USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=43 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 111 SER OG : rot 6:sc= 0.271 USER MOD Set 1.2: A 123 TYR OH : rot 17:sc= 0.276 USER MOD Set 2.1: A 74 TYR OH : rot 171:sc= 0.902 USER MOD Set 2.2: A 101 GLN : amide:sc= 0.788 K(o=1.7,f=-2.1) USER MOD Set 3.1: A 25 ASN : amide:sc= 0.372 K(o=2.1,f=1.2) USER MOD Set 3.2: A 31 SER OG : rot 45:sc= 1.73 USER MOD Single : A 1 GLY N :NH3+ -137:sc= 0.0289 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -158:sc= 0.00988 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -176:sc= 0.861 (180deg=0.832) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 56:sc= 0.873 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc=-0.000456 USER MOD Single : A 18 LYS NZ :NH3+ 149:sc= 0.238 (180deg=0.0239) USER MOD Single : A 19 LYS NZ :NH3+ 148:sc= 0.498 (180deg=-0.505) USER MOD Single : A 20 MET CE :methyl -158:sc= -0.38 (180deg=-0.702) 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= -0.022 USER MOD Single : A 47 MET CE :methyl -175:sc= 0 (180deg=-0.0142) USER MOD Single : A 48 TYR OH : rot -40:sc= 1.23 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 170:sc= -0.223 USER MOD Single : A 51 SER OG : rot -48:sc= 0.00385 USER MOD Single : A 57 GLN : amide:sc= 0.0606 X(o=0.061,f=-0.18) USER MOD Single : A 59 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.28) USER MOD Single : A 61 ASN : amide:sc= 1.15 K(o=1.1,f=-1.3) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.898 K(o=0.9,f=0) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 1 K(o=1,f=-0.011) USER MOD Single : A 77 TYR OH : rot -10:sc= 1.17 USER MOD Single : A 84 SER OG : rot 25:sc= 1.18 USER MOD Single : A 88 SER OG : rot 5:sc= 0.312 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 62:sc=-0.00284 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -140:sc= 0.00635 USER MOD Single : A 102 MET CE :methyl 143:sc= -0.083 (180deg=-0.819) USER MOD Single : A 103 LYS NZ :NH3+ -159:sc= 0.153 (180deg=0.0938) USER MOD Single : A 104 ASN : amide:sc= -0.0716 X(o=-0.072,f=-0.0094) USER MOD Single : A 105 TYR OH : rot 165:sc= 0.281 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -129:sc= 0.00324 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00334 USER MOD Single : A 119 ASN : amide:sc= 0.363 K(o=0.36,f=-2.4!) USER MOD Single : A 120 HIS :FLIP no HD1:sc= -0.0653 F(o=-0.92,f=-0.065) 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 HE2:sc= -0.317 K(o=-0.32,f=-2.8!) USER MOD Single : A 128 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 135 ASN :FLIP amide:sc= 0 F(o=-2.1!,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -111:sc= 1.25 (180deg=-0.335) USER MOD Single : A 150 SER OG : rot -160:sc=-0.00146 USER MOD Single : A 151 LYS NZ :NH3+ 173:sc= 0.762 (180deg=0.728) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.386 -21.644 -14.319 1.00 43.21 N ATOM 2 CA GLY A 1 -5.198 -22.638 -13.254 1.00 24.31 C ATOM 3 C GLY A 1 -4.469 -21.989 -12.091 1.00 11.42 C ATOM 4 O GLY A 1 -4.786 -20.855 -11.737 1.00 72.35 O ATOM 0 H1 GLY A 1 -6.349 -21.725 -14.703 1.00 43.21 H new ATOM 0 H2 GLY A 1 -5.247 -20.689 -13.931 1.00 43.21 H new ATOM 0 H3 GLY A 1 -4.695 -21.814 -15.078 1.00 43.21 H new ATOM 0 HA2 GLY A 1 -6.163 -23.023 -12.925 1.00 24.31 H new ATOM 0 HA3 GLY A 1 -4.627 -23.487 -13.629 1.00 24.31 H new ATOM 8 N MET A 2 -3.504 -22.676 -11.483 1.00 13.13 N ATOM 9 CA MET A 2 -2.596 -22.115 -10.486 1.00 13.51 C ATOM 10 C MET A 2 -1.602 -21.167 -11.150 1.00 1.44 C ATOM 11 O MET A 2 -1.061 -21.483 -12.215 1.00 50.43 O ATOM 12 CB MET A 2 -1.820 -23.251 -9.796 1.00 42.12 C ATOM 13 CG MET A 2 -2.403 -23.553 -8.421 1.00 43.14 C ATOM 14 SD MET A 2 -2.089 -22.285 -7.164 1.00 43.33 S ATOM 15 CE MET A 2 -3.112 -23.033 -5.873 1.00 24.24 C ATOM 0 H MET A 2 -3.328 -23.662 -11.675 1.00 13.13 H new ATOM 0 HA MET A 2 -3.183 -21.565 -9.750 1.00 13.51 H new ATOM 0 HB2 MET A 2 -1.854 -24.148 -10.415 1.00 42.12 H new ATOM 0 HB3 MET A 2 -0.771 -22.972 -9.697 1.00 42.12 H new ATOM 0 HG2 MET A 2 -3.480 -23.686 -8.520 1.00 43.14 H new ATOM 0 HG3 MET A 2 -1.995 -24.501 -8.070 1.00 43.14 H new ATOM 0 HE1 MET A 2 -3.076 -22.415 -4.976 1.00 24.24 H new ATOM 0 HE2 MET A 2 -4.142 -23.106 -6.222 1.00 24.24 H new ATOM 0 HE3 MET A 2 -2.735 -24.029 -5.642 1.00 24.24 H new ATOM 23 N ALA A 3 -1.323 -20.040 -10.496 1.00 22.44 N ATOM 24 CA ALA A 3 -0.147 -19.194 -10.678 1.00 22.24 C ATOM 25 C ALA A 3 -0.189 -18.147 -9.567 1.00 52.33 C ATOM 26 O ALA A 3 -1.126 -17.347 -9.536 1.00 12.33 O ATOM 27 CB ALA A 3 -0.163 -18.480 -12.036 1.00 43.53 C ATOM 0 H ALA A 3 -1.951 -19.672 -9.782 1.00 22.44 H new ATOM 0 HA ALA A 3 0.755 -19.805 -10.643 1.00 22.24 H new ATOM 0 HB1 ALA A 3 0.729 -17.861 -12.132 1.00 43.53 H new ATOM 0 HB2 ALA A 3 -0.179 -19.220 -12.836 1.00 43.53 H new ATOM 0 HB3 ALA A 3 -1.051 -17.851 -12.106 1.00 43.53 H new ATOM 33 N LYS A 4 0.764 -18.143 -8.635 1.00 53.55 N ATOM 34 CA LYS A 4 0.864 -17.067 -7.654 1.00 61.24 C ATOM 35 C LYS A 4 1.803 -15.986 -8.189 1.00 63.03 C ATOM 36 O LYS A 4 2.958 -16.298 -8.486 1.00 73.04 O ATOM 37 CB LYS A 4 1.301 -17.581 -6.288 1.00 1.21 C ATOM 38 CG LYS A 4 0.497 -18.783 -5.779 1.00 70.34 C ATOM 39 CD LYS A 4 0.757 -18.921 -4.281 1.00 13.43 C ATOM 40 CE LYS A 4 0.541 -20.339 -3.733 1.00 70.34 C ATOM 41 NZ LYS A 4 -0.841 -20.822 -3.951 1.00 24.15 N ATOM 0 H LYS A 4 1.474 -18.870 -8.540 1.00 53.55 H new ATOM 0 HA LYS A 4 -0.124 -16.631 -7.505 1.00 61.24 H new ATOM 0 HB2 LYS A 4 2.354 -17.858 -6.337 1.00 1.21 H new ATOM 0 HB3 LYS A 4 1.218 -16.770 -5.564 1.00 1.21 H new ATOM 0 HG2 LYS A 4 -0.566 -18.639 -5.970 1.00 70.34 H new ATOM 0 HG3 LYS A 4 0.795 -19.691 -6.303 1.00 70.34 H new ATOM 0 HD2 LYS A 4 1.782 -18.615 -4.072 1.00 13.43 H new ATOM 0 HD3 LYS A 4 0.103 -18.233 -3.745 1.00 13.43 H new ATOM 0 HE2 LYS A 4 1.242 -21.022 -4.213 1.00 70.34 H new ATOM 0 HE3 LYS A 4 0.764 -20.351 -2.666 1.00 70.34 H new ATOM 0 HZ1 LYS A 4 -1.055 -21.580 -3.272 1.00 24.15 H new ATOM 0 HZ2 LYS A 4 -1.509 -20.037 -3.814 1.00 24.15 H new ATOM 0 HZ3 LYS A 4 -0.932 -21.189 -4.920 1.00 24.15 H new ATOM 51 N LYS A 5 1.307 -14.753 -8.347 1.00 65.14 N ATOM 52 CA LYS A 5 2.060 -13.597 -8.843 1.00 50.54 C ATOM 53 C LYS A 5 2.018 -12.477 -7.818 1.00 13.24 C ATOM 54 O LYS A 5 1.162 -12.504 -6.938 1.00 62.41 O ATOM 55 CB LYS A 5 1.493 -13.021 -10.144 1.00 54.35 C ATOM 56 CG LYS A 5 0.924 -13.952 -11.202 1.00 1.51 C ATOM 57 CD LYS A 5 -0.536 -14.283 -10.897 1.00 12.41 C ATOM 58 CE LYS A 5 -1.289 -14.757 -12.137 1.00 3.22 C ATOM 59 NZ LYS A 5 -1.455 -13.689 -13.153 1.00 3.50 N ATOM 0 H LYS A 5 0.338 -14.526 -8.125 1.00 65.14 H new ATOM 0 HA LYS A 5 3.072 -13.958 -9.025 1.00 50.54 H new ATOM 0 HB2 LYS A 5 0.705 -12.319 -9.872 1.00 54.35 H new ATOM 0 HB3 LYS A 5 2.287 -12.441 -10.615 1.00 54.35 H new ATOM 0 HG2 LYS A 5 0.999 -13.485 -12.184 1.00 1.51 H new ATOM 0 HG3 LYS A 5 1.511 -14.870 -11.240 1.00 1.51 H new ATOM 0 HD2 LYS A 5 -0.579 -15.056 -10.130 1.00 12.41 H new ATOM 0 HD3 LYS A 5 -1.030 -13.401 -10.489 1.00 12.41 H new ATOM 0 HE2 LYS A 5 -0.754 -15.596 -12.583 1.00 3.22 H new ATOM 0 HE3 LYS A 5 -2.271 -15.126 -11.841 1.00 3.22 H new ATOM 0 HZ1 LYS A 5 -2.031 -14.047 -13.942 1.00 3.50 H new ATOM 0 HZ2 LYS A 5 -1.929 -12.870 -12.722 1.00 3.50 H new ATOM 0 HZ3 LYS A 5 -0.521 -13.400 -13.509 1.00 3.50 H new ATOM 69 N THR A 6 2.850 -11.456 -8.001 1.00 23.34 N ATOM 70 CA THR A 6 3.226 -10.516 -6.954 1.00 14.40 C ATOM 71 C THR A 6 3.528 -9.123 -7.538 1.00 43.55 C ATOM 72 O THR A 6 4.647 -8.865 -7.991 1.00 5.53 O ATOM 73 CB THR A 6 4.400 -11.121 -6.165 1.00 10.32 C ATOM 74 OG1 THR A 6 4.031 -12.366 -5.603 1.00 61.22 O ATOM 75 CG2 THR A 6 4.850 -10.203 -5.029 1.00 34.21 C ATOM 0 H THR A 6 3.289 -11.256 -8.900 1.00 23.34 H new ATOM 0 HA THR A 6 2.398 -10.357 -6.263 1.00 14.40 H new ATOM 0 HB THR A 6 5.221 -11.249 -6.871 1.00 10.32 H new ATOM 0 HG1 THR A 6 4.789 -12.738 -5.106 1.00 61.22 H new ATOM 0 HG21 THR A 6 5.681 -10.665 -4.495 1.00 34.21 H new ATOM 0 HG22 THR A 6 5.170 -9.246 -5.440 1.00 34.21 H new ATOM 0 HG23 THR A 6 4.020 -10.043 -4.340 1.00 34.21 H new ATOM 83 N LEU A 7 2.538 -8.220 -7.542 1.00 64.21 N ATOM 84 CA LEU A 7 2.668 -6.864 -8.099 1.00 32.11 C ATOM 85 C LEU A 7 3.244 -5.895 -7.049 1.00 14.41 C ATOM 86 O LEU A 7 3.058 -6.110 -5.853 1.00 51.43 O ATOM 87 CB LEU A 7 1.290 -6.389 -8.599 1.00 62.23 C ATOM 88 CG LEU A 7 1.290 -5.016 -9.308 1.00 2.51 C ATOM 89 CD1 LEU A 7 2.073 -5.002 -10.621 1.00 4.44 C ATOM 90 CD2 LEU A 7 -0.139 -4.584 -9.608 1.00 53.51 C ATOM 0 H LEU A 7 1.614 -8.411 -7.155 1.00 64.21 H new ATOM 0 HA LEU A 7 3.363 -6.882 -8.939 1.00 32.11 H new ATOM 0 HB2 LEU A 7 0.892 -7.136 -9.286 1.00 62.23 H new ATOM 0 HB3 LEU A 7 0.608 -6.342 -7.750 1.00 62.23 H new ATOM 0 HG LEU A 7 1.782 -4.329 -8.619 1.00 2.51 H new ATOM 0 HD11 LEU A 7 2.028 -4.006 -11.061 1.00 4.44 H new ATOM 0 HD12 LEU A 7 3.112 -5.267 -10.428 1.00 4.44 H new ATOM 0 HD13 LEU A 7 1.637 -5.724 -11.312 1.00 4.44 H new ATOM 0 HD21 LEU A 7 -0.129 -3.615 -10.108 1.00 53.51 H new ATOM 0 HD22 LEU A 7 -0.614 -5.321 -10.255 1.00 53.51 H new ATOM 0 HD23 LEU A 7 -0.699 -4.506 -8.676 1.00 53.51 H new ATOM 101 N ILE A 8 3.898 -4.806 -7.474 1.00 54.53 N ATOM 102 CA ILE A 8 4.590 -3.823 -6.635 1.00 74.24 C ATOM 103 C ILE A 8 4.172 -2.412 -7.071 1.00 13.30 C ATOM 104 O ILE A 8 4.525 -1.994 -8.175 1.00 5.21 O ATOM 105 CB ILE A 8 6.119 -4.038 -6.775 1.00 10.30 C ATOM 106 CG1 ILE A 8 6.570 -5.426 -6.269 1.00 22.11 C ATOM 107 CG2 ILE A 8 6.961 -2.970 -6.054 1.00 11.53 C ATOM 108 CD1 ILE A 8 7.845 -5.885 -6.967 1.00 23.02 C ATOM 0 H ILE A 8 3.961 -4.576 -8.466 1.00 54.53 H new ATOM 0 HA ILE A 8 4.322 -3.945 -5.586 1.00 74.24 H new ATOM 0 HB ILE A 8 6.297 -3.958 -7.847 1.00 10.30 H new ATOM 0 HG12 ILE A 8 6.737 -5.386 -5.193 1.00 22.11 H new ATOM 0 HG13 ILE A 8 5.777 -6.153 -6.442 1.00 22.11 H new ATOM 0 HG21 ILE A 8 8.020 -3.185 -6.195 1.00 11.53 H new ATOM 0 HG22 ILE A 8 6.732 -1.987 -6.466 1.00 11.53 H new ATOM 0 HG23 ILE A 8 6.728 -2.980 -4.989 1.00 11.53 H new ATOM 0 HD11 ILE A 8 8.135 -6.865 -6.588 1.00 23.02 H new ATOM 0 HD12 ILE A 8 7.669 -5.949 -8.041 1.00 23.02 H new ATOM 0 HD13 ILE A 8 8.644 -5.170 -6.772 1.00 23.02 H new ATOM 119 N LEU A 9 3.444 -1.653 -6.243 1.00 51.15 N ATOM 120 CA LEU A 9 3.075 -0.260 -6.535 1.00 32.41 C ATOM 121 C LEU A 9 3.923 0.660 -5.663 1.00 42.13 C ATOM 122 O LEU A 9 3.927 0.522 -4.438 1.00 70.41 O ATOM 123 CB LEU A 9 1.594 -0.001 -6.224 1.00 52.42 C ATOM 124 CG LEU A 9 0.557 -0.483 -7.260 1.00 44.43 C ATOM 125 CD1 LEU A 9 0.499 0.459 -8.458 1.00 12.51 C ATOM 126 CD2 LEU A 9 0.789 -1.898 -7.770 1.00 45.12 C ATOM 0 H LEU A 9 3.092 -1.989 -5.346 1.00 51.15 H new ATOM 0 HA LEU A 9 3.247 -0.069 -7.594 1.00 32.41 H new ATOM 0 HB2 LEU A 9 1.362 -0.474 -5.270 1.00 52.42 H new ATOM 0 HB3 LEU A 9 1.461 1.072 -6.088 1.00 52.42 H new ATOM 0 HG LEU A 9 -0.389 -0.483 -6.719 1.00 44.43 H new ATOM 0 HD11 LEU A 9 -0.240 0.095 -9.172 1.00 12.51 H new ATOM 0 HD12 LEU A 9 0.218 1.457 -8.123 1.00 12.51 H new ATOM 0 HD13 LEU A 9 1.477 0.499 -8.937 1.00 12.51 H new ATOM 0 HD21 LEU A 9 0.015 -2.156 -8.493 1.00 45.12 H new ATOM 0 HD22 LEU A 9 1.767 -1.957 -8.248 1.00 45.12 H new ATOM 0 HD23 LEU A 9 0.751 -2.597 -6.934 1.00 45.12 H new ATOM 137 N TYR A 10 4.602 1.629 -6.274 1.00 43.35 N ATOM 138 CA TYR A 10 5.586 2.473 -5.610 1.00 44.52 C ATOM 139 C TYR A 10 5.288 3.942 -5.897 1.00 13.40 C ATOM 140 O TYR A 10 5.808 4.522 -6.849 1.00 74.33 O ATOM 141 CB TYR A 10 6.997 1.999 -6.012 1.00 25.40 C ATOM 142 CG TYR A 10 7.322 1.935 -7.500 1.00 64.12 C ATOM 143 CD1 TYR A 10 6.784 0.919 -8.318 1.00 3.14 C ATOM 144 CD2 TYR A 10 8.202 2.876 -8.065 1.00 71.02 C ATOM 145 CE1 TYR A 10 7.083 0.877 -9.693 1.00 1.10 C ATOM 146 CE2 TYR A 10 8.534 2.817 -9.427 1.00 23.34 C ATOM 147 CZ TYR A 10 7.969 1.823 -10.254 1.00 43.45 C ATOM 148 OH TYR A 10 8.325 1.774 -11.570 1.00 71.22 O ATOM 0 H TYR A 10 4.480 1.851 -7.262 1.00 43.35 H new ATOM 0 HA TYR A 10 5.533 2.382 -4.525 1.00 44.52 H new ATOM 0 HB2 TYR A 10 7.722 2.661 -5.538 1.00 25.40 H new ATOM 0 HB3 TYR A 10 7.150 1.005 -5.591 1.00 25.40 H new ATOM 0 HD1 TYR A 10 6.138 0.168 -7.886 1.00 3.14 H new ATOM 0 HD2 TYR A 10 8.626 3.651 -7.444 1.00 71.02 H new ATOM 0 HE1 TYR A 10 6.634 0.120 -10.320 1.00 1.10 H new ATOM 0 HE2 TYR A 10 9.225 3.535 -9.844 1.00 23.34 H new ATOM 0 HH TYR A 10 8.942 2.509 -11.770 1.00 71.22 H new ATOM 157 N TYR A 11 4.390 4.538 -5.106 1.00 2.12 N ATOM 158 CA TYR A 11 3.891 5.899 -5.295 1.00 53.24 C ATOM 159 C TYR A 11 4.967 6.851 -4.748 1.00 45.24 C ATOM 160 O TYR A 11 5.051 6.965 -3.525 1.00 54.25 O ATOM 161 CB TYR A 11 2.525 6.100 -4.608 1.00 42.43 C ATOM 162 CG TYR A 11 2.183 7.541 -4.276 1.00 12.14 C ATOM 163 CD1 TYR A 11 1.784 8.407 -5.307 1.00 24.13 C ATOM 164 CD2 TYR A 11 2.381 8.060 -2.988 1.00 43.13 C ATOM 165 CE1 TYR A 11 1.685 9.785 -5.091 1.00 61.23 C ATOM 166 CE2 TYR A 11 2.224 9.439 -2.744 1.00 63.43 C ATOM 167 CZ TYR A 11 1.908 10.312 -3.806 1.00 71.45 C ATOM 168 OH TYR A 11 1.851 11.656 -3.615 1.00 65.45 O ATOM 0 H TYR A 11 3.981 4.073 -4.296 1.00 2.12 H new ATOM 0 HA TYR A 11 3.715 6.105 -6.351 1.00 53.24 H new ATOM 0 HB2 TYR A 11 1.746 5.697 -5.255 1.00 42.43 H new ATOM 0 HB3 TYR A 11 2.508 5.516 -3.688 1.00 42.43 H new ATOM 0 HD1 TYR A 11 1.550 8.003 -6.281 1.00 24.13 H new ATOM 0 HD2 TYR A 11 2.655 7.399 -2.179 1.00 43.13 H new ATOM 0 HE1 TYR A 11 1.438 10.444 -5.910 1.00 61.23 H new ATOM 0 HE2 TYR A 11 2.346 9.828 -1.744 1.00 63.43 H new ATOM 0 HH TYR A 11 2.026 11.860 -2.673 1.00 65.45 H new ATOM 177 N SER A 12 5.834 7.423 -5.596 1.00 73.32 N ATOM 178 CA SER A 12 6.834 8.462 -5.318 1.00 73.33 C ATOM 179 C SER A 12 7.668 8.692 -6.595 1.00 32.00 C ATOM 180 O SER A 12 8.889 8.512 -6.617 1.00 12.43 O ATOM 181 CB SER A 12 7.747 8.150 -4.113 1.00 54.35 C ATOM 182 OG SER A 12 7.209 8.523 -2.859 1.00 10.34 O ATOM 0 H SER A 12 5.855 7.146 -6.578 1.00 73.32 H new ATOM 0 HA SER A 12 6.297 9.368 -5.036 1.00 73.33 H new ATOM 0 HB2 SER A 12 7.958 7.081 -4.100 1.00 54.35 H new ATOM 0 HB3 SER A 12 8.699 8.661 -4.253 1.00 54.35 H new ATOM 0 HG SER A 12 6.333 8.101 -2.740 1.00 10.34 H new ATOM 187 N TRP A 13 6.990 9.128 -7.656 1.00 43.54 N ATOM 188 CA TRP A 13 7.516 9.485 -8.969 1.00 55.12 C ATOM 189 C TRP A 13 8.519 8.477 -9.565 1.00 20.22 C ATOM 190 O TRP A 13 8.710 7.351 -9.110 1.00 63.12 O ATOM 191 CB TRP A 13 8.035 10.938 -8.922 1.00 15.23 C ATOM 192 CG TRP A 13 7.414 11.897 -9.896 1.00 2.31 C ATOM 193 CD1 TRP A 13 8.064 12.522 -10.906 1.00 64.03 C ATOM 194 CD2 TRP A 13 6.067 12.469 -9.880 1.00 3.24 C ATOM 195 NE1 TRP A 13 7.220 13.435 -11.507 1.00 21.13 N ATOM 196 CE2 TRP A 13 5.995 13.485 -10.879 1.00 62.01 C ATOM 197 CE3 TRP A 13 4.914 12.278 -9.087 1.00 20.32 C ATOM 198 CZ2 TRP A 13 4.863 14.299 -11.046 1.00 31.14 C ATOM 199 CZ3 TRP A 13 3.770 13.084 -9.249 1.00 20.41 C ATOM 200 CH2 TRP A 13 3.749 14.108 -10.211 1.00 73.12 C ATOM 0 H TRP A 13 5.978 9.250 -7.614 1.00 43.54 H new ATOM 0 HA TRP A 13 6.694 9.429 -9.683 1.00 55.12 H new ATOM 0 HB2 TRP A 13 7.880 11.325 -7.915 1.00 15.23 H new ATOM 0 HB3 TRP A 13 9.111 10.923 -9.095 1.00 15.23 H new ATOM 0 HD1 TRP A 13 9.087 12.335 -11.197 1.00 64.03 H new ATOM 0 HE1 TRP A 13 7.473 14.002 -12.316 1.00 21.13 H new ATOM 0 HE3 TRP A 13 4.909 11.497 -8.341 1.00 20.32 H new ATOM 0 HZ2 TRP A 13 4.849 15.064 -11.808 1.00 31.14 H new ATOM 0 HZ3 TRP A 13 2.902 12.914 -8.629 1.00 20.41 H new ATOM 0 HH2 TRP A 13 2.882 14.744 -10.308 1.00 73.12 H new ATOM 210 N SER A 14 9.143 8.869 -10.671 1.00 15.33 N ATOM 211 CA SER A 14 10.000 8.023 -11.490 1.00 62.25 C ATOM 212 C SER A 14 11.412 7.804 -10.917 1.00 41.24 C ATOM 213 O SER A 14 12.288 7.362 -11.674 1.00 71.21 O ATOM 214 CB SER A 14 10.061 8.649 -12.887 1.00 62.12 C ATOM 215 OG SER A 14 8.750 8.926 -13.349 1.00 4.52 O ATOM 0 H SER A 14 9.062 9.819 -11.034 1.00 15.33 H new ATOM 0 HA SER A 14 9.565 7.024 -11.517 1.00 62.25 H new ATOM 0 HB2 SER A 14 10.647 9.567 -12.858 1.00 62.12 H new ATOM 0 HB3 SER A 14 10.564 7.971 -13.577 1.00 62.12 H new ATOM 0 HG SER A 14 8.796 9.328 -14.242 1.00 4.52 H new ATOM 220 N GLY A 15 11.675 8.131 -9.645 1.00 55.11 N ATOM 221 CA GLY A 15 13.037 8.117 -9.124 1.00 64.11 C ATOM 222 C GLY A 15 13.200 8.170 -7.607 1.00 42.41 C ATOM 223 O GLY A 15 14.305 7.867 -7.161 1.00 54.55 O ATOM 0 H GLY A 15 10.965 8.406 -8.967 1.00 55.11 H new ATOM 0 HA2 GLY A 15 13.529 7.214 -9.486 1.00 64.11 H new ATOM 0 HA3 GLY A 15 13.572 8.965 -9.552 1.00 64.11 H new ATOM 227 N GLU A 16 12.187 8.493 -6.793 1.00 55.54 N ATOM 228 CA GLU A 16 12.382 8.465 -5.340 1.00 13.14 C ATOM 229 C GLU A 16 12.398 7.011 -4.856 1.00 1.24 C ATOM 230 O GLU A 16 13.253 6.626 -4.054 1.00 12.22 O ATOM 231 CB GLU A 16 11.307 9.274 -4.588 1.00 42.44 C ATOM 232 CG GLU A 16 11.838 10.532 -3.898 1.00 42.25 C ATOM 233 CD GLU A 16 11.796 11.767 -4.798 1.00 33.43 C ATOM 234 OE1 GLU A 16 12.517 11.783 -5.826 1.00 15.33 O ATOM 235 OE2 GLU A 16 11.054 12.714 -4.453 1.00 0.53 O ATOM 0 H GLU A 16 11.255 8.768 -7.102 1.00 55.54 H new ATOM 0 HA GLU A 16 13.340 8.938 -5.121 1.00 13.14 H new ATOM 0 HB2 GLU A 16 10.526 9.561 -5.292 1.00 42.44 H new ATOM 0 HB3 GLU A 16 10.842 8.632 -3.840 1.00 42.44 H new ATOM 0 HG2 GLU A 16 11.251 10.723 -3.000 1.00 42.25 H new ATOM 0 HG3 GLU A 16 12.865 10.358 -3.576 1.00 42.25 H new ATOM 240 N THR A 17 11.459 6.189 -5.325 1.00 72.14 N ATOM 241 CA THR A 17 11.263 4.811 -4.873 1.00 40.43 C ATOM 242 C THR A 17 11.783 3.768 -5.863 1.00 31.43 C ATOM 243 O THR A 17 11.872 2.598 -5.501 1.00 42.45 O ATOM 244 CB THR A 17 9.769 4.595 -4.582 1.00 3.13 C ATOM 245 OG1 THR A 17 8.979 5.290 -5.531 1.00 33.41 O ATOM 246 CG2 THR A 17 9.438 5.101 -3.178 1.00 50.31 C ATOM 0 H THR A 17 10.797 6.470 -6.048 1.00 72.14 H new ATOM 0 HA THR A 17 11.851 4.670 -3.966 1.00 40.43 H new ATOM 0 HB THR A 17 9.550 3.529 -4.648 1.00 3.13 H new ATOM 0 HG1 THR A 17 8.030 5.144 -5.336 1.00 33.41 H new ATOM 0 HG21 THR A 17 8.378 4.946 -2.976 1.00 50.31 H new ATOM 0 HG22 THR A 17 10.031 4.554 -2.445 1.00 50.31 H new ATOM 0 HG23 THR A 17 9.668 6.164 -3.111 1.00 50.31 H new ATOM 254 N LYS A 18 12.179 4.167 -7.078 1.00 53.34 N ATOM 255 CA LYS A 18 12.613 3.270 -8.153 1.00 60.24 C ATOM 256 C LYS A 18 13.628 2.233 -7.653 1.00 71.34 C ATOM 257 O LYS A 18 13.432 1.032 -7.859 1.00 0.44 O ATOM 258 CB LYS A 18 13.147 4.123 -9.319 1.00 61.14 C ATOM 259 CG LYS A 18 13.778 3.297 -10.450 1.00 22.00 C ATOM 260 CD LYS A 18 14.220 4.189 -11.617 1.00 3.32 C ATOM 261 CE LYS A 18 13.054 4.420 -12.581 1.00 11.22 C ATOM 262 NZ LYS A 18 13.382 5.379 -13.651 1.00 21.31 N ATOM 0 H LYS A 18 12.207 5.151 -7.347 1.00 53.34 H new ATOM 0 HA LYS A 18 11.765 2.687 -8.513 1.00 60.24 H new ATOM 0 HB2 LYS A 18 12.329 4.717 -9.727 1.00 61.14 H new ATOM 0 HB3 LYS A 18 13.889 4.823 -8.935 1.00 61.14 H new ATOM 0 HG2 LYS A 18 14.637 2.747 -10.065 1.00 22.00 H new ATOM 0 HG3 LYS A 18 13.060 2.558 -10.807 1.00 22.00 H new ATOM 0 HD2 LYS A 18 14.581 5.145 -11.237 1.00 3.32 H new ATOM 0 HD3 LYS A 18 15.051 3.722 -12.146 1.00 3.32 H new ATOM 0 HE2 LYS A 18 12.763 3.469 -13.028 1.00 11.22 H new ATOM 0 HE3 LYS A 18 12.193 4.786 -12.022 1.00 11.22 H new ATOM 0 HZ1 LYS A 18 12.851 5.134 -14.511 1.00 21.31 H new ATOM 0 HZ2 LYS A 18 13.125 6.340 -13.347 1.00 21.31 H new ATOM 0 HZ3 LYS A 18 14.402 5.341 -13.851 1.00 21.31 H new ATOM 272 N LYS A 19 14.661 2.672 -6.931 1.00 0.21 N ATOM 273 CA LYS A 19 15.715 1.816 -6.385 1.00 71.01 C ATOM 274 C LYS A 19 15.265 0.754 -5.417 1.00 44.53 C ATOM 275 O LYS A 19 16.036 -0.145 -5.090 1.00 72.44 O ATOM 276 CB LYS A 19 16.731 2.684 -5.643 1.00 1.34 C ATOM 277 CG LYS A 19 16.233 3.415 -4.366 1.00 23.41 C ATOM 278 CD LYS A 19 16.540 2.685 -3.044 1.00 73.04 C ATOM 279 CE LYS A 19 16.005 3.456 -1.824 1.00 34.04 C ATOM 280 NZ LYS A 19 16.216 2.725 -0.549 1.00 63.33 N ATOM 0 H LYS A 19 14.791 3.658 -6.704 1.00 0.21 H new ATOM 0 HA LYS A 19 16.123 1.301 -7.255 1.00 71.01 H new ATOM 0 HB2 LYS A 19 17.576 2.054 -5.365 1.00 1.34 H new ATOM 0 HB3 LYS A 19 17.108 3.434 -6.338 1.00 1.34 H new ATOM 0 HG2 LYS A 19 16.686 4.406 -4.331 1.00 23.41 H new ATOM 0 HG3 LYS A 19 15.155 3.559 -4.444 1.00 23.41 H new ATOM 0 HD2 LYS A 19 16.096 1.690 -3.067 1.00 73.04 H new ATOM 0 HD3 LYS A 19 17.617 2.551 -2.945 1.00 73.04 H new ATOM 0 HE2 LYS A 19 16.498 4.427 -1.768 1.00 34.04 H new ATOM 0 HE3 LYS A 19 14.940 3.646 -1.957 1.00 34.04 H new ATOM 0 HZ1 LYS A 19 16.365 3.407 0.222 1.00 63.33 H new ATOM 0 HZ2 LYS A 19 15.380 2.143 -0.340 1.00 63.33 H new ATOM 0 HZ3 LYS A 19 17.052 2.112 -0.635 1.00 63.33 H new ATOM 290 N MET A 20 14.070 0.909 -4.887 1.00 54.52 N ATOM 291 CA MET A 20 13.470 -0.007 -3.940 1.00 43.15 C ATOM 292 C MET A 20 12.206 -0.655 -4.505 1.00 72.15 C ATOM 293 O MET A 20 11.493 -1.353 -3.790 1.00 45.12 O ATOM 294 CB MET A 20 13.261 0.704 -2.592 1.00 42.53 C ATOM 295 CG MET A 20 13.821 -0.076 -1.403 1.00 41.12 C ATOM 296 SD MET A 20 13.799 -1.885 -1.527 1.00 11.51 S ATOM 297 CE MET A 20 15.542 -2.111 -1.847 1.00 64.23 C ATOM 0 H MET A 20 13.470 1.703 -5.111 1.00 54.52 H new ATOM 0 HA MET A 20 14.150 -0.839 -3.757 1.00 43.15 H new ATOM 0 HB2 MET A 20 13.735 1.685 -2.629 1.00 42.53 H new ATOM 0 HB3 MET A 20 12.195 0.870 -2.439 1.00 42.53 H new ATOM 0 HG2 MET A 20 14.852 0.241 -1.244 1.00 41.12 H new ATOM 0 HG3 MET A 20 13.259 0.210 -0.514 1.00 41.12 H new ATOM 0 HE1 MET A 20 15.701 -3.073 -2.334 1.00 64.23 H new ATOM 0 HE2 MET A 20 15.899 -1.312 -2.496 1.00 64.23 H new ATOM 0 HE3 MET A 20 16.091 -2.086 -0.906 1.00 64.23 H new ATOM 305 N ALA A 21 11.950 -0.452 -5.799 1.00 63.05 N ATOM 306 CA ALA A 21 10.913 -1.151 -6.538 1.00 61.43 C ATOM 307 C ALA A 21 11.558 -2.216 -7.419 1.00 54.44 C ATOM 308 O ALA A 21 11.151 -3.378 -7.382 1.00 0.53 O ATOM 309 CB ALA A 21 10.103 -0.150 -7.365 1.00 42.41 C ATOM 0 H ALA A 21 12.471 0.216 -6.367 1.00 63.05 H new ATOM 0 HA ALA A 21 10.227 -1.645 -5.850 1.00 61.43 H new ATOM 0 HB1 ALA A 21 9.326 -0.679 -7.918 1.00 42.41 H new ATOM 0 HB2 ALA A 21 9.642 0.582 -6.701 1.00 42.41 H new ATOM 0 HB3 ALA A 21 10.763 0.361 -8.066 1.00 42.41 H new ATOM 315 N GLU A 22 12.571 -1.838 -8.210 1.00 24.42 N ATOM 316 CA GLU A 22 13.067 -2.736 -9.253 1.00 13.42 C ATOM 317 C GLU A 22 13.792 -3.938 -8.656 1.00 55.44 C ATOM 318 O GLU A 22 13.653 -5.058 -9.149 1.00 64.01 O ATOM 319 CB GLU A 22 13.980 -1.990 -10.230 1.00 42.23 C ATOM 320 CG GLU A 22 13.214 -0.889 -10.964 1.00 20.30 C ATOM 321 CD GLU A 22 13.967 -0.419 -12.208 1.00 40.42 C ATOM 322 OE1 GLU A 22 15.034 0.223 -12.057 1.00 35.13 O ATOM 323 OE2 GLU A 22 13.487 -0.627 -13.346 1.00 11.10 O ATOM 0 H GLU A 22 13.051 -0.940 -8.149 1.00 24.42 H new ATOM 0 HA GLU A 22 12.202 -3.106 -9.804 1.00 13.42 H new ATOM 0 HB2 GLU A 22 14.820 -1.555 -9.688 1.00 42.23 H new ATOM 0 HB3 GLU A 22 14.396 -2.692 -10.953 1.00 42.23 H new ATOM 0 HG2 GLU A 22 12.229 -1.258 -11.251 1.00 20.30 H new ATOM 0 HG3 GLU A 22 13.055 -0.045 -10.293 1.00 20.30 H new ATOM 328 N LYS A 23 14.530 -3.714 -7.568 1.00 20.41 N ATOM 329 CA LYS A 23 15.243 -4.750 -6.849 1.00 23.04 C ATOM 330 C LYS A 23 14.275 -5.844 -6.418 1.00 43.41 C ATOM 331 O LYS A 23 14.433 -6.975 -6.869 1.00 42.55 O ATOM 332 CB LYS A 23 16.011 -4.144 -5.668 1.00 45.11 C ATOM 333 CG LYS A 23 17.431 -3.708 -6.068 1.00 22.03 C ATOM 334 CD LYS A 23 17.477 -2.292 -6.663 1.00 72.12 C ATOM 335 CE LYS A 23 18.169 -2.197 -8.025 1.00 41.53 C ATOM 336 NZ LYS A 23 19.616 -2.474 -7.932 1.00 2.34 N ATOM 0 H LYS A 23 14.646 -2.786 -7.160 1.00 20.41 H new ATOM 0 HA LYS A 23 15.981 -5.212 -7.505 1.00 23.04 H new ATOM 0 HB2 LYS A 23 15.463 -3.285 -5.282 1.00 45.11 H new ATOM 0 HB3 LYS A 23 16.070 -4.874 -4.861 1.00 45.11 H new ATOM 0 HG2 LYS A 23 18.079 -3.750 -5.192 1.00 22.03 H new ATOM 0 HG3 LYS A 23 17.831 -4.415 -6.795 1.00 22.03 H new ATOM 0 HD2 LYS A 23 16.457 -1.920 -6.761 1.00 72.12 H new ATOM 0 HD3 LYS A 23 17.991 -1.634 -5.962 1.00 72.12 H new ATOM 0 HE2 LYS A 23 17.708 -2.904 -8.715 1.00 41.53 H new ATOM 0 HE3 LYS A 23 18.017 -1.201 -8.440 1.00 41.53 H new ATOM 0 HZ1 LYS A 23 20.045 -2.399 -8.876 1.00 2.34 H new ATOM 0 HZ2 LYS A 23 20.061 -1.784 -7.294 1.00 2.34 H new ATOM 0 HZ3 LYS A 23 19.762 -3.434 -7.560 1.00 2.34 H new ATOM 346 N ILE A 24 13.265 -5.494 -5.619 1.00 45.14 N ATOM 347 CA ILE A 24 12.233 -6.405 -5.122 1.00 1.20 C ATOM 348 C ILE A 24 11.604 -7.165 -6.295 1.00 43.54 C ATOM 349 O ILE A 24 11.487 -8.384 -6.233 1.00 22.10 O ATOM 350 CB ILE A 24 11.190 -5.588 -4.310 1.00 41.51 C ATOM 351 CG1 ILE A 24 11.862 -4.912 -3.092 1.00 22.12 C ATOM 352 CG2 ILE A 24 9.995 -6.444 -3.862 1.00 25.11 C ATOM 353 CD1 ILE A 24 10.892 -4.172 -2.165 1.00 61.35 C ATOM 0 H ILE A 24 13.139 -4.537 -5.289 1.00 45.14 H new ATOM 0 HA ILE A 24 12.664 -7.152 -4.455 1.00 1.20 H new ATOM 0 HB ILE A 24 10.799 -4.817 -4.974 1.00 41.51 H new ATOM 0 HG12 ILE A 24 12.389 -5.672 -2.515 1.00 22.12 H new ATOM 0 HG13 ILE A 24 12.612 -4.207 -3.451 1.00 22.12 H new ATOM 0 HG21 ILE A 24 9.296 -5.826 -3.299 1.00 25.11 H new ATOM 0 HG22 ILE A 24 9.493 -6.854 -4.738 1.00 25.11 H new ATOM 0 HG23 ILE A 24 10.348 -7.260 -3.231 1.00 25.11 H new ATOM 0 HD11 ILE A 24 11.446 -3.728 -1.338 1.00 61.35 H new ATOM 0 HD12 ILE A 24 10.383 -3.387 -2.724 1.00 61.35 H new ATOM 0 HD13 ILE A 24 10.156 -4.874 -1.773 1.00 61.35 H new ATOM 364 N ASN A 25 11.245 -6.472 -7.382 1.00 70.43 N ATOM 365 CA ASN A 25 10.615 -7.081 -8.554 1.00 43.54 C ATOM 366 C ASN A 25 11.471 -8.176 -9.225 1.00 52.15 C ATOM 367 O ASN A 25 10.972 -9.007 -9.986 1.00 33.11 O ATOM 368 CB ASN A 25 10.275 -5.962 -9.552 1.00 23.24 C ATOM 369 CG ASN A 25 9.654 -6.512 -10.821 1.00 35.44 C ATOM 370 OD1 ASN A 25 10.080 -6.177 -11.922 1.00 34.11 O ATOM 371 ND2 ASN A 25 8.664 -7.370 -10.728 1.00 31.02 N ATOM 0 H ASN A 25 11.386 -5.466 -7.471 1.00 70.43 H new ATOM 0 HA ASN A 25 9.713 -7.594 -8.220 1.00 43.54 H new ATOM 0 HB2 ASN A 25 9.587 -5.256 -9.087 1.00 23.24 H new ATOM 0 HB3 ASN A 25 11.180 -5.408 -9.800 1.00 23.24 H new ATOM 0 HD21 ASN A 25 8.246 -7.760 -11.573 1.00 31.02 H new ATOM 0 HD22 ASN A 25 8.313 -7.646 -9.811 1.00 31.02 H new ATOM 377 N SER A 26 12.769 -8.178 -8.962 1.00 72.01 N ATOM 378 CA SER A 26 13.720 -9.177 -9.401 1.00 2.52 C ATOM 379 C SER A 26 13.832 -10.377 -8.451 1.00 55.44 C ATOM 380 O SER A 26 14.138 -11.475 -8.920 1.00 31.32 O ATOM 381 CB SER A 26 15.060 -8.488 -9.584 1.00 42.25 C ATOM 382 OG SER A 26 15.410 -8.365 -10.946 1.00 2.10 O ATOM 0 H SER A 26 13.206 -7.442 -8.407 1.00 72.01 H new ATOM 0 HA SER A 26 13.369 -9.602 -10.342 1.00 2.52 H new ATOM 0 HB2 SER A 26 15.024 -7.499 -9.128 1.00 42.25 H new ATOM 0 HB3 SER A 26 15.832 -9.052 -9.061 1.00 42.25 H new ATOM 0 HG SER A 26 16.277 -7.915 -11.022 1.00 2.10 H new ATOM 387 N GLU A 27 13.602 -10.181 -7.150 1.00 74.35 N ATOM 388 CA GLU A 27 13.821 -11.168 -6.085 1.00 65.31 C ATOM 389 C GLU A 27 12.625 -12.128 -5.934 1.00 52.44 C ATOM 390 O GLU A 27 12.596 -12.962 -5.029 1.00 63.42 O ATOM 391 CB GLU A 27 14.147 -10.431 -4.760 1.00 61.44 C ATOM 392 CG GLU A 27 15.446 -9.608 -4.877 1.00 51.42 C ATOM 393 CD GLU A 27 16.216 -9.315 -3.579 1.00 63.02 C ATOM 394 OE1 GLU A 27 15.675 -9.416 -2.458 1.00 24.15 O ATOM 395 OE2 GLU A 27 17.418 -8.964 -3.710 1.00 2.55 O ATOM 0 H GLU A 27 13.244 -9.295 -6.794 1.00 74.35 H new ATOM 0 HA GLU A 27 14.672 -11.792 -6.355 1.00 65.31 H new ATOM 0 HB2 GLU A 27 13.320 -9.772 -4.496 1.00 61.44 H new ATOM 0 HB3 GLU A 27 14.246 -11.157 -3.953 1.00 61.44 H new ATOM 0 HG2 GLU A 27 16.118 -10.133 -5.556 1.00 51.42 H new ATOM 0 HG3 GLU A 27 15.200 -8.655 -5.345 1.00 51.42 H new ATOM 400 N ILE A 28 11.613 -12.014 -6.795 1.00 11.10 N ATOM 401 CA ILE A 28 10.308 -12.636 -6.625 1.00 63.44 C ATOM 402 C ILE A 28 9.928 -13.314 -7.940 1.00 12.34 C ATOM 403 O ILE A 28 10.132 -12.743 -9.018 1.00 65.43 O ATOM 404 CB ILE A 28 9.295 -11.548 -6.218 1.00 1.14 C ATOM 405 CG1 ILE A 28 9.654 -10.880 -4.876 1.00 50.53 C ATOM 406 CG2 ILE A 28 7.884 -12.139 -6.103 1.00 14.53 C ATOM 407 CD1 ILE A 28 8.774 -9.657 -4.608 1.00 73.02 C ATOM 0 H ILE A 28 11.685 -11.469 -7.654 1.00 11.10 H new ATOM 0 HA ILE A 28 10.318 -13.393 -5.841 1.00 63.44 H new ATOM 0 HB ILE A 28 9.329 -10.791 -7.002 1.00 1.14 H new ATOM 0 HG12 ILE A 28 9.535 -11.600 -4.066 1.00 50.53 H new ATOM 0 HG13 ILE A 28 10.702 -10.581 -4.886 1.00 50.53 H new ATOM 0 HG21 ILE A 28 7.184 -11.355 -5.815 1.00 14.53 H new ATOM 0 HG22 ILE A 28 7.585 -12.557 -7.064 1.00 14.53 H new ATOM 0 HG23 ILE A 28 7.879 -12.925 -5.348 1.00 14.53 H new ATOM 0 HD11 ILE A 28 9.053 -9.210 -3.654 1.00 73.02 H new ATOM 0 HD12 ILE A 28 8.913 -8.927 -5.405 1.00 73.02 H new ATOM 0 HD13 ILE A 28 7.728 -9.962 -4.573 1.00 73.02 H new ATOM 418 N LYS A 29 9.340 -14.511 -7.856 1.00 71.14 N ATOM 419 CA LYS A 29 8.808 -15.227 -9.006 1.00 10.20 C ATOM 420 C LYS A 29 7.497 -14.602 -9.473 1.00 2.53 C ATOM 421 O LYS A 29 6.652 -14.244 -8.647 1.00 3.24 O ATOM 422 CB LYS A 29 8.597 -16.709 -8.644 1.00 32.30 C ATOM 423 CG LYS A 29 9.559 -17.626 -9.411 1.00 24.24 C ATOM 424 CD LYS A 29 11.000 -17.482 -8.906 1.00 63.14 C ATOM 425 CE LYS A 29 11.979 -18.164 -9.862 1.00 44.23 C ATOM 426 NZ LYS A 29 13.350 -18.138 -9.322 1.00 53.44 N ATOM 0 H LYS A 29 9.222 -15.011 -6.975 1.00 71.14 H new ATOM 0 HA LYS A 29 9.525 -15.158 -9.824 1.00 10.20 H new ATOM 0 HB2 LYS A 29 8.742 -16.845 -7.572 1.00 32.30 H new ATOM 0 HB3 LYS A 29 7.569 -16.994 -8.866 1.00 32.30 H new ATOM 0 HG2 LYS A 29 9.237 -18.662 -9.305 1.00 24.24 H new ATOM 0 HG3 LYS A 29 9.520 -17.388 -10.474 1.00 24.24 H new ATOM 0 HD2 LYS A 29 11.253 -16.426 -8.811 1.00 63.14 H new ATOM 0 HD3 LYS A 29 11.088 -17.922 -7.913 1.00 63.14 H new ATOM 0 HE2 LYS A 29 11.670 -19.196 -10.030 1.00 44.23 H new ATOM 0 HE3 LYS A 29 11.956 -17.663 -10.830 1.00 44.23 H new ATOM 0 HZ1 LYS A 29 13.995 -18.607 -9.990 1.00 53.44 H new ATOM 0 HZ2 LYS A 29 13.651 -17.152 -9.185 1.00 53.44 H new ATOM 0 HZ3 LYS A 29 13.373 -18.637 -8.410 1.00 53.44 H new ATOM 436 N ASP A 30 7.317 -14.528 -10.791 1.00 71.01 N ATOM 437 CA ASP A 30 6.122 -14.062 -11.501 1.00 20.33 C ATOM 438 C ASP A 30 5.744 -12.621 -11.118 1.00 51.54 C ATOM 439 O ASP A 30 4.598 -12.208 -11.283 1.00 72.25 O ATOM 440 CB ASP A 30 4.976 -15.087 -11.345 1.00 61.15 C ATOM 441 CG ASP A 30 4.184 -15.341 -12.635 1.00 20.24 C ATOM 442 OD1 ASP A 30 3.700 -14.397 -13.294 1.00 2.10 O ATOM 443 OD2 ASP A 30 4.045 -16.530 -13.015 1.00 71.33 O ATOM 0 H ASP A 30 8.053 -14.812 -11.438 1.00 71.01 H new ATOM 0 HA ASP A 30 6.342 -14.005 -12.567 1.00 20.33 H new ATOM 0 HB2 ASP A 30 5.393 -16.031 -10.995 1.00 61.15 H new ATOM 0 HB3 ASP A 30 4.291 -14.735 -10.574 1.00 61.15 H new ATOM 447 N SER A 31 6.674 -11.840 -10.553 1.00 2.22 N ATOM 448 CA SER A 31 6.403 -10.495 -10.065 1.00 42.34 C ATOM 449 C SER A 31 6.172 -9.512 -11.216 1.00 55.31 C ATOM 450 O SER A 31 6.615 -9.731 -12.344 1.00 64.11 O ATOM 451 CB SER A 31 7.558 -10.053 -9.163 1.00 74.23 C ATOM 452 OG SER A 31 7.330 -8.813 -8.513 1.00 33.30 O ATOM 0 H SER A 31 7.642 -12.133 -10.424 1.00 2.22 H new ATOM 0 HA SER A 31 5.481 -10.503 -9.484 1.00 42.34 H new ATOM 0 HB2 SER A 31 7.734 -10.821 -8.410 1.00 74.23 H new ATOM 0 HB3 SER A 31 8.466 -9.978 -9.761 1.00 74.23 H new ATOM 0 HG SER A 31 6.418 -8.794 -8.156 1.00 33.30 H new ATOM 457 N GLU A 32 5.539 -8.383 -10.903 1.00 74.11 N ATOM 458 CA GLU A 32 5.505 -7.166 -11.701 1.00 72.24 C ATOM 459 C GLU A 32 5.645 -5.974 -10.765 1.00 51.42 C ATOM 460 O GLU A 32 5.547 -6.100 -9.543 1.00 20.40 O ATOM 461 CB GLU A 32 4.200 -7.033 -12.516 1.00 64.31 C ATOM 462 CG GLU A 32 4.415 -7.517 -13.940 1.00 41.15 C ATOM 463 CD GLU A 32 3.397 -6.949 -14.929 1.00 75.24 C ATOM 464 OE1 GLU A 32 2.172 -7.189 -14.786 1.00 64.23 O ATOM 465 OE2 GLU A 32 3.840 -6.292 -15.899 1.00 51.24 O ATOM 0 H GLU A 32 5.008 -8.291 -10.037 1.00 74.11 H new ATOM 0 HA GLU A 32 6.327 -7.203 -12.416 1.00 72.24 H new ATOM 0 HB2 GLU A 32 3.408 -7.613 -12.043 1.00 64.31 H new ATOM 0 HB3 GLU A 32 3.873 -5.993 -12.524 1.00 64.31 H new ATOM 0 HG2 GLU A 32 5.419 -7.241 -14.263 1.00 41.15 H new ATOM 0 HG3 GLU A 32 4.362 -8.606 -13.959 1.00 41.15 H new ATOM 470 N LEU A 33 5.784 -4.792 -11.352 1.00 2.40 N ATOM 471 CA LEU A 33 5.650 -3.511 -10.720 1.00 62.34 C ATOM 472 C LEU A 33 4.713 -2.620 -11.552 1.00 73.03 C ATOM 473 O LEU A 33 4.554 -2.863 -12.749 1.00 1.23 O ATOM 474 CB LEU A 33 7.051 -2.937 -10.527 1.00 41.12 C ATOM 475 CG LEU A 33 7.755 -2.270 -11.725 1.00 23.11 C ATOM 476 CD1 LEU A 33 9.128 -1.760 -11.260 1.00 51.53 C ATOM 477 CD2 LEU A 33 7.985 -3.207 -12.913 1.00 53.44 C ATOM 0 H LEU A 33 6.007 -4.711 -12.344 1.00 2.40 H new ATOM 0 HA LEU A 33 5.187 -3.583 -9.736 1.00 62.34 H new ATOM 0 HB2 LEU A 33 6.998 -2.201 -9.725 1.00 41.12 H new ATOM 0 HB3 LEU A 33 7.693 -3.745 -10.176 1.00 41.12 H new ATOM 0 HG LEU A 33 7.097 -1.471 -12.065 1.00 23.11 H new ATOM 0 HD11 LEU A 33 9.642 -1.284 -12.096 1.00 51.53 H new ATOM 0 HD12 LEU A 33 8.994 -1.036 -10.457 1.00 51.53 H new ATOM 0 HD13 LEU A 33 9.724 -2.598 -10.898 1.00 51.53 H new ATOM 0 HD21 LEU A 33 8.485 -2.663 -13.714 1.00 53.44 H new ATOM 0 HD22 LEU A 33 8.608 -4.045 -12.600 1.00 53.44 H new ATOM 0 HD23 LEU A 33 7.026 -3.582 -13.272 1.00 53.44 H new ATOM 488 N LYS A 34 4.104 -1.589 -10.955 1.00 24.22 N ATOM 489 CA LYS A 34 3.171 -0.660 -11.605 1.00 3.40 C ATOM 490 C LYS A 34 3.299 0.734 -10.989 1.00 2.22 C ATOM 491 O LYS A 34 3.871 0.888 -9.907 1.00 1.30 O ATOM 492 CB LYS A 34 1.723 -1.181 -11.459 1.00 62.15 C ATOM 493 CG LYS A 34 1.159 -1.875 -12.709 1.00 54.51 C ATOM 494 CD LYS A 34 0.810 -0.846 -13.790 1.00 2.54 C ATOM 495 CE LYS A 34 0.012 -1.435 -14.960 1.00 62.25 C ATOM 496 NZ LYS A 34 0.832 -2.242 -15.883 1.00 63.13 N ATOM 0 H LYS A 34 4.253 -1.370 -9.970 1.00 24.22 H new ATOM 0 HA LYS A 34 3.416 -0.594 -12.665 1.00 3.40 H new ATOM 0 HB2 LYS A 34 1.686 -1.881 -10.624 1.00 62.15 H new ATOM 0 HB3 LYS A 34 1.075 -0.343 -11.202 1.00 62.15 H new ATOM 0 HG2 LYS A 34 1.890 -2.584 -13.098 1.00 54.51 H new ATOM 0 HG3 LYS A 34 0.270 -2.447 -12.443 1.00 54.51 H new ATOM 0 HD2 LYS A 34 0.235 -0.037 -13.339 1.00 2.54 H new ATOM 0 HD3 LYS A 34 1.731 -0.407 -14.173 1.00 2.54 H new ATOM 0 HE2 LYS A 34 -0.793 -2.055 -14.565 1.00 62.25 H new ATOM 0 HE3 LYS A 34 -0.455 -0.623 -15.517 1.00 62.25 H new ATOM 0 HZ1 LYS A 34 0.232 -2.609 -16.649 1.00 63.13 H new ATOM 0 HZ2 LYS A 34 1.585 -1.649 -16.287 1.00 63.13 H new ATOM 0 HZ3 LYS A 34 1.257 -3.037 -15.365 1.00 63.13 H new ATOM 506 N GLU A 35 2.726 1.742 -11.649 1.00 2.13 N ATOM 507 CA GLU A 35 2.839 3.138 -11.236 1.00 22.03 C ATOM 508 C GLU A 35 1.574 3.634 -10.522 1.00 63.35 C ATOM 509 O GLU A 35 0.446 3.284 -10.851 1.00 43.35 O ATOM 510 CB GLU A 35 3.189 4.029 -12.435 1.00 2.53 C ATOM 511 CG GLU A 35 2.131 4.096 -13.546 1.00 22.42 C ATOM 512 CD GLU A 35 2.577 5.069 -14.639 1.00 52.45 C ATOM 513 OE1 GLU A 35 2.617 6.294 -14.362 1.00 0.14 O ATOM 514 OE2 GLU A 35 2.914 4.613 -15.754 1.00 22.02 O ATOM 0 H GLU A 35 2.167 1.609 -12.491 1.00 2.13 H new ATOM 0 HA GLU A 35 3.652 3.201 -10.513 1.00 22.03 H new ATOM 0 HB2 GLU A 35 3.372 5.040 -12.072 1.00 2.53 H new ATOM 0 HB3 GLU A 35 4.123 3.672 -12.869 1.00 2.53 H new ATOM 0 HG2 GLU A 35 1.976 3.105 -13.972 1.00 22.42 H new ATOM 0 HG3 GLU A 35 1.176 4.417 -13.130 1.00 22.42 H new ATOM 519 N VAL A 36 1.781 4.536 -9.568 1.00 51.44 N ATOM 520 CA VAL A 36 0.817 5.183 -8.691 1.00 75.45 C ATOM 521 C VAL A 36 1.153 6.663 -8.555 1.00 54.31 C ATOM 522 O VAL A 36 2.318 7.022 -8.386 1.00 23.52 O ATOM 523 CB VAL A 36 0.733 4.370 -7.381 1.00 43.15 C ATOM 524 CG1 VAL A 36 2.071 3.878 -6.861 1.00 41.35 C ATOM 525 CG2 VAL A 36 -0.298 4.954 -6.394 1.00 1.03 C ATOM 0 H VAL A 36 2.727 4.864 -9.372 1.00 51.44 H new ATOM 0 HA VAL A 36 -0.194 5.183 -9.099 1.00 75.45 H new ATOM 0 HB VAL A 36 0.287 3.401 -7.605 1.00 43.15 H new ATOM 0 HG11 VAL A 36 1.919 3.317 -5.939 1.00 41.35 H new ATOM 0 HG12 VAL A 36 2.536 3.232 -7.606 1.00 41.35 H new ATOM 0 HG13 VAL A 36 2.721 4.731 -6.664 1.00 41.35 H new ATOM 0 HG21 VAL A 36 -0.320 4.347 -5.489 1.00 1.03 H new ATOM 0 HG22 VAL A 36 -0.019 5.976 -6.139 1.00 1.03 H new ATOM 0 HG23 VAL A 36 -1.285 4.952 -6.856 1.00 1.03 H new ATOM 535 N LYS A 37 0.147 7.540 -8.658 1.00 12.20 N ATOM 536 CA LYS A 37 0.221 9.001 -8.621 1.00 23.31 C ATOM 537 C LYS A 37 -0.988 9.516 -7.839 1.00 63.15 C ATOM 538 O LYS A 37 -1.743 8.702 -7.307 1.00 1.20 O ATOM 539 CB LYS A 37 0.246 9.542 -10.060 1.00 23.32 C ATOM 540 CG LYS A 37 1.644 9.405 -10.673 1.00 51.44 C ATOM 541 CD LYS A 37 1.608 9.901 -12.112 1.00 34.54 C ATOM 542 CE LYS A 37 3.025 9.937 -12.679 1.00 1.31 C ATOM 543 NZ LYS A 37 3.058 10.654 -13.964 1.00 42.33 N ATOM 0 H LYS A 37 -0.814 7.219 -8.779 1.00 12.20 H new ATOM 0 HA LYS A 37 1.130 9.342 -8.125 1.00 23.31 H new ATOM 0 HB2 LYS A 37 -0.477 8.999 -10.669 1.00 23.32 H new ATOM 0 HB3 LYS A 37 -0.056 10.589 -10.064 1.00 23.32 H new ATOM 0 HG2 LYS A 37 2.366 9.981 -10.095 1.00 51.44 H new ATOM 0 HG3 LYS A 37 1.968 8.365 -10.642 1.00 51.44 H new ATOM 0 HD2 LYS A 37 0.980 9.247 -12.717 1.00 34.54 H new ATOM 0 HD3 LYS A 37 1.164 10.896 -12.153 1.00 34.54 H new ATOM 0 HE2 LYS A 37 3.693 10.424 -11.969 1.00 1.31 H new ATOM 0 HE3 LYS A 37 3.392 8.920 -12.816 1.00 1.31 H new ATOM 0 HZ1 LYS A 37 4.031 10.666 -14.330 1.00 42.33 H new ATOM 0 HZ2 LYS A 37 2.437 10.173 -14.646 1.00 42.33 H new ATOM 0 HZ3 LYS A 37 2.729 11.631 -13.825 1.00 42.33 H new ATOM 553 N VAL A 38 -1.201 10.833 -7.765 1.00 12.03 N ATOM 554 CA VAL A 38 -2.324 11.447 -7.057 1.00 20.11 C ATOM 555 C VAL A 38 -3.056 12.434 -7.975 1.00 52.02 C ATOM 556 O VAL A 38 -2.426 13.087 -8.807 1.00 1.14 O ATOM 557 CB VAL A 38 -1.860 12.095 -5.732 1.00 53.14 C ATOM 558 CG1 VAL A 38 -1.684 11.025 -4.645 1.00 65.43 C ATOM 559 CG2 VAL A 38 -0.568 12.919 -5.877 1.00 24.53 C ATOM 0 H VAL A 38 -0.584 11.515 -8.206 1.00 12.03 H new ATOM 0 HA VAL A 38 -3.038 10.670 -6.784 1.00 20.11 H new ATOM 0 HB VAL A 38 -2.645 12.792 -5.440 1.00 53.14 H new ATOM 0 HG11 VAL A 38 -1.357 11.498 -3.719 1.00 65.43 H new ATOM 0 HG12 VAL A 38 -2.634 10.517 -4.478 1.00 65.43 H new ATOM 0 HG13 VAL A 38 -0.936 10.300 -4.966 1.00 65.43 H new ATOM 0 HG21 VAL A 38 -0.298 13.346 -4.911 1.00 24.53 H new ATOM 0 HG22 VAL A 38 0.238 12.274 -6.226 1.00 24.53 H new ATOM 0 HG23 VAL A 38 -0.727 13.722 -6.597 1.00 24.53 H new ATOM 569 N SER A 39 -4.381 12.517 -7.848 1.00 32.10 N ATOM 570 CA SER A 39 -5.274 13.475 -8.491 1.00 13.20 C ATOM 571 C SER A 39 -5.000 14.852 -7.904 1.00 62.31 C ATOM 572 O SER A 39 -4.946 15.027 -6.686 1.00 63.31 O ATOM 573 CB SER A 39 -6.726 13.056 -8.240 1.00 35.12 C ATOM 574 OG SER A 39 -7.677 13.862 -8.910 1.00 55.41 O ATOM 0 H SER A 39 -4.893 11.869 -7.249 1.00 32.10 H new ATOM 0 HA SER A 39 -5.105 13.502 -9.567 1.00 13.20 H new ATOM 0 HB2 SER A 39 -6.855 12.020 -8.555 1.00 35.12 H new ATOM 0 HB3 SER A 39 -6.924 13.091 -7.169 1.00 35.12 H new ATOM 0 HG SER A 39 -8.580 13.539 -8.708 1.00 55.41 H new ATOM 579 N GLU A 40 -4.835 15.821 -8.789 1.00 43.22 N ATOM 580 CA GLU A 40 -4.436 17.188 -8.484 1.00 44.12 C ATOM 581 C GLU A 40 -5.647 18.115 -8.610 1.00 53.42 C ATOM 582 O GLU A 40 -6.756 17.663 -8.908 1.00 55.43 O ATOM 583 CB GLU A 40 -3.276 17.604 -9.410 1.00 72.31 C ATOM 584 CG GLU A 40 -1.955 16.913 -9.038 1.00 14.11 C ATOM 585 CD GLU A 40 -0.782 17.270 -9.958 1.00 22.21 C ATOM 586 OE1 GLU A 40 -0.805 18.339 -10.612 1.00 31.10 O ATOM 587 OE2 GLU A 40 0.193 16.483 -10.002 1.00 41.21 O ATOM 0 H GLU A 40 -4.982 15.670 -9.787 1.00 43.22 H new ATOM 0 HA GLU A 40 -4.076 17.260 -7.458 1.00 44.12 H new ATOM 0 HB2 GLU A 40 -3.532 17.361 -10.441 1.00 72.31 H new ATOM 0 HB3 GLU A 40 -3.144 18.685 -9.360 1.00 72.31 H new ATOM 0 HG2 GLU A 40 -1.694 17.179 -8.014 1.00 14.11 H new ATOM 0 HG3 GLU A 40 -2.104 15.833 -9.059 1.00 14.11 H new ATOM 592 N GLY A 41 -5.445 19.409 -8.357 1.00 12.12 N ATOM 593 CA GLY A 41 -6.425 20.462 -8.565 1.00 22.14 C ATOM 594 C GLY A 41 -6.677 21.254 -7.285 1.00 21.42 C ATOM 595 O GLY A 41 -6.528 20.736 -6.175 1.00 52.42 O ATOM 0 H GLY A 41 -4.561 19.759 -7.988 1.00 12.12 H new ATOM 0 HA2 GLY A 41 -6.076 21.135 -9.348 1.00 22.14 H new ATOM 0 HA3 GLY A 41 -7.361 20.025 -8.914 1.00 22.14 H new ATOM 599 N THR A 42 -7.067 22.514 -7.455 1.00 13.00 N ATOM 600 CA THR A 42 -7.614 23.422 -6.451 1.00 22.34 C ATOM 601 C THR A 42 -8.092 24.678 -7.195 1.00 0.24 C ATOM 602 O THR A 42 -7.801 24.851 -8.387 1.00 64.35 O ATOM 603 CB THR A 42 -6.583 23.740 -5.341 1.00 0.01 C ATOM 604 OG1 THR A 42 -7.200 24.482 -4.313 1.00 1.34 O ATOM 605 CG2 THR A 42 -5.362 24.521 -5.827 1.00 13.41 C ATOM 0 H THR A 42 -7.004 22.962 -8.369 1.00 13.00 H new ATOM 0 HA THR A 42 -8.452 22.961 -5.928 1.00 22.34 H new ATOM 0 HB THR A 42 -6.228 22.773 -4.985 1.00 0.01 H new ATOM 0 HG1 THR A 42 -6.544 24.679 -3.613 1.00 1.34 H new ATOM 0 HG21 THR A 42 -4.689 24.703 -4.989 1.00 13.41 H new ATOM 0 HG22 THR A 42 -4.842 23.944 -6.591 1.00 13.41 H new ATOM 0 HG23 THR A 42 -5.683 25.474 -6.248 1.00 13.41 H new ATOM 613 N PHE A 43 -8.786 25.571 -6.491 1.00 0.41 N ATOM 614 CA PHE A 43 -9.223 26.877 -6.975 1.00 51.03 C ATOM 615 C PHE A 43 -9.080 27.912 -5.853 1.00 1.40 C ATOM 616 O PHE A 43 -9.902 28.822 -5.740 1.00 33.11 O ATOM 617 CB PHE A 43 -10.660 26.789 -7.512 1.00 54.24 C ATOM 618 CG PHE A 43 -10.804 25.937 -8.753 1.00 23.24 C ATOM 619 CD1 PHE A 43 -10.546 26.497 -10.018 1.00 61.12 C ATOM 620 CD2 PHE A 43 -11.186 24.586 -8.649 1.00 75.53 C ATOM 621 CE1 PHE A 43 -10.680 25.713 -11.175 1.00 43.22 C ATOM 622 CE2 PHE A 43 -11.314 23.804 -9.807 1.00 55.25 C ATOM 623 CZ PHE A 43 -11.064 24.367 -11.070 1.00 22.14 C ATOM 0 H PHE A 43 -9.070 25.395 -5.527 1.00 0.41 H new ATOM 0 HA PHE A 43 -8.593 27.199 -7.804 1.00 51.03 H new ATOM 0 HB2 PHE A 43 -11.304 26.386 -6.731 1.00 54.24 H new ATOM 0 HB3 PHE A 43 -11.017 27.795 -7.732 1.00 54.24 H new ATOM 0 HD1 PHE A 43 -10.245 27.531 -10.099 1.00 61.12 H new ATOM 0 HD2 PHE A 43 -11.380 24.152 -7.679 1.00 75.53 H new ATOM 0 HE1 PHE A 43 -10.488 26.146 -12.146 1.00 43.22 H new ATOM 0 HE2 PHE A 43 -11.605 22.767 -9.727 1.00 55.25 H new ATOM 0 HZ PHE A 43 -11.167 23.764 -11.960 1.00 22.14 H new ATOM 632 N ASP A 44 -8.076 27.756 -4.991 1.00 41.11 N ATOM 633 CA ASP A 44 -7.727 28.725 -3.956 1.00 14.03 C ATOM 634 C ASP A 44 -6.200 28.887 -3.933 1.00 22.44 C ATOM 635 O ASP A 44 -5.512 28.388 -4.833 1.00 22.30 O ATOM 636 CB ASP A 44 -8.328 28.308 -2.603 1.00 12.12 C ATOM 637 CG ASP A 44 -8.353 29.499 -1.646 1.00 71.42 C ATOM 638 OD1 ASP A 44 -9.240 30.370 -1.820 1.00 21.12 O ATOM 639 OD2 ASP A 44 -7.470 29.589 -0.771 1.00 61.42 O ATOM 0 H ASP A 44 -7.471 26.935 -4.994 1.00 41.11 H new ATOM 0 HA ASP A 44 -8.157 29.702 -4.175 1.00 14.03 H new ATOM 0 HB2 ASP A 44 -9.339 27.928 -2.748 1.00 12.12 H new ATOM 0 HB3 ASP A 44 -7.741 27.497 -2.171 1.00 12.12 H new ATOM 643 N ALA A 45 -5.660 29.614 -2.955 1.00 40.23 N ATOM 644 CA ALA A 45 -4.238 29.849 -2.803 1.00 75.23 C ATOM 645 C ALA A 45 -3.498 28.544 -2.468 1.00 21.31 C ATOM 646 O ALA A 45 -4.110 27.515 -2.178 1.00 64.12 O ATOM 647 CB ALA A 45 -4.025 30.912 -1.719 1.00 34.33 C ATOM 0 H ALA A 45 -6.221 30.064 -2.231 1.00 40.23 H new ATOM 0 HA ALA A 45 -3.824 30.213 -3.743 1.00 75.23 H new ATOM 0 HB1 ALA A 45 -2.958 31.097 -1.596 1.00 34.33 H new ATOM 0 HB2 ALA A 45 -4.522 31.836 -2.013 1.00 34.33 H new ATOM 0 HB3 ALA A 45 -4.443 30.559 -0.776 1.00 34.33 H new ATOM 653 N ASP A 46 -2.165 28.610 -2.489 1.00 3.32 N ATOM 654 CA ASP A 46 -1.235 27.483 -2.405 1.00 11.44 C ATOM 655 C ASP A 46 -1.665 26.332 -3.311 1.00 64.34 C ATOM 656 O ASP A 46 -2.212 25.314 -2.899 1.00 14.01 O ATOM 657 CB ASP A 46 -0.837 27.147 -0.963 1.00 74.43 C ATOM 658 CG ASP A 46 0.448 27.883 -0.571 1.00 25.42 C ATOM 659 OD1 ASP A 46 0.646 29.044 -0.995 1.00 10.31 O ATOM 660 OD2 ASP A 46 1.324 27.294 0.104 1.00 31.31 O ATOM 0 H ASP A 46 -1.678 29.503 -2.570 1.00 3.32 H new ATOM 0 HA ASP A 46 -0.275 27.779 -2.828 1.00 11.44 H new ATOM 0 HB2 ASP A 46 -1.643 27.425 -0.284 1.00 74.43 H new ATOM 0 HB3 ASP A 46 -0.691 26.072 -0.862 1.00 74.43 H new ATOM 664 N MET A 47 -1.389 26.529 -4.602 1.00 12.24 N ATOM 665 CA MET A 47 -1.817 25.725 -5.744 1.00 72.32 C ATOM 666 C MET A 47 -1.185 24.319 -5.787 1.00 64.34 C ATOM 667 O MET A 47 -1.400 23.565 -6.742 1.00 61.14 O ATOM 668 CB MET A 47 -1.526 26.551 -7.009 1.00 43.05 C ATOM 669 CG MET A 47 -2.326 26.091 -8.231 1.00 0.43 C ATOM 670 SD MET A 47 -2.744 27.424 -9.391 1.00 43.11 S ATOM 671 CE MET A 47 -4.087 28.234 -8.470 1.00 2.14 C ATOM 0 H MET A 47 -0.814 27.318 -4.897 1.00 12.24 H new ATOM 0 HA MET A 47 -2.883 25.515 -5.662 1.00 72.32 H new ATOM 0 HB2 MET A 47 -1.751 27.599 -6.810 1.00 43.05 H new ATOM 0 HB3 MET A 47 -0.462 26.491 -7.237 1.00 43.05 H new ATOM 0 HG2 MET A 47 -1.753 25.330 -8.761 1.00 0.43 H new ATOM 0 HG3 MET A 47 -3.247 25.618 -7.891 1.00 0.43 H new ATOM 0 HE1 MET A 47 -4.522 29.025 -9.081 1.00 2.14 H new ATOM 0 HE2 MET A 47 -4.855 27.500 -8.226 1.00 2.14 H new ATOM 0 HE3 MET A 47 -3.690 28.663 -7.550 1.00 2.14 H new ATOM 679 N TYR A 48 -0.411 23.966 -4.763 1.00 0.01 N ATOM 680 CA TYR A 48 0.191 22.678 -4.492 1.00 61.45 C ATOM 681 C TYR A 48 -0.416 22.240 -3.151 1.00 4.12 C ATOM 682 O TYR A 48 -0.095 22.790 -2.099 1.00 12.41 O ATOM 683 CB TYR A 48 1.734 22.792 -4.527 1.00 4.43 C ATOM 684 CG TYR A 48 2.341 23.952 -3.751 1.00 52.15 C ATOM 685 CD1 TYR A 48 2.575 23.820 -2.371 1.00 33.22 C ATOM 686 CD2 TYR A 48 2.630 25.173 -4.395 1.00 74.14 C ATOM 687 CE1 TYR A 48 2.940 24.936 -1.606 1.00 74.45 C ATOM 688 CE2 TYR A 48 3.056 26.282 -3.641 1.00 20.14 C ATOM 689 CZ TYR A 48 3.146 26.179 -2.236 1.00 33.12 C ATOM 690 OH TYR A 48 3.389 27.286 -1.493 1.00 20.21 O ATOM 0 H TYR A 48 -0.172 24.643 -4.039 1.00 0.01 H new ATOM 0 HA TYR A 48 -0.019 21.913 -5.240 1.00 61.45 H new ATOM 0 HB2 TYR A 48 2.155 21.864 -4.140 1.00 4.43 H new ATOM 0 HB3 TYR A 48 2.048 22.875 -5.568 1.00 4.43 H new ATOM 0 HD1 TYR A 48 2.473 22.854 -1.898 1.00 33.22 H new ATOM 0 HD2 TYR A 48 2.524 25.257 -5.467 1.00 74.14 H new ATOM 0 HE1 TYR A 48 3.063 24.843 -0.537 1.00 74.45 H new ATOM 0 HE2 TYR A 48 3.313 27.208 -4.135 1.00 20.14 H new ATOM 0 HH TYR A 48 2.817 27.278 -0.697 1.00 20.21 H new ATOM 699 N LYS A 49 -1.384 21.319 -3.189 1.00 52.15 N ATOM 700 CA LYS A 49 -2.077 20.819 -1.996 1.00 64.41 C ATOM 701 C LYS A 49 -2.388 19.334 -2.163 1.00 62.31 C ATOM 702 O LYS A 49 -3.540 18.911 -2.039 1.00 74.21 O ATOM 703 CB LYS A 49 -3.305 21.692 -1.655 1.00 34.10 C ATOM 704 CG LYS A 49 -4.393 21.802 -2.746 1.00 33.21 C ATOM 705 CD LYS A 49 -5.809 21.510 -2.217 1.00 12.41 C ATOM 706 CE LYS A 49 -6.296 22.467 -1.121 1.00 13.14 C ATOM 707 NZ LYS A 49 -7.403 21.883 -0.333 1.00 53.44 N ATOM 0 H LYS A 49 -1.712 20.895 -4.057 1.00 52.15 H new ATOM 0 HA LYS A 49 -1.425 20.902 -1.127 1.00 64.41 H new ATOM 0 HB2 LYS A 49 -3.766 21.295 -0.751 1.00 34.10 H new ATOM 0 HB3 LYS A 49 -2.955 22.697 -1.419 1.00 34.10 H new ATOM 0 HG2 LYS A 49 -4.371 22.804 -3.173 1.00 33.21 H new ATOM 0 HG3 LYS A 49 -4.162 21.106 -3.553 1.00 33.21 H new ATOM 0 HD2 LYS A 49 -6.509 21.550 -3.052 1.00 12.41 H new ATOM 0 HD3 LYS A 49 -5.834 20.492 -1.828 1.00 12.41 H new ATOM 0 HE2 LYS A 49 -5.467 22.711 -0.457 1.00 13.14 H new ATOM 0 HE3 LYS A 49 -6.627 23.401 -1.575 1.00 13.14 H new ATOM 0 HZ1 LYS A 49 -7.704 22.560 0.397 1.00 53.44 H new ATOM 0 HZ2 LYS A 49 -8.204 21.673 -0.962 1.00 53.44 H new ATOM 0 HZ3 LYS A 49 -7.080 21.005 0.121 1.00 53.44 H new ATOM 717 N THR A 50 -1.400 18.547 -2.592 1.00 70.53 N ATOM 718 CA THR A 50 -1.627 17.197 -3.095 1.00 44.01 C ATOM 719 C THR A 50 -0.420 16.266 -2.889 1.00 24.32 C ATOM 720 O THR A 50 -0.613 15.088 -2.587 1.00 10.24 O ATOM 721 CB THR A 50 -2.004 17.299 -4.589 1.00 72.44 C ATOM 722 OG1 THR A 50 -3.042 18.243 -4.816 1.00 64.35 O ATOM 723 CG2 THR A 50 -2.479 15.962 -5.144 1.00 52.15 C ATOM 0 H THR A 50 -0.420 18.831 -2.599 1.00 70.53 H new ATOM 0 HA THR A 50 -2.439 16.746 -2.525 1.00 44.01 H new ATOM 0 HB THR A 50 -1.093 17.618 -5.095 1.00 72.44 H new ATOM 0 HG1 THR A 50 -3.140 18.396 -5.779 1.00 64.35 H new ATOM 0 HG21 THR A 50 -2.735 16.076 -6.197 1.00 52.15 H new ATOM 0 HG22 THR A 50 -1.685 15.223 -5.041 1.00 52.15 H new ATOM 0 HG23 THR A 50 -3.358 15.630 -4.591 1.00 52.15 H new ATOM 731 N SER A 51 0.816 16.745 -3.048 1.00 30.11 N ATOM 732 CA SER A 51 2.025 15.927 -3.099 1.00 31.44 C ATOM 733 C SER A 51 2.956 16.294 -1.936 1.00 71.52 C ATOM 734 O SER A 51 4.178 16.219 -2.100 1.00 2.21 O ATOM 735 CB SER A 51 2.676 16.102 -4.489 1.00 75.24 C ATOM 736 OG SER A 51 3.618 15.092 -4.840 1.00 31.10 O ATOM 0 H SER A 51 1.006 17.742 -3.148 1.00 30.11 H new ATOM 0 HA SER A 51 1.793 14.869 -2.975 1.00 31.44 H new ATOM 0 HB2 SER A 51 1.889 16.123 -5.243 1.00 75.24 H new ATOM 0 HB3 SER A 51 3.174 17.071 -4.522 1.00 75.24 H new ATOM 0 HG SER A 51 4.240 14.952 -4.096 1.00 31.10 H new ATOM 741 N ASP A 52 2.416 16.699 -0.783 1.00 61.53 N ATOM 742 CA ASP A 52 3.226 16.980 0.402 1.00 5.32 C ATOM 743 C ASP A 52 3.415 15.722 1.247 1.00 25.40 C ATOM 744 O ASP A 52 2.627 14.772 1.158 1.00 34.33 O ATOM 745 CB ASP A 52 2.643 18.123 1.246 1.00 43.24 C ATOM 746 CG ASP A 52 3.457 19.391 1.015 1.00 41.21 C ATOM 747 OD1 ASP A 52 4.550 19.534 1.605 1.00 71.54 O ATOM 748 OD2 ASP A 52 3.037 20.247 0.198 1.00 71.51 O ATOM 0 H ASP A 52 1.415 16.840 -0.647 1.00 61.53 H new ATOM 0 HA ASP A 52 4.204 17.308 0.049 1.00 5.32 H new ATOM 0 HB2 ASP A 52 1.601 18.293 0.977 1.00 43.24 H new ATOM 0 HB3 ASP A 52 2.660 17.855 2.302 1.00 43.24 H new ATOM 752 N ILE A 53 4.454 15.720 2.089 1.00 3.12 N ATOM 753 CA ILE A 53 4.768 14.667 3.050 1.00 54.35 C ATOM 754 C ILE A 53 5.204 15.264 4.397 1.00 31.23 C ATOM 755 O ILE A 53 6.258 14.899 4.931 1.00 71.13 O ATOM 756 CB ILE A 53 5.782 13.639 2.482 1.00 53.33 C ATOM 757 CG1 ILE A 53 7.135 14.231 2.025 1.00 13.30 C ATOM 758 CG2 ILE A 53 5.165 12.867 1.312 1.00 4.21 C ATOM 759 CD1 ILE A 53 8.305 13.268 2.257 1.00 32.23 C ATOM 0 H ILE A 53 5.126 16.487 2.117 1.00 3.12 H new ATOM 0 HA ILE A 53 3.855 14.101 3.237 1.00 54.35 H new ATOM 0 HB ILE A 53 6.002 12.982 3.324 1.00 53.33 H new ATOM 0 HG12 ILE A 53 7.079 14.481 0.966 1.00 13.30 H new ATOM 0 HG13 ILE A 53 7.321 15.161 2.563 1.00 13.30 H new ATOM 0 HG21 ILE A 53 5.890 12.151 0.926 1.00 4.21 H new ATOM 0 HG22 ILE A 53 4.277 12.336 1.655 1.00 4.21 H new ATOM 0 HG23 ILE A 53 4.888 13.565 0.522 1.00 4.21 H new ATOM 0 HD11 ILE A 53 9.231 13.733 1.919 1.00 32.23 H new ATOM 0 HD12 ILE A 53 8.381 13.038 3.320 1.00 32.23 H new ATOM 0 HD13 ILE A 53 8.135 12.348 1.698 1.00 32.23 H new ATOM 770 N ALA A 54 4.393 16.147 4.993 1.00 2.41 N ATOM 771 CA ALA A 54 4.573 16.559 6.386 1.00 13.40 C ATOM 772 C ALA A 54 3.243 17.015 7.001 1.00 44.14 C ATOM 773 O ALA A 54 2.962 18.211 7.039 1.00 13.43 O ATOM 774 CB ALA A 54 5.653 17.646 6.491 1.00 70.14 C ATOM 0 H ALA A 54 3.602 16.591 4.527 1.00 2.41 H new ATOM 0 HA ALA A 54 4.914 15.698 6.960 1.00 13.40 H new ATOM 0 HB1 ALA A 54 5.773 17.940 7.534 1.00 70.14 H new ATOM 0 HB2 ALA A 54 6.598 17.257 6.112 1.00 70.14 H new ATOM 0 HB3 ALA A 54 5.355 18.513 5.902 1.00 70.14 H new ATOM 780 N LEU A 55 2.462 16.058 7.527 1.00 52.41 N ATOM 781 CA LEU A 55 1.247 16.238 8.325 1.00 53.33 C ATOM 782 C LEU A 55 0.082 16.943 7.621 1.00 72.54 C ATOM 783 O LEU A 55 -0.959 17.155 8.243 1.00 51.14 O ATOM 784 CB LEU A 55 1.615 16.841 9.704 1.00 23.40 C ATOM 785 CG LEU A 55 0.840 16.195 10.875 1.00 44.13 C ATOM 786 CD1 LEU A 55 1.761 15.888 12.064 1.00 11.22 C ATOM 787 CD2 LEU A 55 -0.292 17.070 11.410 1.00 12.12 C ATOM 0 H LEU A 55 2.682 15.071 7.394 1.00 52.41 H new ATOM 0 HA LEU A 55 0.827 15.244 8.481 1.00 53.33 H new ATOM 0 HB2 LEU A 55 2.685 16.719 9.873 1.00 23.40 H new ATOM 0 HB3 LEU A 55 1.414 17.912 9.691 1.00 23.40 H new ATOM 0 HG LEU A 55 0.424 15.281 10.451 1.00 44.13 H new ATOM 0 HD11 LEU A 55 1.180 15.435 12.867 1.00 11.22 H new ATOM 0 HD12 LEU A 55 2.544 15.198 11.749 1.00 11.22 H new ATOM 0 HD13 LEU A 55 2.214 16.813 12.421 1.00 11.22 H new ATOM 0 HD21 LEU A 55 -0.793 16.555 12.230 1.00 12.12 H new ATOM 0 HD22 LEU A 55 0.117 18.014 11.770 1.00 12.12 H new ATOM 0 HD23 LEU A 55 -1.009 17.266 10.612 1.00 12.12 H new ATOM 798 N ASP A 56 0.192 17.262 6.334 1.00 65.23 N ATOM 799 CA ASP A 56 -0.685 18.245 5.706 1.00 34.50 C ATOM 800 C ASP A 56 -1.990 17.657 5.161 1.00 22.14 C ATOM 801 O ASP A 56 -2.787 18.373 4.567 1.00 10.33 O ATOM 802 CB ASP A 56 0.078 19.066 4.655 1.00 70.41 C ATOM 803 CG ASP A 56 -0.560 20.452 4.581 1.00 2.44 C ATOM 804 OD1 ASP A 56 -0.464 21.178 5.607 1.00 64.22 O ATOM 805 OD2 ASP A 56 -1.193 20.790 3.560 1.00 11.03 O ATOM 0 H ASP A 56 0.882 16.852 5.704 1.00 65.23 H new ATOM 0 HA ASP A 56 -1.004 18.924 6.497 1.00 34.50 H new ATOM 0 HB2 ASP A 56 1.131 19.146 4.925 1.00 70.41 H new ATOM 0 HB3 ASP A 56 0.035 18.575 3.683 1.00 70.41 H new ATOM 809 N GLN A 57 -2.267 16.376 5.410 1.00 51.35 N ATOM 810 CA GLN A 57 -3.500 15.700 4.999 1.00 65.54 C ATOM 811 C GLN A 57 -4.150 14.943 6.166 1.00 4.04 C ATOM 812 O GLN A 57 -4.818 13.926 5.966 1.00 25.12 O ATOM 813 CB GLN A 57 -3.183 14.791 3.797 1.00 4.43 C ATOM 814 CG GLN A 57 -4.363 14.715 2.823 1.00 12.33 C ATOM 815 CD GLN A 57 -4.601 16.043 2.113 1.00 64.22 C ATOM 816 OE1 GLN A 57 -3.769 16.500 1.331 1.00 2.43 O ATOM 817 NE2 GLN A 57 -5.736 16.682 2.351 1.00 13.10 N ATOM 0 H GLN A 57 -1.625 15.765 5.915 1.00 51.35 H new ATOM 0 HA GLN A 57 -4.241 16.438 4.690 1.00 65.54 H new ATOM 0 HB2 GLN A 57 -2.304 15.169 3.276 1.00 4.43 H new ATOM 0 HB3 GLN A 57 -2.938 13.790 4.151 1.00 4.43 H new ATOM 0 HG2 GLN A 57 -4.174 13.937 2.084 1.00 12.33 H new ATOM 0 HG3 GLN A 57 -5.263 14.427 3.365 1.00 12.33 H new ATOM 0 HE21 GLN A 57 -6.415 16.289 3.002 1.00 13.10 H new ATOM 0 HE22 GLN A 57 -5.931 17.567 1.883 1.00 13.10 H new ATOM 824 N ILE A 58 -3.898 15.370 7.409 1.00 43.42 N ATOM 825 CA ILE A 58 -4.282 14.610 8.590 1.00 31.11 C ATOM 826 C ILE A 58 -4.979 15.548 9.582 1.00 42.42 C ATOM 827 O ILE A 58 -6.211 15.602 9.630 1.00 71.33 O ATOM 828 CB ILE A 58 -3.072 13.829 9.185 1.00 52.35 C ATOM 829 CG1 ILE A 58 -2.343 12.891 8.190 1.00 53.22 C ATOM 830 CG2 ILE A 58 -3.577 12.923 10.320 1.00 73.13 C ATOM 831 CD1 ILE A 58 -1.221 13.561 7.396 1.00 34.43 C ATOM 0 H ILE A 58 -3.424 16.249 7.617 1.00 43.42 H new ATOM 0 HA ILE A 58 -5.000 13.834 8.323 1.00 31.11 H new ATOM 0 HB ILE A 58 -2.368 14.598 9.502 1.00 52.35 H new ATOM 0 HG12 ILE A 58 -1.927 12.048 8.742 1.00 53.22 H new ATOM 0 HG13 ILE A 58 -3.074 12.485 7.491 1.00 53.22 H new ATOM 0 HG21 ILE A 58 -2.739 12.371 10.745 1.00 73.13 H new ATOM 0 HG22 ILE A 58 -4.039 13.534 11.095 1.00 73.13 H new ATOM 0 HG23 ILE A 58 -4.312 12.221 9.926 1.00 73.13 H new ATOM 0 HD11 ILE A 58 -0.765 12.833 6.725 1.00 34.43 H new ATOM 0 HD12 ILE A 58 -1.630 14.386 6.813 1.00 34.43 H new ATOM 0 HD13 ILE A 58 -0.466 13.942 8.084 1.00 34.43 H new ATOM 842 N GLN A 59 -4.210 16.251 10.416 1.00 1.40 N ATOM 843 CA GLN A 59 -4.736 16.874 11.619 1.00 34.31 C ATOM 844 C GLN A 59 -5.140 18.300 11.306 1.00 43.03 C ATOM 845 O GLN A 59 -4.336 19.227 11.383 1.00 41.13 O ATOM 846 CB GLN A 59 -3.733 16.805 12.774 1.00 62.54 C ATOM 847 CG GLN A 59 -3.372 15.362 13.175 1.00 11.21 C ATOM 848 CD GLN A 59 -2.244 15.303 14.199 1.00 63.14 C ATOM 849 OE1 GLN A 59 -1.220 14.669 13.972 1.00 33.32 O ATOM 850 NE2 GLN A 59 -2.380 15.985 15.326 1.00 23.23 N ATOM 0 H GLN A 59 -3.211 16.400 10.272 1.00 1.40 H new ATOM 0 HA GLN A 59 -5.618 16.324 11.948 1.00 34.31 H new ATOM 0 HB2 GLN A 59 -2.824 17.335 12.490 1.00 62.54 H new ATOM 0 HB3 GLN A 59 -4.147 17.323 13.639 1.00 62.54 H new ATOM 0 HG2 GLN A 59 -4.255 14.871 13.584 1.00 11.21 H new ATOM 0 HG3 GLN A 59 -3.080 14.804 12.285 1.00 11.21 H new ATOM 0 HE21 GLN A 59 -3.237 16.509 15.505 1.00 23.23 H new ATOM 0 HE22 GLN A 59 -1.628 15.986 16.015 1.00 23.23 H new ATOM 857 N GLY A 60 -6.402 18.453 10.932 1.00 4.22 N ATOM 858 CA GLY A 60 -6.926 19.697 10.416 1.00 25.42 C ATOM 859 C GLY A 60 -7.444 19.429 9.028 1.00 63.52 C ATOM 860 O GLY A 60 -8.627 19.654 8.767 1.00 62.12 O ATOM 0 H GLY A 60 -7.094 17.705 10.981 1.00 4.22 H new ATOM 0 HA2 GLY A 60 -7.724 20.072 11.057 1.00 25.42 H new ATOM 0 HA3 GLY A 60 -6.149 20.461 10.394 1.00 25.42 H new ATOM 864 N ASN A 61 -6.583 18.886 8.171 1.00 44.34 N ATOM 865 CA ASN A 61 -6.918 18.743 6.759 1.00 13.33 C ATOM 866 C ASN A 61 -7.625 17.412 6.583 1.00 12.10 C ATOM 867 O ASN A 61 -7.013 16.402 6.234 1.00 62.52 O ATOM 868 CB ASN A 61 -5.692 18.944 5.856 1.00 13.34 C ATOM 869 CG ASN A 61 -5.202 20.395 5.885 1.00 72.15 C ATOM 870 OD1 ASN A 61 -5.864 21.279 6.419 1.00 11.40 O ATOM 871 ND2 ASN A 61 -4.047 20.690 5.328 1.00 14.00 N ATOM 0 H ASN A 61 -5.658 18.541 8.427 1.00 44.34 H new ATOM 0 HA ASN A 61 -7.600 19.530 6.438 1.00 13.33 H new ATOM 0 HB2 ASN A 61 -4.889 18.282 6.179 1.00 13.34 H new ATOM 0 HB3 ASN A 61 -5.943 18.665 4.833 1.00 13.34 H new ATOM 0 HD21 ASN A 61 -3.705 21.651 5.341 1.00 14.00 H new ATOM 0 HD22 ASN A 61 -3.494 19.958 4.883 1.00 14.00 H new ATOM 877 N LYS A 62 -8.922 17.413 6.909 1.00 33.22 N ATOM 878 CA LYS A 62 -9.837 16.319 6.619 1.00 30.21 C ATOM 879 C LYS A 62 -10.008 16.212 5.110 1.00 44.23 C ATOM 880 O LYS A 62 -9.927 17.222 4.413 1.00 10.44 O ATOM 881 CB LYS A 62 -11.194 16.560 7.295 1.00 1.13 C ATOM 882 CG LYS A 62 -11.162 16.253 8.797 1.00 10.20 C ATOM 883 CD LYS A 62 -12.530 16.543 9.429 1.00 32.40 C ATOM 884 CE LYS A 62 -12.719 15.837 10.777 1.00 32.10 C ATOM 885 NZ LYS A 62 -11.755 16.269 11.812 1.00 12.32 N ATOM 0 H LYS A 62 -9.368 18.193 7.392 1.00 33.22 H new ATOM 0 HA LYS A 62 -9.428 15.387 7.010 1.00 30.21 H new ATOM 0 HB2 LYS A 62 -11.492 17.598 7.145 1.00 1.13 H new ATOM 0 HB3 LYS A 62 -11.951 15.939 6.816 1.00 1.13 H new ATOM 0 HG2 LYS A 62 -10.894 15.208 8.956 1.00 10.20 H new ATOM 0 HG3 LYS A 62 -10.394 16.856 9.282 1.00 10.20 H new ATOM 0 HD2 LYS A 62 -12.641 17.618 9.568 1.00 32.40 H new ATOM 0 HD3 LYS A 62 -13.317 16.227 8.744 1.00 32.40 H new ATOM 0 HE2 LYS A 62 -13.732 16.022 11.136 1.00 32.10 H new ATOM 0 HE3 LYS A 62 -12.624 14.761 10.631 1.00 32.10 H new ATOM 0 HZ1 LYS A 62 -11.940 15.753 12.696 1.00 12.32 H new ATOM 0 HZ2 LYS A 62 -10.787 16.068 11.490 1.00 12.32 H new ATOM 0 HZ3 LYS A 62 -11.860 17.290 11.979 1.00 12.32 H new ATOM 895 N ASP A 63 -10.357 15.015 4.643 1.00 45.22 N ATOM 896 CA ASP A 63 -10.362 14.587 3.239 1.00 65.31 C ATOM 897 C ASP A 63 -8.929 14.459 2.707 1.00 13.34 C ATOM 898 O ASP A 63 -7.965 14.870 3.368 1.00 42.24 O ATOM 899 CB ASP A 63 -11.290 15.460 2.358 1.00 63.41 C ATOM 900 CG ASP A 63 -11.742 14.770 1.064 1.00 44.03 C ATOM 901 OD1 ASP A 63 -11.758 13.517 1.035 1.00 70.24 O ATOM 902 OD2 ASP A 63 -12.168 15.468 0.109 1.00 11.12 O ATOM 0 H ASP A 63 -10.663 14.271 5.270 1.00 45.22 H new ATOM 0 HA ASP A 63 -10.799 13.590 3.186 1.00 65.31 H new ATOM 0 HB2 ASP A 63 -12.170 15.738 2.938 1.00 63.41 H new ATOM 0 HB3 ASP A 63 -10.771 16.384 2.104 1.00 63.41 H new ATOM 906 N PHE A 64 -8.760 13.801 1.563 1.00 74.52 N ATOM 907 CA PHE A 64 -7.461 13.526 0.957 1.00 32.13 C ATOM 908 C PHE A 64 -7.638 13.282 -0.544 1.00 33.11 C ATOM 909 O PHE A 64 -8.717 12.845 -0.960 1.00 32.33 O ATOM 910 CB PHE A 64 -6.791 12.315 1.630 1.00 41.21 C ATOM 911 CG PHE A 64 -7.713 11.202 2.068 1.00 4.43 C ATOM 912 CD1 PHE A 64 -8.316 10.381 1.103 1.00 3.11 C ATOM 913 CD2 PHE A 64 -7.987 11.011 3.435 1.00 11.44 C ATOM 914 CE1 PHE A 64 -9.239 9.402 1.507 1.00 13.41 C ATOM 915 CE2 PHE A 64 -8.902 10.025 3.838 1.00 62.45 C ATOM 916 CZ PHE A 64 -9.556 9.245 2.869 1.00 24.10 C ATOM 0 H PHE A 64 -9.542 13.436 1.019 1.00 74.52 H new ATOM 0 HA PHE A 64 -6.812 14.389 1.103 1.00 32.13 H new ATOM 0 HB2 PHE A 64 -6.058 11.900 0.938 1.00 41.21 H new ATOM 0 HB3 PHE A 64 -6.242 12.668 2.503 1.00 41.21 H new ATOM 0 HD1 PHE A 64 -8.072 10.501 0.058 1.00 3.11 H new ATOM 0 HD2 PHE A 64 -7.493 11.623 4.175 1.00 11.44 H new ATOM 0 HE1 PHE A 64 -9.707 8.767 0.769 1.00 13.41 H new ATOM 0 HE2 PHE A 64 -9.102 9.867 4.887 1.00 62.45 H new ATOM 0 HZ PHE A 64 -10.302 8.525 3.170 1.00 24.10 H new ATOM 925 N PRO A 65 -6.609 13.549 -1.367 1.00 30.53 N ATOM 926 CA PRO A 65 -6.704 13.416 -2.808 1.00 14.41 C ATOM 927 C PRO A 65 -6.742 11.944 -3.193 1.00 72.43 C ATOM 928 O PRO A 65 -6.160 11.093 -2.514 1.00 62.35 O ATOM 929 CB PRO A 65 -5.475 14.133 -3.372 1.00 54.43 C ATOM 930 CG PRO A 65 -4.443 14.012 -2.256 1.00 23.21 C ATOM 931 CD PRO A 65 -5.285 14.004 -0.977 1.00 5.14 C ATOM 0 HA PRO A 65 -7.616 13.856 -3.211 1.00 14.41 H new ATOM 0 HB2 PRO A 65 -5.126 13.666 -4.293 1.00 54.43 H new ATOM 0 HB3 PRO A 65 -5.692 15.175 -3.606 1.00 54.43 H new ATOM 0 HG2 PRO A 65 -3.855 13.100 -2.353 1.00 23.21 H new ATOM 0 HG3 PRO A 65 -3.742 14.846 -2.268 1.00 23.21 H new ATOM 0 HD2 PRO A 65 -4.850 13.341 -0.229 1.00 5.14 H new ATOM 0 HD3 PRO A 65 -5.330 14.999 -0.534 1.00 5.14 H new ATOM 936 N GLU A 66 -7.414 11.654 -4.304 1.00 24.14 N ATOM 937 CA GLU A 66 -7.493 10.351 -4.893 1.00 22.53 C ATOM 938 C GLU A 66 -6.113 10.001 -5.456 1.00 24.34 C ATOM 939 O GLU A 66 -5.314 10.881 -5.794 1.00 65.12 O ATOM 940 CB GLU A 66 -8.613 10.471 -5.943 1.00 43.43 C ATOM 941 CG GLU A 66 -8.460 9.472 -7.071 1.00 64.23 C ATOM 942 CD GLU A 66 -9.693 9.335 -7.962 1.00 10.23 C ATOM 943 OE1 GLU A 66 -10.666 8.709 -7.475 1.00 25.41 O ATOM 944 OE2 GLU A 66 -9.652 9.816 -9.122 1.00 61.45 O ATOM 0 H GLU A 66 -7.933 12.359 -4.827 1.00 24.14 H new ATOM 0 HA GLU A 66 -7.738 9.538 -4.210 1.00 22.53 H new ATOM 0 HB2 GLU A 66 -9.578 10.322 -5.459 1.00 43.43 H new ATOM 0 HB3 GLU A 66 -8.615 11.481 -6.354 1.00 43.43 H new ATOM 0 HG2 GLU A 66 -7.611 9.766 -7.688 1.00 64.23 H new ATOM 0 HG3 GLU A 66 -8.223 8.496 -6.647 1.00 64.23 H new ATOM 949 N ILE A 67 -5.849 8.708 -5.598 1.00 70.21 N ATOM 950 CA ILE A 67 -4.728 8.191 -6.357 1.00 25.50 C ATOM 951 C ILE A 67 -5.120 8.088 -7.831 1.00 12.01 C ATOM 952 O ILE A 67 -6.143 7.500 -8.175 1.00 13.23 O ATOM 953 CB ILE A 67 -4.243 6.847 -5.791 1.00 31.50 C ATOM 954 CG1 ILE A 67 -5.374 5.805 -5.626 1.00 62.35 C ATOM 955 CG2 ILE A 67 -3.536 7.092 -4.448 1.00 42.04 C ATOM 956 CD1 ILE A 67 -5.243 4.665 -6.624 1.00 64.21 C ATOM 0 H ILE A 67 -6.424 7.978 -5.178 1.00 70.21 H new ATOM 0 HA ILE A 67 -3.887 8.880 -6.272 1.00 25.50 H new ATOM 0 HB ILE A 67 -3.549 6.421 -6.515 1.00 31.50 H new ATOM 0 HG12 ILE A 67 -5.354 5.405 -4.612 1.00 62.35 H new ATOM 0 HG13 ILE A 67 -6.340 6.293 -5.757 1.00 62.35 H new ATOM 0 HG21 ILE A 67 -3.189 6.142 -4.041 1.00 42.04 H new ATOM 0 HG22 ILE A 67 -2.684 7.754 -4.601 1.00 42.04 H new ATOM 0 HG23 ILE A 67 -4.233 7.554 -3.749 1.00 42.04 H new ATOM 0 HD11 ILE A 67 -6.057 3.955 -6.474 1.00 64.21 H new ATOM 0 HD12 ILE A 67 -5.290 5.062 -7.638 1.00 64.21 H new ATOM 0 HD13 ILE A 67 -4.289 4.160 -6.476 1.00 64.21 H new ATOM 967 N GLN A 68 -4.273 8.639 -8.694 1.00 54.15 N ATOM 968 CA GLN A 68 -4.341 8.423 -10.132 1.00 32.40 C ATOM 969 C GLN A 68 -3.575 7.150 -10.455 1.00 55.05 C ATOM 970 O GLN A 68 -2.446 6.960 -9.974 1.00 1.01 O ATOM 971 CB GLN A 68 -3.694 9.572 -10.913 1.00 2.21 C ATOM 972 CG GLN A 68 -4.628 10.761 -11.138 1.00 14.34 C ATOM 973 CD GLN A 68 -3.928 11.762 -12.050 1.00 42.11 C ATOM 974 OE1 GLN A 68 -3.920 11.606 -13.270 1.00 23.41 O ATOM 975 NE2 GLN A 68 -3.217 12.729 -11.494 1.00 2.40 N ATOM 0 H GLN A 68 -3.512 9.255 -8.410 1.00 54.15 H new ATOM 0 HA GLN A 68 -5.391 8.357 -10.419 1.00 32.40 H new ATOM 0 HB2 GLN A 68 -2.809 9.912 -10.376 1.00 2.21 H new ATOM 0 HB3 GLN A 68 -3.356 9.198 -11.879 1.00 2.21 H new ATOM 0 HG2 GLN A 68 -5.563 10.428 -11.589 1.00 14.34 H new ATOM 0 HG3 GLN A 68 -4.881 11.229 -10.187 1.00 14.34 H new ATOM 0 HE21 GLN A 68 -3.228 12.853 -10.482 1.00 2.40 H new ATOM 0 HE22 GLN A 68 -2.658 13.351 -12.078 1.00 2.40 H new ATOM 982 N LEU A 69 -4.144 6.310 -11.316 1.00 13.31 N ATOM 983 CA LEU A 69 -3.425 5.190 -11.899 1.00 55.22 C ATOM 984 C LEU A 69 -4.044 4.723 -13.209 1.00 3.11 C ATOM 985 O LEU A 69 -5.117 5.164 -13.627 1.00 14.31 O ATOM 986 CB LEU A 69 -3.227 4.054 -10.869 1.00 75.24 C ATOM 987 CG LEU A 69 -4.385 3.060 -10.656 1.00 3.31 C ATOM 988 CD1 LEU A 69 -4.074 2.248 -9.395 1.00 70.14 C ATOM 989 CD2 LEU A 69 -5.765 3.707 -10.474 1.00 72.52 C ATOM 0 H LEU A 69 -5.113 6.389 -11.626 1.00 13.31 H new ATOM 0 HA LEU A 69 -2.427 5.539 -12.166 1.00 55.22 H new ATOM 0 HB2 LEU A 69 -2.348 3.483 -11.167 1.00 75.24 H new ATOM 0 HB3 LEU A 69 -2.999 4.512 -9.907 1.00 75.24 H new ATOM 0 HG LEU A 69 -4.448 2.456 -11.561 1.00 3.31 H new ATOM 0 HD11 LEU A 69 -4.877 1.533 -9.216 1.00 70.14 H new ATOM 0 HD12 LEU A 69 -3.134 1.712 -9.530 1.00 70.14 H new ATOM 0 HD13 LEU A 69 -3.989 2.920 -8.541 1.00 70.14 H new ATOM 0 HD21 LEU A 69 -6.515 2.929 -10.331 1.00 72.52 H new ATOM 0 HD22 LEU A 69 -5.748 4.360 -9.602 1.00 72.52 H new ATOM 0 HD23 LEU A 69 -6.013 4.291 -11.360 1.00 72.52 H new ATOM 1000 N ASP A 70 -3.309 3.810 -13.836 1.00 72.34 N ATOM 1001 CA ASP A 70 -3.617 3.121 -15.081 1.00 33.24 C ATOM 1002 C ASP A 70 -4.874 2.253 -14.943 1.00 73.31 C ATOM 1003 O ASP A 70 -5.507 2.244 -13.879 1.00 22.50 O ATOM 1004 CB ASP A 70 -2.380 2.307 -15.471 1.00 61.24 C ATOM 1005 CG ASP A 70 -2.118 2.382 -16.969 1.00 52.25 C ATOM 1006 OD1 ASP A 70 -2.785 1.635 -17.714 1.00 12.21 O ATOM 1007 OD2 ASP A 70 -1.187 3.107 -17.393 1.00 32.00 O ATOM 0 H ASP A 70 -2.412 3.510 -13.455 1.00 72.34 H new ATOM 0 HA ASP A 70 -3.846 3.836 -15.872 1.00 33.24 H new ATOM 0 HB2 ASP A 70 -1.511 2.680 -14.929 1.00 61.24 H new ATOM 0 HB3 ASP A 70 -2.518 1.267 -15.175 1.00 61.24 H new ATOM 1011 N ASN A 71 -5.258 1.510 -15.984 1.00 64.32 N ATOM 1012 CA ASN A 71 -6.268 0.471 -15.810 1.00 63.31 C ATOM 1013 C ASN A 71 -5.523 -0.771 -15.353 1.00 23.23 C ATOM 1014 O ASN A 71 -5.014 -1.557 -16.160 1.00 20.13 O ATOM 1015 CB ASN A 71 -7.148 0.248 -17.041 1.00 15.21 C ATOM 1016 CG ASN A 71 -8.534 -0.194 -16.578 1.00 31.40 C ATOM 1017 OD1 ASN A 71 -9.460 0.614 -16.557 1.00 21.24 O ATOM 1018 ND2 ASN A 71 -8.698 -1.430 -16.137 1.00 12.21 N ATOM 0 H ASN A 71 -4.894 1.606 -16.932 1.00 64.32 H new ATOM 0 HA ASN A 71 -6.999 0.774 -15.060 1.00 63.31 H new ATOM 0 HB2 ASN A 71 -7.220 1.165 -17.626 1.00 15.21 H new ATOM 0 HB3 ASN A 71 -6.707 -0.509 -17.689 1.00 15.21 H new ATOM 0 HD21 ASN A 71 -9.604 -1.725 -15.772 1.00 12.21 H new ATOM 0 HD22 ASN A 71 -7.919 -2.088 -16.162 1.00 12.21 H new ATOM 1024 N ILE A 72 -5.338 -0.855 -14.044 1.00 40.05 N ATOM 1025 CA ILE A 72 -4.805 -2.001 -13.334 1.00 53.32 C ATOM 1026 C ILE A 72 -6.000 -2.899 -13.010 1.00 2.11 C ATOM 1027 O ILE A 72 -7.151 -2.461 -12.952 1.00 20.11 O ATOM 1028 CB ILE A 72 -4.028 -1.531 -12.071 1.00 72.11 C ATOM 1029 CG1 ILE A 72 -2.994 -0.446 -12.477 1.00 33.43 C ATOM 1030 CG2 ILE A 72 -3.333 -2.700 -11.343 1.00 43.55 C ATOM 1031 CD1 ILE A 72 -2.001 -0.048 -11.383 1.00 34.43 C ATOM 0 H ILE A 72 -5.569 -0.083 -13.418 1.00 40.05 H new ATOM 0 HA ILE A 72 -4.083 -2.563 -13.927 1.00 53.32 H new ATOM 0 HB ILE A 72 -4.748 -1.110 -11.369 1.00 72.11 H new ATOM 0 HG12 ILE A 72 -2.434 -0.806 -13.340 1.00 33.43 H new ATOM 0 HG13 ILE A 72 -3.534 0.445 -12.797 1.00 33.43 H new ATOM 0 HG21 ILE A 72 -2.804 -2.321 -10.468 1.00 43.55 H new ATOM 0 HG22 ILE A 72 -4.080 -3.428 -11.028 1.00 43.55 H new ATOM 0 HG23 ILE A 72 -2.623 -3.178 -12.018 1.00 43.55 H new ATOM 0 HD11 ILE A 72 -1.323 0.714 -11.767 1.00 34.43 H new ATOM 0 HD12 ILE A 72 -2.544 0.348 -10.525 1.00 34.43 H new ATOM 0 HD13 ILE A 72 -1.427 -0.923 -11.077 1.00 34.43 H new ATOM 1042 N ASP A 73 -5.690 -4.166 -12.768 1.00 12.01 N ATOM 1043 CA ASP A 73 -6.597 -5.177 -12.279 1.00 24.44 C ATOM 1044 C ASP A 73 -5.913 -5.799 -11.070 1.00 25.50 C ATOM 1045 O ASP A 73 -4.767 -6.241 -11.172 1.00 25.40 O ATOM 1046 CB ASP A 73 -6.829 -6.209 -13.376 1.00 23.43 C ATOM 1047 CG ASP A 73 -7.671 -7.360 -12.852 1.00 52.31 C ATOM 1048 OD1 ASP A 73 -8.907 -7.224 -12.701 1.00 61.32 O ATOM 1049 OD2 ASP A 73 -7.097 -8.442 -12.635 1.00 61.24 O ATOM 0 H ASP A 73 -4.748 -4.527 -12.918 1.00 12.01 H new ATOM 0 HA ASP A 73 -7.570 -4.772 -12.001 1.00 24.44 H new ATOM 0 HB2 ASP A 73 -7.329 -5.741 -14.224 1.00 23.43 H new ATOM 0 HB3 ASP A 73 -5.872 -6.585 -13.738 1.00 23.43 H new ATOM 1053 N TYR A 74 -6.561 -5.770 -9.911 1.00 10.11 N ATOM 1054 CA TYR A 74 -6.072 -6.409 -8.691 1.00 3.14 C ATOM 1055 C TYR A 74 -6.275 -7.920 -8.756 1.00 52.01 C ATOM 1056 O TYR A 74 -5.480 -8.691 -8.217 1.00 54.15 O ATOM 1057 CB TYR A 74 -6.786 -5.799 -7.479 1.00 45.03 C ATOM 1058 CG TYR A 74 -6.760 -4.282 -7.477 1.00 11.10 C ATOM 1059 CD1 TYR A 74 -5.541 -3.592 -7.333 1.00 23.10 C ATOM 1060 CD2 TYR A 74 -7.948 -3.555 -7.686 1.00 21.43 C ATOM 1061 CE1 TYR A 74 -5.511 -2.188 -7.374 1.00 53.42 C ATOM 1062 CE2 TYR A 74 -7.922 -2.151 -7.745 1.00 44.23 C ATOM 1063 CZ TYR A 74 -6.700 -1.458 -7.590 1.00 34.12 C ATOM 1064 OH TYR A 74 -6.641 -0.098 -7.634 1.00 74.41 O ATOM 0 H TYR A 74 -7.455 -5.295 -9.789 1.00 10.11 H new ATOM 0 HA TYR A 74 -5.001 -6.231 -8.591 1.00 3.14 H new ATOM 0 HB2 TYR A 74 -7.821 -6.139 -7.465 1.00 45.03 H new ATOM 0 HB3 TYR A 74 -6.318 -6.166 -6.566 1.00 45.03 H new ATOM 0 HD1 TYR A 74 -4.624 -4.145 -7.190 1.00 23.10 H new ATOM 0 HD2 TYR A 74 -8.885 -4.080 -7.802 1.00 21.43 H new ATOM 0 HE1 TYR A 74 -4.575 -1.665 -7.240 1.00 53.42 H new ATOM 0 HE2 TYR A 74 -8.837 -1.601 -7.909 1.00 44.23 H new ATOM 0 HH TYR A 74 -7.503 0.257 -7.936 1.00 74.41 H new ATOM 1073 N ASN A 75 -7.349 -8.344 -9.419 1.00 41.03 N ATOM 1074 CA ASN A 75 -7.877 -9.688 -9.299 1.00 51.42 C ATOM 1075 C ASN A 75 -6.934 -10.751 -9.843 1.00 41.23 C ATOM 1076 O ASN A 75 -6.866 -11.857 -9.311 1.00 42.11 O ATOM 1077 CB ASN A 75 -9.218 -9.753 -10.035 1.00 24.23 C ATOM 1078 CG ASN A 75 -10.079 -10.830 -9.427 1.00 43.14 C ATOM 1079 OD1 ASN A 75 -10.258 -11.912 -9.980 1.00 1.11 O ATOM 1080 ND2 ASN A 75 -10.662 -10.532 -8.278 1.00 4.32 N ATOM 0 H ASN A 75 -7.878 -7.752 -10.060 1.00 41.03 H new ATOM 0 HA ASN A 75 -8.002 -9.903 -8.238 1.00 51.42 H new ATOM 0 HB2 ASN A 75 -9.725 -8.790 -9.973 1.00 24.23 H new ATOM 0 HB3 ASN A 75 -9.054 -9.959 -11.093 1.00 24.23 H new ATOM 0 HD21 ASN A 75 -11.279 -11.209 -7.828 1.00 4.32 H new ATOM 0 HD22 ASN A 75 -10.495 -9.625 -7.841 1.00 4.32 H new ATOM 1086 N ASN A 76 -6.203 -10.433 -10.908 1.00 23.42 N ATOM 1087 CA ASN A 76 -5.315 -11.373 -11.571 1.00 5.14 C ATOM 1088 C ASN A 76 -3.939 -11.508 -10.914 1.00 22.11 C ATOM 1089 O ASN A 76 -3.105 -12.224 -11.476 1.00 51.21 O ATOM 1090 CB ASN A 76 -5.175 -11.061 -13.068 1.00 33.32 C ATOM 1091 CG ASN A 76 -4.110 -10.021 -13.379 1.00 13.42 C ATOM 1092 OD1 ASN A 76 -3.060 -10.342 -13.925 1.00 23.34 O ATOM 1093 ND2 ASN A 76 -4.386 -8.763 -13.094 1.00 24.11 N ATOM 0 H ASN A 76 -6.213 -9.507 -11.336 1.00 23.42 H new ATOM 0 HA ASN A 76 -5.798 -12.344 -11.457 1.00 5.14 H new ATOM 0 HB2 ASN A 76 -4.938 -11.982 -13.601 1.00 33.32 H new ATOM 0 HB3 ASN A 76 -6.134 -10.710 -13.448 1.00 33.32 H new ATOM 0 HD21 ASN A 76 -3.718 -8.029 -13.328 1.00 24.11 H new ATOM 0 HD22 ASN A 76 -5.267 -8.525 -12.639 1.00 24.11 H new ATOM 1099 N TYR A 77 -3.682 -10.875 -9.763 1.00 53.14 N ATOM 1100 CA TYR A 77 -2.459 -11.117 -8.994 1.00 11.14 C ATOM 1101 C TYR A 77 -2.814 -11.838 -7.692 1.00 14.32 C ATOM 1102 O TYR A 77 -3.952 -11.761 -7.221 1.00 32.11 O ATOM 1103 CB TYR A 77 -1.638 -9.834 -8.797 1.00 1.23 C ATOM 1104 CG TYR A 77 -1.276 -9.116 -10.094 1.00 61.13 C ATOM 1105 CD1 TYR A 77 -0.173 -9.531 -10.872 1.00 64.02 C ATOM 1106 CD2 TYR A 77 -2.057 -8.028 -10.530 1.00 45.31 C ATOM 1107 CE1 TYR A 77 0.163 -8.849 -12.056 1.00 24.20 C ATOM 1108 CE2 TYR A 77 -1.724 -7.338 -11.712 1.00 72.35 C ATOM 1109 CZ TYR A 77 -0.606 -7.742 -12.475 1.00 12.42 C ATOM 1110 OH TYR A 77 -0.275 -7.058 -13.604 1.00 34.13 O ATOM 0 H TYR A 77 -4.309 -10.189 -9.344 1.00 53.14 H new ATOM 0 HA TYR A 77 -1.798 -11.775 -9.558 1.00 11.14 H new ATOM 0 HB2 TYR A 77 -2.201 -9.150 -8.162 1.00 1.23 H new ATOM 0 HB3 TYR A 77 -0.720 -10.082 -8.264 1.00 1.23 H new ATOM 0 HD1 TYR A 77 0.417 -10.378 -10.556 1.00 64.02 H new ATOM 0 HD2 TYR A 77 -2.917 -7.721 -9.954 1.00 45.31 H new ATOM 0 HE1 TYR A 77 1.009 -9.172 -12.644 1.00 24.20 H new ATOM 0 HE2 TYR A 77 -2.324 -6.500 -12.035 1.00 72.35 H new ATOM 0 HH TYR A 77 0.604 -7.354 -13.920 1.00 34.13 H new ATOM 1119 N ASP A 78 -1.856 -12.585 -7.136 1.00 24.34 N ATOM 1120 CA ASP A 78 -2.063 -13.408 -5.931 1.00 25.23 C ATOM 1121 C ASP A 78 -1.567 -12.679 -4.680 1.00 44.24 C ATOM 1122 O ASP A 78 -2.113 -12.837 -3.594 1.00 61.05 O ATOM 1123 CB ASP A 78 -1.336 -14.752 -6.095 1.00 42.44 C ATOM 1124 CG ASP A 78 -1.808 -15.822 -5.107 1.00 32.34 C ATOM 1125 OD1 ASP A 78 -2.742 -16.593 -5.447 1.00 5.43 O ATOM 1126 OD2 ASP A 78 -1.162 -16.019 -4.063 1.00 21.01 O ATOM 0 H ASP A 78 -0.908 -12.639 -7.508 1.00 24.34 H new ATOM 0 HA ASP A 78 -3.131 -13.590 -5.809 1.00 25.23 H new ATOM 0 HB2 ASP A 78 -1.485 -15.116 -7.112 1.00 42.44 H new ATOM 0 HB3 ASP A 78 -0.265 -14.596 -5.966 1.00 42.44 H new ATOM 1130 N LEU A 79 -0.584 -11.799 -4.849 1.00 34.04 N ATOM 1131 CA LEU A 79 0.108 -11.024 -3.832 1.00 51.52 C ATOM 1132 C LEU A 79 0.268 -9.612 -4.394 1.00 63.03 C ATOM 1133 O LEU A 79 0.490 -9.453 -5.599 1.00 32.11 O ATOM 1134 CB LEU A 79 1.481 -11.676 -3.580 1.00 74.32 C ATOM 1135 CG LEU A 79 1.650 -12.238 -2.166 1.00 25.03 C ATOM 1136 CD1 LEU A 79 2.801 -13.245 -2.134 1.00 22.13 C ATOM 1137 CD2 LEU A 79 1.934 -11.109 -1.171 1.00 21.34 C ATOM 0 H LEU A 79 -0.223 -11.595 -5.781 1.00 34.04 H new ATOM 0 HA LEU A 79 -0.435 -10.990 -2.888 1.00 51.52 H new ATOM 0 HB2 LEU A 79 1.628 -12.481 -4.300 1.00 74.32 H new ATOM 0 HB3 LEU A 79 2.262 -10.938 -3.763 1.00 74.32 H new ATOM 0 HG LEU A 79 0.723 -12.737 -1.883 1.00 25.03 H new ATOM 0 HD11 LEU A 79 2.912 -13.638 -1.124 1.00 22.13 H new ATOM 0 HD12 LEU A 79 2.587 -14.064 -2.821 1.00 22.13 H new ATOM 0 HD13 LEU A 79 3.725 -12.751 -2.435 1.00 22.13 H new ATOM 0 HD21 LEU A 79 2.051 -11.526 -0.171 1.00 21.34 H new ATOM 0 HD22 LEU A 79 2.850 -10.593 -1.458 1.00 21.34 H new ATOM 0 HD23 LEU A 79 1.103 -10.403 -1.174 1.00 21.34 H new ATOM 1148 N ILE A 80 0.139 -8.579 -3.565 1.00 72.24 N ATOM 1149 CA ILE A 80 0.243 -7.195 -4.013 1.00 43.51 C ATOM 1150 C ILE A 80 0.943 -6.388 -2.915 1.00 25.14 C ATOM 1151 O ILE A 80 0.540 -6.389 -1.749 1.00 51.15 O ATOM 1152 CB ILE A 80 -1.147 -6.643 -4.423 1.00 11.10 C ATOM 1153 CG1 ILE A 80 -1.776 -7.447 -5.586 1.00 30.31 C ATOM 1154 CG2 ILE A 80 -1.017 -5.164 -4.823 1.00 50.14 C ATOM 1155 CD1 ILE A 80 -3.100 -6.889 -6.118 1.00 14.44 C ATOM 0 H ILE A 80 -0.040 -8.679 -2.566 1.00 72.24 H new ATOM 0 HA ILE A 80 0.850 -7.116 -4.915 1.00 43.51 H new ATOM 0 HB ILE A 80 -1.808 -6.742 -3.562 1.00 11.10 H new ATOM 0 HG12 ILE A 80 -1.061 -7.489 -6.407 1.00 30.31 H new ATOM 0 HG13 ILE A 80 -1.939 -8.472 -5.253 1.00 30.31 H new ATOM 0 HG21 ILE A 80 -1.995 -4.778 -5.111 1.00 50.14 H new ATOM 0 HG22 ILE A 80 -0.635 -4.591 -3.978 1.00 50.14 H new ATOM 0 HG23 ILE A 80 -0.329 -5.074 -5.664 1.00 50.14 H new ATOM 0 HD11 ILE A 80 -3.461 -7.520 -6.930 1.00 14.44 H new ATOM 0 HD12 ILE A 80 -3.837 -6.874 -5.315 1.00 14.44 H new ATOM 0 HD13 ILE A 80 -2.945 -5.875 -6.488 1.00 14.44 H new ATOM 1166 N LEU A 81 1.999 -5.681 -3.307 1.00 32.12 N ATOM 1167 CA LEU A 81 2.959 -4.996 -2.453 1.00 25.11 C ATOM 1168 C LEU A 81 2.829 -3.479 -2.681 1.00 30.43 C ATOM 1169 O LEU A 81 2.332 -3.047 -3.730 1.00 54.52 O ATOM 1170 CB LEU A 81 4.371 -5.530 -2.783 1.00 34.40 C ATOM 1171 CG LEU A 81 4.516 -7.072 -2.787 1.00 70.22 C ATOM 1172 CD1 LEU A 81 5.876 -7.486 -3.346 1.00 23.32 C ATOM 1173 CD2 LEU A 81 4.351 -7.657 -1.388 1.00 34.30 C ATOM 0 H LEU A 81 2.220 -5.565 -4.296 1.00 32.12 H new ATOM 0 HA LEU A 81 2.770 -5.185 -1.396 1.00 25.11 H new ATOM 0 HB2 LEU A 81 4.664 -5.152 -3.763 1.00 34.40 H new ATOM 0 HB3 LEU A 81 5.075 -5.118 -2.060 1.00 34.40 H new ATOM 0 HG LEU A 81 3.724 -7.465 -3.424 1.00 70.22 H new ATOM 0 HD11 LEU A 81 5.956 -8.573 -3.340 1.00 23.32 H new ATOM 0 HD12 LEU A 81 5.976 -7.121 -4.368 1.00 23.32 H new ATOM 0 HD13 LEU A 81 6.668 -7.060 -2.730 1.00 23.32 H new ATOM 0 HD21 LEU A 81 4.459 -8.741 -1.432 1.00 34.30 H new ATOM 0 HD22 LEU A 81 5.113 -7.242 -0.728 1.00 34.30 H new ATOM 0 HD23 LEU A 81 3.362 -7.406 -1.003 1.00 34.30 H new ATOM 1184 N ILE A 82 3.246 -2.658 -1.709 1.00 11.30 N ATOM 1185 CA ILE A 82 2.993 -1.213 -1.684 1.00 2.20 C ATOM 1186 C ILE A 82 4.156 -0.486 -1.000 1.00 71.31 C ATOM 1187 O ILE A 82 4.553 -0.938 0.067 1.00 13.44 O ATOM 1188 CB ILE A 82 1.712 -0.917 -0.856 1.00 71.33 C ATOM 1189 CG1 ILE A 82 0.504 -1.836 -1.146 1.00 14.02 C ATOM 1190 CG2 ILE A 82 1.355 0.560 -1.077 1.00 5.32 C ATOM 1191 CD1 ILE A 82 -0.742 -1.536 -0.299 1.00 3.04 C ATOM 0 H ILE A 82 3.778 -2.986 -0.903 1.00 11.30 H new ATOM 0 HA ILE A 82 2.879 -0.871 -2.713 1.00 2.20 H new ATOM 0 HB ILE A 82 1.941 -1.130 0.188 1.00 71.33 H new ATOM 0 HG12 ILE A 82 0.241 -1.748 -2.200 1.00 14.02 H new ATOM 0 HG13 ILE A 82 0.802 -2.871 -0.977 1.00 14.02 H new ATOM 0 HG21 ILE A 82 0.458 0.806 -0.510 1.00 5.32 H new ATOM 0 HG22 ILE A 82 2.180 1.188 -0.741 1.00 5.32 H new ATOM 0 HG23 ILE A 82 1.173 0.736 -2.137 1.00 5.32 H new ATOM 0 HD11 ILE A 82 -1.540 -2.228 -0.568 1.00 3.04 H new ATOM 0 HD12 ILE A 82 -0.501 -1.654 0.757 1.00 3.04 H new ATOM 0 HD13 ILE A 82 -1.070 -0.513 -0.484 1.00 3.04 H new ATOM 1202 N GLY A 83 4.604 0.689 -1.471 1.00 25.11 N ATOM 1203 CA GLY A 83 5.453 1.557 -0.651 1.00 70.15 C ATOM 1204 C GLY A 83 4.928 2.975 -0.479 1.00 12.10 C ATOM 1205 O GLY A 83 4.057 3.421 -1.236 1.00 50.01 O ATOM 0 H GLY A 83 4.395 1.052 -2.401 1.00 25.11 H new ATOM 0 HA2 GLY A 83 5.569 1.104 0.334 1.00 70.15 H new ATOM 0 HA3 GLY A 83 6.445 1.603 -1.100 1.00 70.15 H new ATOM 1209 N SER A 84 5.496 3.723 0.475 1.00 52.14 N ATOM 1210 CA SER A 84 5.324 5.167 0.681 1.00 71.35 C ATOM 1211 C SER A 84 6.378 5.711 1.667 1.00 24.44 C ATOM 1212 O SER A 84 7.005 4.926 2.393 1.00 12.43 O ATOM 1213 CB SER A 84 3.913 5.452 1.223 1.00 2.23 C ATOM 1214 OG SER A 84 2.998 5.473 0.147 1.00 22.52 O ATOM 0 H SER A 84 6.125 3.312 1.165 1.00 52.14 H new ATOM 0 HA SER A 84 5.456 5.668 -0.278 1.00 71.35 H new ATOM 0 HB2 SER A 84 3.626 4.687 1.945 1.00 2.23 H new ATOM 0 HB3 SER A 84 3.898 6.407 1.748 1.00 2.23 H new ATOM 0 HG SER A 84 3.348 4.931 -0.591 1.00 22.52 H new ATOM 1219 N PRO A 85 6.582 7.044 1.715 1.00 64.41 N ATOM 1220 CA PRO A 85 7.434 7.698 2.702 1.00 62.51 C ATOM 1221 C PRO A 85 6.711 7.837 4.048 1.00 44.11 C ATOM 1222 O PRO A 85 5.492 7.658 4.131 1.00 32.23 O ATOM 1223 CB PRO A 85 7.751 9.070 2.102 1.00 23.10 C ATOM 1224 CG PRO A 85 6.515 9.388 1.266 1.00 25.23 C ATOM 1225 CD PRO A 85 6.066 8.021 0.761 1.00 61.23 C ATOM 0 HA PRO A 85 8.338 7.124 2.906 1.00 62.51 H new ATOM 0 HB2 PRO A 85 7.915 9.819 2.877 1.00 23.10 H new ATOM 0 HB3 PRO A 85 8.653 9.042 1.490 1.00 23.10 H new ATOM 0 HG2 PRO A 85 5.740 9.870 1.862 1.00 25.23 H new ATOM 0 HG3 PRO A 85 6.750 10.063 0.443 1.00 25.23 H new ATOM 0 HD2 PRO A 85 4.979 7.967 0.698 1.00 61.23 H new ATOM 0 HD3 PRO A 85 6.453 7.830 -0.240 1.00 61.23 H new ATOM 1230 N VAL A 86 7.456 8.203 5.100 1.00 70.15 N ATOM 1231 CA VAL A 86 6.927 8.424 6.440 1.00 10.34 C ATOM 1232 C VAL A 86 7.905 9.297 7.228 1.00 61.32 C ATOM 1233 O VAL A 86 9.109 9.056 7.195 1.00 51.04 O ATOM 1234 CB VAL A 86 6.662 7.060 7.109 1.00 10.20 C ATOM 1235 CG1 VAL A 86 7.877 6.173 7.384 1.00 50.13 C ATOM 1236 CG2 VAL A 86 5.844 7.234 8.402 1.00 61.32 C ATOM 0 H VAL A 86 8.463 8.355 5.035 1.00 70.15 H new ATOM 0 HA VAL A 86 5.977 8.957 6.406 1.00 10.34 H new ATOM 0 HB VAL A 86 6.098 6.519 6.350 1.00 10.20 H new ATOM 0 HG11 VAL A 86 7.551 5.246 7.856 1.00 50.13 H new ATOM 0 HG12 VAL A 86 8.381 5.945 6.445 1.00 50.13 H new ATOM 0 HG13 VAL A 86 8.566 6.695 8.048 1.00 50.13 H new ATOM 0 HG21 VAL A 86 5.669 6.259 8.856 1.00 61.32 H new ATOM 0 HG22 VAL A 86 6.395 7.865 9.099 1.00 61.32 H new ATOM 0 HG23 VAL A 86 4.888 7.701 8.167 1.00 61.32 H new ATOM 1246 N TRP A 87 7.411 10.300 7.959 1.00 41.33 N ATOM 1247 CA TRP A 87 8.276 11.079 8.857 1.00 63.34 C ATOM 1248 C TRP A 87 7.573 11.758 10.041 1.00 33.21 C ATOM 1249 O TRP A 87 8.251 12.257 10.941 1.00 50.12 O ATOM 1250 CB TRP A 87 9.158 12.083 8.081 1.00 25.43 C ATOM 1251 CG TRP A 87 10.371 12.570 8.831 1.00 70.45 C ATOM 1252 CD1 TRP A 87 11.076 11.851 9.737 1.00 44.03 C ATOM 1253 CD2 TRP A 87 11.022 13.876 8.786 1.00 63.31 C ATOM 1254 NE1 TRP A 87 12.037 12.639 10.329 1.00 44.34 N ATOM 1255 CE2 TRP A 87 12.079 13.884 9.748 1.00 21.41 C ATOM 1256 CE3 TRP A 87 10.834 15.055 8.035 1.00 52.45 C ATOM 1257 CZ2 TRP A 87 12.915 14.991 9.944 1.00 71.54 C ATOM 1258 CZ3 TRP A 87 11.680 16.166 8.212 1.00 54.24 C ATOM 1259 CH2 TRP A 87 12.718 16.135 9.157 1.00 11.04 C ATOM 0 H TRP A 87 6.433 10.591 7.950 1.00 41.33 H new ATOM 0 HA TRP A 87 8.915 10.324 9.316 1.00 63.34 H new ATOM 0 HB2 TRP A 87 9.486 11.615 7.153 1.00 25.43 H new ATOM 0 HB3 TRP A 87 8.548 12.944 7.806 1.00 25.43 H new ATOM 0 HD1 TRP A 87 10.908 10.808 9.963 1.00 44.03 H new ATOM 0 HE1 TRP A 87 12.638 12.339 11.097 1.00 44.34 H new ATOM 0 HE3 TRP A 87 10.031 15.106 7.315 1.00 52.45 H new ATOM 0 HZ2 TRP A 87 13.697 14.964 10.688 1.00 71.54 H new ATOM 0 HZ3 TRP A 87 11.529 17.053 7.614 1.00 54.24 H new ATOM 0 HH2 TRP A 87 13.364 16.992 9.278 1.00 11.04 H new ATOM 1269 N SER A 88 6.243 11.716 10.109 1.00 61.15 N ATOM 1270 CA SER A 88 5.494 12.162 11.279 1.00 63.32 C ATOM 1271 C SER A 88 4.238 11.298 11.419 1.00 13.14 C ATOM 1272 O SER A 88 3.109 11.768 11.279 1.00 12.21 O ATOM 1273 CB SER A 88 5.186 13.663 11.144 1.00 54.33 C ATOM 1274 OG SER A 88 6.347 14.457 11.254 1.00 25.34 O ATOM 0 H SER A 88 5.655 11.370 9.351 1.00 61.15 H new ATOM 0 HA SER A 88 6.075 12.041 12.193 1.00 63.32 H new ATOM 0 HB2 SER A 88 4.710 13.849 10.181 1.00 54.33 H new ATOM 0 HB3 SER A 88 4.473 13.957 11.914 1.00 54.33 H new ATOM 0 HG SER A 88 7.135 13.878 11.319 1.00 25.34 H new ATOM 1279 N GLY A 89 4.425 10.004 11.653 1.00 30.50 N ATOM 1280 CA GLY A 89 3.371 9.031 11.890 1.00 21.41 C ATOM 1281 C GLY A 89 2.778 8.529 10.582 1.00 63.25 C ATOM 1282 O GLY A 89 2.898 7.343 10.286 1.00 44.35 O ATOM 0 H GLY A 89 5.356 9.589 11.684 1.00 30.50 H new ATOM 0 HA2 GLY A 89 3.770 8.190 12.457 1.00 21.41 H new ATOM 0 HA3 GLY A 89 2.587 9.482 12.498 1.00 21.41 H new ATOM 1286 N TYR A 90 2.147 9.424 9.822 1.00 12.10 N ATOM 1287 CA TYR A 90 1.430 9.138 8.586 1.00 43.43 C ATOM 1288 C TYR A 90 1.288 10.420 7.744 1.00 2.41 C ATOM 1289 O TYR A 90 0.183 10.931 7.625 1.00 12.13 O ATOM 1290 CB TYR A 90 0.065 8.468 8.890 1.00 44.04 C ATOM 1291 CG TYR A 90 -0.810 8.923 10.063 1.00 73.42 C ATOM 1292 CD1 TYR A 90 -0.720 10.188 10.684 1.00 13.24 C ATOM 1293 CD2 TYR A 90 -1.774 8.018 10.537 1.00 64.11 C ATOM 1294 CE1 TYR A 90 -1.530 10.497 11.801 1.00 21.31 C ATOM 1295 CE2 TYR A 90 -2.590 8.322 11.634 1.00 21.10 C ATOM 1296 CZ TYR A 90 -2.471 9.560 12.285 1.00 61.11 C ATOM 1297 OH TYR A 90 -3.315 9.843 13.321 1.00 14.33 O ATOM 0 H TYR A 90 2.123 10.414 10.066 1.00 12.10 H new ATOM 0 HA TYR A 90 2.003 8.426 7.992 1.00 43.43 H new ATOM 0 HB2 TYR A 90 -0.541 8.562 7.989 1.00 44.04 H new ATOM 0 HB3 TYR A 90 0.260 7.405 9.034 1.00 44.04 H new ATOM 0 HD1 TYR A 90 -0.028 10.924 10.303 1.00 13.24 H new ATOM 0 HD2 TYR A 90 -1.889 7.064 10.043 1.00 64.11 H new ATOM 0 HE1 TYR A 90 -1.429 11.456 12.288 1.00 21.31 H new ATOM 0 HE2 TYR A 90 -3.315 7.600 11.981 1.00 21.10 H new ATOM 0 HH TYR A 90 -3.885 9.066 13.500 1.00 14.33 H new ATOM 1306 N PRO A 91 2.371 10.990 7.181 1.00 14.23 N ATOM 1307 CA PRO A 91 2.336 12.289 6.503 1.00 14.33 C ATOM 1308 C PRO A 91 1.743 12.289 5.084 1.00 71.35 C ATOM 1309 O PRO A 91 1.759 13.338 4.442 1.00 23.54 O ATOM 1310 CB PRO A 91 3.802 12.730 6.461 1.00 74.12 C ATOM 1311 CG PRO A 91 4.536 11.409 6.308 1.00 74.53 C ATOM 1312 CD PRO A 91 3.743 10.517 7.261 1.00 73.51 C ATOM 0 HA PRO A 91 1.670 12.958 7.048 1.00 14.33 H new ATOM 0 HB2 PRO A 91 4.000 13.404 5.627 1.00 74.12 H new ATOM 0 HB3 PRO A 91 4.095 13.254 7.371 1.00 74.12 H new ATOM 0 HG2 PRO A 91 4.511 11.041 5.282 1.00 74.53 H new ATOM 0 HG3 PRO A 91 5.585 11.486 6.593 1.00 74.53 H new ATOM 0 HD2 PRO A 91 3.815 9.469 6.970 1.00 73.51 H new ATOM 0 HD3 PRO A 91 4.126 10.592 8.279 1.00 73.51 H new ATOM 1317 N ALA A 92 1.281 11.151 4.567 1.00 53.23 N ATOM 1318 CA ALA A 92 0.732 11.004 3.226 1.00 53.22 C ATOM 1319 C ALA A 92 -0.571 10.216 3.367 1.00 70.21 C ATOM 1320 O ALA A 92 -0.690 9.442 4.322 1.00 33.33 O ATOM 1321 CB ALA A 92 1.756 10.250 2.350 1.00 41.31 C ATOM 0 H ALA A 92 1.280 10.277 5.092 1.00 53.23 H new ATOM 0 HA ALA A 92 0.532 11.965 2.752 1.00 53.22 H new ATOM 0 HB1 ALA A 92 1.357 10.133 1.342 1.00 41.31 H new ATOM 0 HB2 ALA A 92 2.686 10.817 2.308 1.00 41.31 H new ATOM 0 HB3 ALA A 92 1.949 9.267 2.780 1.00 41.31 H new ATOM 1327 N THR A 93 -1.478 10.285 2.389 1.00 12.33 N ATOM 1328 CA THR A 93 -2.596 9.341 2.332 1.00 72.45 C ATOM 1329 C THR A 93 -2.830 8.764 0.916 1.00 41.45 C ATOM 1330 O THR A 93 -3.976 8.542 0.520 1.00 32.53 O ATOM 1331 CB THR A 93 -3.859 10.109 2.794 1.00 12.11 C ATOM 1332 OG1 THR A 93 -3.885 11.396 2.207 1.00 5.44 O ATOM 1333 CG2 THR A 93 -3.945 10.343 4.302 1.00 64.11 C ATOM 0 H THR A 93 -1.462 10.974 1.637 1.00 12.33 H new ATOM 0 HA THR A 93 -2.370 8.489 2.974 1.00 72.45 H new ATOM 0 HB THR A 93 -4.690 9.473 2.487 1.00 12.11 H new ATOM 0 HG1 THR A 93 -3.932 11.310 1.232 1.00 5.44 H new ATOM 0 HG21 THR A 93 -4.861 10.887 4.534 1.00 64.11 H new ATOM 0 HG22 THR A 93 -3.952 9.384 4.819 1.00 64.11 H new ATOM 0 HG23 THR A 93 -3.084 10.925 4.630 1.00 64.11 H new ATOM 1341 N PRO A 94 -1.797 8.245 0.232 1.00 21.21 N ATOM 1342 CA PRO A 94 -1.963 7.634 -1.080 1.00 4.43 C ATOM 1343 C PRO A 94 -2.589 6.254 -0.886 1.00 11.00 C ATOM 1344 O PRO A 94 -3.564 5.884 -1.539 1.00 43.31 O ATOM 1345 CB PRO A 94 -0.548 7.602 -1.682 1.00 31.24 C ATOM 1346 CG PRO A 94 0.358 7.559 -0.450 1.00 50.25 C ATOM 1347 CD PRO A 94 -0.395 8.397 0.546 1.00 70.13 C ATOM 0 HA PRO A 94 -2.627 8.171 -1.757 1.00 4.43 H new ATOM 0 HB2 PRO A 94 -0.402 6.730 -2.319 1.00 31.24 H new ATOM 0 HB3 PRO A 94 -0.352 8.482 -2.295 1.00 31.24 H new ATOM 0 HG2 PRO A 94 0.506 6.540 -0.092 1.00 50.25 H new ATOM 0 HG3 PRO A 94 1.346 7.970 -0.660 1.00 50.25 H new ATOM 0 HD2 PRO A 94 -0.188 8.069 1.565 1.00 70.13 H new ATOM 0 HD3 PRO A 94 -0.094 9.442 0.480 1.00 70.13 H new ATOM 1352 N ILE A 95 -2.083 5.505 0.097 1.00 14.41 N ATOM 1353 CA ILE A 95 -2.475 4.135 0.357 1.00 53.44 C ATOM 1354 C ILE A 95 -3.731 4.152 1.244 1.00 32.31 C ATOM 1355 O ILE A 95 -3.775 3.565 2.325 1.00 45.35 O ATOM 1356 CB ILE A 95 -1.295 3.336 0.952 1.00 11.10 C ATOM 1357 CG1 ILE A 95 0.130 3.698 0.451 1.00 22.12 C ATOM 1358 CG2 ILE A 95 -1.568 1.836 0.767 1.00 34.44 C ATOM 1359 CD1 ILE A 95 0.344 3.848 -1.066 1.00 51.45 C ATOM 0 H ILE A 95 -1.374 5.851 0.744 1.00 14.41 H new ATOM 0 HA ILE A 95 -2.732 3.616 -0.567 1.00 53.44 H new ATOM 0 HB ILE A 95 -1.264 3.623 2.003 1.00 11.10 H new ATOM 0 HG12 ILE A 95 0.423 4.635 0.924 1.00 22.12 H new ATOM 0 HG13 ILE A 95 0.816 2.931 0.811 1.00 22.12 H new ATOM 0 HG21 ILE A 95 -0.741 1.262 1.184 1.00 34.44 H new ATOM 0 HG22 ILE A 95 -2.491 1.568 1.281 1.00 34.44 H new ATOM 0 HG23 ILE A 95 -1.666 1.612 -0.295 1.00 34.44 H new ATOM 0 HD11 ILE A 95 1.386 4.101 -1.263 1.00 51.45 H new ATOM 0 HD12 ILE A 95 0.099 2.909 -1.563 1.00 51.45 H new ATOM 0 HD13 ILE A 95 -0.301 4.640 -1.448 1.00 51.45 H new ATOM 1370 N LYS A 96 -4.761 4.868 0.803 1.00 4.00 N ATOM 1371 CA LYS A 96 -6.128 4.790 1.300 1.00 1.02 C ATOM 1372 C LYS A 96 -7.053 4.506 0.124 1.00 12.20 C ATOM 1373 O LYS A 96 -7.669 3.444 0.113 1.00 12.43 O ATOM 1374 CB LYS A 96 -6.452 6.074 2.081 1.00 10.23 C ATOM 1375 CG LYS A 96 -7.930 6.307 2.392 1.00 72.32 C ATOM 1376 CD LYS A 96 -8.583 5.317 3.359 1.00 65.33 C ATOM 1377 CE LYS A 96 -8.368 5.721 4.822 1.00 22.10 C ATOM 1378 NZ LYS A 96 -9.259 4.965 5.721 1.00 72.55 N ATOM 0 H LYS A 96 -4.658 5.551 0.053 1.00 4.00 H new ATOM 0 HA LYS A 96 -6.268 3.971 2.006 1.00 1.02 H new ATOM 0 HB2 LYS A 96 -5.901 6.054 3.021 1.00 10.23 H new ATOM 0 HB3 LYS A 96 -6.081 6.926 1.512 1.00 10.23 H new ATOM 0 HG2 LYS A 96 -8.039 7.310 2.804 1.00 72.32 H new ATOM 0 HG3 LYS A 96 -8.485 6.286 1.454 1.00 72.32 H new ATOM 0 HD2 LYS A 96 -9.652 5.258 3.152 1.00 65.33 H new ATOM 0 HD3 LYS A 96 -8.171 4.322 3.193 1.00 65.33 H new ATOM 0 HE2 LYS A 96 -7.330 5.544 5.102 1.00 22.10 H new ATOM 0 HE3 LYS A 96 -8.552 6.789 4.938 1.00 22.10 H new ATOM 0 HZ1 LYS A 96 -9.091 5.259 6.704 1.00 72.55 H new ATOM 0 HZ2 LYS A 96 -10.250 5.154 5.467 1.00 72.55 H new ATOM 0 HZ3 LYS A 96 -9.065 3.948 5.626 1.00 72.55 H new ATOM 1388 N THR A 97 -7.149 5.388 -0.869 1.00 21.13 N ATOM 1389 CA THR A 97 -8.137 5.263 -1.939 1.00 1.02 C ATOM 1390 C THR A 97 -7.982 3.934 -2.696 1.00 10.32 C ATOM 1391 O THR A 97 -8.979 3.280 -2.991 1.00 22.11 O ATOM 1392 CB THR A 97 -8.013 6.484 -2.866 1.00 73.45 C ATOM 1393 OG1 THR A 97 -7.976 7.665 -2.088 1.00 62.41 O ATOM 1394 CG2 THR A 97 -9.145 6.568 -3.887 1.00 52.34 C ATOM 0 H THR A 97 -6.547 6.207 -0.955 1.00 21.13 H new ATOM 0 HA THR A 97 -9.141 5.246 -1.514 1.00 1.02 H new ATOM 0 HB THR A 97 -7.087 6.372 -3.429 1.00 73.45 H new ATOM 0 HG1 THR A 97 -8.504 8.363 -2.528 1.00 62.41 H new ATOM 0 HG21 THR A 97 -9.005 7.449 -4.514 1.00 52.34 H new ATOM 0 HG22 THR A 97 -9.139 5.674 -4.511 1.00 52.34 H new ATOM 0 HG23 THR A 97 -10.100 6.641 -3.366 1.00 52.34 H new ATOM 1402 N LEU A 98 -6.744 3.491 -2.953 1.00 12.40 N ATOM 1403 CA LEU A 98 -6.459 2.223 -3.627 1.00 62.24 C ATOM 1404 C LEU A 98 -7.157 1.051 -2.939 1.00 32.41 C ATOM 1405 O LEU A 98 -7.840 0.276 -3.589 1.00 43.45 O ATOM 1406 CB LEU A 98 -4.955 1.995 -3.680 1.00 74.24 C ATOM 1407 CG LEU A 98 -4.660 0.823 -4.638 1.00 52.14 C ATOM 1408 CD1 LEU A 98 -4.257 1.341 -6.012 1.00 43.41 C ATOM 1409 CD2 LEU A 98 -3.564 -0.020 -4.032 1.00 62.41 C ATOM 0 H LEU A 98 -5.905 4.011 -2.695 1.00 12.40 H new ATOM 0 HA LEU A 98 -6.849 2.282 -4.643 1.00 62.24 H new ATOM 0 HB2 LEU A 98 -4.449 2.898 -4.022 1.00 74.24 H new ATOM 0 HB3 LEU A 98 -4.572 1.773 -2.684 1.00 74.24 H new ATOM 0 HG LEU A 98 -5.555 0.216 -4.773 1.00 52.14 H new ATOM 0 HD11 LEU A 98 -4.053 0.499 -6.673 1.00 43.41 H new ATOM 0 HD12 LEU A 98 -5.067 1.940 -6.427 1.00 43.41 H new ATOM 0 HD13 LEU A 98 -3.361 1.956 -5.921 1.00 43.41 H new ATOM 0 HD21 LEU A 98 -3.339 -0.856 -4.695 1.00 62.41 H new ATOM 0 HD22 LEU A 98 -2.669 0.588 -3.899 1.00 62.41 H new ATOM 0 HD23 LEU A 98 -3.891 -0.401 -3.065 1.00 62.41 H new ATOM 1420 N LEU A 99 -7.013 0.926 -1.622 1.00 50.31 N ATOM 1421 CA LEU A 99 -7.591 -0.169 -0.859 1.00 64.12 C ATOM 1422 C LEU A 99 -9.116 -0.263 -1.021 1.00 3.22 C ATOM 1423 O LEU A 99 -9.667 -1.359 -0.970 1.00 44.34 O ATOM 1424 CB LEU A 99 -7.267 0.049 0.616 1.00 41.34 C ATOM 1425 CG LEU A 99 -5.816 -0.182 1.074 1.00 32.54 C ATOM 1426 CD1 LEU A 99 -4.818 -0.819 0.113 1.00 1.42 C ATOM 1427 CD2 LEU A 99 -5.210 1.110 1.599 1.00 73.13 C ATOM 0 H LEU A 99 -6.487 1.589 -1.053 1.00 50.31 H new ATOM 0 HA LEU A 99 -7.164 -1.099 -1.234 1.00 64.12 H new ATOM 0 HB2 LEU A 99 -7.540 1.073 0.871 1.00 41.34 H new ATOM 0 HB3 LEU A 99 -7.911 -0.607 1.201 1.00 41.34 H new ATOM 0 HG LEU A 99 -5.961 -0.946 1.838 1.00 32.54 H new ATOM 0 HD11 LEU A 99 -3.847 -0.905 0.601 1.00 1.42 H new ATOM 0 HD12 LEU A 99 -5.170 -1.810 -0.173 1.00 1.42 H new ATOM 0 HD13 LEU A 99 -4.722 -0.197 -0.777 1.00 1.42 H new ATOM 0 HD21 LEU A 99 -4.184 0.927 1.918 1.00 73.13 H new ATOM 0 HD22 LEU A 99 -5.216 1.862 0.810 1.00 73.13 H new ATOM 0 HD23 LEU A 99 -5.795 1.468 2.446 1.00 73.13 H new ATOM 1438 N ASP A 100 -9.798 0.867 -1.218 1.00 53.45 N ATOM 1439 CA ASP A 100 -11.251 0.905 -1.432 1.00 61.23 C ATOM 1440 C ASP A 100 -11.627 0.440 -2.843 1.00 13.13 C ATOM 1441 O ASP A 100 -12.710 -0.096 -3.075 1.00 42.11 O ATOM 1442 CB ASP A 100 -11.761 2.325 -1.206 1.00 1.11 C ATOM 1443 CG ASP A 100 -13.287 2.424 -1.168 1.00 33.32 C ATOM 1444 OD1 ASP A 100 -13.943 1.636 -0.448 1.00 52.41 O ATOM 1445 OD2 ASP A 100 -13.803 3.389 -1.778 1.00 54.42 O ATOM 0 H ASP A 100 -9.358 1.787 -1.234 1.00 53.45 H new ATOM 0 HA ASP A 100 -11.716 0.222 -0.720 1.00 61.23 H new ATOM 0 HB2 ASP A 100 -11.356 2.703 -0.267 1.00 1.11 H new ATOM 0 HB3 ASP A 100 -11.382 2.970 -1.999 1.00 1.11 H new ATOM 1449 N GLN A 101 -10.710 0.591 -3.802 1.00 54.23 N ATOM 1450 CA GLN A 101 -10.812 -0.076 -5.091 1.00 11.23 C ATOM 1451 C GLN A 101 -10.583 -1.585 -4.908 1.00 33.34 C ATOM 1452 O GLN A 101 -11.341 -2.405 -5.422 1.00 10.13 O ATOM 1453 CB GLN A 101 -9.823 0.528 -6.103 1.00 13.44 C ATOM 1454 CG GLN A 101 -9.914 2.056 -6.300 1.00 65.55 C ATOM 1455 CD GLN A 101 -9.091 2.538 -7.497 1.00 70.41 C ATOM 1456 OE1 GLN A 101 -8.603 1.734 -8.289 1.00 3.20 O ATOM 1457 NE2 GLN A 101 -8.928 3.839 -7.673 1.00 74.23 N ATOM 0 H GLN A 101 -9.882 1.178 -3.702 1.00 54.23 H new ATOM 0 HA GLN A 101 -11.813 0.076 -5.494 1.00 11.23 H new ATOM 0 HB2 GLN A 101 -8.810 0.281 -5.784 1.00 13.44 H new ATOM 0 HB3 GLN A 101 -9.980 0.046 -7.068 1.00 13.44 H new ATOM 0 HG2 GLN A 101 -10.957 2.340 -6.441 1.00 65.55 H new ATOM 0 HG3 GLN A 101 -9.566 2.558 -5.397 1.00 65.55 H new ATOM 0 HE21 GLN A 101 -9.337 4.498 -7.011 1.00 74.23 H new ATOM 0 HE22 GLN A 101 -8.394 4.183 -8.471 1.00 74.23 H new ATOM 1464 N MET A 102 -9.579 -1.976 -4.118 1.00 74.32 N ATOM 1465 CA MET A 102 -9.192 -3.365 -3.855 1.00 3.10 C ATOM 1466 C MET A 102 -10.201 -4.172 -3.019 1.00 24.40 C ATOM 1467 O MET A 102 -9.888 -5.291 -2.620 1.00 53.15 O ATOM 1468 CB MET A 102 -7.833 -3.403 -3.147 1.00 43.13 C ATOM 1469 CG MET A 102 -6.693 -2.904 -4.027 1.00 41.21 C ATOM 1470 SD MET A 102 -5.067 -3.106 -3.270 1.00 30.22 S ATOM 1471 CE MET A 102 -4.959 -4.915 -3.251 1.00 61.44 C ATOM 0 H MET A 102 -8.990 -1.306 -3.624 1.00 74.32 H new ATOM 0 HA MET A 102 -9.153 -3.838 -4.836 1.00 3.10 H new ATOM 0 HB2 MET A 102 -7.882 -2.794 -2.244 1.00 43.13 H new ATOM 0 HB3 MET A 102 -7.622 -4.425 -2.831 1.00 43.13 H new ATOM 0 HG2 MET A 102 -6.714 -3.440 -4.976 1.00 41.21 H new ATOM 0 HG3 MET A 102 -6.852 -1.850 -4.253 1.00 41.21 H new ATOM 0 HE1 MET A 102 -3.934 -5.220 -3.459 1.00 61.44 H new ATOM 0 HE2 MET A 102 -5.256 -5.287 -2.270 1.00 61.44 H new ATOM 0 HE3 MET A 102 -5.622 -5.327 -4.012 1.00 61.44 H new ATOM 1479 N LYS A 103 -11.397 -3.664 -2.715 1.00 3.32 N ATOM 1480 CA LYS A 103 -12.342 -4.323 -1.804 1.00 42.43 C ATOM 1481 C LYS A 103 -12.667 -5.775 -2.164 1.00 41.34 C ATOM 1482 O LYS A 103 -13.028 -6.546 -1.278 1.00 65.14 O ATOM 1483 CB LYS A 103 -13.628 -3.485 -1.729 1.00 32.40 C ATOM 1484 CG LYS A 103 -13.446 -2.229 -0.865 1.00 50.12 C ATOM 1485 CD LYS A 103 -13.376 -2.542 0.635 1.00 71.44 C ATOM 1486 CE LYS A 103 -11.955 -2.448 1.199 1.00 13.12 C ATOM 1487 NZ LYS A 103 -11.903 -2.967 2.579 1.00 64.44 N ATOM 0 H LYS A 103 -11.741 -2.781 -3.094 1.00 3.32 H new ATOM 0 HA LYS A 103 -11.853 -4.378 -0.831 1.00 42.43 H new ATOM 0 HB2 LYS A 103 -13.929 -3.193 -2.735 1.00 32.40 H new ATOM 0 HB3 LYS A 103 -14.434 -4.094 -1.319 1.00 32.40 H new ATOM 0 HG2 LYS A 103 -12.533 -1.715 -1.167 1.00 50.12 H new ATOM 0 HG3 LYS A 103 -14.273 -1.544 -1.050 1.00 50.12 H new ATOM 0 HD2 LYS A 103 -14.022 -1.851 1.176 1.00 71.44 H new ATOM 0 HD3 LYS A 103 -13.765 -3.545 0.810 1.00 71.44 H new ATOM 0 HE2 LYS A 103 -11.270 -3.013 0.567 1.00 13.12 H new ATOM 0 HE3 LYS A 103 -11.621 -1.411 1.183 1.00 13.12 H new ATOM 0 HZ1 LYS A 103 -11.065 -2.585 3.062 1.00 64.44 H new ATOM 0 HZ2 LYS A 103 -12.760 -2.677 3.091 1.00 64.44 H new ATOM 0 HZ3 LYS A 103 -11.847 -4.005 2.558 1.00 64.44 H new ATOM 1497 N ASN A 104 -12.553 -6.169 -3.432 1.00 65.44 N ATOM 1498 CA ASN A 104 -12.862 -7.507 -3.933 1.00 70.14 C ATOM 1499 C ASN A 104 -11.595 -8.218 -4.421 1.00 31.33 C ATOM 1500 O ASN A 104 -11.678 -9.123 -5.253 1.00 34.42 O ATOM 1501 CB ASN A 104 -13.986 -7.437 -4.986 1.00 1.31 C ATOM 1502 CG ASN A 104 -13.716 -6.457 -6.121 1.00 41.13 C ATOM 1503 OD1 ASN A 104 -13.310 -6.839 -7.212 1.00 52.24 O ATOM 1504 ND2 ASN A 104 -13.984 -5.177 -5.903 1.00 4.21 N ATOM 0 H ASN A 104 -12.230 -5.540 -4.167 1.00 65.44 H new ATOM 0 HA ASN A 104 -13.244 -8.122 -3.118 1.00 70.14 H new ATOM 0 HB2 ASN A 104 -14.137 -8.431 -5.407 1.00 1.31 H new ATOM 0 HB3 ASN A 104 -14.916 -7.156 -4.491 1.00 1.31 H new ATOM 0 HD21 ASN A 104 -13.853 -4.494 -6.649 1.00 4.21 H new ATOM 0 HD22 ASN A 104 -14.321 -4.875 -4.989 1.00 4.21 H new ATOM 1510 N TYR A 105 -10.419 -7.807 -3.938 1.00 73.52 N ATOM 1511 CA TYR A 105 -9.142 -8.486 -4.125 1.00 71.14 C ATOM 1512 C TYR A 105 -9.155 -9.840 -3.401 1.00 21.52 C ATOM 1513 O TYR A 105 -9.778 -9.987 -2.343 1.00 53.05 O ATOM 1514 CB TYR A 105 -8.045 -7.562 -3.581 1.00 21.54 C ATOM 1515 CG TYR A 105 -6.648 -8.136 -3.571 1.00 21.31 C ATOM 1516 CD1 TYR A 105 -6.099 -8.678 -4.747 1.00 12.11 C ATOM 1517 CD2 TYR A 105 -5.899 -8.134 -2.377 1.00 13.01 C ATOM 1518 CE1 TYR A 105 -4.827 -9.267 -4.722 1.00 13.12 C ATOM 1519 CE2 TYR A 105 -4.605 -8.673 -2.360 1.00 4.32 C ATOM 1520 CZ TYR A 105 -4.078 -9.264 -3.529 1.00 63.32 C ATOM 1521 OH TYR A 105 -2.867 -9.869 -3.489 1.00 33.10 O ATOM 0 H TYR A 105 -10.332 -6.956 -3.383 1.00 73.52 H new ATOM 0 HA TYR A 105 -8.955 -8.692 -5.179 1.00 71.14 H new ATOM 0 HB2 TYR A 105 -8.038 -6.648 -4.175 1.00 21.54 H new ATOM 0 HB3 TYR A 105 -8.308 -7.277 -2.562 1.00 21.54 H new ATOM 0 HD1 TYR A 105 -6.658 -8.640 -5.670 1.00 12.11 H new ATOM 0 HD2 TYR A 105 -6.322 -7.717 -1.475 1.00 13.01 H new ATOM 0 HE1 TYR A 105 -4.423 -9.722 -5.614 1.00 13.12 H new ATOM 0 HE2 TYR A 105 -4.014 -8.636 -1.457 1.00 4.32 H new ATOM 0 HH TYR A 105 -2.384 -9.580 -2.687 1.00 33.10 H new ATOM 1530 N ARG A 106 -8.459 -10.841 -3.948 1.00 65.11 N ATOM 1531 CA ARG A 106 -8.471 -12.231 -3.488 1.00 51.13 C ATOM 1532 C ARG A 106 -7.027 -12.709 -3.369 1.00 1.40 C ATOM 1533 O ARG A 106 -6.613 -13.651 -4.050 1.00 74.21 O ATOM 1534 CB ARG A 106 -9.291 -13.071 -4.486 1.00 1.30 C ATOM 1535 CG ARG A 106 -10.788 -12.722 -4.484 1.00 12.04 C ATOM 1536 CD ARG A 106 -11.568 -13.546 -3.460 1.00 64.51 C ATOM 1537 NE ARG A 106 -11.871 -14.897 -3.962 1.00 22.13 N ATOM 1538 CZ ARG A 106 -11.724 -16.061 -3.317 1.00 53.11 C ATOM 1539 NH1 ARG A 106 -11.207 -16.116 -2.094 1.00 71.43 N ATOM 1540 NH2 ARG A 106 -12.132 -17.187 -3.883 1.00 63.53 N ATOM 0 H ARG A 106 -7.849 -10.699 -4.753 1.00 65.11 H new ATOM 0 HA ARG A 106 -8.939 -12.332 -2.509 1.00 51.13 H new ATOM 0 HB2 ARG A 106 -8.891 -12.924 -5.489 1.00 1.30 H new ATOM 0 HB3 ARG A 106 -9.170 -14.128 -4.247 1.00 1.30 H new ATOM 0 HG2 ARG A 106 -10.912 -11.661 -4.266 1.00 12.04 H new ATOM 0 HG3 ARG A 106 -11.201 -12.894 -5.478 1.00 12.04 H new ATOM 0 HD2 ARG A 106 -10.991 -13.622 -2.539 1.00 64.51 H new ATOM 0 HD3 ARG A 106 -12.497 -13.033 -3.213 1.00 64.51 H new ATOM 0 HE ARG A 106 -12.236 -14.952 -4.913 1.00 22.13 H new ATOM 0 HH11 ARG A 106 -10.912 -15.259 -1.626 1.00 71.43 H new ATOM 0 HH12 ARG A 106 -11.105 -17.015 -1.623 1.00 71.43 H new ATOM 0 HH21 ARG A 106 -12.558 -17.167 -4.810 1.00 63.53 H new ATOM 0 HH22 ARG A 106 -12.020 -18.074 -3.392 1.00 63.53 H new ATOM 1551 N GLY A 107 -6.251 -12.045 -2.519 1.00 44.31 N ATOM 1552 CA GLY A 107 -4.836 -12.303 -2.357 1.00 5.14 C ATOM 1553 C GLY A 107 -4.320 -11.615 -1.099 1.00 64.24 C ATOM 1554 O GLY A 107 -5.115 -11.268 -0.215 1.00 51.32 O ATOM 0 H GLY A 107 -6.600 -11.300 -1.915 1.00 44.31 H new ATOM 0 HA2 GLY A 107 -4.659 -13.377 -2.293 1.00 5.14 H new ATOM 0 HA3 GLY A 107 -4.290 -11.942 -3.229 1.00 5.14 H new ATOM 1558 N GLU A 108 -3.005 -11.409 -1.011 1.00 22.43 N ATOM 1559 CA GLU A 108 -2.321 -10.949 0.184 1.00 2.42 C ATOM 1560 C GLU A 108 -1.707 -9.573 -0.018 1.00 43.35 C ATOM 1561 O GLU A 108 -1.200 -9.237 -1.089 1.00 61.13 O ATOM 1562 CB GLU A 108 -1.215 -11.942 0.537 1.00 63.43 C ATOM 1563 CG GLU A 108 -1.786 -13.195 1.197 1.00 33.30 C ATOM 1564 CD GLU A 108 -1.384 -14.471 0.478 1.00 30.00 C ATOM 1565 OE1 GLU A 108 -0.221 -14.903 0.630 1.00 73.30 O ATOM 1566 OE2 GLU A 108 -2.280 -15.047 -0.182 1.00 12.22 O ATOM 0 H GLU A 108 -2.373 -11.564 -1.797 1.00 22.43 H new ATOM 0 HA GLU A 108 -3.051 -10.880 0.990 1.00 2.42 H new ATOM 0 HB2 GLU A 108 -0.671 -12.220 -0.366 1.00 63.43 H new ATOM 0 HB3 GLU A 108 -0.499 -11.469 1.209 1.00 63.43 H new ATOM 0 HG2 GLU A 108 -1.446 -13.243 2.231 1.00 33.30 H new ATOM 0 HG3 GLU A 108 -2.873 -13.124 1.222 1.00 33.30 H new ATOM 1571 N VAL A 109 -1.709 -8.793 1.055 1.00 63.11 N ATOM 1572 CA VAL A 109 -1.100 -7.475 1.099 1.00 53.03 C ATOM 1573 C VAL A 109 0.240 -7.543 1.836 1.00 74.33 C ATOM 1574 O VAL A 109 0.351 -8.211 2.867 1.00 34.22 O ATOM 1575 CB VAL A 109 -2.082 -6.457 1.728 1.00 30.34 C ATOM 1576 CG1 VAL A 109 -1.477 -5.050 1.609 1.00 43.42 C ATOM 1577 CG2 VAL A 109 -3.459 -6.506 1.042 1.00 44.15 C ATOM 0 H VAL A 109 -2.144 -9.067 1.936 1.00 63.11 H new ATOM 0 HA VAL A 109 -0.890 -7.128 0.087 1.00 53.03 H new ATOM 0 HB VAL A 109 -2.233 -6.713 2.777 1.00 30.34 H new ATOM 0 HG11 VAL A 109 -2.159 -4.322 2.049 1.00 43.42 H new ATOM 0 HG12 VAL A 109 -0.523 -5.018 2.136 1.00 43.42 H new ATOM 0 HG13 VAL A 109 -1.319 -4.810 0.558 1.00 43.42 H new ATOM 0 HG21 VAL A 109 -4.124 -5.779 1.508 1.00 44.15 H new ATOM 0 HG22 VAL A 109 -3.347 -6.269 -0.016 1.00 44.15 H new ATOM 0 HG23 VAL A 109 -3.883 -7.505 1.147 1.00 44.15 H new ATOM 1587 N ALA A 110 1.240 -6.786 1.373 1.00 73.13 N ATOM 1588 CA ALA A 110 2.318 -6.309 2.232 1.00 45.35 C ATOM 1589 C ALA A 110 2.667 -4.858 1.882 1.00 42.24 C ATOM 1590 O ALA A 110 2.217 -4.343 0.856 1.00 34.22 O ATOM 1591 CB ALA A 110 3.543 -7.232 2.171 1.00 43.25 C ATOM 0 H ALA A 110 1.321 -6.491 0.400 1.00 73.13 H new ATOM 0 HA ALA A 110 1.972 -6.331 3.265 1.00 45.35 H new ATOM 0 HB1 ALA A 110 4.324 -6.843 2.824 1.00 43.25 H new ATOM 0 HB2 ALA A 110 3.261 -8.233 2.498 1.00 43.25 H new ATOM 0 HB3 ALA A 110 3.915 -7.276 1.147 1.00 43.25 H new ATOM 1597 N SER A 111 3.478 -4.201 2.717 1.00 61.22 N ATOM 1598 CA SER A 111 3.942 -2.833 2.502 1.00 61.25 C ATOM 1599 C SER A 111 5.453 -2.747 2.733 1.00 32.04 C ATOM 1600 O SER A 111 6.050 -3.640 3.345 1.00 44.41 O ATOM 1601 CB SER A 111 3.188 -1.885 3.445 1.00 12.21 C ATOM 1602 OG SER A 111 3.091 -0.542 2.989 1.00 44.41 O ATOM 0 H SER A 111 3.836 -4.616 3.577 1.00 61.22 H new ATOM 0 HA SER A 111 3.741 -2.536 1.473 1.00 61.25 H new ATOM 0 HB2 SER A 111 2.182 -2.274 3.600 1.00 12.21 H new ATOM 0 HB3 SER A 111 3.685 -1.889 4.415 1.00 12.21 H new ATOM 0 HG SER A 111 3.450 -0.479 2.079 1.00 44.41 H new ATOM 1607 N PHE A 112 6.066 -1.658 2.279 1.00 13.41 N ATOM 1608 CA PHE A 112 7.490 -1.417 2.361 1.00 74.15 C ATOM 1609 C PHE A 112 7.742 0.099 2.478 1.00 72.45 C ATOM 1610 O PHE A 112 7.446 0.860 1.560 1.00 70.21 O ATOM 1611 CB PHE A 112 8.164 -2.139 1.182 1.00 64.21 C ATOM 1612 CG PHE A 112 7.689 -1.814 -0.231 1.00 51.34 C ATOM 1613 CD1 PHE A 112 8.151 -0.672 -0.905 1.00 13.51 C ATOM 1614 CD2 PHE A 112 6.838 -2.704 -0.916 1.00 11.13 C ATOM 1615 CE1 PHE A 112 7.834 -0.456 -2.255 1.00 41.44 C ATOM 1616 CE2 PHE A 112 6.470 -2.450 -2.250 1.00 42.23 C ATOM 1617 CZ PHE A 112 6.963 -1.323 -2.921 1.00 54.53 C ATOM 0 H PHE A 112 5.560 -0.895 1.829 1.00 13.41 H new ATOM 0 HA PHE A 112 7.949 -1.834 3.257 1.00 74.15 H new ATOM 0 HB2 PHE A 112 9.232 -1.929 1.230 1.00 64.21 H new ATOM 0 HB3 PHE A 112 8.043 -3.211 1.335 1.00 64.21 H new ATOM 0 HD1 PHE A 112 8.758 0.049 -0.378 1.00 13.51 H new ATOM 0 HD2 PHE A 112 6.466 -3.585 -0.415 1.00 11.13 H new ATOM 0 HE1 PHE A 112 8.265 0.383 -2.781 1.00 41.44 H new ATOM 0 HE2 PHE A 112 5.803 -3.129 -2.761 1.00 42.23 H new ATOM 0 HZ PHE A 112 6.673 -1.126 -3.943 1.00 54.53 H new ATOM 1626 N PHE A 113 8.228 0.588 3.627 1.00 10.42 N ATOM 1627 CA PHE A 113 8.519 2.010 3.814 1.00 53.55 C ATOM 1628 C PHE A 113 10.001 2.264 3.531 1.00 62.43 C ATOM 1629 O PHE A 113 10.864 1.552 4.051 1.00 14.23 O ATOM 1630 CB PHE A 113 8.062 2.517 5.200 1.00 3.44 C ATOM 1631 CG PHE A 113 8.730 1.923 6.432 1.00 21.33 C ATOM 1632 CD1 PHE A 113 10.036 2.309 6.785 1.00 44.51 C ATOM 1633 CD2 PHE A 113 8.034 1.037 7.277 1.00 71.44 C ATOM 1634 CE1 PHE A 113 10.654 1.789 7.931 1.00 2.42 C ATOM 1635 CE2 PHE A 113 8.669 0.463 8.392 1.00 23.13 C ATOM 1636 CZ PHE A 113 9.986 0.837 8.711 1.00 44.51 C ATOM 0 H PHE A 113 8.428 0.012 4.445 1.00 10.42 H new ATOM 0 HA PHE A 113 7.939 2.594 3.099 1.00 53.55 H new ATOM 0 HB2 PHE A 113 8.211 3.596 5.227 1.00 3.44 H new ATOM 0 HB3 PHE A 113 6.990 2.341 5.283 1.00 3.44 H new ATOM 0 HD1 PHE A 113 10.569 3.015 6.165 1.00 44.51 H new ATOM 0 HD2 PHE A 113 7.002 0.796 7.066 1.00 71.44 H new ATOM 0 HE1 PHE A 113 11.642 2.122 8.211 1.00 2.42 H new ATOM 0 HE2 PHE A 113 8.148 -0.261 9.000 1.00 23.13 H new ATOM 0 HZ PHE A 113 10.483 0.389 9.559 1.00 44.51 H new ATOM 1645 N THR A 114 10.310 3.312 2.763 1.00 54.35 N ATOM 1646 CA THR A 114 11.689 3.690 2.455 1.00 33.30 C ATOM 1647 C THR A 114 12.233 4.735 3.444 1.00 31.21 C ATOM 1648 O THR A 114 13.312 5.291 3.206 1.00 45.23 O ATOM 1649 CB THR A 114 11.777 4.193 0.999 1.00 25.10 C ATOM 1650 OG1 THR A 114 10.915 5.299 0.771 1.00 33.23 O ATOM 1651 CG2 THR A 114 11.469 3.100 -0.031 1.00 73.04 C ATOM 0 H THR A 114 9.611 3.921 2.338 1.00 54.35 H new ATOM 0 HA THR A 114 12.318 2.806 2.562 1.00 33.30 H new ATOM 0 HB THR A 114 12.813 4.505 0.866 1.00 25.10 H new ATOM 0 HG1 THR A 114 10.998 5.592 -0.160 1.00 33.23 H new ATOM 0 HG21 THR A 114 11.547 3.515 -1.036 1.00 73.04 H new ATOM 0 HG22 THR A 114 12.182 2.283 0.081 1.00 73.04 H new ATOM 0 HG23 THR A 114 10.459 2.724 0.129 1.00 73.04 H new ATOM 1659 N SER A 115 11.477 5.106 4.485 1.00 43.12 N ATOM 1660 CA SER A 115 11.777 6.242 5.349 1.00 2.31 C ATOM 1661 C SER A 115 11.806 5.779 6.798 1.00 42.51 C ATOM 1662 O SER A 115 10.863 5.161 7.283 1.00 61.05 O ATOM 1663 CB SER A 115 10.748 7.355 5.127 1.00 24.32 C ATOM 1664 OG SER A 115 11.405 8.609 5.109 1.00 24.24 O ATOM 0 H SER A 115 10.625 4.612 4.751 1.00 43.12 H new ATOM 0 HA SER A 115 12.758 6.650 5.103 1.00 2.31 H new ATOM 0 HB2 SER A 115 10.221 7.195 4.186 1.00 24.32 H new ATOM 0 HB3 SER A 115 9.999 7.336 5.919 1.00 24.32 H new ATOM 0 HG SER A 115 10.959 9.221 5.732 1.00 24.24 H new ATOM 1669 N ALA A 116 12.912 6.049 7.486 1.00 22.32 N ATOM 1670 CA ALA A 116 13.174 5.566 8.839 1.00 10.21 C ATOM 1671 C ALA A 116 13.200 6.695 9.873 1.00 44.14 C ATOM 1672 O ALA A 116 13.430 6.402 11.045 1.00 71.33 O ATOM 1673 CB ALA A 116 14.507 4.800 8.834 1.00 42.11 C ATOM 0 H ALA A 116 13.668 6.622 7.110 1.00 22.32 H new ATOM 0 HA ALA A 116 12.358 4.906 9.134 1.00 10.21 H new ATOM 0 HB1 ALA A 116 14.719 4.432 9.838 1.00 42.11 H new ATOM 0 HB2 ALA A 116 14.440 3.958 8.145 1.00 42.11 H new ATOM 0 HB3 ALA A 116 15.308 5.467 8.516 1.00 42.11 H new ATOM 1679 N GLY A 117 13.006 7.955 9.461 1.00 51.34 N ATOM 1680 CA GLY A 117 13.522 9.133 10.162 1.00 41.14 C ATOM 1681 C GLY A 117 13.337 9.114 11.684 1.00 13.50 C ATOM 1682 O GLY A 117 14.316 9.232 12.425 1.00 73.22 O ATOM 0 H GLY A 117 12.478 8.185 8.619 1.00 51.34 H new ATOM 0 HA2 GLY A 117 14.585 9.232 9.941 1.00 41.14 H new ATOM 0 HA3 GLY A 117 13.030 10.020 9.762 1.00 41.14 H new ATOM 1686 N THR A 118 12.101 8.984 12.162 1.00 2.03 N ATOM 1687 CA THR A 118 11.784 8.978 13.589 1.00 71.34 C ATOM 1688 C THR A 118 10.582 8.066 13.900 1.00 25.14 C ATOM 1689 O THR A 118 10.077 8.044 15.024 1.00 34.41 O ATOM 1690 CB THR A 118 11.539 10.426 14.086 1.00 71.44 C ATOM 1691 OG1 THR A 118 11.835 11.441 13.133 1.00 52.02 O ATOM 1692 CG2 THR A 118 12.399 10.694 15.319 1.00 5.44 C ATOM 0 H THR A 118 11.282 8.879 11.563 1.00 2.03 H new ATOM 0 HA THR A 118 12.639 8.568 14.127 1.00 71.34 H new ATOM 0 HB THR A 118 10.471 10.478 14.296 1.00 71.44 H new ATOM 0 HG1 THR A 118 11.652 12.321 13.525 1.00 52.02 H new ATOM 0 HG21 THR A 118 12.227 11.712 15.668 1.00 5.44 H new ATOM 0 HG22 THR A 118 12.134 9.990 16.108 1.00 5.44 H new ATOM 0 HG23 THR A 118 13.451 10.572 15.062 1.00 5.44 H new ATOM 1700 N ASN A 119 10.098 7.303 12.915 1.00 52.34 N ATOM 1701 CA ASN A 119 8.864 6.529 12.968 1.00 34.33 C ATOM 1702 C ASN A 119 9.177 5.160 12.382 1.00 50.34 C ATOM 1703 O ASN A 119 9.643 5.078 11.243 1.00 22.10 O ATOM 1704 CB ASN A 119 7.739 7.241 12.193 1.00 41.14 C ATOM 1705 CG ASN A 119 6.974 8.248 13.036 1.00 71.14 C ATOM 1706 OD1 ASN A 119 7.009 9.442 12.761 1.00 64.24 O ATOM 1707 ND2 ASN A 119 6.220 7.803 14.026 1.00 21.44 N ATOM 0 H ASN A 119 10.581 7.207 12.022 1.00 52.34 H new ATOM 0 HA ASN A 119 8.507 6.425 13.993 1.00 34.33 H new ATOM 0 HB2 ASN A 119 8.168 7.751 11.330 1.00 41.14 H new ATOM 0 HB3 ASN A 119 7.043 6.495 11.809 1.00 41.14 H new ATOM 0 HD21 ASN A 119 5.658 8.456 14.572 1.00 21.44 H new ATOM 0 HD22 ASN A 119 6.200 6.807 14.244 1.00 21.44 H new ATOM 1713 N HIS A 120 8.911 4.103 13.156 1.00 11.11 N ATOM 1714 CA HIS A 120 8.912 2.717 12.691 1.00 30.55 C ATOM 1715 C HIS A 120 7.624 2.018 13.135 1.00 32.33 C ATOM 1716 O HIS A 120 6.872 1.541 12.288 1.00 42.10 O ATOM 1717 CB HIS A 120 10.192 2.007 13.150 1.00 25.32 C ATOM 1718 CG HIS A 120 10.366 0.574 12.697 1.00 53.50 C ATOM 1719 ND1 HIS A 120 9.571 -0.137 11.835 1.00 11.33 N flip ATOM 1720 CD2 HIS A 120 11.396 -0.254 13.084 1.00 62.02 C flip ATOM 1721 CE1 HIS A 120 10.127 -1.412 11.706 1.00 71.22 C flip ATOM 1722 NE2 HIS A 120 11.220 -1.439 12.483 1.00 1.41 N flip ATOM 0 H HIS A 120 8.684 4.192 14.146 1.00 11.11 H new ATOM 0 HA HIS A 120 8.921 2.682 11.602 1.00 30.55 H new ATOM 0 HB2 HIS A 120 11.047 2.583 12.797 1.00 25.32 H new ATOM 0 HB3 HIS A 120 10.222 2.027 14.239 1.00 25.32 H new ATOM 0 HD2 HIS A 120 12.203 0.006 13.753 1.00 62.02 H new ATOM 0 HE1 HIS A 120 9.749 -2.221 11.098 1.00 71.22 H new ATOM 0 HE2 HIS A 120 11.831 -2.247 12.600 1.00 1.41 H new ATOM 1729 N LYS A 121 7.327 1.983 14.441 1.00 31.31 N ATOM 1730 CA LYS A 121 6.094 1.373 14.956 1.00 43.21 C ATOM 1731 C LYS A 121 4.845 1.921 14.267 1.00 33.35 C ATOM 1732 O LYS A 121 3.972 1.138 13.902 1.00 63.41 O ATOM 1733 CB LYS A 121 5.985 1.576 16.482 1.00 3.05 C ATOM 1734 CG LYS A 121 6.565 0.406 17.285 1.00 25.12 C ATOM 1735 CD LYS A 121 5.603 -0.789 17.300 1.00 51.12 C ATOM 1736 CE LYS A 121 6.333 -2.032 17.811 1.00 33.34 C ATOM 1737 NZ LYS A 121 5.549 -3.262 17.597 1.00 13.41 N ATOM 0 H LYS A 121 7.930 2.374 15.165 1.00 31.31 H new ATOM 0 HA LYS A 121 6.151 0.307 14.736 1.00 43.21 H new ATOM 0 HB2 LYS A 121 6.505 2.493 16.759 1.00 3.05 H new ATOM 0 HB3 LYS A 121 4.937 1.710 16.751 1.00 3.05 H new ATOM 0 HG2 LYS A 121 7.519 0.103 16.853 1.00 25.12 H new ATOM 0 HG3 LYS A 121 6.766 0.727 18.307 1.00 25.12 H new ATOM 0 HD2 LYS A 121 4.746 -0.571 17.938 1.00 51.12 H new ATOM 0 HD3 LYS A 121 5.216 -0.969 16.297 1.00 51.12 H new ATOM 0 HE2 LYS A 121 7.294 -2.122 17.304 1.00 33.34 H new ATOM 0 HE3 LYS A 121 6.543 -1.917 18.874 1.00 33.34 H new ATOM 0 HZ1 LYS A 121 6.081 -4.080 17.958 1.00 13.41 H new ATOM 0 HZ2 LYS A 121 4.643 -3.188 18.102 1.00 13.41 H new ATOM 0 HZ3 LYS A 121 5.370 -3.387 16.580 1.00 13.41 H new ATOM 1747 N ALA A 122 4.766 3.245 14.108 1.00 22.32 N ATOM 1748 CA ALA A 122 3.570 3.933 13.660 1.00 61.45 C ATOM 1749 C ALA A 122 3.009 3.354 12.365 1.00 10.11 C ATOM 1750 O ALA A 122 1.861 2.933 12.336 1.00 42.34 O ATOM 1751 CB ALA A 122 3.898 5.410 13.481 1.00 24.50 C ATOM 0 H ALA A 122 5.549 3.872 14.292 1.00 22.32 H new ATOM 0 HA ALA A 122 2.797 3.800 14.417 1.00 61.45 H new ATOM 0 HB1 ALA A 122 3.008 5.942 13.144 1.00 24.50 H new ATOM 0 HB2 ALA A 122 4.232 5.826 14.431 1.00 24.50 H new ATOM 0 HB3 ALA A 122 4.689 5.520 12.739 1.00 24.50 H new ATOM 1757 N TYR A 123 3.812 3.332 11.301 1.00 73.12 N ATOM 1758 CA TYR A 123 3.390 3.023 9.938 1.00 3.14 C ATOM 1759 C TYR A 123 2.738 1.645 9.867 1.00 43.21 C ATOM 1760 O TYR A 123 1.783 1.457 9.122 1.00 5.04 O ATOM 1761 CB TYR A 123 4.616 3.128 9.018 1.00 12.13 C ATOM 1762 CG TYR A 123 4.399 2.929 7.534 1.00 53.01 C ATOM 1763 CD1 TYR A 123 4.340 1.628 7.006 1.00 74.44 C ATOM 1764 CD2 TYR A 123 4.352 4.043 6.669 1.00 33.30 C ATOM 1765 CE1 TYR A 123 4.232 1.442 5.616 1.00 4.21 C ATOM 1766 CE2 TYR A 123 4.263 3.853 5.278 1.00 2.34 C ATOM 1767 CZ TYR A 123 4.207 2.548 4.741 1.00 4.42 C ATOM 1768 OH TYR A 123 4.111 2.349 3.395 1.00 43.14 O ATOM 0 H TYR A 123 4.809 3.536 11.369 1.00 73.12 H new ATOM 0 HA TYR A 123 2.635 3.736 9.608 1.00 3.14 H new ATOM 0 HB2 TYR A 123 5.061 4.112 9.163 1.00 12.13 H new ATOM 0 HB3 TYR A 123 5.350 2.394 9.351 1.00 12.13 H new ATOM 0 HD1 TYR A 123 4.377 0.774 7.666 1.00 74.44 H new ATOM 0 HD2 TYR A 123 4.384 5.043 7.076 1.00 33.30 H new ATOM 0 HE1 TYR A 123 4.168 0.442 5.214 1.00 4.21 H new ATOM 0 HE2 TYR A 123 4.237 4.708 4.619 1.00 2.34 H new ATOM 0 HH TYR A 123 3.806 1.434 3.221 1.00 43.14 H new ATOM 1777 N VAL A 124 3.216 0.691 10.667 1.00 11.01 N ATOM 1778 CA VAL A 124 2.684 -0.662 10.752 1.00 73.44 C ATOM 1779 C VAL A 124 1.220 -0.615 11.199 1.00 70.44 C ATOM 1780 O VAL A 124 0.340 -1.194 10.557 1.00 71.22 O ATOM 1781 CB VAL A 124 3.568 -1.471 11.723 1.00 63.54 C ATOM 1782 CG1 VAL A 124 3.119 -2.936 11.796 1.00 11.03 C ATOM 1783 CG2 VAL A 124 5.048 -1.384 11.289 1.00 45.31 C ATOM 0 H VAL A 124 4.008 0.847 11.291 1.00 11.01 H new ATOM 0 HA VAL A 124 2.704 -1.153 9.779 1.00 73.44 H new ATOM 0 HB VAL A 124 3.462 -1.039 12.718 1.00 63.54 H new ATOM 0 HG11 VAL A 124 3.762 -3.479 12.488 1.00 11.03 H new ATOM 0 HG12 VAL A 124 2.087 -2.983 12.145 1.00 11.03 H new ATOM 0 HG13 VAL A 124 3.188 -3.388 10.806 1.00 11.03 H new ATOM 0 HG21 VAL A 124 5.664 -1.958 11.981 1.00 45.31 H new ATOM 0 HG22 VAL A 124 5.157 -1.790 10.283 1.00 45.31 H new ATOM 0 HG23 VAL A 124 5.369 -0.342 11.296 1.00 45.31 H new ATOM 1793 N SER A 125 0.975 0.054 12.321 1.00 50.24 N ATOM 1794 CA SER A 125 -0.323 0.202 12.948 1.00 42.04 C ATOM 1795 C SER A 125 -1.233 1.071 12.069 1.00 43.14 C ATOM 1796 O SER A 125 -2.381 0.711 11.803 1.00 74.32 O ATOM 1797 CB SER A 125 -0.047 0.838 14.309 1.00 34.20 C ATOM 1798 OG SER A 125 0.306 -0.147 15.275 1.00 31.15 O ATOM 0 H SER A 125 1.715 0.528 12.838 1.00 50.24 H new ATOM 0 HA SER A 125 -0.844 -0.747 13.071 1.00 42.04 H new ATOM 0 HB2 SER A 125 0.759 1.566 14.217 1.00 34.20 H new ATOM 0 HB3 SER A 125 -0.930 1.381 14.645 1.00 34.20 H new ATOM 0 HG SER A 125 0.479 0.287 16.136 1.00 31.15 H new ATOM 1803 N HIS A 126 -0.722 2.195 11.571 1.00 73.34 N ATOM 1804 CA HIS A 126 -1.476 3.118 10.743 1.00 12.04 C ATOM 1805 C HIS A 126 -1.899 2.467 9.422 1.00 21.51 C ATOM 1806 O HIS A 126 -2.985 2.744 8.907 1.00 25.42 O ATOM 1807 CB HIS A 126 -0.630 4.368 10.468 1.00 64.14 C ATOM 1808 CG HIS A 126 -0.332 5.232 11.672 1.00 23.43 C ATOM 1809 ND1 HIS A 126 0.689 6.153 11.750 1.00 65.42 N ATOM 1810 CD2 HIS A 126 -1.056 5.319 12.836 1.00 25.22 C ATOM 1811 CE1 HIS A 126 0.571 6.784 12.930 1.00 42.33 C ATOM 1812 NE2 HIS A 126 -0.461 6.300 13.638 1.00 70.34 N ATOM 0 H HIS A 126 0.241 2.489 11.737 1.00 73.34 H new ATOM 0 HA HIS A 126 -2.382 3.399 11.280 1.00 12.04 H new ATOM 0 HB2 HIS A 126 0.315 4.055 10.025 1.00 64.14 H new ATOM 0 HB3 HIS A 126 -1.144 4.977 9.725 1.00 64.14 H new ATOM 0 HD1 HIS A 126 1.403 6.324 11.042 1.00 65.42 H new ATOM 0 HD2 HIS A 126 -1.929 4.735 13.088 1.00 25.22 H new ATOM 0 HE1 HIS A 126 1.222 7.578 13.265 1.00 42.33 H new ATOM 1819 N PHE A 127 -1.050 1.609 8.849 1.00 53.23 N ATOM 1820 CA PHE A 127 -1.362 0.911 7.614 1.00 10.10 C ATOM 1821 C PHE A 127 -2.500 -0.082 7.837 1.00 65.41 C ATOM 1822 O PHE A 127 -3.456 -0.072 7.065 1.00 64.23 O ATOM 1823 CB PHE A 127 -0.101 0.248 7.045 1.00 21.42 C ATOM 1824 CG PHE A 127 -0.323 -0.520 5.760 1.00 11.11 C ATOM 1825 CD1 PHE A 127 -1.096 0.034 4.725 1.00 64.55 C ATOM 1826 CD2 PHE A 127 0.215 -1.808 5.606 1.00 44.05 C ATOM 1827 CE1 PHE A 127 -1.335 -0.690 3.553 1.00 41.03 C ATOM 1828 CE2 PHE A 127 -0.048 -2.551 4.446 1.00 32.41 C ATOM 1829 CZ PHE A 127 -0.810 -1.980 3.420 1.00 53.11 C ATOM 0 H PHE A 127 -0.132 1.384 9.232 1.00 53.23 H new ATOM 0 HA PHE A 127 -1.709 1.628 6.870 1.00 10.10 H new ATOM 0 HB2 PHE A 127 0.651 1.017 6.869 1.00 21.42 H new ATOM 0 HB3 PHE A 127 0.307 -0.431 7.794 1.00 21.42 H new ATOM 0 HD1 PHE A 127 -1.508 1.026 4.836 1.00 64.55 H new ATOM 0 HD2 PHE A 127 0.834 -2.228 6.385 1.00 44.05 H new ATOM 0 HE1 PHE A 127 -1.921 -0.256 2.756 1.00 41.03 H new ATOM 0 HE2 PHE A 127 0.334 -3.556 4.345 1.00 32.41 H new ATOM 0 HZ PHE A 127 -0.995 -2.541 2.516 1.00 53.11 H new ATOM 1838 N ASN A 128 -2.413 -0.882 8.909 1.00 74.52 N ATOM 1839 CA ASN A 128 -3.415 -1.894 9.266 1.00 54.43 C ATOM 1840 C ASN A 128 -4.830 -1.313 9.269 1.00 63.11 C ATOM 1841 O ASN A 128 -5.775 -1.977 8.844 1.00 31.43 O ATOM 1842 CB ASN A 128 -3.106 -2.497 10.647 1.00 2.10 C ATOM 1843 CG ASN A 128 -2.322 -3.791 10.541 1.00 21.40 C ATOM 1844 OD1 ASN A 128 -2.893 -4.872 10.468 1.00 63.51 O ATOM 1845 ND2 ASN A 128 -1.004 -3.708 10.497 1.00 34.24 N ATOM 0 H ASN A 128 -1.631 -0.843 9.563 1.00 74.52 H new ATOM 0 HA ASN A 128 -3.367 -2.676 8.508 1.00 54.43 H new ATOM 0 HB2 ASN A 128 -2.539 -1.777 11.238 1.00 2.10 H new ATOM 0 HB3 ASN A 128 -4.039 -2.681 11.179 1.00 2.10 H new ATOM 0 HD21 ASN A 128 -0.443 -4.554 10.401 1.00 34.24 H new ATOM 0 HD22 ASN A 128 -0.548 -2.798 10.559 1.00 34.24 H new ATOM 1851 N GLU A 129 -4.975 -0.085 9.748 1.00 23.30 N ATOM 1852 CA GLU A 129 -6.161 0.702 9.855 1.00 71.44 C ATOM 1853 C GLU A 129 -6.602 1.224 8.495 1.00 1.12 C ATOM 1854 O GLU A 129 -7.742 1.011 8.073 1.00 1.11 O ATOM 1855 CB GLU A 129 -5.715 1.779 10.845 1.00 71.31 C ATOM 1856 CG GLU A 129 -6.465 3.066 10.793 1.00 32.24 C ATOM 1857 CD GLU A 129 -6.546 3.707 12.164 1.00 63.32 C ATOM 1858 OE1 GLU A 129 -5.483 4.134 12.668 1.00 65.15 O ATOM 1859 OE2 GLU A 129 -7.636 3.681 12.769 1.00 5.24 O ATOM 0 H GLU A 129 -4.167 0.424 10.106 1.00 23.30 H new ATOM 0 HA GLU A 129 -7.050 0.173 10.198 1.00 71.44 H new ATOM 0 HB2 GLU A 129 -5.798 1.374 11.854 1.00 71.31 H new ATOM 0 HB3 GLU A 129 -4.660 1.989 10.671 1.00 71.31 H new ATOM 0 HG2 GLU A 129 -5.975 3.748 10.098 1.00 32.24 H new ATOM 0 HG3 GLU A 129 -7.470 2.889 10.411 1.00 32.24 H new ATOM 1864 N TRP A 130 -5.719 1.940 7.801 1.00 42.01 N ATOM 1865 CA TRP A 130 -6.107 2.632 6.580 1.00 71.32 C ATOM 1866 C TRP A 130 -6.327 1.648 5.429 1.00 50.04 C ATOM 1867 O TRP A 130 -6.850 2.066 4.403 1.00 70.43 O ATOM 1868 CB TRP A 130 -5.130 3.788 6.305 1.00 71.43 C ATOM 1869 CG TRP A 130 -5.308 4.988 7.211 1.00 13.40 C ATOM 1870 CD1 TRP A 130 -6.224 5.121 8.205 1.00 24.20 C ATOM 1871 CD2 TRP A 130 -4.549 6.242 7.230 1.00 21.33 C ATOM 1872 NE1 TRP A 130 -6.150 6.391 8.750 1.00 25.10 N ATOM 1873 CE2 TRP A 130 -5.126 7.124 8.191 1.00 13.11 C ATOM 1874 CE3 TRP A 130 -3.410 6.720 6.547 1.00 41.25 C ATOM 1875 CZ2 TRP A 130 -4.644 8.428 8.405 1.00 42.04 C ATOM 1876 CZ3 TRP A 130 -2.918 8.024 6.745 1.00 62.33 C ATOM 1877 CH2 TRP A 130 -3.546 8.888 7.661 1.00 50.41 C ATOM 0 H TRP A 130 -4.740 2.054 8.063 1.00 42.01 H new ATOM 0 HA TRP A 130 -7.082 3.104 6.699 1.00 71.32 H new ATOM 0 HB2 TRP A 130 -4.110 3.418 6.409 1.00 71.43 H new ATOM 0 HB3 TRP A 130 -5.248 4.109 5.270 1.00 71.43 H new ATOM 0 HD1 TRP A 130 -6.909 4.349 8.523 1.00 24.20 H new ATOM 0 HE1 TRP A 130 -6.776 6.741 9.475 1.00 25.10 H new ATOM 0 HE3 TRP A 130 -2.902 6.067 5.853 1.00 41.25 H new ATOM 0 HZ2 TRP A 130 -5.114 9.070 9.135 1.00 42.04 H new ATOM 0 HZ3 TRP A 130 -2.055 8.363 6.191 1.00 62.33 H new ATOM 0 HH2 TRP A 130 -3.186 9.898 7.791 1.00 50.41 H new ATOM 1887 N ALA A 131 -6.033 0.359 5.624 1.00 3.11 N ATOM 1888 CA ALA A 131 -6.198 -0.739 4.683 1.00 13.33 C ATOM 1889 C ALA A 131 -7.165 -1.828 5.195 1.00 50.23 C ATOM 1890 O ALA A 131 -7.206 -2.919 4.615 1.00 64.22 O ATOM 1891 CB ALA A 131 -4.818 -1.332 4.406 1.00 32.52 C ATOM 0 H ALA A 131 -5.645 0.038 6.511 1.00 3.11 H new ATOM 0 HA ALA A 131 -6.646 -0.350 3.769 1.00 13.33 H new ATOM 0 HB1 ALA A 131 -4.912 -2.159 3.702 1.00 32.52 H new ATOM 0 HB2 ALA A 131 -4.171 -0.565 3.980 1.00 32.52 H new ATOM 0 HB3 ALA A 131 -4.385 -1.696 5.338 1.00 32.52 H new ATOM 1897 N ASP A 132 -7.963 -1.545 6.233 1.00 70.31 N ATOM 1898 CA ASP A 132 -8.845 -2.468 6.960 1.00 64.11 C ATOM 1899 C ASP A 132 -9.634 -3.376 6.020 1.00 71.11 C ATOM 1900 O ASP A 132 -10.276 -2.901 5.078 1.00 74.23 O ATOM 1901 CB ASP A 132 -9.781 -1.673 7.873 1.00 71.35 C ATOM 1902 CG ASP A 132 -10.676 -2.558 8.742 1.00 4.21 C ATOM 1903 OD1 ASP A 132 -11.698 -3.094 8.254 1.00 50.01 O ATOM 1904 OD2 ASP A 132 -10.348 -2.668 9.941 1.00 73.15 O ATOM 0 H ASP A 132 -8.013 -0.600 6.613 1.00 70.31 H new ATOM 0 HA ASP A 132 -8.220 -3.122 7.568 1.00 64.11 H new ATOM 0 HB2 ASP A 132 -9.185 -1.027 8.518 1.00 71.35 H new ATOM 0 HB3 ASP A 132 -10.408 -1.024 7.262 1.00 71.35 H new ATOM 1908 N GLY A 133 -9.512 -4.684 6.234 1.00 11.33 N ATOM 1909 CA GLY A 133 -10.320 -5.705 5.573 1.00 50.35 C ATOM 1910 C GLY A 133 -9.633 -6.424 4.413 1.00 45.03 C ATOM 1911 O GLY A 133 -10.215 -7.347 3.844 1.00 43.43 O ATOM 0 H GLY A 133 -8.832 -5.072 6.888 1.00 11.33 H new ATOM 0 HA2 GLY A 133 -10.618 -6.446 6.314 1.00 50.35 H new ATOM 0 HA3 GLY A 133 -11.233 -5.240 5.202 1.00 50.35 H new ATOM 1915 N LEU A 134 -8.409 -6.036 4.041 1.00 21.42 N ATOM 1916 CA LEU A 134 -7.591 -6.812 3.100 1.00 44.03 C ATOM 1917 C LEU A 134 -6.630 -7.689 3.912 1.00 51.24 C ATOM 1918 O LEU A 134 -6.211 -7.275 4.995 1.00 1.10 O ATOM 1919 CB LEU A 134 -6.811 -5.893 2.146 1.00 5.04 C ATOM 1920 CG LEU A 134 -7.630 -4.781 1.461 1.00 74.15 C ATOM 1921 CD1 LEU A 134 -6.694 -3.934 0.600 1.00 1.44 C ATOM 1922 CD2 LEU A 134 -8.769 -5.307 0.585 1.00 34.41 C ATOM 0 H LEU A 134 -7.960 -5.185 4.379 1.00 21.42 H new ATOM 0 HA LEU A 134 -8.239 -7.434 2.483 1.00 44.03 H new ATOM 0 HB2 LEU A 134 -5.999 -5.428 2.704 1.00 5.04 H new ATOM 0 HB3 LEU A 134 -6.353 -6.509 1.372 1.00 5.04 H new ATOM 0 HG LEU A 134 -8.089 -4.194 2.256 1.00 74.15 H new ATOM 0 HD11 LEU A 134 -7.264 -3.144 0.111 1.00 1.44 H new ATOM 0 HD12 LEU A 134 -5.924 -3.489 1.230 1.00 1.44 H new ATOM 0 HD13 LEU A 134 -6.225 -4.564 -0.156 1.00 1.44 H new ATOM 0 HD21 LEU A 134 -9.300 -4.468 0.136 1.00 34.41 H new ATOM 0 HD22 LEU A 134 -8.360 -5.940 -0.202 1.00 34.41 H new ATOM 0 HD23 LEU A 134 -9.459 -5.888 1.196 1.00 34.41 H new ATOM 1933 N ASN A 135 -6.261 -8.864 3.400 1.00 72.41 N ATOM 1934 CA ASN A 135 -5.432 -9.843 4.113 1.00 52.03 C ATOM 1935 C ASN A 135 -3.964 -9.450 4.096 1.00 24.40 C ATOM 1936 O ASN A 135 -3.300 -9.677 3.092 1.00 12.24 O ATOM 1937 CB ASN A 135 -5.552 -11.211 3.443 1.00 33.33 C ATOM 1938 CG ASN A 135 -4.785 -12.270 4.222 1.00 61.15 C ATOM 1939 OD1 ASN A 135 -3.743 -12.835 3.649 1.00 45.12 O flip ATOM 1940 ND2 ASN A 135 -5.112 -12.579 5.360 1.00 70.23 N flip ATOM 0 H ASN A 135 -6.532 -9.169 2.465 1.00 72.41 H new ATOM 0 HA ASN A 135 -5.787 -9.876 5.143 1.00 52.03 H new ATOM 0 HB2 ASN A 135 -6.602 -11.495 3.374 1.00 33.33 H new ATOM 0 HB3 ASN A 135 -5.169 -11.156 2.424 1.00 33.33 H new ATOM 0 HD21 ASN A 135 -5.921 -12.136 5.796 1.00 70.23 H new ATOM 0 HD22 ASN A 135 -4.576 -13.279 5.872 1.00 70.23 H new ATOM 1946 N VAL A 136 -3.425 -8.882 5.166 1.00 31.12 N ATOM 1947 CA VAL A 136 -2.090 -8.293 5.159 1.00 73.24 C ATOM 1948 C VAL A 136 -1.116 -9.098 6.009 1.00 50.14 C ATOM 1949 O VAL A 136 -1.346 -9.365 7.188 1.00 24.22 O ATOM 1950 CB VAL A 136 -2.175 -6.801 5.504 1.00 33.51 C ATOM 1951 CG1 VAL A 136 -2.971 -6.492 6.754 1.00 71.35 C ATOM 1952 CG2 VAL A 136 -0.801 -6.116 5.535 1.00 61.32 C ATOM 0 H VAL A 136 -3.901 -8.816 6.066 1.00 31.12 H new ATOM 0 HA VAL A 136 -1.669 -8.345 4.155 1.00 73.24 H new ATOM 0 HB VAL A 136 -2.740 -6.371 4.677 1.00 33.51 H new ATOM 0 HG11 VAL A 136 -2.980 -5.415 6.923 1.00 71.35 H new ATOM 0 HG12 VAL A 136 -3.994 -6.848 6.631 1.00 71.35 H new ATOM 0 HG13 VAL A 136 -2.514 -6.990 7.609 1.00 71.35 H new ATOM 0 HG21 VAL A 136 -0.925 -5.062 5.784 1.00 61.32 H new ATOM 0 HG22 VAL A 136 -0.173 -6.595 6.286 1.00 61.32 H new ATOM 0 HG23 VAL A 136 -0.328 -6.204 4.557 1.00 61.32 H new ATOM 1962 N ILE A 137 0.017 -9.441 5.404 1.00 12.42 N ATOM 1963 CA ILE A 137 1.028 -10.359 5.913 1.00 44.24 C ATOM 1964 C ILE A 137 2.437 -9.729 5.913 1.00 12.51 C ATOM 1965 O ILE A 137 3.428 -10.425 6.155 1.00 73.02 O ATOM 1966 CB ILE A 137 0.898 -11.705 5.151 1.00 23.31 C ATOM 1967 CG1 ILE A 137 0.978 -11.613 3.611 1.00 54.43 C ATOM 1968 CG2 ILE A 137 -0.470 -12.344 5.469 1.00 42.34 C ATOM 1969 CD1 ILE A 137 2.333 -11.207 3.041 1.00 62.33 C ATOM 0 H ILE A 137 0.268 -9.062 4.491 1.00 12.42 H new ATOM 0 HA ILE A 137 0.858 -10.574 6.968 1.00 44.24 H new ATOM 0 HB ILE A 137 1.753 -12.289 5.492 1.00 23.31 H new ATOM 0 HG12 ILE A 137 0.704 -12.582 3.193 1.00 54.43 H new ATOM 0 HG13 ILE A 137 0.231 -10.896 3.269 1.00 54.43 H new ATOM 0 HG21 ILE A 137 -0.563 -13.289 4.935 1.00 42.34 H new ATOM 0 HG22 ILE A 137 -0.547 -12.524 6.541 1.00 42.34 H new ATOM 0 HG23 ILE A 137 -1.268 -11.670 5.156 1.00 42.34 H new ATOM 0 HD11 ILE A 137 2.275 -11.174 1.953 1.00 62.33 H new ATOM 0 HD12 ILE A 137 2.607 -10.222 3.420 1.00 62.33 H new ATOM 0 HD13 ILE A 137 3.087 -11.934 3.342 1.00 62.33 H new ATOM 1980 N GLY A 138 2.550 -8.412 5.677 1.00 63.01 N ATOM 1981 CA GLY A 138 3.817 -7.694 5.738 1.00 33.45 C ATOM 1982 C GLY A 138 3.663 -6.179 5.743 1.00 64.05 C ATOM 1983 O GLY A 138 2.646 -5.665 5.289 1.00 54.32 O ATOM 0 H GLY A 138 1.755 -7.819 5.438 1.00 63.01 H new ATOM 0 HA2 GLY A 138 4.354 -7.999 6.636 1.00 33.45 H new ATOM 0 HA3 GLY A 138 4.431 -7.985 4.886 1.00 33.45 H new ATOM 1987 N VAL A 139 4.682 -5.471 6.235 1.00 73.14 N ATOM 1988 CA VAL A 139 4.859 -4.026 6.320 1.00 3.10 C ATOM 1989 C VAL A 139 6.230 -3.760 6.961 1.00 31.41 C ATOM 1990 O VAL A 139 6.322 -3.631 8.183 1.00 34.24 O ATOM 1991 CB VAL A 139 3.620 -3.375 6.963 1.00 73.53 C ATOM 1992 CG1 VAL A 139 3.069 -4.085 8.196 1.00 54.30 C ATOM 1993 CG2 VAL A 139 3.731 -1.882 7.281 1.00 63.44 C ATOM 0 H VAL A 139 5.491 -5.954 6.626 1.00 73.14 H new ATOM 0 HA VAL A 139 4.901 -3.532 5.349 1.00 3.10 H new ATOM 0 HB VAL A 139 2.913 -3.495 6.142 1.00 73.53 H new ATOM 0 HG11 VAL A 139 2.199 -3.544 8.569 1.00 54.30 H new ATOM 0 HG12 VAL A 139 2.779 -5.102 7.931 1.00 54.30 H new ATOM 0 HG13 VAL A 139 3.835 -4.117 8.970 1.00 54.30 H new ATOM 0 HG21 VAL A 139 2.800 -1.535 7.730 1.00 63.44 H new ATOM 0 HG22 VAL A 139 4.553 -1.719 7.978 1.00 63.44 H new ATOM 0 HG23 VAL A 139 3.919 -1.327 6.362 1.00 63.44 H new ATOM 2003 N ALA A 140 7.305 -3.746 6.155 1.00 43.30 N ATOM 2004 CA ALA A 140 8.703 -3.652 6.613 1.00 42.22 C ATOM 2005 C ALA A 140 9.474 -2.478 5.978 1.00 13.14 C ATOM 2006 O ALA A 140 8.858 -1.608 5.359 1.00 24.22 O ATOM 2007 CB ALA A 140 9.406 -4.996 6.400 1.00 10.12 C ATOM 0 H ALA A 140 7.224 -3.801 5.140 1.00 43.30 H new ATOM 0 HA ALA A 140 8.690 -3.430 7.680 1.00 42.22 H new ATOM 0 HB1 ALA A 140 10.439 -4.924 6.739 1.00 10.12 H new ATOM 0 HB2 ALA A 140 8.891 -5.770 6.968 1.00 10.12 H new ATOM 0 HB3 ALA A 140 9.389 -5.252 5.341 1.00 10.12 H new ATOM 2013 N ARG A 141 10.799 -2.388 6.181 1.00 73.22 N ATOM 2014 CA ARG A 141 11.676 -1.366 5.623 1.00 71.12 C ATOM 2015 C ARG A 141 12.486 -1.954 4.469 1.00 3.30 C ATOM 2016 O ARG A 141 13.071 -3.028 4.639 1.00 71.43 O ATOM 2017 CB ARG A 141 12.620 -0.885 6.738 1.00 12.51 C ATOM 2018 CG ARG A 141 13.725 0.039 6.207 1.00 43.54 C ATOM 2019 CD ARG A 141 14.701 0.441 7.307 1.00 11.52 C ATOM 2020 NE ARG A 141 15.856 1.157 6.739 1.00 51.24 N ATOM 2021 CZ ARG A 141 16.904 1.631 7.421 1.00 73.04 C ATOM 2022 NH1 ARG A 141 17.000 1.467 8.739 1.00 41.30 N ATOM 2023 NH2 ARG A 141 17.867 2.293 6.794 1.00 23.01 N ATOM 0 H ARG A 141 11.301 -3.057 6.764 1.00 73.22 H new ATOM 0 HA ARG A 141 11.090 -0.530 5.242 1.00 71.12 H new ATOM 0 HB2 ARG A 141 12.043 -0.358 7.498 1.00 12.51 H new ATOM 0 HB3 ARG A 141 13.074 -1.748 7.224 1.00 12.51 H new ATOM 0 HG2 ARG A 141 14.267 -0.464 5.406 1.00 43.54 H new ATOM 0 HG3 ARG A 141 13.275 0.933 5.775 1.00 43.54 H new ATOM 0 HD2 ARG A 141 14.195 1.075 8.035 1.00 11.52 H new ATOM 0 HD3 ARG A 141 15.043 -0.446 7.840 1.00 11.52 H new ATOM 0 HE ARG A 141 15.857 1.305 5.730 1.00 51.24 H new ATOM 0 HH11 ARG A 141 16.266 0.972 9.246 1.00 41.30 H new ATOM 0 HH12 ARG A 141 17.807 1.836 9.241 1.00 41.30 H new ATOM 0 HH21 ARG A 141 17.810 2.443 5.787 1.00 23.01 H new ATOM 0 HH22 ARG A 141 18.664 2.652 7.319 1.00 23.01 H new ATOM 2034 N ASP A 142 12.657 -1.151 3.414 1.00 65.41 N ATOM 2035 CA ASP A 142 13.308 -1.421 2.128 1.00 5.13 C ATOM 2036 C ASP A 142 12.882 -2.776 1.586 1.00 44.12 C ATOM 2037 O ASP A 142 11.827 -2.841 0.951 1.00 52.13 O ATOM 2038 CB ASP A 142 14.846 -1.243 2.200 1.00 42.43 C ATOM 2039 CG ASP A 142 15.335 0.212 2.152 1.00 14.53 C ATOM 2040 OD1 ASP A 142 15.037 0.956 1.185 1.00 23.32 O ATOM 2041 OD2 ASP A 142 16.108 0.617 3.055 1.00 43.24 O ATOM 0 H ASP A 142 12.305 -0.194 3.443 1.00 65.41 H new ATOM 0 HA ASP A 142 12.969 -0.673 1.412 1.00 5.13 H new ATOM 0 HB2 ASP A 142 15.207 -1.701 3.121 1.00 42.43 H new ATOM 0 HB3 ASP A 142 15.299 -1.790 1.373 1.00 42.43 H new ATOM 2045 N ASP A 143 13.561 -3.864 1.940 1.00 72.13 N ATOM 2046 CA ASP A 143 13.384 -5.165 1.298 1.00 31.42 C ATOM 2047 C ASP A 143 13.499 -6.343 2.281 1.00 33.22 C ATOM 2048 O ASP A 143 13.470 -7.507 1.876 1.00 24.35 O ATOM 2049 CB ASP A 143 14.397 -5.315 0.146 1.00 5.13 C ATOM 2050 CG ASP A 143 15.853 -5.181 0.605 1.00 12.21 C ATOM 2051 OD1 ASP A 143 16.277 -5.918 1.526 1.00 11.31 O ATOM 2052 OD2 ASP A 143 16.579 -4.304 0.080 1.00 31.31 O ATOM 0 H ASP A 143 14.256 -3.868 2.687 1.00 72.13 H new ATOM 0 HA ASP A 143 12.368 -5.197 0.904 1.00 31.42 H new ATOM 0 HB2 ASP A 143 14.259 -6.287 -0.327 1.00 5.13 H new ATOM 0 HB3 ASP A 143 14.190 -4.560 -0.612 1.00 5.13 H new ATOM 2056 N SER A 144 13.630 -6.064 3.582 1.00 5.22 N ATOM 2057 CA SER A 144 14.181 -6.996 4.560 1.00 53.44 C ATOM 2058 C SER A 144 13.332 -8.234 4.855 1.00 70.21 C ATOM 2059 O SER A 144 13.809 -9.100 5.588 1.00 4.55 O ATOM 2060 CB SER A 144 14.422 -6.220 5.857 1.00 3.52 C ATOM 2061 OG SER A 144 15.563 -5.410 5.683 1.00 5.13 O ATOM 0 H SER A 144 13.351 -5.170 3.987 1.00 5.22 H new ATOM 0 HA SER A 144 15.097 -7.394 4.123 1.00 53.44 H new ATOM 0 HB2 SER A 144 13.554 -5.606 6.099 1.00 3.52 H new ATOM 0 HB3 SER A 144 14.568 -6.908 6.690 1.00 3.52 H new ATOM 0 HG SER A 144 15.733 -4.903 6.504 1.00 5.13 H new ATOM 2066 N GLU A 145 12.101 -8.317 4.350 1.00 70.31 N ATOM 2067 CA GLU A 145 11.166 -9.394 4.665 1.00 73.10 C ATOM 2068 C GLU A 145 10.484 -9.916 3.384 1.00 10.31 C ATOM 2069 O GLU A 145 9.475 -10.615 3.457 1.00 23.45 O ATOM 2070 CB GLU A 145 10.176 -8.934 5.768 1.00 5.23 C ATOM 2071 CG GLU A 145 10.844 -8.208 6.962 1.00 34.15 C ATOM 2072 CD GLU A 145 9.976 -8.045 8.224 1.00 25.42 C ATOM 2073 OE1 GLU A 145 8.746 -8.301 8.183 1.00 24.02 O ATOM 2074 OE2 GLU A 145 10.534 -7.668 9.289 1.00 12.14 O ATOM 0 H GLU A 145 11.721 -7.627 3.701 1.00 70.31 H new ATOM 0 HA GLU A 145 11.706 -10.247 5.077 1.00 73.10 H new ATOM 0 HB2 GLU A 145 9.436 -8.269 5.322 1.00 5.23 H new ATOM 0 HB3 GLU A 145 9.638 -9.805 6.142 1.00 5.23 H new ATOM 0 HG2 GLU A 145 11.747 -8.754 7.234 1.00 34.15 H new ATOM 0 HG3 GLU A 145 11.158 -7.218 6.630 1.00 34.15 H new ATOM 2079 N VAL A 146 11.012 -9.581 2.199 1.00 74.02 N ATOM 2080 CA VAL A 146 10.443 -9.963 0.905 1.00 3.25 C ATOM 2081 C VAL A 146 10.404 -11.481 0.732 1.00 70.00 C ATOM 2082 O VAL A 146 9.419 -11.993 0.198 1.00 5.43 O ATOM 2083 CB VAL A 146 11.222 -9.247 -0.226 1.00 44.33 C ATOM 2084 CG1 VAL A 146 10.942 -9.824 -1.621 1.00 24.14 C ATOM 2085 CG2 VAL A 146 10.864 -7.751 -0.234 1.00 21.30 C ATOM 0 H VAL A 146 11.863 -9.026 2.114 1.00 74.02 H new ATOM 0 HA VAL A 146 9.403 -9.639 0.857 1.00 3.25 H new ATOM 0 HB VAL A 146 12.280 -9.402 -0.015 1.00 44.33 H new ATOM 0 HG11 VAL A 146 11.520 -9.275 -2.364 1.00 24.14 H new ATOM 0 HG12 VAL A 146 11.227 -10.876 -1.644 1.00 24.14 H new ATOM 0 HG13 VAL A 146 9.880 -9.731 -1.847 1.00 24.14 H new ATOM 0 HG21 VAL A 146 11.414 -7.250 -1.031 1.00 21.30 H new ATOM 0 HG22 VAL A 146 9.793 -7.634 -0.402 1.00 21.30 H new ATOM 0 HG23 VAL A 146 11.131 -7.308 0.725 1.00 21.30 H new ATOM 2095 N ASP A 147 11.433 -12.188 1.206 1.00 62.34 N ATOM 2096 CA ASP A 147 11.530 -13.646 1.145 1.00 50.41 C ATOM 2097 C ASP A 147 10.280 -14.302 1.742 1.00 33.24 C ATOM 2098 O ASP A 147 9.630 -15.112 1.080 1.00 54.52 O ATOM 2099 CB ASP A 147 12.815 -14.090 1.853 1.00 73.24 C ATOM 2100 CG ASP A 147 12.875 -15.598 2.105 1.00 74.11 C ATOM 2101 OD1 ASP A 147 12.403 -16.030 3.183 1.00 71.43 O ATOM 2102 OD2 ASP A 147 13.521 -16.325 1.321 1.00 64.20 O ATOM 0 H ASP A 147 12.239 -11.751 1.653 1.00 62.34 H new ATOM 0 HA ASP A 147 11.581 -13.971 0.106 1.00 50.41 H new ATOM 0 HB2 ASP A 147 13.674 -13.794 1.251 1.00 73.24 H new ATOM 0 HB3 ASP A 147 12.897 -13.566 2.805 1.00 73.24 H new ATOM 2106 N LYS A 148 9.857 -13.911 2.954 1.00 42.12 N ATOM 2107 CA LYS A 148 8.667 -14.530 3.548 1.00 43.51 C ATOM 2108 C LYS A 148 7.398 -14.182 2.775 1.00 53.42 C ATOM 2109 O LYS A 148 6.435 -14.953 2.851 1.00 2.31 O ATOM 2110 CB LYS A 148 8.503 -14.229 5.048 1.00 13.43 C ATOM 2111 CG LYS A 148 8.360 -12.746 5.405 1.00 50.33 C ATOM 2112 CD LYS A 148 7.924 -12.514 6.858 1.00 73.44 C ATOM 2113 CE LYS A 148 7.209 -11.158 6.946 1.00 62.42 C ATOM 2114 NZ LYS A 148 7.220 -10.583 8.305 1.00 73.40 N ATOM 0 H LYS A 148 10.305 -13.194 3.524 1.00 42.12 H new ATOM 0 HA LYS A 148 8.828 -15.605 3.467 1.00 43.51 H new ATOM 0 HB2 LYS A 148 7.625 -14.761 5.415 1.00 13.43 H new ATOM 0 HB3 LYS A 148 9.365 -14.632 5.579 1.00 13.43 H new ATOM 0 HG2 LYS A 148 9.312 -12.244 5.234 1.00 50.33 H new ATOM 0 HG3 LYS A 148 7.632 -12.286 4.736 1.00 50.33 H new ATOM 0 HD2 LYS A 148 7.260 -13.314 7.186 1.00 73.44 H new ATOM 0 HD3 LYS A 148 8.790 -12.528 7.519 1.00 73.44 H new ATOM 0 HE2 LYS A 148 7.684 -10.458 6.258 1.00 62.42 H new ATOM 0 HE3 LYS A 148 6.177 -11.277 6.617 1.00 62.42 H new ATOM 0 HZ1 LYS A 148 6.256 -10.596 8.695 1.00 73.40 H new ATOM 0 HZ2 LYS A 148 7.848 -11.145 8.915 1.00 73.40 H new ATOM 0 HZ3 LYS A 148 7.563 -9.602 8.264 1.00 73.40 H new ATOM 2124 N TRP A 149 7.374 -13.072 2.032 1.00 63.43 N ATOM 2125 CA TRP A 149 6.258 -12.664 1.192 1.00 42.53 C ATOM 2126 C TRP A 149 6.310 -13.283 -0.211 1.00 52.22 C ATOM 2127 O TRP A 149 5.665 -12.758 -1.113 1.00 12.52 O ATOM 2128 CB TRP A 149 6.191 -11.129 1.091 1.00 70.23 C ATOM 2129 CG TRP A 149 6.275 -10.318 2.345 1.00 30.14 C ATOM 2130 CD1 TRP A 149 5.800 -10.667 3.557 1.00 51.10 C ATOM 2131 CD2 TRP A 149 6.831 -8.977 2.502 1.00 5.52 C ATOM 2132 NE1 TRP A 149 6.043 -9.649 4.453 1.00 41.21 N ATOM 2133 CE2 TRP A 149 6.685 -8.576 3.860 1.00 53.23 C ATOM 2134 CE3 TRP A 149 7.418 -8.049 1.619 1.00 42.24 C ATOM 2135 CZ2 TRP A 149 7.093 -7.305 4.316 1.00 44.22 C ATOM 2136 CZ3 TRP A 149 7.841 -6.784 2.064 1.00 33.43 C ATOM 2137 CH2 TRP A 149 7.672 -6.401 3.403 1.00 42.41 C ATOM 0 H TRP A 149 8.156 -12.418 2.001 1.00 63.43 H new ATOM 0 HA TRP A 149 5.354 -13.038 1.673 1.00 42.53 H new ATOM 0 HB2 TRP A 149 6.999 -10.806 0.435 1.00 70.23 H new ATOM 0 HB3 TRP A 149 5.255 -10.872 0.594 1.00 70.23 H new ATOM 0 HD1 TRP A 149 5.306 -11.599 3.790 1.00 51.10 H new ATOM 0 HE1 TRP A 149 5.780 -9.682 5.438 1.00 41.21 H new ATOM 0 HE3 TRP A 149 7.546 -8.315 0.580 1.00 42.24 H new ATOM 0 HZ2 TRP A 149 6.963 -7.028 5.352 1.00 44.22 H new ATOM 0 HZ3 TRP A 149 8.301 -6.099 1.367 1.00 33.43 H new ATOM 0 HH2 TRP A 149 7.983 -5.420 3.732 1.00 42.41 H new ATOM 2147 N SER A 150 7.083 -14.341 -0.458 1.00 42.30 N ATOM 2148 CA SER A 150 6.919 -15.131 -1.681 1.00 31.31 C ATOM 2149 C SER A 150 7.182 -16.616 -1.408 1.00 30.02 C ATOM 2150 O SER A 150 6.448 -17.476 -1.902 1.00 73.23 O ATOM 2151 CB SER A 150 7.820 -14.561 -2.790 1.00 13.53 C ATOM 2152 OG SER A 150 7.456 -15.089 -4.055 1.00 10.13 O ATOM 0 H SER A 150 7.822 -14.669 0.164 1.00 42.30 H new ATOM 0 HA SER A 150 5.888 -15.061 -2.027 1.00 31.31 H new ATOM 0 HB2 SER A 150 7.739 -13.474 -2.808 1.00 13.53 H new ATOM 0 HB3 SER A 150 8.862 -14.800 -2.577 1.00 13.53 H new ATOM 0 HG SER A 150 8.202 -14.982 -4.681 1.00 10.13 H new ATOM 2157 N LYS A 151 8.156 -16.913 -0.544 1.00 32.03 N ATOM 2158 CA LYS A 151 8.653 -18.236 -0.204 1.00 42.14 C ATOM 2159 C LYS A 151 8.837 -19.082 -1.454 1.00 1.31 C ATOM 2160 O LYS A 151 9.742 -18.755 -2.245 1.00 64.32 O ATOM 2161 CB LYS A 151 7.776 -18.852 0.888 1.00 41.33 C ATOM 2162 CG LYS A 151 7.910 -18.098 2.215 1.00 65.04 C ATOM 2163 CD LYS A 151 7.421 -18.950 3.392 1.00 3.24 C ATOM 2164 CE LYS A 151 7.419 -18.145 4.694 1.00 22.21 C ATOM 2165 NZ LYS A 151 6.301 -17.181 4.778 1.00 63.24 N ATOM 0 H LYS A 151 8.648 -16.181 -0.032 1.00 32.03 H new ATOM 0 HA LYS A 151 9.652 -18.175 0.227 1.00 42.14 H new ATOM 0 HB2 LYS A 151 6.734 -18.842 0.567 1.00 41.33 H new ATOM 0 HB3 LYS A 151 8.055 -19.896 1.033 1.00 41.33 H new ATOM 0 HG2 LYS A 151 8.952 -17.819 2.373 1.00 65.04 H new ATOM 0 HG3 LYS A 151 7.335 -17.173 2.170 1.00 65.04 H new ATOM 0 HD2 LYS A 151 6.415 -19.316 3.186 1.00 3.24 H new ATOM 0 HD3 LYS A 151 8.062 -19.824 3.503 1.00 3.24 H new ATOM 0 HE2 LYS A 151 7.363 -18.832 5.539 1.00 22.21 H new ATOM 0 HE3 LYS A 151 8.363 -17.607 4.783 1.00 22.21 H new ATOM 0 HZ1 LYS A 151 6.283 -16.752 5.725 1.00 63.24 H new ATOM 0 HZ2 LYS A 151 6.430 -16.436 4.064 1.00 63.24 H new ATOM 0 HZ3 LYS A 151 5.403 -17.675 4.604 1.00 63.24 H new TER 2175 LYS A 151