499 1.00 3.33 H new ATOM 0 HB3 PHE A 112 5.899 -0.990 4.868 1.00 3.33 H new ATOM 0 HD1 PHE A 112 5.207 -0.454 2.388 1.00 33.23 H new ATOM 0 HD2 PHE A 112 9.057 0.482 4.056 1.00 25.41 H new ATOM 0 HE1 PHE A 112 6.122 -0.121 0.115 1.00 73.24 H new ATOM 0 HE2 PHE A 112 9.958 0.833 1.777 1.00 32.04 H new ATOM 0 HZ PHE A 112 8.520 0.442 -0.213 1.00 71.12 H new ATOM 1626 N PHE A 113 7.204 2.889 4.809 1.00 45.42 N ATOM 1627 CA PHE A 113 7.808 4.154 4.437 1.00 34.13 C ATOM 1628 C PHE A 113 9.275 3.881 4.192 1.00 45.43 C ATOM 1629 O PHE A 113 9.822 2.920 4.735 1.00 12.40 O ATOM 1630 CB PHE A 113 7.611 5.159 5.588 1.00 72.14 C ATOM 1631 CG PHE A 113 6.144 5.218 5.965 1.00 12.54 C ATOM 1632 CD1 PHE A 113 5.224 5.710 5.019 1.00 42.33 C ATOM 1633 CD2 PHE A 113 5.690 4.392 7.014 1.00 4.10 C ATOM 1634 CE1 PHE A 113 3.946 5.136 4.966 1.00 62.33 C ATOM 1635 CE2 PHE A 113 4.386 3.885 7.001 1.00 73.05 C ATOM 1636 CZ PHE A 113 3.535 4.206 5.936 1.00 64.14 C ATOM 0 H PHE A 113 7.773 2.379 5.485 1.00 45.42 H new ATOM 0 HA PHE A 113 7.355 4.580 3.542 1.00 34.13 H new ATOM 0 HB2 PHE A 113 8.207 4.861 6.451 1.00 72.14 H new ATOM 0 HB3 PHE A 113 7.959 6.147 5.286 1.00 72.14 H new ATOM 0 HD1 PHE A 113 5.497 6.512 4.349 1.00 42.33 H new ATOM 0 HD2 PHE A 113 6.352 4.149 7.832 1.00 4.10 H new ATOM 0 HE1 PHE A 113 3.270 5.412 4.171 1.00 62.33 H new ATOM 0 HE2 PHE A 113 4.039 3.252 7.804 1.00 73.05 H new ATOM 0 HZ PHE A 113 2.564 3.739 5.860 1.00 64.14 H new ATOM 1645 N THR A 114 9.908 4.755 3.420 1.00 72.45 N ATOM 1646 CA THR A 114 11.356 4.704 3.204 1.00 53.14 C ATOM 1647 C THR A 114 11.980 6.071 3.539 1.00 33.12 C ATOM 1648 O THR A 114 12.997 6.471 2.970 1.00 71.25 O ATOM 1649 CB THR A 114 11.646 4.186 1.782 1.00 22.44 C ATOM 1650 OG1 THR A 114 10.685 3.225 1.381 1.00 25.30 O ATOM 1651 CG2 THR A 114 12.990 3.469 1.702 1.00 61.31 C ATOM 0 H THR A 114 9.440 5.516 2.927 1.00 72.45 H new ATOM 0 HA THR A 114 11.834 3.994 3.879 1.00 53.14 H new ATOM 0 HB THR A 114 11.630 5.069 1.143 1.00 22.44 H new ATOM 0 HG1 THR A 114 11.142 2.424 1.049 1.00 25.30 H new ATOM 0 HG21 THR A 114 13.156 3.120 0.683 1.00 61.31 H new ATOM 0 HG22 THR A 114 13.787 4.157 1.984 1.00 61.31 H new ATOM 0 HG23 THR A 114 12.989 2.617 2.382 1.00 61.31 H new ATOM 1659 N SER A 115 11.340 6.824 4.443 1.00 14.14 N ATOM 1660 CA SER A 115 11.837 8.103 4.923 1.00 42.25 C ATOM 1661 C SER A 115 13.071 7.895 5.809 1.00 74.33 C ATOM 1662 O SER A 115 13.490 6.771 6.084 1.00 12.10 O ATOM 1663 CB SER A 115 10.730 8.844 5.689 1.00 5.20 C ATOM 1664 OG SER A 115 10.639 10.171 5.211 1.00 24.33 O ATOM 0 H SER A 115 10.451 6.551 4.862 1.00 14.14 H new ATOM 0 HA SER A 115 12.132 8.713 4.069 1.00 42.25 H new ATOM 0 HB2 SER A 115 9.777 8.332 5.559 1.00 5.20 H new ATOM 0 HB3 SER A 115 10.948 8.844 6.757 1.00 5.20 H new ATOM 0 HG SER A 115 10.185 10.728 5.877 1.00 24.33 H new ATOM 1669 N ALA A 116 13.590 8.985 6.368 1.00 53.33 N ATOM 1670 CA ALA A 116 14.613 8.949 7.400 1.00 70.13 C ATOM 1671 C ALA A 116 13.982 8.777 8.784 1.00 51.03 C ATOM 1672 O ALA A 116 14.568 9.168 9.793 1.00 41.14 O ATOM 1673 CB ALA A 116 15.463 10.208 7.310 1.00 31.50 C ATOM 0 H ALA A 116 13.305 9.930 6.111 1.00 53.33 H new ATOM 0 HA ALA A 116 15.262 8.088 7.243 1.00 70.13 H new ATOM 0 HB1 ALA A 116 16.231 10.184 8.083 1.00 31.50 H new ATOM 0 HB2 ALA A 116 15.936 10.258 6.329 1.00 31.50 H new ATOM 0 HB3 ALA A 116 14.831 11.085 7.453 1.00 31.50 H new ATOM 1679 N GLY A 117 12.788 8.187 8.865 1.00 24.54 N ATOM 1680 CA GLY A 117 12.191 7.821 10.137 1.00 11.20 C ATOM 1681 C GLY A 117 11.576 8.966 10.913 1.00 64.53 C ATOM 1682 O GLY A 117 11.126 8.790 12.048 1.00 22.34 O ATOM 0 H GLY A 117 12.216 7.954 8.053 1.00 24.54 H new ATOM 0 HA2 GLY A 117 11.421 7.071 9.956 1.00 11.20 H new ATOM 0 HA3 GLY A 117 12.955 7.352 10.757 1.00 11.20 H new ATOM 1686 N THR A 118 11.514 10.142 10.311 1.00 64.43 N ATOM 1687 CA THR A 118 10.776 11.253 10.856 1.00 25.24 C ATOM 1688 C THR A 118 9.310 11.101 10.479 1.00 65.35 C ATOM 1689 O THR A 118 8.974 10.479 9.468 1.00 50.31 O ATOM 1690 CB THR A 118 11.434 12.557 10.375 1.00 65.55 C ATOM 1691 OG1 THR A 118 12.038 12.453 9.088 1.00 64.33 O ATOM 1692 CG2 THR A 118 12.563 12.822 11.364 1.00 41.13 C ATOM 0 H THR A 118 11.979 10.347 9.426 1.00 64.43 H new ATOM 0 HA THR A 118 10.803 11.280 11.945 1.00 25.24 H new ATOM 0 HB THR A 118 10.670 13.332 10.314 1.00 65.55 H new ATOM 0 HG1 THR A 118 12.435 13.315 8.842 1.00 64.33 H new ATOM 0 HG21 THR A 118 13.082 13.740 11.087 1.00 41.13 H new ATOM 0 HG22 THR A 118 12.150 12.928 12.367 1.00 41.13 H new ATOM 0 HG23 THR A 118 13.265 11.989 11.346 1.00 41.13 H new ATOM 1700 N ASN A 119 8.432 11.680 11.298 1.00 4.02 N ATOM 1701 CA ASN A 119 6.992 11.782 11.074 1.00 25.24 C ATOM 1702 C ASN A 119 6.287 10.418 11.043 1.00 65.12 C ATOM 1703 O ASN A 119 5.117 10.340 10.680 1.00 65.54 O ATOM 1704 CB ASN A 119 6.701 12.653 9.841 1.00 42.34 C ATOM 1705 CG ASN A 119 7.429 13.990 9.881 1.00 1.00 C ATOM 1706 OD1 ASN A 119 8.150 14.363 8.838 1.00 11.10 O flip ATOM 1707 ND2 ASN A 119 7.355 14.710 10.874 1.00 45.33 N flip ATOM 0 H ASN A 119 8.720 12.111 12.177 1.00 4.02 H new ATOM 0 HA ASN A 119 6.557 12.287 11.937 1.00 25.24 H new ATOM 0 HB2 ASN A 119 6.994 12.111 8.941 1.00 42.34 H new ATOM 0 HB3 ASN A 119 5.628 12.830 9.772 1.00 42.34 H new ATOM 0 HD21 ASN A 119 6.797 14.417 11.676 1.00 45.33 H new ATOM 0 HD22 ASN A 119 7.852 15.601 10.896 1.00 45.33 H new ATOM 1713 N HIS A 120 6.965 9.335 11.448 1.00 5.14 N ATOM 1714 CA HIS A 120 6.442 7.974 11.435 1.00 34.10 C ATOM 1715 C HIS A 120 5.093 7.878 12.163 1.00 45.01 C ATOM 1716 O HIS A 120 4.116 7.411 11.581 1.00 62.54 O ATOM 1717 CB HIS A 120 7.494 6.997 11.996 1.00 24.13 C ATOM 1718 CG HIS A 120 7.789 7.143 13.473 1.00 10.22 C ATOM 1719 ND1 HIS A 120 7.285 6.354 14.487 1.00 12.33 N ATOM 1720 CD2 HIS A 120 8.558 8.116 14.051 1.00 65.25 C ATOM 1721 CE1 HIS A 120 7.739 6.850 15.652 1.00 1.30 C ATOM 1722 NE2 HIS A 120 8.514 7.929 15.437 1.00 12.13 N ATOM 0 H HIS A 120 7.920 9.390 11.803 1.00 5.14 H new ATOM 0 HA HIS A 120 6.244 7.685 10.403 1.00 34.10 H new ATOM 0 HB2 HIS A 120 7.156 5.978 11.809 1.00 24.13 H new ATOM 0 HB3 HIS A 120 8.423 7.131 11.442 1.00 24.13 H new ATOM 0 HD2 HIS A 120 9.102 8.890 13.530 1.00 65.25 H new ATOM 0 HE1 HIS A 120 7.513 6.439 16.625 1.00 1.30 H new ATOM 0 HE2 HIS A 120 8.978 8.498 16.145 1.00 12.13 H new ATOM 1729 N LYS A 121 5.006 8.344 13.416 1.00 51.04 N ATOM 1730 CA LYS A 121 3.799 8.352 14.218 1.00 33.50 C ATOM 1731 C LYS A 121 2.692 9.146 13.528 1.00 12.32 C ATOM 1732 O LYS A 121 1.552 8.670 13.461 1.00 34.31 O ATOM 1733 CB LYS A 121 4.160 8.936 15.597 1.00 43.35 C ATOM 1734 CG LYS A 121 3.171 8.407 16.619 1.00 23.33 C ATOM 1735 CD LYS A 121 3.479 8.813 18.068 1.00 65.22 C ATOM 1736 CE LYS A 121 2.144 8.917 18.821 1.00 50.32 C ATOM 1737 NZ LYS A 121 2.253 8.803 20.286 1.00 2.04 N ATOM 0 H LYS A 121 5.809 8.737 13.907 1.00 51.04 H new ATOM 0 HA LYS A 121 3.412 7.341 14.343 1.00 33.50 H new ATOM 0 HB2 LYS A 121 5.176 8.655 15.873 1.00 43.35 H new ATOM 0 HB3 LYS A 121 4.128 10.025 15.567 1.00 43.35 H new ATOM 0 HG2 LYS A 121 2.174 8.762 16.359 1.00 23.33 H new ATOM 0 HG3 LYS A 121 3.149 7.319 16.556 1.00 23.33 H new ATOM 0 HD2 LYS A 121 4.128 8.076 18.541 1.00 65.22 H new ATOM 0 HD3 LYS A 121 4.007 9.766 18.094 1.00 65.22 H new ATOM 0 HE2 LYS A 121 1.679 9.872 18.578 1.00 50.32 H new ATOM 0 HE3 LYS A 121 1.476 8.136 18.458 1.00 50.32 H new ATOM 0 HZ1 LYS A 121 1.308 8.884 20.712 1.00 2.04 H new ATOM 0 HZ2 LYS A 121 2.666 7.881 20.533 1.00 2.04 H new ATOM 0 HZ3 LYS A 121 2.863 9.563 20.649 1.00 2.04 H new ATOM 1747 N ALA A 122 3.037 10.321 12.993 1.00 65.42 N ATOM 1748 CA ALA A 122 2.103 11.164 12.259 1.00 11.10 C ATOM 1749 C ALA A 122 1.532 10.409 11.057 1.00 51.41 C ATOM 1750 O ALA A 122 0.334 10.537 10.794 1.00 50.32 O ATOM 1751 CB ALA A 122 2.771 12.482 11.844 1.00 11.03 C ATOM 0 H ALA A 122 3.977 10.711 13.060 1.00 65.42 H new ATOM 0 HA ALA A 122 1.269 11.417 12.914 1.00 11.10 H new ATOM 0 HB1 ALA A 122 2.056 13.096 11.297 1.00 11.03 H new ATOM 0 HB2 ALA A 122 3.103 13.017 12.733 1.00 11.03 H new ATOM 0 HB3 ALA A 122 3.629 12.270 11.206 1.00 11.03 H new ATOM 1757 N TYR A 123 2.330 9.596 10.347 1.00 50.01 N ATOM 1758 CA TYR A 123 1.820 8.770 9.254 1.00 31.13 C ATOM 1759 C TYR A 123 0.685 7.902 9.756 1.00 54.11 C ATOM 1760 O TYR A 123 -0.392 7.970 9.168 1.00 72.32 O ATOM 1761 CB TYR A 123 2.882 7.920 8.543 1.00 30.20 C ATOM 1762 CG TYR A 123 2.311 7.355 7.252 1.00 22.40 C ATOM 1763 CD1 TYR A 123 1.474 6.222 7.277 1.00 12.20 C ATOM 1764 CD2 TYR A 123 2.530 8.024 6.036 1.00 53.41 C ATOM 1765 CE1 TYR A 123 0.822 5.777 6.111 1.00 11.44 C ATOM 1766 CE2 TYR A 123 1.912 7.562 4.862 1.00 62.14 C ATOM 1767 CZ TYR A 123 1.038 6.455 4.892 1.00 33.44 C ATOM 1768 OH TYR A 123 0.456 6.029 3.738 1.00 44.34 O ATOM 0 H TYR A 123 3.331 9.497 10.515 1.00 50.01 H new ATOM 0 HA TYR A 123 1.460 9.463 8.494 1.00 31.13 H new ATOM 0 HB2 TYR A 123 3.762 8.527 8.327 1.00 30.20 H new ATOM 0 HB3 TYR A 123 3.206 7.108 9.194 1.00 30.20 H new ATOM 0 HD1 TYR A 123 1.330 5.687 8.204 1.00 12.20 H new ATOM 0 HD2 TYR A 123 3.172 8.892 6.004 1.00 53.41 H new ATOM 0 HE1 TYR A 123 0.162 4.923 6.149 1.00 11.44 H new ATOM 0 HE2 TYR A 123 2.109 8.061 3.924 1.00 62.14 H new ATOM 0 HH TYR A 123 -0.498 5.866 3.893 1.00 44.34 H new ATOM 1777 N VAL A 124 0.912 7.125 10.823 1.00 3.12 N ATOM 1778 CA VAL A 124 -0.086 6.211 11.368 1.00 73.11 C ATOM 1779 C VAL A 124 -1.398 6.984 11.584 1.00 22.11 C ATOM 1780 O VAL A 124 -2.415 6.626 10.995 1.00 64.42 O ATOM 1781 CB VAL A 124 0.411 5.495 12.652 1.00 10.31 C ATOM 1782 CG1 VAL A 124 -0.318 4.161 12.865 1.00 5.44 C ATOM 1783 CG2 VAL A 124 1.916 5.190 12.674 1.00 14.41 C ATOM 0 H VAL A 124 1.797 7.117 11.330 1.00 3.12 H new ATOM 0 HA VAL A 124 -0.268 5.408 10.654 1.00 73.11 H new ATOM 0 HB VAL A 124 0.193 6.209 13.446 1.00 10.31 H new ATOM 0 HG11 VAL A 124 0.053 3.684 13.772 1.00 5.44 H new ATOM 0 HG12 VAL A 124 -1.388 4.343 12.962 1.00 5.44 H new ATOM 0 HG13 VAL A 124 -0.137 3.507 12.012 1.00 5.44 H new ATOM 0 HG21 VAL A 124 2.172 4.690 13.608 1.00 14.41 H new ATOM 0 HG22 VAL A 124 2.168 4.542 11.834 1.00 14.41 H new ATOM 0 HG23 VAL A 124 2.477 6.121 12.595 1.00 14.41 H new ATOM 1793 N SER A 125 -1.381 8.067 12.369 1.00 63.33 N ATOM 1794 CA SER A 125 -2.609 8.738 12.784 1.00 25.54 C ATOM 1795 C SER A 125 -3.355 9.333 11.585 1.00 44.14 C ATOM 1796 O SER A 125 -4.542 9.076 11.398 1.00 30.44 O ATOM 1797 CB SER A 125 -2.278 9.829 13.822 1.00 62.22 C ATOM 1798 OG SER A 125 -3.153 9.805 14.936 1.00 11.33 O ATOM 0 H SER A 125 -0.527 8.495 12.728 1.00 63.33 H new ATOM 0 HA SER A 125 -3.269 8.000 13.240 1.00 25.54 H new ATOM 0 HB2 SER A 125 -1.253 9.697 14.167 1.00 62.22 H new ATOM 0 HB3 SER A 125 -2.331 10.807 13.344 1.00 62.22 H new ATOM 0 HG SER A 125 -2.901 10.513 15.565 1.00 11.33 H new ATOM 1803 N HIS A 126 -2.668 10.148 10.784 1.00 50.32 N ATOM 1804 CA HIS A 126 -3.281 10.885 9.686 1.00 11.43 C ATOM 1805 C HIS A 126 -3.777 9.922 8.601 1.00 21.54 C ATOM 1806 O HIS A 126 -4.856 10.113 8.050 1.00 52.24 O ATOM 1807 CB HIS A 126 -2.227 11.828 9.116 1.00 62.34 C ATOM 1808 CG HIS A 126 -1.710 12.906 10.047 1.00 50.35 C ATOM 1809 ND1 HIS A 126 -0.478 13.516 9.949 1.00 13.32 N ATOM 1810 CD2 HIS A 126 -2.326 13.416 11.160 1.00 1.40 C ATOM 1811 CE1 HIS A 126 -0.346 14.351 10.985 1.00 25.12 C ATOM 1812 NE2 HIS A 126 -1.445 14.325 11.757 1.00 51.22 N ATOM 0 H HIS A 126 -1.666 10.314 10.882 1.00 50.32 H new ATOM 0 HA HIS A 126 -4.143 11.448 10.045 1.00 11.43 H new ATOM 0 HB2 HIS A 126 -1.379 11.230 8.782 1.00 62.34 H new ATOM 0 HB3 HIS A 126 -2.644 12.311 8.232 1.00 62.34 H new ATOM 0 HD2 HIS A 126 -3.314 13.162 11.513 1.00 1.40 H new ATOM 0 HE1 HIS A 126 0.524 14.962 11.175 1.00 25.12 H new ATOM 0 HE2 HIS A 126 -1.606 14.862 12.610 1.00 51.22 H new ATOM 1819 N PHE A 127 -2.999 8.874 8.295 1.00 4.44 N ATOM 1820 CA PHE A 127 -3.399 7.847 7.339 1.00 65.12 C ATOM 1821 C PHE A 127 -4.721 7.212 7.744 1.00 41.14 C ATOM 1822 O PHE A 127 -5.561 7.014 6.868 1.00 44.24 O ATOM 1823 CB PHE A 127 -2.329 6.757 7.215 1.00 65.41 C ATOM 1824 CG PHE A 127 -2.718 5.654 6.257 1.00 70.14 C ATOM 1825 CD1 PHE A 127 -2.488 5.819 4.880 1.00 2.10 C ATOM 1826 CD2 PHE A 127 -3.360 4.492 6.730 1.00 72.21 C ATOM 1827 CE1 PHE A 127 -2.892 4.823 3.978 1.00 64.21 C ATOM 1828 CE2 PHE A 127 -3.782 3.507 5.822 1.00 13.40 C ATOM 1829 CZ PHE A 127 -3.550 3.678 4.448 1.00 64.11 C ATOM 0 H PHE A 127 -2.078 8.720 8.705 1.00 4.44 H new ATOM 0 HA PHE A 127 -3.518 8.336 6.372 1.00 65.12 H new ATOM 0 HB2 PHE A 127 -1.395 7.209 6.881 1.00 65.41 H new ATOM 0 HB3 PHE A 127 -2.141 6.327 8.199 1.00 65.41 H new ATOM 0 HD1 PHE A 127 -2.001 6.712 4.517 1.00 2.10 H new ATOM 0 HD2 PHE A 127 -3.527 4.359 7.789 1.00 72.21 H new ATOM 0 HE1 PHE A 127 -2.696 4.939 2.922 1.00 64.21 H new ATOM 0 HE2 PHE A 127 -4.284 2.620 6.180 1.00 13.40 H new ATOM 0 HZ PHE A 127 -3.880 2.923 3.749 1.00 64.11 H new ATOM 1838 N ASN A 128 -4.876 6.891 9.035 1.00 54.05 N ATOM 1839 CA ASN A 128 -6.072 6.243 9.557 1.00 2.01 C ATOM 1840 C ASN A 128 -7.291 7.100 9.241 1.00 64.15 C ATOM 1841 O ASN A 128 -8.219 6.581 8.636 1.00 3.11 O ATOM 1842 CB ASN A 128 -5.952 5.924 11.057 1.00 74.45 C ATOM 1843 CG ASN A 128 -5.327 4.551 11.283 1.00 24.13 C ATOM 1844 OD1 ASN A 128 -6.022 3.548 11.299 1.00 13.53 O ATOM 1845 ND2 ASN A 128 -4.012 4.464 11.418 1.00 45.34 N ATOM 0 H ASN A 128 -4.168 7.077 9.745 1.00 54.05 H new ATOM 0 HA ASN A 128 -6.191 5.278 9.063 1.00 2.01 H new ATOM 0 HB2 ASN A 128 -5.346 6.687 11.546 1.00 74.45 H new ATOM 0 HB3 ASN A 128 -6.939 5.957 11.518 1.00 74.45 H new ATOM 0 HD21 ASN A 128 -3.571 3.552 11.537 1.00 45.34 H new ATOM 0 HD22 ASN A 128 -3.441 5.309 11.403 1.00 45.34 H new ATOM 1851 N GLU A 129 -7.267 8.405 9.541 1.00 5.04 N ATOM 1852 CA GLU A 129 -8.338 9.350 9.186 1.00 52.25 C ATOM 1853 C GLU A 129 -8.776 9.183 7.727 1.00 31.52 C ATOM 1854 O GLU A 129 -9.960 9.159 7.404 1.00 52.34 O ATOM 1855 CB GLU A 129 -7.832 10.801 9.379 1.00 72.54 C ATOM 1856 CG GLU A 129 -8.632 11.638 10.383 1.00 65.14 C ATOM 1857 CD GLU A 129 -9.272 12.855 9.711 1.00 14.13 C ATOM 1858 OE1 GLU A 129 -8.548 13.836 9.408 1.00 12.43 O ATOM 1859 OE2 GLU A 129 -10.495 12.831 9.447 1.00 43.14 O ATOM 0 H GLU A 129 -6.494 8.841 10.043 1.00 5.04 H new ATOM 0 HA GLU A 129 -9.189 9.144 9.835 1.00 52.25 H new ATOM 0 HB2 GLU A 129 -6.792 10.767 9.704 1.00 72.54 H new ATOM 0 HB3 GLU A 129 -7.847 11.307 8.413 1.00 72.54 H new ATOM 0 HG2 GLU A 129 -9.408 11.021 10.837 1.00 65.14 H new ATOM 0 HG3 GLU A 129 -7.976 11.968 11.188 1.00 65.14 H new ATOM 1864 N TRP A 130 -7.795 9.084 6.834 1.00 5.44 N ATOM 1865 CA TRP A 130 -8.012 9.095 5.403 1.00 72.54 C ATOM 1866 C TRP A 130 -8.298 7.700 4.822 1.00 3.40 C ATOM 1867 O TRP A 130 -8.564 7.615 3.619 1.00 22.14 O ATOM 1868 CB TRP A 130 -6.773 9.744 4.775 1.00 65.44 C ATOM 1869 CG TRP A 130 -6.465 11.155 5.187 1.00 22.54 C ATOM 1870 CD1 TRP A 130 -7.365 12.100 5.549 1.00 24.52 C ATOM 1871 CD2 TRP A 130 -5.157 11.793 5.322 1.00 31.42 C ATOM 1872 NE1 TRP A 130 -6.721 13.297 5.776 1.00 65.53 N ATOM 1873 CE2 TRP A 130 -5.352 13.152 5.709 1.00 53.41 C ATOM 1874 CE3 TRP A 130 -3.822 11.352 5.180 1.00 21.21 C ATOM 1875 CZ2 TRP A 130 -4.281 14.024 5.935 1.00 5.20 C ATOM 1876 CZ3 TRP A 130 -2.738 12.226 5.392 1.00 11.03 C ATOM 1877 CH2 TRP A 130 -2.967 13.562 5.766 1.00 50.15 C ATOM 0 H TRP A 130 -6.813 8.993 7.096 1.00 5.44 H new ATOM 0 HA TRP A 130 -8.910 9.667 5.169 1.00 72.54 H new ATOM 0 HB2 TRP A 130 -5.908 9.124 5.012 1.00 65.44 H new ATOM 0 HB3 TRP A 130 -6.892 9.725 3.692 1.00 65.44 H new ATOM 0 HD1 TRP A 130 -8.429 11.939 5.645 1.00 24.52 H new ATOM 0 HE1 TRP A 130 -7.197 14.178 5.969 1.00 65.53 H new ATOM 0 HE3 TRP A 130 -3.629 10.326 4.904 1.00 21.21 H new ATOM 0 HZ2 TRP A 130 -4.464 15.045 6.237 1.00 5.20 H new ATOM 0 HZ3 TRP A 130 -1.727 11.868 5.267 1.00 11.03 H new ATOM 0 HH2 TRP A 130 -2.134 14.231 5.923 1.00 50.15 H new ATOM 1887 N ALA A 131 -8.232 6.625 5.621 1.00 54.55 N ATOM 1888 CA ALA A 131 -8.338 5.228 5.185 1.00 1.34 C ATOM 1889 C ALA A 131 -9.329 4.392 5.990 1.00 4.34 C ATOM 1890 O ALA A 131 -9.552 3.231 5.638 1.00 32.31 O ATOM 1891 CB ALA A 131 -6.959 4.559 5.273 1.00 3.41 C ATOM 0 H ALA A 131 -8.098 6.710 6.629 1.00 54.55 H new ATOM 0 HA ALA A 131 -8.711 5.265 4.161 1.00 1.34 H new ATOM 0 HB1 ALA A 131 -7.037 3.521 4.949 1.00 3.41 H new ATOM 0 HB2 ALA A 131 -6.256 5.088 4.629 1.00 3.41 H new ATOM 0 HB3 ALA A 131 -6.604 4.592 6.303 1.00 3.41 H new ATOM 1897 N ASP A 132 -9.884 4.953 7.064 1.00 2.33 N ATOM 1898 CA ASP A 132 -10.646 4.232 8.071 1.00 65.15 C ATOM 1899 C ASP A 132 -11.778 3.461 7.404 1.00 21.31 C ATOM 1900 O ASP A 132 -12.648 4.063 6.760 1.00 65.41 O ATOM 1901 CB ASP A 132 -11.175 5.213 9.124 1.00 73.03 C ATOM 1902 CG ASP A 132 -11.962 4.568 10.263 1.00 50.34 C ATOM 1903 OD1 ASP A 132 -11.886 3.333 10.455 1.00 34.44 O ATOM 1904 OD2 ASP A 132 -12.646 5.325 10.990 1.00 53.32 O ATOM 0 H ASP A 132 -9.811 5.952 7.259 1.00 2.33 H new ATOM 0 HA ASP A 132 -10.002 3.513 8.578 1.00 65.15 H new ATOM 0 HB2 ASP A 132 -10.332 5.759 9.547 1.00 73.03 H new ATOM 0 HB3 ASP A 132 -11.813 5.945 8.630 1.00 73.03 H new ATOM 1908 N GLY A 133 -11.696 2.137 7.493 1.00 44.53 N ATOM 1909 CA GLY A 133 -12.498 1.168 6.776 1.00 13.41 C ATOM 1910 C GLY A 133 -11.653 -0.073 6.498 1.00 3.34 C ATOM 1911 O GLY A 133 -11.953 -1.148 7.017 1.00 23.21 O ATOM 0 H GLY A 133 -11.020 1.689 8.111 1.00 44.53 H new ATOM 0 HA2 GLY A 133 -13.377 0.901 7.362 1.00 13.41 H new ATOM 0 HA3 GLY A 133 -12.857 1.596 5.840 1.00 13.41 H new ATOM 1915 N LEU A 134 -10.589 0.060 5.699 1.00 73.22 N ATOM 1916 CA LEU A 134 -9.716 -1.070 5.372 1.00 23.11 C ATOM 1917 C LEU A 134 -8.726 -1.299 6.521 1.00 41.51 C ATOM 1918 O LEU A 134 -8.018 -0.373 6.927 1.00 63.04 O ATOM 1919 CB LEU A 134 -8.923 -0.832 4.071 1.00 34.14 C ATOM 1920 CG LEU A 134 -9.639 -0.938 2.709 1.00 53.53 C ATOM 1921 CD1 LEU A 134 -10.533 -2.172 2.595 1.00 44.32 C ATOM 1922 CD2 LEU A 134 -10.438 0.299 2.295 1.00 4.42 C ATOM 0 H LEU A 134 -10.312 0.941 5.267 1.00 73.22 H new ATOM 0 HA LEU A 134 -10.351 -1.944 5.227 1.00 23.11 H new ATOM 0 HB2 LEU A 134 -8.487 0.165 4.133 1.00 34.14 H new ATOM 0 HB3 LEU A 134 -8.095 -1.541 4.060 1.00 34.14 H new ATOM 0 HG LEU A 134 -8.806 -1.028 2.012 1.00 53.53 H new ATOM 0 HD11 LEU A 134 -11.008 -2.188 1.614 1.00 44.32 H new ATOM 0 HD12 LEU A 134 -9.930 -3.071 2.721 1.00 44.32 H new ATOM 0 HD13 LEU A 134 -11.300 -2.138 3.369 1.00 44.32 H new ATOM 0 HD21 LEU A 134 -10.903 0.124 1.325 1.00 4.42 H new ATOM 0 HD22 LEU A 134 -11.211 0.498 3.037 1.00 4.42 H new ATOM 0 HD23 LEU A 134 -9.770 1.158 2.228 1.00 4.42 H new ATOM 1933 N ASN A 135 -8.628 -2.541 7.000 1.00 24.04 N ATOM 1934 CA ASN A 135 -7.716 -3.006 8.047 1.00 43.42 C ATOM 1935 C ASN A 135 -6.255 -2.725 7.700 1.00 43.33 C ATOM 1936 O ASN A 135 -5.885 -2.781 6.524 1.00 64.35 O ATOM 1937 CB ASN A 135 -7.911 -4.525 8.204 1.00 51.23 C ATOM 1938 CG ASN A 135 -7.022 -5.182 9.249 1.00 42.34 C ATOM 1939 OD1 ASN A 135 -6.864 -4.680 10.351 1.00 52.21 O ATOM 1940 ND2 ASN A 135 -6.397 -6.295 8.899 1.00 62.02 N ATOM 0 H ASN A 135 -9.218 -3.294 6.646 1.00 24.04 H new ATOM 0 HA ASN A 135 -7.943 -2.473 8.970 1.00 43.42 H new ATOM 0 HB2 ASN A 135 -8.952 -4.718 8.461 1.00 51.23 H new ATOM 0 HB3 ASN A 135 -7.727 -5.001 7.241 1.00 51.23 H new ATOM 0 HD21 ASN A 135 -5.766 -6.754 9.556 1.00 62.02 H new ATOM 0 HD22 ASN A 135 -6.546 -6.694 7.972 1.00 62.02 H new ATOM 1946 N VAL A 136 -5.388 -2.582 8.706 1.00 41.35 N ATOM 1947 CA VAL A 136 -3.931 -2.496 8.540 1.00 43.52 C ATOM 1948 C VAL A 136 -3.234 -3.399 9.568 1.00 61.04 C ATOM 1949 O VAL A 136 -3.230 -3.089 10.759 1.00 33.44 O ATOM 1950 CB VAL A 136 -3.449 -1.034 8.620 1.00 21.30 C ATOM 1951 CG1 VAL A 136 -1.930 -0.933 8.418 1.00 74.05 C ATOM 1952 CG2 VAL A 136 -4.082 -0.157 7.540 1.00 51.45 C ATOM 0 H VAL A 136 -5.684 -2.521 9.680 1.00 41.35 H new ATOM 0 HA VAL A 136 -3.663 -2.855 7.547 1.00 43.52 H new ATOM 0 HB VAL A 136 -3.741 -0.690 9.612 1.00 21.30 H new ATOM 0 HG11 VAL A 136 -1.623 0.111 8.480 1.00 74.05 H new ATOM 0 HG12 VAL A 136 -1.421 -1.508 9.192 1.00 74.05 H new ATOM 0 HG13 VAL A 136 -1.666 -1.331 7.438 1.00 74.05 H new ATOM 0 HG21 VAL A 136 -3.712 0.864 7.637 1.00 51.45 H new ATOM 0 HG22 VAL A 136 -3.820 -0.546 6.556 1.00 51.45 H new ATOM 0 HG23 VAL A 136 -5.166 -0.162 7.656 1.00 51.45 H new ATOM 1962 N ILE A 137 -2.634 -4.508 9.123 1.00 72.41 N ATOM 1963 CA ILE A 137 -1.895 -5.449 9.973 1.00 44.45 C ATOM 1964 C ILE A 137 -0.529 -4.920 10.447 1.00 14.31 C ATOM 1965 O ILE A 137 0.078 -5.537 11.326 1.00 13.52 O ATOM 1966 CB ILE A 137 -1.732 -6.826 9.280 1.00 50.21 C ATOM 1967 CG1 ILE A 137 -1.187 -6.704 7.842 1.00 44.25 C ATOM 1968 CG2 ILE A 137 -3.058 -7.603 9.283 1.00 44.45 C ATOM 1969 CD1 ILE A 137 -0.394 -7.920 7.379 1.00 13.43 C ATOM 0 H ILE A 137 -2.649 -4.783 8.141 1.00 72.41 H new ATOM 0 HA ILE A 137 -2.505 -5.569 10.869 1.00 44.45 H new ATOM 0 HB ILE A 137 -0.994 -7.380 9.860 1.00 50.21 H new ATOM 0 HG12 ILE A 137 -2.022 -6.545 7.159 1.00 44.25 H new ATOM 0 HG13 ILE A 137 -0.551 -5.821 7.778 1.00 44.25 H new ATOM 0 HG21 ILE A 137 -2.917 -8.565 8.791 1.00 44.45 H new ATOM 0 HG22 ILE A 137 -3.382 -7.765 10.311 1.00 44.45 H new ATOM 0 HG23 ILE A 137 -3.816 -7.030 8.749 1.00 44.45 H new ATOM 0 HD11 ILE A 137 -0.044 -7.759 6.359 1.00 13.43 H new ATOM 0 HD12 ILE A 137 0.462 -8.068 8.037 1.00 13.43 H new ATOM 0 HD13 ILE A 137 -1.032 -8.803 7.409 1.00 13.43 H new ATOM 1980 N GLY A 138 -0.012 -3.803 9.923 1.00 41.15 N ATOM 1981 CA GLY A 138 1.228 -3.236 10.440 1.00 31.24 C ATOM 1982 C GLY A 138 1.603 -1.922 9.777 1.00 65.42 C ATOM 1983 O GLY A 138 1.261 -1.699 8.614 1.00 53.14 O ATOM 0 H GLY A 138 -0.430 -3.283 9.151 1.00 41.15 H new ATOM 0 HA2 GLY A 138 1.129 -3.079 11.514 1.00 31.24 H new ATOM 0 HA3 GLY A 138 2.036 -3.953 10.296 1.00 31.24 H new ATOM 1987 N VAL A 139 2.324 -1.065 10.509 1.00 2.11 N ATOM 1988 CA VAL A 139 2.809 0.233 10.051 1.00 41.51 C ATOM 1989 C VAL A 139 4.256 0.355 10.542 1.00 73.13 C ATOM 1990 O VAL A 139 4.484 0.564 11.735 1.00 5.33 O ATOM 1991 CB VAL A 139 1.866 1.387 10.490 1.00 2.24 C ATOM 1992 CG1 VAL A 139 2.162 2.692 9.736 1.00 73.13 C ATOM 1993 CG2 VAL A 139 0.398 1.060 10.185 1.00 72.02 C ATOM 0 H VAL A 139 2.593 -1.268 11.472 1.00 2.11 H new ATOM 0 HA VAL A 139 2.803 0.313 8.964 1.00 41.51 H new ATOM 0 HB VAL A 139 2.039 1.504 11.560 1.00 2.24 H new ATOM 0 HG11 VAL A 139 1.479 3.471 10.075 1.00 73.13 H new ATOM 0 HG12 VAL A 139 3.189 3.000 9.931 1.00 73.13 H new ATOM 0 HG13 VAL A 139 2.028 2.532 8.666 1.00 73.13 H new ATOM 0 HG21 VAL A 139 -0.233 1.889 10.505 1.00 72.02 H new ATOM 0 HG22 VAL A 139 0.275 0.903 9.113 1.00 72.02 H new ATOM 0 HG23 VAL A 139 0.108 0.155 10.720 1.00 72.02 H new ATOM 2003 N ALA A 140 5.235 0.135 9.659 1.00 45.33 N ATOM 2004 CA ALA A 140 6.677 0.125 9.960 1.00 24.10 C ATOM 2005 C ALA A 140 7.433 0.882 8.865 1.00 45.14 C ATOM 2006 O ALA A 140 6.805 1.635 8.123 1.00 74.25 O ATOM 2007 CB ALA A 140 7.176 -1.318 10.110 1.00 4.54 C ATOM 0 H ALA A 140 5.041 -0.049 8.675 1.00 45.33 H new ATOM 0 HA ALA A 140 6.861 0.631 10.907 1.00 24.10 H new ATOM 0 HB1 ALA A 140 8.243 -1.313 10.332 1.00 4.54 H new ATOM 0 HB2 ALA A 140 6.638 -1.806 10.923 1.00 4.54 H new ATOM 0 HB3 ALA A 140 7.002 -1.862 9.182 1.00 4.54 H new ATOM 2013 N ARG A 141 8.760 0.767 8.758 1.00 70.42 N ATOM 2014 CA ARG A 141 9.490 1.199 7.570 1.00 11.43 C ATOM 2015 C ARG A 141 10.263 0.042 6.948 1.00 5.14 C ATOM 2016 O ARG A 141 10.312 -1.038 7.541 1.00 1.12 O ATOM 2017 CB ARG A 141 10.444 2.313 7.980 1.00 11.13 C ATOM 2018 CG ARG A 141 11.609 1.783 8.841 1.00 23.01 C ATOM 2019 CD ARG A 141 11.708 2.533 10.149 1.00 13.44 C ATOM 2020 NE ARG A 141 10.529 2.354 11.003 1.00 51.21 N ATOM 2021 CZ ARG A 141 10.531 2.146 12.317 1.00 22.44 C ATOM 2022 NH1 ARG A 141 11.650 1.809 12.956 1.00 5.33 N ATOM 2023 NH2 ARG A 141 9.384 2.298 12.968 1.00 65.31 N ATOM 0 H ARG A 141 9.352 0.374 9.489 1.00 70.42 H new ATOM 0 HA ARG A 141 8.786 1.559 6.820 1.00 11.43 H new ATOM 0 HB2 ARG A 141 10.842 2.797 7.088 1.00 11.13 H new ATOM 0 HB3 ARG A 141 9.897 3.073 8.538 1.00 11.13 H new ATOM 0 HG2 ARG A 141 11.465 0.721 9.038 1.00 23.01 H new ATOM 0 HG3 ARG A 141 12.545 1.881 8.291 1.00 23.01 H new ATOM 0 HD2 ARG A 141 12.594 2.198 10.688 1.00 13.44 H new ATOM 0 HD3 ARG A 141 11.843 3.595 9.943 1.00 13.44 H new ATOM 0 HE ARG A 141 9.619 2.393 10.545 1.00 51.21 H new ATOM 0 HH11 ARG A 141 12.522 1.707 12.437 1.00 5.33 H new ATOM 0 HH12 ARG A 141 11.635 1.653 13.964 1.00 5.33 H new ATOM 0 HH21 ARG A 141 8.541 2.566 12.460 1.00 65.31 H new ATOM 0 HH22 ARG A 141 9.346 2.147 13.976 1.00 65.31 H new ATOM 2034 N ASP A 142 10.963 0.356 5.856 1.00 5.43 N ATOM 2035 CA ASP A 142 12.011 -0.473 5.272 1.00 61.45 C ATOM 2036 C ASP A 142 11.464 -1.892 5.049 1.00 21.23 C ATOM 2037 O ASP A 142 10.273 -2.051 4.767 1.00 63.14 O ATOM 2038 CB ASP A 142 13.339 -0.357 6.060 1.00 2.10 C ATOM 2039 CG ASP A 142 13.946 1.058 6.081 1.00 41.45 C ATOM 2040 OD1 ASP A 142 13.700 1.874 5.161 1.00 14.23 O ATOM 2041 OD2 ASP A 142 14.670 1.381 7.050 1.00 42.31 O ATOM 0 H ASP A 142 10.809 1.222 5.340 1.00 5.43 H new ATOM 0 HA ASP A 142 12.292 -0.111 4.283 1.00 61.45 H new ATOM 0 HB2 ASP A 142 13.167 -0.681 7.087 1.00 2.10 H new ATOM 0 HB3 ASP A 142 14.066 -1.044 5.626 1.00 2.10 H new ATOM 2045 N ASP A 143 12.311 -2.918 5.042 1.00 22.44 N ATOM 2046 CA ASP A 143 11.951 -4.324 4.841 1.00 41.34 C ATOM 2047 C ASP A 143 11.966 -5.115 6.160 1.00 44.52 C ATOM 2048 O ASP A 143 12.140 -6.333 6.165 1.00 11.23 O ATOM 2049 CB ASP A 143 12.844 -4.950 3.756 1.00 22.01 C ATOM 2050 CG ASP A 143 14.340 -4.990 4.057 1.00 10.31 C ATOM 2051 OD1 ASP A 143 14.804 -4.492 5.107 1.00 43.24 O ATOM 2052 OD2 ASP A 143 15.084 -5.428 3.144 1.00 70.14 O ATOM 0 H ASP A 143 13.313 -2.789 5.182 1.00 22.44 H new ATOM 0 HA ASP A 143 10.922 -4.371 4.485 1.00 41.34 H new ATOM 0 HB2 ASP A 143 12.503 -5.970 3.577 1.00 22.01 H new ATOM 0 HB3 ASP A 143 12.695 -4.397 2.829 1.00 22.01 H new ATOM 2056 N SER A 144 11.777 -4.434 7.292 1.00 31.42 N ATOM 2057 CA SER A 144 11.997 -4.974 8.625 1.00 13.11 C ATOM 2058 C SER A 144 10.932 -6.007 9.042 1.00 32.32 C ATOM 2059 O SER A 144 11.197 -6.865 9.887 1.00 11.23 O ATOM 2060 CB SER A 144 11.939 -3.768 9.559 1.00 31.24 C ATOM 2061 OG SER A 144 13.099 -2.955 9.440 1.00 3.23 O ATOM 0 H SER A 144 11.458 -3.465 7.301 1.00 31.42 H new ATOM 0 HA SER A 144 12.948 -5.505 8.661 1.00 13.11 H new ATOM 0 HB2 SER A 144 11.054 -3.174 9.332 1.00 31.24 H new ATOM 0 HB3 SER A 144 11.838 -4.110 10.589 1.00 31.24 H new ATOM 0 HG SER A 144 13.028 -2.192 10.050 1.00 3.23 H new ATOM 2066 N GLU A 145 9.723 -5.940 8.479 1.00 73.01 N ATOM 2067 CA GLU A 145 8.565 -6.702 8.946 1.00 43.25 C ATOM 2068 C GLU A 145 8.032 -7.658 7.862 1.00 43.42 C ATOM 2069 O GLU A 145 6.920 -8.168 7.983 1.00 4.50 O ATOM 2070 CB GLU A 145 7.507 -5.744 9.532 1.00 3.13 C ATOM 2071 CG GLU A 145 7.973 -5.067 10.838 1.00 45.14 C ATOM 2072 CD GLU A 145 6.865 -4.412 11.689 1.00 2.11 C ATOM 2073 OE1 GLU A 145 5.659 -4.764 11.574 1.00 32.33 O ATOM 2074 OE2 GLU A 145 7.214 -3.551 12.529 1.00 5.53 O ATOM 0 H GLU A 145 9.519 -5.346 7.675 1.00 73.01 H new ATOM 0 HA GLU A 145 8.869 -7.361 9.759 1.00 43.25 H new ATOM 0 HB2 GLU A 145 7.270 -4.977 8.795 1.00 3.13 H new ATOM 0 HB3 GLU A 145 6.588 -6.298 9.723 1.00 3.13 H new ATOM 0 HG2 GLU A 145 8.482 -5.812 11.450 1.00 45.14 H new ATOM 0 HG3 GLU A 145 8.710 -4.304 10.586 1.00 45.14 H new ATOM 2079 N VAL A 146 8.802 -7.932 6.802 1.00 11.10 N ATOM 2080 CA VAL A 146 8.320 -8.703 5.655 1.00 72.43 C ATOM 2081 C VAL A 146 7.822 -10.086 6.050 1.00 51.21 C ATOM 2082 O VAL A 146 6.711 -10.458 5.666 1.00 25.02 O ATOM 2083 CB VAL A 146 9.412 -8.769 4.558 1.00 53.45 C ATOM 2084 CG1 VAL A 146 9.013 -9.638 3.358 1.00 74.45 C ATOM 2085 CG2 VAL A 146 9.747 -7.376 4.010 1.00 2.30 C ATOM 0 H VAL A 146 9.771 -7.626 6.717 1.00 11.10 H new ATOM 0 HA VAL A 146 7.454 -8.183 5.245 1.00 72.43 H new ATOM 0 HB VAL A 146 10.274 -9.213 5.056 1.00 53.45 H new ATOM 0 HG11 VAL A 146 9.821 -9.642 2.627 1.00 74.45 H new ATOM 0 HG12 VAL A 146 8.823 -10.657 3.694 1.00 74.45 H new ATOM 0 HG13 VAL A 146 8.111 -9.233 2.899 1.00 74.45 H new ATOM 0 HG21 VAL A 146 10.517 -7.462 3.243 1.00 2.30 H new ATOM 0 HG22 VAL A 146 8.851 -6.930 3.577 1.00 2.30 H new ATOM 0 HG23 VAL A 146 10.111 -6.744 4.820 1.00 2.30 H new ATOM 2095 N ASP A 147 8.594 -10.807 6.862 1.00 51.33 N ATOM 2096 CA ASP A 147 8.220 -12.159 7.279 1.00 4.20 C ATOM 2097 C ASP A 147 6.859 -12.118 7.955 1.00 10.21 C ATOM 2098 O ASP A 147 5.993 -12.948 7.684 1.00 34.10 O ATOM 2099 CB ASP A 147 9.263 -12.751 8.235 1.00 73.05 C ATOM 2100 CG ASP A 147 8.801 -14.065 8.880 1.00 31.42 C ATOM 2101 OD1 ASP A 147 8.188 -14.029 9.972 1.00 4.20 O ATOM 2102 OD2 ASP A 147 9.106 -15.155 8.331 1.00 21.10 O ATOM 0 H ASP A 147 9.481 -10.479 7.244 1.00 51.33 H new ATOM 0 HA ASP A 147 8.175 -12.796 6.396 1.00 4.20 H new ATOM 0 HB2 ASP A 147 10.191 -12.926 7.690 1.00 73.05 H new ATOM 0 HB3 ASP A 147 9.485 -12.026 9.018 1.00 73.05 H new ATOM 2106 N LYS A 148 6.632 -11.107 8.795 1.00 10.10 N ATOM 2107 CA LYS A 148 5.439 -11.096 9.633 1.00 11.30 C ATOM 2108 C LYS A 148 4.236 -10.570 8.874 1.00 52.25 C ATOM 2109 O LYS A 148 3.111 -10.758 9.340 1.00 63.14 O ATOM 2110 CB LYS A 148 5.680 -10.362 10.959 1.00 54.22 C ATOM 2111 CG LYS A 148 6.331 -8.986 10.859 1.00 22.40 C ATOM 2112 CD LYS A 148 6.408 -8.278 12.219 1.00 12.51 C ATOM 2113 CE LYS A 148 5.127 -7.487 12.508 1.00 12.54 C ATOM 2114 NZ LYS A 148 4.120 -8.227 13.295 1.00 72.45 N ATOM 0 H LYS A 148 7.247 -10.301 8.910 1.00 10.10 H new ATOM 0 HA LYS A 148 5.209 -12.128 9.900 1.00 11.30 H new ATOM 0 HB2 LYS A 148 4.723 -10.252 11.468 1.00 54.22 H new ATOM 0 HB3 LYS A 148 6.306 -10.992 11.590 1.00 54.22 H new ATOM 0 HG2 LYS A 148 7.335 -9.091 10.449 1.00 22.40 H new ATOM 0 HG3 LYS A 148 5.765 -8.368 10.162 1.00 22.40 H new ATOM 0 HD2 LYS A 148 6.569 -9.015 13.006 1.00 12.51 H new ATOM 0 HD3 LYS A 148 7.265 -7.604 12.233 1.00 12.51 H new ATOM 0 HE2 LYS A 148 5.390 -6.575 13.043 1.00 12.54 H new ATOM 0 HE3 LYS A 148 4.680 -7.184 11.561 1.00 12.54 H new ATOM 0 HZ1 LYS A 148 3.479 -7.553 13.760 1.00 72.45 H new ATOM 0 HZ2 LYS A 148 3.573 -8.847 12.664 1.00 72.45 H new ATOM 0 HZ3 LYS A 148 4.598 -8.803 14.017 1.00 72.45 H new ATOM 2124 N TRP A 149 4.433 -9.919 7.731 1.00 72.03 N ATOM 2125 CA TRP A 149 3.330 -9.427 6.928 1.00 25.33 C ATOM 2126 C TRP A 149 2.896 -10.434 5.869 1.00 10.50 C ATOM 2127 O TRP A 149 1.832 -10.220 5.303 1.00 71.24 O ATOM 2128 CB TRP A 149 3.694 -8.069 6.326 1.00 25.40 C ATOM 2129 CG TRP A 149 3.936 -6.968 7.329 1.00 1.32 C ATOM 2130 CD1 TRP A 149 3.583 -6.983 8.638 1.00 64.44 C ATOM 2131 CD2 TRP A 149 4.586 -5.677 7.119 1.00 3.40 C ATOM 2132 NE1 TRP A 149 3.984 -5.812 9.243 1.00 70.34 N ATOM 2133 CE2 TRP A 149 4.507 -4.926 8.329 1.00 11.32 C ATOM 2134 CE3 TRP A 149 5.197 -5.046 6.017 1.00 44.43 C ATOM 2135 CZ2 TRP A 149 4.939 -3.593 8.420 1.00 73.22 C ATOM 2136 CZ3 TRP A 149 5.659 -3.718 6.101 1.00 63.24 C ATOM 2137 CH2 TRP A 149 5.503 -2.981 7.287 1.00 21.21 C ATOM 0 H TRP A 149 5.355 -9.722 7.342 1.00 72.03 H new ATOM 0 HA TRP A 149 2.464 -9.291 7.576 1.00 25.33 H new ATOM 0 HB2 TRP A 149 4.590 -8.188 5.717 1.00 25.40 H new ATOM 0 HB3 TRP A 149 2.892 -7.759 5.656 1.00 25.40 H new ATOM 0 HD1 TRP A 149 3.065 -7.792 9.132 1.00 64.44 H new ATOM 0 HE1 TRP A 149 3.903 -5.625 10.243 1.00 70.34 H new ATOM 0 HE3 TRP A 149 5.313 -5.590 5.091 1.00 44.43 H new ATOM 0 HZ2 TRP A 149 4.840 -3.046 9.346 1.00 73.22 H new ATOM 0 HZ3 TRP A 149 6.137 -3.262 5.247 1.00 63.24 H new ATOM 0 HH2 TRP A 149 5.815 -1.948 7.328 1.00 21.21 H new ATOM 2147 N SER A 150 3.649 -11.512 5.620 1.00 34.34 N ATOM 2148 CA SER A 150 3.411 -12.436 4.512 1.00 30.11 C ATOM 2149 C SER A 150 3.443 -13.889 5.015 1.00 41.53 C ATOM 2150 O SER A 150 4.159 -14.738 4.475 1.00 11.44 O ATOM 2151 CB SER A 150 4.417 -12.115 3.382 1.00 10.42 C ATOM 2152 OG SER A 150 3.764 -11.906 2.141 1.00 70.33 O ATOM 0 H SER A 150 4.453 -11.768 6.193 1.00 34.34 H new ATOM 0 HA SER A 150 2.414 -12.310 4.089 1.00 30.11 H new ATOM 0 HB2 SER A 150 4.989 -11.226 3.646 1.00 10.42 H new ATOM 0 HB3 SER A 150 5.129 -12.935 3.285 1.00 10.42 H new ATOM 0 HG SER A 150 3.957 -11.001 1.818 1.00 70.33 H new ATOM 2157 N LYS A 151 2.670 -14.188 6.065 1.00 12.23 N ATOM 2158 CA LYS A 151 2.558 -15.517 6.668 1.00 72.42 C ATOM 2159 C LYS A 151 1.113 -15.905 6.858 1.00 53.45 C ATOM 2160 O LYS A 151 0.816 -17.120 6.890 1.00 45.13 O ATOM 2161 CB LYS A 151 3.319 -15.551 7.994 1.00 14.21 C ATOM 2162 CG LYS A 151 4.770 -15.955 7.727 1.00 25.31 C ATOM 2163 CD LYS A 151 5.659 -15.761 8.948 1.00 10.14 C ATOM 2164 CE LYS A 151 5.279 -16.637 10.134 1.00 5.32 C ATOM 2165 NZ LYS A 151 6.271 -16.464 11.212 1.00 50.53 N ATOM 0 H LYS A 151 2.089 -13.491 6.531 1.00 12.23 H new ATOM 0 HA LYS A 151 3.004 -16.247 5.993 1.00 72.42 H new ATOM 0 HB2 LYS A 151 3.283 -14.573 8.474 1.00 14.21 H new ATOM 0 HB3 LYS A 151 2.851 -16.259 8.678 1.00 14.21 H new ATOM 0 HG2 LYS A 151 4.803 -17.000 7.419 1.00 25.31 H new ATOM 0 HG3 LYS A 151 5.162 -15.366 6.898 1.00 25.31 H new ATOM 0 HD2 LYS A 151 6.692 -15.971 8.670 1.00 10.14 H new ATOM 0 HD3 LYS A 151 5.617 -14.715 9.253 1.00 10.14 H new ATOM 0 HE2 LYS A 151 4.285 -16.370 10.493 1.00 5.32 H new ATOM 0 HE3 LYS A 151 5.237 -17.682 9.829 1.00 5.32 H new ATOM 0 HZ1 LYS A 151 6.779 -17.359 11.364 1.00 50.53 H new ATOM 0 HZ2 LYS A 151 6.949 -15.723 10.944 1.00 50.53 H new ATOM 0 HZ3 LYS A 151 5.786 -16.188 12.089 1.00 50.53 H new TER 2175 LYS A 151