USER MOD reduce.3.24.130724 H: found=0, std=0, add=1513, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1516 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: B 55 THR OG1 : rot -57:sc= 1.09 USER MOD Set 1.2: B 57 SER OG : rot -87:sc= 1.25 USER MOD Set 2.1: B 7 THR OG1 : rot -178:sc= 0.139 USER MOD Set 2.2: B 9 THR OG1 : rot 81:sc= 0.161 USER MOD Set 3.1: A 116 GLN : amide:sc=-0.00284 K(o=0.95,f=-1.6) USER MOD Set 3.2: A 120 HIS : no HD1:sc= 0.953 K(o=0.95,f=-4.7!) USER MOD Set 4.1: A 109 MET CE :methyl 179:sc= 0 (180deg=0) USER MOD Set 4.2: A 121 CYS SG : rot -157:sc= 1.44 USER MOD Set 5.1: A 66 SER OG : rot -82:sc= 2.03 USER MOD Set 5.2: A 68 THR OG1 : rot 83:sc= 0.732 USER MOD Set 6.1: A 52 THR OG1 : rot 96:sc= 1.27 USER MOD Set 6.2: A 58 HIS : no HE2:sc= -0.139 K(o=1.1,f=0.52) USER MOD Set 7.1: A 48 TYR OH : rot 101:sc= 0.448 USER MOD Set 7.2: A 60 CYS SG : rot -121:sc= 1.29 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -119:sc= 2.43 (180deg=-0.0623) USER MOD Single : A 31 MET CE :methyl 171:sc= 0 (180deg=-0.0123) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -43:sc= 0.121 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 95:sc= 1.25 USER MOD Single : A 80 CYS SG : rot -41:sc= -3.51! USER MOD Single : A 83 LYS NZ :NH3+ -164:sc= 1.24 (180deg=1.2) USER MOD Single : A 87 GLN : amide:sc= -0.27 K(o=-0.27,f=-0.84) USER MOD Single : A 88 CYS SG : rot -140:sc= -0.0125 USER MOD Single : A 90 SER OG : rot -170:sc= -0.0562 USER MOD Single : A 94 TYR OH : rot 160:sc= 1.25 USER MOD Single : A 97 LYS NZ :NH3+ -169:sc= 0.778 (180deg=0.586) USER MOD Single : A 99 LYS NZ :NH3+ -179:sc= 1.29 (180deg=1.24) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0.804 K(o=0.8,f=-4.4!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 123 LYS NZ :NH3+ -155:sc= 1.26 (180deg=-0.199) USER MOD Single : A 125 ASN : amide:sc= 0.0194 K(o=0.019,f=-1.8!) USER MOD Single : A 127 CYS SG : rot 74:sc= 1.12 USER MOD Single : A 129 ASN : amide:sc= 2.18 K(o=2.2,f=-1.1) USER MOD Single : A 130 ASN : amide:sc= -0.102 K(o=-0.1,f=-2.2!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -174:sc= 2.44 (180deg=2.15) USER MOD Single : B 2 GLN : amide:sc= -2.68 K(o=-2.7,f=-5.6!) USER MOD Single : B 6 LYS NZ :NH3+ 147:sc= 0.753 (180deg=-0.133) USER MOD Single : B 11 LYS NZ :NH3+ -102:sc= 0.795 (180deg=-0.655!) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0.0609 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -0.114 K(o=-0.11,f=-2.2!) USER MOD Single : B 27 LYS NZ :NH3+ -175:sc= 1.38 (180deg=1.27) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : B 33 LYS NZ :NH3+ 174:sc= 1.27 (180deg=1.12) USER MOD Single : B 40 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 41 GLN : amide:sc= 0.24 K(o=0.24,f=-6.7!) USER MOD Single : B 48 LYS NZ :NH3+ -141:sc= 1.28 (180deg=0.458) USER MOD Single : B 49 GLN : amide:sc= 1.21 K(o=1.2,f=-0.067) USER MOD Single : B 59 TYR OH : rot 50:sc= 0.743 USER MOD Single : B 60 ASN : amide:sc= -0.0969 K(o=-0.097,f=-1.3!) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -130:sc= -0.0618 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : +bothHN:sc= -0.867 K(o=-0.87,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 22 11.994 -7.111 -8.765 1.00 45.61 N ATOM 2 CA TYR A 22 10.980 -6.732 -7.757 1.00 43.51 C ATOM 3 C TYR A 22 11.462 -7.114 -6.366 1.00 43.60 C ATOM 4 O TYR A 22 12.439 -7.851 -6.223 1.00 44.61 O ATOM 5 CB TYR A 22 9.646 -7.435 -8.038 1.00 47.56 C ATOM 6 CG TYR A 22 9.074 -7.180 -9.417 1.00 46.63 C ATOM 7 CD1 TYR A 22 9.091 -5.912 -9.982 1.00 50.27 C ATOM 8 CD2 TYR A 22 8.507 -8.216 -10.149 1.00 46.46 C ATOM 9 CE1 TYR A 22 8.560 -5.682 -11.238 1.00 50.44 C ATOM 10 CE2 TYR A 22 7.974 -7.995 -11.403 1.00 48.24 C ATOM 11 CZ TYR A 22 8.001 -6.728 -11.943 1.00 52.62 C ATOM 12 OH TYR A 22 7.468 -6.502 -13.192 1.00 54.99 O ATOM 0 HA TYR A 22 10.832 -5.654 -7.813 1.00 43.51 H new ATOM 0 HB2 TYR A 22 9.783 -8.509 -7.909 1.00 47.56 H new ATOM 0 HB3 TYR A 22 8.918 -7.115 -7.293 1.00 47.56 H new ATOM 0 HD1 TYR A 22 9.526 -5.091 -9.431 1.00 50.27 H new ATOM 0 HD2 TYR A 22 8.483 -9.211 -9.730 1.00 46.46 H new ATOM 0 HE1 TYR A 22 8.583 -4.690 -11.664 1.00 50.44 H new ATOM 0 HE2 TYR A 22 7.538 -8.812 -11.958 1.00 48.24 H new ATOM 0 HH TYR A 22 7.116 -7.342 -13.554 1.00 54.99 H new ATOM 24 N LEU A 23 10.773 -6.620 -5.347 1.00 31.65 N ATOM 25 CA LEU A 23 11.127 -6.931 -3.970 1.00 32.60 C ATOM 26 C LEU A 23 10.553 -8.289 -3.592 1.00 33.92 C ATOM 27 O LEU A 23 11.280 -9.206 -3.215 1.00 33.21 O ATOM 28 CB LEU A 23 10.594 -5.856 -3.018 1.00 31.36 C ATOM 29 CG LEU A 23 11.022 -4.424 -3.337 1.00 32.85 C ATOM 30 CD1 LEU A 23 10.299 -3.441 -2.432 1.00 37.08 C ATOM 31 CD2 LEU A 23 12.531 -4.269 -3.198 1.00 41.11 C ATOM 0 H LEU A 23 9.967 -6.003 -5.448 1.00 31.65 H new ATOM 0 HA LEU A 23 12.213 -6.957 -3.884 1.00 32.60 H new ATOM 0 HB2 LEU A 23 9.505 -5.900 -3.021 1.00 31.36 H new ATOM 0 HB3 LEU A 23 10.920 -6.097 -2.006 1.00 31.36 H new ATOM 0 HG LEU A 23 10.751 -4.207 -4.370 1.00 32.85 H new ATOM 0 HD11 LEU A 23 10.615 -2.426 -2.672 1.00 37.08 H new ATOM 0 HD12 LEU A 23 9.223 -3.531 -2.582 1.00 37.08 H new ATOM 0 HD13 LEU A 23 10.540 -3.660 -1.392 1.00 37.08 H new ATOM 0 HD21 LEU A 23 12.814 -3.242 -3.430 1.00 41.11 H new ATOM 0 HD22 LEU A 23 12.829 -4.506 -2.176 1.00 41.11 H new ATOM 0 HD23 LEU A 23 13.032 -4.948 -3.888 1.00 41.11 H new ATOM 43 N VAL A 24 9.237 -8.406 -3.710 1.00 28.03 N ATOM 44 CA VAL A 24 8.538 -9.644 -3.397 1.00 29.15 C ATOM 45 C VAL A 24 7.670 -10.043 -4.582 1.00 22.96 C ATOM 46 O VAL A 24 7.121 -9.175 -5.267 1.00 24.25 O ATOM 47 CB VAL A 24 7.641 -9.500 -2.142 1.00 32.80 C ATOM 48 CG1 VAL A 24 7.172 -10.860 -1.642 1.00 42.00 C ATOM 49 CG2 VAL A 24 8.365 -8.752 -1.037 1.00 41.63 C ATOM 0 H VAL A 24 8.628 -7.650 -4.023 1.00 28.03 H new ATOM 0 HA VAL A 24 9.288 -10.408 -3.191 1.00 29.15 H new ATOM 0 HB VAL A 24 6.764 -8.921 -2.431 1.00 32.80 H new ATOM 0 HG11 VAL A 24 6.545 -10.727 -0.761 1.00 42.00 H new ATOM 0 HG12 VAL A 24 6.598 -11.357 -2.424 1.00 42.00 H new ATOM 0 HG13 VAL A 24 8.037 -11.470 -1.383 1.00 42.00 H new ATOM 0 HG21 VAL A 24 7.712 -8.665 -0.168 1.00 41.63 H new ATOM 0 HG22 VAL A 24 9.268 -9.297 -0.760 1.00 41.63 H new ATOM 0 HG23 VAL A 24 8.636 -7.756 -1.388 1.00 41.63 H new ATOM 59 N GLU A 25 7.564 -11.341 -4.839 1.00 24.89 N ATOM 60 CA GLU A 25 6.756 -11.840 -5.942 1.00 23.60 C ATOM 61 C GLU A 25 6.346 -13.290 -5.700 1.00 24.58 C ATOM 62 O GLU A 25 7.186 -14.152 -5.440 1.00 25.27 O ATOM 63 CB GLU A 25 7.510 -11.719 -7.270 1.00 29.00 C ATOM 64 CG GLU A 25 8.929 -12.266 -7.226 1.00 33.54 C ATOM 65 CD GLU A 25 9.479 -12.561 -8.603 1.00 42.16 C ATOM 66 OE1 GLU A 25 8.985 -13.506 -9.254 1.00 53.32 O ATOM 67 OE2 GLU A 25 10.414 -11.861 -9.040 1.00 44.93 O ATOM 0 H GLU A 25 8.030 -12.068 -4.296 1.00 24.89 H new ATOM 0 HA GLU A 25 5.855 -11.229 -5.999 1.00 23.60 H new ATOM 0 HB2 GLU A 25 6.951 -12.247 -8.043 1.00 29.00 H new ATOM 0 HB3 GLU A 25 7.545 -10.670 -7.562 1.00 29.00 H new ATOM 0 HG2 GLU A 25 9.577 -11.546 -6.726 1.00 33.54 H new ATOM 0 HG3 GLU A 25 8.945 -13.178 -6.629 1.00 33.54 H new ATOM 74 N PHE A 26 5.051 -13.552 -5.777 1.00 22.47 N ATOM 75 CA PHE A 26 4.525 -14.894 -5.568 1.00 21.66 C ATOM 76 C PHE A 26 3.233 -15.083 -6.349 1.00 24.04 C ATOM 77 O PHE A 26 2.643 -14.116 -6.830 1.00 22.30 O ATOM 78 CB PHE A 26 4.293 -15.164 -4.075 1.00 23.47 C ATOM 79 CG PHE A 26 3.426 -14.146 -3.388 1.00 21.92 C ATOM 80 CD1 PHE A 26 3.980 -12.999 -2.842 1.00 23.12 C ATOM 81 CD2 PHE A 26 2.059 -14.342 -3.280 1.00 22.79 C ATOM 82 CE1 PHE A 26 3.186 -12.067 -2.204 1.00 24.88 C ATOM 83 CE2 PHE A 26 1.261 -13.414 -2.642 1.00 25.76 C ATOM 84 CZ PHE A 26 1.823 -12.274 -2.103 1.00 26.66 C ATOM 0 H PHE A 26 4.341 -12.850 -5.984 1.00 22.47 H new ATOM 0 HA PHE A 26 5.262 -15.610 -5.932 1.00 21.66 H new ATOM 0 HB2 PHE A 26 3.837 -16.147 -3.963 1.00 23.47 H new ATOM 0 HB3 PHE A 26 5.258 -15.201 -3.570 1.00 23.47 H new ATOM 0 HD1 PHE A 26 5.044 -12.832 -2.916 1.00 23.12 H new ATOM 0 HD2 PHE A 26 1.612 -15.231 -3.700 1.00 22.79 H new ATOM 0 HE1 PHE A 26 3.630 -11.176 -1.784 1.00 24.88 H new ATOM 0 HE2 PHE A 26 0.197 -13.580 -2.564 1.00 25.76 H new ATOM 0 HZ PHE A 26 1.200 -11.546 -1.604 1.00 26.66 H new ATOM 94 N ARG A 27 2.800 -16.327 -6.474 1.00 22.71 N ATOM 95 CA ARG A 27 1.584 -16.635 -7.208 1.00 22.16 C ATOM 96 C ARG A 27 0.379 -16.644 -6.281 1.00 22.93 C ATOM 97 O ARG A 27 0.356 -17.363 -5.279 1.00 23.03 O ATOM 98 CB ARG A 27 1.720 -17.988 -7.899 1.00 25.12 C ATOM 99 CG ARG A 27 2.904 -18.061 -8.844 1.00 24.95 C ATOM 100 CD ARG A 27 3.380 -19.490 -9.020 1.00 29.77 C ATOM 101 NE ARG A 27 4.713 -19.550 -9.614 1.00 40.26 N ATOM 102 CZ ARG A 27 5.841 -19.645 -8.911 1.00 43.84 C ATOM 103 NH1 ARG A 27 5.814 -19.613 -7.580 1.00 42.26 N ATOM 104 NH2 ARG A 27 7.004 -19.744 -9.546 1.00 53.40 N ATOM 0 H ARG A 27 3.272 -17.139 -6.077 1.00 22.71 H new ATOM 0 HA ARG A 27 1.433 -15.861 -7.960 1.00 22.16 H new ATOM 0 HB2 ARG A 27 1.819 -18.767 -7.143 1.00 25.12 H new ATOM 0 HB3 ARG A 27 0.806 -18.198 -8.455 1.00 25.12 H new ATOM 0 HG2 ARG A 27 2.625 -17.646 -9.813 1.00 24.95 H new ATOM 0 HG3 ARG A 27 3.719 -17.449 -8.458 1.00 24.95 H new ATOM 0 HD2 ARG A 27 3.391 -19.991 -8.052 1.00 29.77 H new ATOM 0 HD3 ARG A 27 2.676 -20.032 -9.652 1.00 29.77 H new ATOM 0 HE ARG A 27 4.785 -19.517 -10.631 1.00 40.26 H new ATOM 0 HH11 ARG A 27 4.925 -19.515 -7.090 1.00 42.26 H new ATOM 0 HH12 ARG A 27 6.683 -19.686 -7.050 1.00 42.26 H new ATOM 0 HH21 ARG A 27 7.030 -19.747 -10.566 1.00 53.40 H new ATOM 0 HH22 ARG A 27 7.871 -19.817 -9.014 1.00 53.40 H new ATOM 118 N ALA A 28 -0.619 -15.847 -6.620 1.00 21.69 N ATOM 119 CA ALA A 28 -1.833 -15.757 -5.830 1.00 21.30 C ATOM 120 C ALA A 28 -2.955 -15.138 -6.647 1.00 21.54 C ATOM 121 O ALA A 28 -2.727 -14.234 -7.457 1.00 22.17 O ATOM 122 CB ALA A 28 -1.595 -14.956 -4.559 1.00 23.20 C ATOM 0 H ALA A 28 -0.611 -15.248 -7.445 1.00 21.69 H new ATOM 0 HA ALA A 28 -2.128 -16.767 -5.545 1.00 21.30 H new ATOM 0 HB1 ALA A 28 -2.519 -14.903 -3.984 1.00 23.20 H new ATOM 0 HB2 ALA A 28 -0.824 -15.442 -3.962 1.00 23.20 H new ATOM 0 HB3 ALA A 28 -1.271 -13.948 -4.819 1.00 23.20 H new ATOM 128 N GLY A 29 -4.160 -15.631 -6.437 1.00 21.31 N ATOM 129 CA GLY A 29 -5.302 -15.121 -7.152 1.00 23.36 C ATOM 130 C GLY A 29 -5.980 -14.018 -6.380 1.00 24.59 C ATOM 131 O GLY A 29 -6.108 -14.097 -5.159 1.00 24.46 O ATOM 0 H GLY A 29 -4.368 -16.382 -5.778 1.00 21.31 H new ATOM 0 HA2 GLY A 29 -4.987 -14.746 -8.126 1.00 23.36 H new ATOM 0 HA3 GLY A 29 -6.010 -15.929 -7.335 1.00 23.36 H new ATOM 135 N LYS A 30 -6.401 -12.986 -7.082 1.00 23.00 N ATOM 136 CA LYS A 30 -7.073 -11.869 -6.447 1.00 21.15 C ATOM 137 C LYS A 30 -8.568 -12.136 -6.375 1.00 23.64 C ATOM 138 O LYS A 30 -9.059 -13.126 -6.918 1.00 24.84 O ATOM 139 CB LYS A 30 -6.810 -10.579 -7.224 1.00 23.49 C ATOM 140 CG LYS A 30 -7.379 -10.602 -8.630 1.00 27.46 C ATOM 141 CD LYS A 30 -7.352 -9.225 -9.256 1.00 31.74 C ATOM 142 CE LYS A 30 -8.015 -9.227 -10.617 1.00 38.65 C ATOM 143 NZ LYS A 30 -8.174 -7.856 -11.158 1.00 36.43 N ATOM 0 H LYS A 30 -6.290 -12.897 -8.092 1.00 23.00 H new ATOM 0 HA LYS A 30 -6.682 -11.754 -5.436 1.00 21.15 H new ATOM 0 HB2 LYS A 30 -7.241 -9.740 -6.678 1.00 23.49 H new ATOM 0 HB3 LYS A 30 -5.735 -10.407 -7.277 1.00 23.49 H new ATOM 0 HG2 LYS A 30 -6.805 -11.295 -9.246 1.00 27.46 H new ATOM 0 HG3 LYS A 30 -8.404 -10.972 -8.604 1.00 27.46 H new ATOM 0 HD2 LYS A 30 -7.860 -8.516 -8.602 1.00 31.74 H new ATOM 0 HD3 LYS A 30 -6.320 -8.887 -9.352 1.00 31.74 H new ATOM 0 HE2 LYS A 30 -7.421 -9.823 -11.309 1.00 38.65 H new ATOM 0 HE3 LYS A 30 -8.992 -9.704 -10.544 1.00 38.65 H new ATOM 0 HZ1 LYS A 30 -9.184 -7.654 -11.301 1.00 36.43 H new ATOM 0 HZ2 LYS A 30 -7.775 -7.169 -10.486 1.00 36.43 H new ATOM 0 HZ3 LYS A 30 -7.674 -7.781 -12.067 1.00 36.43 H new ATOM 157 N MET A 31 -9.282 -11.263 -5.690 1.00 25.36 N ATOM 158 CA MET A 31 -10.722 -11.393 -5.569 1.00 27.00 C ATOM 159 C MET A 31 -11.392 -10.106 -6.024 1.00 27.82 C ATOM 160 O MET A 31 -10.765 -9.046 -6.039 1.00 32.62 O ATOM 161 CB MET A 31 -11.120 -11.727 -4.129 1.00 24.59 C ATOM 162 CG MET A 31 -10.449 -12.982 -3.590 1.00 24.61 C ATOM 163 SD MET A 31 -11.360 -13.730 -2.230 1.00 26.00 S ATOM 164 CE MET A 31 -10.326 -15.149 -1.881 1.00 24.15 C ATOM 0 H MET A 31 -8.888 -10.455 -5.208 1.00 25.36 H new ATOM 0 HA MET A 31 -11.055 -12.212 -6.206 1.00 27.00 H new ATOM 0 HB2 MET A 31 -10.867 -10.884 -3.486 1.00 24.59 H new ATOM 0 HB3 MET A 31 -12.202 -11.853 -4.079 1.00 24.59 H new ATOM 0 HG2 MET A 31 -10.347 -13.709 -4.396 1.00 24.61 H new ATOM 0 HG3 MET A 31 -9.442 -12.735 -3.254 1.00 24.61 H new ATOM 0 HE1 MET A 31 -10.664 -15.628 -0.962 1.00 24.15 H new ATOM 0 HE2 MET A 31 -10.392 -15.859 -2.706 1.00 24.15 H new ATOM 0 HE3 MET A 31 -9.292 -14.825 -1.763 1.00 24.15 H new ATOM 174 N SER A 32 -12.650 -10.205 -6.405 1.00 25.88 N ATOM 175 CA SER A 32 -13.392 -9.048 -6.869 1.00 31.55 C ATOM 176 C SER A 32 -14.715 -8.928 -6.131 1.00 35.12 C ATOM 177 O SER A 32 -15.309 -9.933 -5.733 1.00 33.62 O ATOM 178 CB SER A 32 -13.624 -9.149 -8.380 1.00 37.48 C ATOM 179 OG SER A 32 -13.890 -10.488 -8.777 1.00 45.53 O ATOM 0 H SER A 32 -13.181 -11.076 -6.403 1.00 25.88 H new ATOM 0 HA SER A 32 -12.808 -8.151 -6.662 1.00 31.55 H new ATOM 0 HB2 SER A 32 -14.461 -8.511 -8.664 1.00 37.48 H new ATOM 0 HB3 SER A 32 -12.746 -8.779 -8.910 1.00 37.48 H new ATOM 0 HG SER A 32 -14.035 -10.519 -9.746 1.00 45.53 H new ATOM 185 N LEU A 33 -15.165 -7.702 -5.935 1.00 42.07 N ATOM 186 CA LEU A 33 -16.416 -7.454 -5.245 1.00 44.29 C ATOM 187 C LEU A 33 -17.573 -7.491 -6.232 1.00 50.09 C ATOM 188 O LEU A 33 -18.030 -6.452 -6.709 1.00 52.46 O ATOM 189 CB LEU A 33 -16.371 -6.109 -4.518 1.00 46.72 C ATOM 190 CG LEU A 33 -15.342 -6.017 -3.389 1.00 51.34 C ATOM 191 CD1 LEU A 33 -15.266 -4.600 -2.847 1.00 57.04 C ATOM 192 CD2 LEU A 33 -15.684 -6.995 -2.274 1.00 54.38 C ATOM 0 H LEU A 33 -14.680 -6.860 -6.246 1.00 42.07 H new ATOM 0 HA LEU A 33 -16.567 -8.237 -4.502 1.00 44.29 H new ATOM 0 HB2 LEU A 33 -16.159 -5.326 -5.247 1.00 46.72 H new ATOM 0 HB3 LEU A 33 -17.359 -5.903 -4.106 1.00 46.72 H new ATOM 0 HG LEU A 33 -14.366 -6.282 -3.794 1.00 51.34 H new ATOM 0 HD11 LEU A 33 -14.529 -4.556 -2.045 1.00 57.04 H new ATOM 0 HD12 LEU A 33 -14.973 -3.920 -3.647 1.00 57.04 H new ATOM 0 HD13 LEU A 33 -16.241 -4.306 -2.459 1.00 57.04 H new ATOM 0 HD21 LEU A 33 -14.942 -6.916 -1.480 1.00 54.38 H new ATOM 0 HD22 LEU A 33 -16.670 -6.760 -1.874 1.00 54.38 H new ATOM 0 HD23 LEU A 33 -15.686 -8.011 -2.669 1.00 54.38 H new ATOM 204 N LYS A 34 -18.018 -8.699 -6.547 1.00 52.69 N ATOM 205 CA LYS A 34 -19.117 -8.904 -7.478 1.00 53.15 C ATOM 206 C LYS A 34 -20.421 -8.441 -6.844 1.00 56.50 C ATOM 207 O LYS A 34 -21.071 -9.196 -6.114 1.00 56.84 O ATOM 208 CB LYS A 34 -19.200 -10.383 -7.850 1.00 2.00 C ATOM 209 CG LYS A 34 -19.938 -10.663 -9.146 1.00 2.00 C ATOM 210 CD LYS A 34 -20.195 -12.149 -9.314 1.00 2.00 C ATOM 211 CE LYS A 34 -20.963 -12.441 -10.590 1.00 2.00 C ATOM 212 NZ LYS A 34 -21.216 -13.896 -10.763 1.00 2.00 N ATOM 0 H LYS A 34 -17.629 -9.561 -6.166 1.00 52.69 H new ATOM 0 HA LYS A 34 -18.944 -8.322 -8.383 1.00 53.15 H new ATOM 0 HB2 LYS A 34 -18.189 -10.783 -7.928 1.00 2.00 H new ATOM 0 HB3 LYS A 34 -19.694 -10.921 -7.041 1.00 2.00 H new ATOM 0 HG2 LYS A 34 -20.885 -10.123 -9.154 1.00 2.00 H new ATOM 0 HG3 LYS A 34 -19.354 -10.294 -9.989 1.00 2.00 H new ATOM 0 HD2 LYS A 34 -19.245 -12.684 -9.329 1.00 2.00 H new ATOM 0 HD3 LYS A 34 -20.757 -12.521 -8.457 1.00 2.00 H new ATOM 0 HE2 LYS A 34 -21.913 -11.907 -10.573 1.00 2.00 H new ATOM 0 HE3 LYS A 34 -20.402 -12.066 -11.446 1.00 2.00 H new ATOM 0 HZ1 LYS A 34 -21.743 -14.054 -11.646 1.00 2.00 H new ATOM 0 HZ2 LYS A 34 -20.309 -14.403 -10.805 1.00 2.00 H new ATOM 0 HZ3 LYS A 34 -21.773 -14.249 -9.959 1.00 2.00 H new ATOM 226 N GLY A 35 -20.781 -7.192 -7.105 1.00 57.85 N ATOM 227 CA GLY A 35 -21.991 -6.631 -6.538 1.00 55.33 C ATOM 228 C GLY A 35 -21.809 -6.309 -5.070 1.00 54.05 C ATOM 229 O GLY A 35 -21.510 -5.171 -4.703 1.00 55.43 O ATOM 0 H GLY A 35 -20.254 -6.555 -7.702 1.00 57.85 H new ATOM 0 HA2 GLY A 35 -22.264 -5.726 -7.080 1.00 55.33 H new ATOM 0 HA3 GLY A 35 -22.813 -7.336 -6.659 1.00 55.33 H new ATOM 233 N THR A 36 -21.971 -7.320 -4.232 1.00 51.72 N ATOM 234 CA THR A 36 -21.810 -7.160 -2.799 1.00 51.05 C ATOM 235 C THR A 36 -21.173 -8.415 -2.194 1.00 46.50 C ATOM 236 O THR A 36 -21.011 -8.526 -0.979 1.00 45.65 O ATOM 237 CB THR A 36 -23.167 -6.855 -2.119 1.00 51.58 C ATOM 238 OG1 THR A 36 -22.963 -6.305 -0.809 1.00 60.43 O ATOM 239 CG2 THR A 36 -24.033 -8.104 -2.018 1.00 49.93 C ATOM 0 H THR A 36 -22.216 -8.266 -4.524 1.00 51.72 H new ATOM 0 HA THR A 36 -21.148 -6.312 -2.621 1.00 51.05 H new ATOM 0 HB THR A 36 -23.685 -6.125 -2.741 1.00 51.58 H new ATOM 0 HG1 THR A 36 -22.256 -6.805 -0.351 1.00 60.43 H new ATOM 0 HG21 THR A 36 -24.978 -7.854 -1.536 1.00 49.93 H new ATOM 0 HG22 THR A 36 -24.228 -8.494 -3.017 1.00 49.93 H new ATOM 0 HG23 THR A 36 -23.514 -8.860 -1.429 1.00 49.93 H new ATOM 247 N THR A 37 -20.782 -9.348 -3.053 1.00 41.86 N ATOM 248 CA THR A 37 -20.178 -10.591 -2.602 1.00 36.46 C ATOM 249 C THR A 37 -18.759 -10.744 -3.143 1.00 36.55 C ATOM 250 O THR A 37 -18.512 -10.548 -4.336 1.00 36.77 O ATOM 251 CB THR A 37 -21.028 -11.795 -3.041 1.00 40.82 C ATOM 252 OG1 THR A 37 -22.400 -11.568 -2.684 1.00 46.77 O ATOM 253 CG2 THR A 37 -20.537 -13.085 -2.396 1.00 40.62 C ATOM 0 H THR A 37 -20.873 -9.266 -4.066 1.00 41.86 H new ATOM 0 HA THR A 37 -20.134 -10.559 -1.513 1.00 36.46 H new ATOM 0 HB THR A 37 -20.937 -11.902 -4.122 1.00 40.82 H new ATOM 0 HG1 THR A 37 -22.942 -12.334 -2.965 1.00 46.77 H new ATOM 0 HG21 THR A 37 -21.159 -13.917 -2.727 1.00 40.62 H new ATOM 0 HG22 THR A 37 -19.503 -13.267 -2.688 1.00 40.62 H new ATOM 0 HG23 THR A 37 -20.598 -12.996 -1.311 1.00 40.62 H new ATOM 261 N VAL A 38 -17.827 -11.088 -2.262 1.00 33.78 N ATOM 262 CA VAL A 38 -16.437 -11.268 -2.651 1.00 28.48 C ATOM 263 C VAL A 38 -16.273 -12.548 -3.459 1.00 29.22 C ATOM 264 O VAL A 38 -16.450 -13.650 -2.938 1.00 31.27 O ATOM 265 CB VAL A 38 -15.501 -11.318 -1.425 1.00 29.43 C ATOM 266 CG1 VAL A 38 -14.043 -11.276 -1.860 1.00 28.05 C ATOM 267 CG2 VAL A 38 -15.805 -10.181 -0.463 1.00 31.46 C ATOM 0 H VAL A 38 -18.011 -11.248 -1.272 1.00 33.78 H new ATOM 0 HA VAL A 38 -16.160 -10.408 -3.261 1.00 28.48 H new ATOM 0 HB VAL A 38 -15.677 -12.259 -0.904 1.00 29.43 H new ATOM 0 HG11 VAL A 38 -13.400 -11.312 -0.981 1.00 28.05 H new ATOM 0 HG12 VAL A 38 -13.830 -12.131 -2.501 1.00 28.05 H new ATOM 0 HG13 VAL A 38 -13.854 -10.354 -2.410 1.00 28.05 H new ATOM 0 HG21 VAL A 38 -15.132 -10.238 0.392 1.00 31.46 H new ATOM 0 HG22 VAL A 38 -15.665 -9.227 -0.971 1.00 31.46 H new ATOM 0 HG23 VAL A 38 -16.836 -10.261 -0.119 1.00 31.46 H new ATOM 277 N THR A 39 -15.954 -12.396 -4.734 1.00 27.35 N ATOM 278 CA THR A 39 -15.764 -13.534 -5.615 1.00 27.23 C ATOM 279 C THR A 39 -14.316 -13.585 -6.104 1.00 28.27 C ATOM 280 O THR A 39 -13.828 -12.626 -6.711 1.00 28.17 O ATOM 281 CB THR A 39 -16.718 -13.458 -6.820 1.00 32.67 C ATOM 282 OG1 THR A 39 -18.018 -13.049 -6.371 1.00 34.63 O ATOM 283 CG2 THR A 39 -16.819 -14.809 -7.521 1.00 37.07 C ATOM 0 H THR A 39 -15.821 -11.490 -5.183 1.00 27.35 H new ATOM 0 HA THR A 39 -15.986 -14.441 -5.053 1.00 27.23 H new ATOM 0 HB THR A 39 -16.324 -12.732 -7.531 1.00 32.67 H new ATOM 0 HG1 THR A 39 -18.627 -12.998 -7.137 1.00 34.63 H new ATOM 0 HG21 THR A 39 -17.499 -14.729 -8.369 1.00 37.07 H new ATOM 0 HG22 THR A 39 -15.833 -15.110 -7.874 1.00 37.07 H new ATOM 0 HG23 THR A 39 -17.197 -15.554 -6.822 1.00 37.07 H new ATOM 291 N PRO A 40 -13.599 -14.682 -5.817 1.00 26.41 N ATOM 292 CA PRO A 40 -12.205 -14.844 -6.229 1.00 25.74 C ATOM 293 C PRO A 40 -12.065 -15.022 -7.736 1.00 27.33 C ATOM 294 O PRO A 40 -12.962 -15.550 -8.396 1.00 29.54 O ATOM 295 CB PRO A 40 -11.741 -16.115 -5.503 1.00 27.62 C ATOM 296 CG PRO A 40 -12.815 -16.438 -4.519 1.00 30.25 C ATOM 297 CD PRO A 40 -14.081 -15.853 -5.071 1.00 27.97 C ATOM 0 HA PRO A 40 -11.614 -13.962 -5.981 1.00 25.74 H new ATOM 0 HB2 PRO A 40 -11.595 -16.935 -6.206 1.00 27.62 H new ATOM 0 HB3 PRO A 40 -10.787 -15.952 -5.001 1.00 27.62 H new ATOM 0 HG2 PRO A 40 -12.910 -17.516 -4.387 1.00 30.25 H new ATOM 0 HG3 PRO A 40 -12.586 -16.016 -3.541 1.00 30.25 H new ATOM 0 HD2 PRO A 40 -14.604 -16.558 -5.718 1.00 27.97 H new ATOM 0 HD3 PRO A 40 -14.775 -15.571 -4.279 1.00 27.97 H new ATOM 305 N ASP A 41 -10.948 -14.560 -8.277 1.00 27.01 N ATOM 306 CA ASP A 41 -10.677 -14.689 -9.701 1.00 28.40 C ATOM 307 C ASP A 41 -10.218 -16.112 -9.993 1.00 29.86 C ATOM 308 O ASP A 41 -9.495 -16.711 -9.195 1.00 28.83 O ATOM 309 CB ASP A 41 -9.612 -13.678 -10.140 1.00 28.84 C ATOM 310 CG ASP A 41 -9.792 -13.227 -11.575 1.00 32.16 C ATOM 311 OD1 ASP A 41 -9.738 -14.078 -12.483 1.00 34.80 O ATOM 312 OD2 ASP A 41 -9.989 -12.013 -11.804 1.00 35.13 O ATOM 0 H ASP A 41 -10.212 -14.091 -7.749 1.00 27.01 H new ATOM 0 HA ASP A 41 -11.587 -14.480 -10.263 1.00 28.40 H new ATOM 0 HB2 ASP A 41 -9.649 -12.809 -9.483 1.00 28.84 H new ATOM 0 HB3 ASP A 41 -8.624 -14.124 -10.024 1.00 28.84 H new ATOM 317 N LYS A 42 -10.646 -16.652 -11.123 1.00 30.36 N ATOM 318 CA LYS A 42 -10.294 -18.015 -11.504 1.00 30.52 C ATOM 319 C LYS A 42 -9.139 -18.022 -12.502 1.00 29.13 C ATOM 320 O LYS A 42 -9.028 -18.924 -13.337 1.00 33.35 O ATOM 321 CB LYS A 42 -11.523 -18.722 -12.094 1.00 34.43 C ATOM 322 CG LYS A 42 -12.716 -18.738 -11.148 1.00 40.16 C ATOM 323 CD LYS A 42 -13.909 -19.469 -11.741 1.00 53.68 C ATOM 324 CE LYS A 42 -15.153 -19.265 -10.887 1.00 57.99 C ATOM 325 NZ LYS A 42 -16.320 -20.035 -11.397 1.00 50.24 N ATOM 0 H LYS A 42 -11.240 -16.167 -11.796 1.00 30.36 H new ATOM 0 HA LYS A 42 -9.967 -18.553 -10.614 1.00 30.52 H new ATOM 0 HB2 LYS A 42 -11.809 -18.226 -13.021 1.00 34.43 H new ATOM 0 HB3 LYS A 42 -11.256 -19.747 -12.350 1.00 34.43 H new ATOM 0 HG2 LYS A 42 -12.428 -19.215 -10.211 1.00 40.16 H new ATOM 0 HG3 LYS A 42 -13.002 -17.714 -10.909 1.00 40.16 H new ATOM 0 HD2 LYS A 42 -14.095 -19.108 -12.753 1.00 53.68 H new ATOM 0 HD3 LYS A 42 -13.687 -20.533 -11.818 1.00 53.68 H new ATOM 0 HE2 LYS A 42 -14.941 -19.568 -9.862 1.00 57.99 H new ATOM 0 HE3 LYS A 42 -15.403 -18.204 -10.861 1.00 57.99 H new ATOM 0 HZ1 LYS A 42 -17.143 -19.865 -10.784 1.00 50.24 H new ATOM 0 HZ2 LYS A 42 -16.541 -19.729 -12.366 1.00 50.24 H new ATOM 0 HZ3 LYS A 42 -16.093 -21.050 -11.398 1.00 50.24 H new ATOM 339 N ARG A 43 -8.278 -17.019 -12.405 1.00 27.87 N ATOM 340 CA ARG A 43 -7.125 -16.903 -13.289 1.00 26.95 C ATOM 341 C ARG A 43 -5.828 -16.984 -12.494 1.00 27.24 C ATOM 342 O ARG A 43 -5.823 -16.802 -11.277 1.00 26.67 O ATOM 343 CB ARG A 43 -7.165 -15.579 -14.055 1.00 29.39 C ATOM 344 CG ARG A 43 -8.246 -15.510 -15.120 1.00 31.56 C ATOM 345 CD ARG A 43 -8.320 -14.121 -15.727 1.00 30.38 C ATOM 346 NE ARG A 43 -8.581 -13.102 -14.713 1.00 29.25 N ATOM 347 CZ ARG A 43 -8.163 -11.839 -14.791 1.00 29.05 C ATOM 348 NH1 ARG A 43 -7.446 -11.435 -15.831 1.00 37.71 N ATOM 349 NH2 ARG A 43 -8.465 -10.981 -13.823 1.00 30.67 N ATOM 0 H ARG A 43 -8.357 -16.269 -11.718 1.00 27.87 H new ATOM 0 HA ARG A 43 -7.164 -17.730 -13.998 1.00 26.95 H new ATOM 0 HB2 ARG A 43 -7.317 -14.766 -13.345 1.00 29.39 H new ATOM 0 HB3 ARG A 43 -6.196 -15.415 -14.526 1.00 29.39 H new ATOM 0 HG2 ARG A 43 -8.040 -16.242 -15.901 1.00 31.56 H new ATOM 0 HG3 ARG A 43 -9.210 -15.772 -14.683 1.00 31.56 H new ATOM 0 HD2 ARG A 43 -7.383 -13.896 -16.236 1.00 30.38 H new ATOM 0 HD3 ARG A 43 -9.107 -14.095 -16.481 1.00 30.38 H new ATOM 0 HE ARG A 43 -9.119 -13.375 -13.891 1.00 29.25 H new ATOM 0 HH11 ARG A 43 -7.212 -12.092 -16.575 1.00 37.71 H new ATOM 0 HH12 ARG A 43 -7.128 -10.467 -15.886 1.00 37.71 H new ATOM 0 HH21 ARG A 43 -9.016 -11.289 -13.022 1.00 30.67 H new ATOM 0 HH22 ARG A 43 -8.146 -10.014 -13.881 1.00 30.67 H new ATOM 363 N LYS A 44 -4.734 -17.256 -13.190 1.00 27.38 N ATOM 364 CA LYS A 44 -3.423 -17.346 -12.562 1.00 24.82 C ATOM 365 C LYS A 44 -2.776 -15.969 -12.527 1.00 25.07 C ATOM 366 O LYS A 44 -2.525 -15.364 -13.571 1.00 25.72 O ATOM 367 CB LYS A 44 -2.535 -18.333 -13.323 1.00 31.68 C ATOM 368 CG LYS A 44 -3.029 -19.769 -13.253 1.00 36.95 C ATOM 369 CD LYS A 44 -2.279 -20.667 -14.221 1.00 40.69 C ATOM 370 CE LYS A 44 -2.699 -22.118 -14.065 1.00 45.64 C ATOM 371 NZ LYS A 44 -2.080 -22.985 -15.095 1.00 49.09 N ATOM 0 H LYS A 44 -4.728 -17.419 -14.197 1.00 27.38 H new ATOM 0 HA LYS A 44 -3.542 -17.709 -11.541 1.00 24.82 H new ATOM 0 HB2 LYS A 44 -2.477 -18.027 -14.368 1.00 31.68 H new ATOM 0 HB3 LYS A 44 -1.523 -18.285 -12.920 1.00 31.68 H new ATOM 0 HG2 LYS A 44 -2.908 -20.147 -12.238 1.00 36.95 H new ATOM 0 HG3 LYS A 44 -4.095 -19.799 -13.480 1.00 36.95 H new ATOM 0 HD2 LYS A 44 -2.466 -20.340 -15.244 1.00 40.69 H new ATOM 0 HD3 LYS A 44 -1.207 -20.576 -14.049 1.00 40.69 H new ATOM 0 HE2 LYS A 44 -2.417 -22.473 -13.074 1.00 45.64 H new ATOM 0 HE3 LYS A 44 -3.784 -22.191 -14.133 1.00 45.64 H new ATOM 0 HZ1 LYS A 44 -2.391 -23.967 -14.955 1.00 49.09 H new ATOM 0 HZ2 LYS A 44 -2.369 -22.662 -16.040 1.00 49.09 H new ATOM 0 HZ3 LYS A 44 -1.044 -22.935 -15.014 1.00 49.09 H new ATOM 385 N GLY A 45 -2.504 -15.470 -11.332 1.00 25.23 N ATOM 386 CA GLY A 45 -1.917 -14.156 -11.213 1.00 22.86 C ATOM 387 C GLY A 45 -0.639 -14.137 -10.411 1.00 20.43 C ATOM 388 O GLY A 45 -0.368 -15.042 -9.618 1.00 22.06 O ATOM 0 H GLY A 45 -2.678 -15.949 -10.448 1.00 25.23 H new ATOM 0 HA2 GLY A 45 -1.716 -13.765 -12.210 1.00 22.86 H new ATOM 0 HA3 GLY A 45 -2.639 -13.485 -10.747 1.00 22.86 H new ATOM 392 N LEU A 46 0.145 -13.096 -10.629 1.00 20.38 N ATOM 393 CA LEU A 46 1.405 -12.914 -9.940 1.00 20.77 C ATOM 394 C LEU A 46 1.370 -11.634 -9.113 1.00 23.10 C ATOM 395 O LEU A 46 1.179 -10.540 -9.648 1.00 23.65 O ATOM 396 CB LEU A 46 2.555 -12.851 -10.953 1.00 23.04 C ATOM 397 CG LEU A 46 3.940 -12.587 -10.360 1.00 26.36 C ATOM 398 CD1 LEU A 46 4.460 -13.820 -9.643 1.00 27.21 C ATOM 399 CD2 LEU A 46 4.907 -12.147 -11.451 1.00 26.03 C ATOM 0 H LEU A 46 -0.077 -12.353 -11.291 1.00 20.38 H new ATOM 0 HA LEU A 46 1.566 -13.761 -9.274 1.00 20.77 H new ATOM 0 HB2 LEU A 46 2.587 -13.793 -11.500 1.00 23.04 H new ATOM 0 HB3 LEU A 46 2.334 -12.068 -11.679 1.00 23.04 H new ATOM 0 HG LEU A 46 3.857 -11.782 -9.629 1.00 26.36 H new ATOM 0 HD11 LEU A 46 5.446 -13.611 -9.229 1.00 27.21 H new ATOM 0 HD12 LEU A 46 3.777 -14.087 -8.837 1.00 27.21 H new ATOM 0 HD13 LEU A 46 4.531 -14.648 -10.348 1.00 27.21 H new ATOM 0 HD21 LEU A 46 5.889 -11.963 -11.014 1.00 26.03 H new ATOM 0 HD22 LEU A 46 4.986 -12.931 -12.205 1.00 26.03 H new ATOM 0 HD23 LEU A 46 4.539 -11.232 -11.916 1.00 26.03 H new ATOM 411 N VAL A 47 1.534 -11.781 -7.808 1.00 21.70 N ATOM 412 CA VAL A 47 1.544 -10.643 -6.904 1.00 22.89 C ATOM 413 C VAL A 47 2.980 -10.200 -6.692 1.00 23.42 C ATOM 414 O VAL A 47 3.822 -11.006 -6.293 1.00 22.22 O ATOM 415 CB VAL A 47 0.912 -10.981 -5.537 1.00 20.99 C ATOM 416 CG1 VAL A 47 0.616 -9.711 -4.750 1.00 24.03 C ATOM 417 CG2 VAL A 47 -0.349 -11.809 -5.718 1.00 19.99 C ATOM 0 H VAL A 47 1.663 -12.683 -7.349 1.00 21.70 H new ATOM 0 HA VAL A 47 0.951 -9.848 -7.356 1.00 22.89 H new ATOM 0 HB VAL A 47 1.629 -11.573 -4.968 1.00 20.99 H new ATOM 0 HG11 VAL A 47 0.171 -9.973 -3.790 1.00 24.03 H new ATOM 0 HG12 VAL A 47 1.543 -9.162 -4.583 1.00 24.03 H new ATOM 0 HG13 VAL A 47 -0.078 -9.087 -5.313 1.00 24.03 H new ATOM 0 HG21 VAL A 47 -0.778 -12.036 -4.742 1.00 19.99 H new ATOM 0 HG22 VAL A 47 -1.071 -11.247 -6.310 1.00 19.99 H new ATOM 0 HG23 VAL A 47 -0.103 -12.739 -6.232 1.00 19.99 H new ATOM 427 N TYR A 48 3.265 -8.938 -6.963 1.00 22.85 N ATOM 428 CA TYR A 48 4.619 -8.435 -6.814 1.00 23.49 C ATOM 429 C TYR A 48 4.643 -7.028 -6.226 1.00 21.86 C ATOM 430 O TYR A 48 3.645 -6.305 -6.255 1.00 23.94 O ATOM 431 CB TYR A 48 5.337 -8.446 -8.168 1.00 25.01 C ATOM 432 CG TYR A 48 4.892 -7.342 -9.105 1.00 28.77 C ATOM 433 CD1 TYR A 48 3.787 -7.506 -9.932 1.00 30.08 C ATOM 434 CD2 TYR A 48 5.578 -6.133 -9.157 1.00 31.32 C ATOM 435 CE1 TYR A 48 3.382 -6.495 -10.783 1.00 31.24 C ATOM 436 CE2 TYR A 48 5.178 -5.121 -10.003 1.00 31.62 C ATOM 437 CZ TYR A 48 4.081 -5.307 -10.814 1.00 33.90 C ATOM 438 OH TYR A 48 3.683 -4.295 -11.657 1.00 40.45 O ATOM 0 H TYR A 48 2.585 -8.249 -7.284 1.00 22.85 H new ATOM 0 HA TYR A 48 5.138 -9.094 -6.118 1.00 23.49 H new ATOM 0 HB2 TYR A 48 6.410 -8.357 -8.000 1.00 25.01 H new ATOM 0 HB3 TYR A 48 5.169 -9.409 -8.650 1.00 25.01 H new ATOM 0 HD1 TYR A 48 3.238 -8.436 -9.909 1.00 30.08 H new ATOM 0 HD2 TYR A 48 6.440 -5.985 -8.523 1.00 31.32 H new ATOM 0 HE1 TYR A 48 2.522 -6.635 -11.421 1.00 31.24 H new ATOM 0 HE2 TYR A 48 5.722 -4.188 -10.030 1.00 31.62 H new ATOM 0 HH TYR A 48 3.181 -3.624 -11.149 1.00 40.45 H new ATOM 448 N ILE A 49 5.799 -6.661 -5.693 1.00 22.39 N ATOM 449 CA ILE A 49 6.011 -5.347 -5.109 1.00 23.58 C ATOM 450 C ILE A 49 7.254 -4.719 -5.723 1.00 27.61 C ATOM 451 O ILE A 49 8.327 -5.326 -5.717 1.00 27.30 O ATOM 452 CB ILE A 49 6.193 -5.419 -3.578 1.00 25.90 C ATOM 453 CG1 ILE A 49 5.066 -6.235 -2.942 1.00 27.10 C ATOM 454 CG2 ILE A 49 6.238 -4.018 -2.983 1.00 27.09 C ATOM 455 CD1 ILE A 49 5.198 -6.379 -1.445 1.00 25.36 C ATOM 0 H ILE A 49 6.618 -7.268 -5.654 1.00 22.39 H new ATOM 0 HA ILE A 49 5.127 -4.744 -5.318 1.00 23.58 H new ATOM 0 HB ILE A 49 7.139 -5.916 -3.365 1.00 25.90 H new ATOM 0 HG12 ILE A 49 4.111 -5.761 -3.171 1.00 27.10 H new ATOM 0 HG13 ILE A 49 5.046 -7.227 -3.394 1.00 27.10 H new ATOM 0 HG21 ILE A 49 6.367 -4.085 -1.903 1.00 27.09 H new ATOM 0 HG22 ILE A 49 7.073 -3.466 -3.414 1.00 27.09 H new ATOM 0 HG23 ILE A 49 5.306 -3.498 -3.206 1.00 27.09 H new ATOM 0 HD11 ILE A 49 4.365 -6.969 -1.061 1.00 25.36 H new ATOM 0 HD12 ILE A 49 6.137 -6.880 -1.209 1.00 25.36 H new ATOM 0 HD13 ILE A 49 5.187 -5.392 -0.982 1.00 25.36 H new ATOM 467 N GLN A 50 7.112 -3.519 -6.264 1.00 27.71 N ATOM 468 CA GLN A 50 8.238 -2.836 -6.879 1.00 32.14 C ATOM 469 C GLN A 50 8.459 -1.458 -6.269 1.00 32.00 C ATOM 470 O GLN A 50 7.523 -0.671 -6.120 1.00 30.85 O ATOM 471 CB GLN A 50 8.028 -2.708 -8.390 1.00 36.37 C ATOM 472 CG GLN A 50 9.053 -1.809 -9.070 1.00 39.34 C ATOM 473 CD GLN A 50 8.990 -1.868 -10.582 1.00 45.99 C ATOM 474 OE1 GLN A 50 7.951 -2.180 -11.164 1.00 55.21 O ATOM 475 NE2 GLN A 50 10.102 -1.559 -11.231 1.00 53.40 N ATOM 0 H GLN A 50 6.234 -3.001 -6.290 1.00 27.71 H new ATOM 0 HA GLN A 50 9.127 -3.437 -6.690 1.00 32.14 H new ATOM 0 HB2 GLN A 50 8.070 -3.700 -8.840 1.00 36.37 H new ATOM 0 HB3 GLN A 50 7.029 -2.315 -8.578 1.00 36.37 H new ATOM 0 HG2 GLN A 50 8.896 -0.780 -8.746 1.00 39.34 H new ATOM 0 HG3 GLN A 50 10.052 -2.097 -8.743 1.00 39.34 H new ATOM 0 HE21 GLN A 50 10.942 -1.306 -10.711 1.00 53.40 H new ATOM 0 HE22 GLN A 50 10.118 -1.574 -12.251 1.00 53.40 H new ATOM 484 N GLN A 51 9.700 -1.181 -5.908 1.00 32.95 N ATOM 485 CA GLN A 51 10.065 0.105 -5.344 1.00 32.74 C ATOM 486 C GLN A 51 10.767 0.927 -6.414 1.00 36.30 C ATOM 487 O GLN A 51 11.885 0.609 -6.817 1.00 38.61 O ATOM 488 CB GLN A 51 10.972 -0.071 -4.125 1.00 33.49 C ATOM 489 CG GLN A 51 11.396 1.241 -3.481 1.00 36.02 C ATOM 490 CD GLN A 51 12.356 1.042 -2.325 1.00 40.59 C ATOM 491 OE1 GLN A 51 13.155 0.103 -2.321 1.00 47.50 O ATOM 492 NE2 GLN A 51 12.281 1.912 -1.333 1.00 36.66 N ATOM 0 H GLN A 51 10.477 -1.836 -5.997 1.00 32.95 H new ATOM 0 HA GLN A 51 9.164 0.622 -5.013 1.00 32.74 H new ATOM 0 HB2 GLN A 51 10.454 -0.679 -3.383 1.00 33.49 H new ATOM 0 HB3 GLN A 51 11.863 -0.623 -4.423 1.00 33.49 H new ATOM 0 HG2 GLN A 51 11.866 1.875 -4.233 1.00 36.02 H new ATOM 0 HG3 GLN A 51 10.511 1.769 -3.126 1.00 36.02 H new ATOM 0 HE21 GLN A 51 11.606 2.676 -1.374 1.00 36.66 H new ATOM 0 HE22 GLN A 51 12.898 1.820 -0.526 1.00 36.66 H new ATOM 501 N THR A 52 10.100 1.960 -6.895 1.00 32.79 N ATOM 502 CA THR A 52 10.657 2.808 -7.932 1.00 35.62 C ATOM 503 C THR A 52 11.512 3.935 -7.349 1.00 34.85 C ATOM 504 O THR A 52 11.537 4.143 -6.133 1.00 33.85 O ATOM 505 CB THR A 52 9.527 3.380 -8.804 1.00 36.57 C ATOM 506 OG1 THR A 52 8.299 3.389 -8.059 1.00 36.03 O ATOM 507 CG2 THR A 52 9.353 2.546 -10.065 1.00 36.33 C ATOM 0 H THR A 52 9.168 2.232 -6.582 1.00 32.79 H new ATOM 0 HA THR A 52 11.312 2.195 -8.551 1.00 35.62 H new ATOM 0 HB THR A 52 9.788 4.399 -9.091 1.00 36.57 H new ATOM 0 HG1 THR A 52 8.165 4.274 -7.660 1.00 36.03 H new ATOM 0 HG21 THR A 52 8.549 2.965 -10.670 1.00 36.33 H new ATOM 0 HG22 THR A 52 10.281 2.554 -10.637 1.00 36.33 H new ATOM 0 HG23 THR A 52 9.104 1.521 -9.792 1.00 36.33 H new ATOM 515 N ASP A 53 12.206 4.658 -8.227 1.00 40.95 N ATOM 516 CA ASP A 53 13.085 5.763 -7.822 1.00 43.16 C ATOM 517 C ASP A 53 12.301 6.907 -7.186 1.00 43.44 C ATOM 518 O ASP A 53 12.875 7.781 -6.541 1.00 42.75 O ATOM 519 CB ASP A 53 13.867 6.296 -9.029 1.00 50.66 C ATOM 520 CG ASP A 53 13.094 7.341 -9.817 1.00 58.97 C ATOM 521 OD1 ASP A 53 12.125 6.972 -10.517 1.00 70.66 O ATOM 522 OD2 ASP A 53 13.450 8.536 -9.744 1.00 70.60 O ATOM 0 H ASP A 53 12.178 4.499 -9.234 1.00 40.95 H new ATOM 0 HA ASP A 53 13.778 5.366 -7.080 1.00 43.16 H new ATOM 0 HB2 ASP A 53 14.807 6.728 -8.685 1.00 50.66 H new ATOM 0 HB3 ASP A 53 14.121 5.465 -9.687 1.00 50.66 H new ATOM 527 N ASP A 54 10.992 6.894 -7.367 1.00 39.48 N ATOM 528 CA ASP A 54 10.124 7.927 -6.812 1.00 39.12 C ATOM 529 C ASP A 54 9.723 7.582 -5.382 1.00 37.04 C ATOM 530 O ASP A 54 8.968 8.321 -4.742 1.00 37.46 O ATOM 531 CB ASP A 54 8.875 8.099 -7.682 1.00 40.13 C ATOM 532 CG ASP A 54 8.270 6.772 -8.100 1.00 38.54 C ATOM 533 OD1 ASP A 54 8.288 5.824 -7.289 1.00 36.07 O ATOM 534 OD2 ASP A 54 7.789 6.667 -9.247 1.00 42.19 O ATOM 0 H ASP A 54 10.500 6.175 -7.898 1.00 39.48 H new ATOM 0 HA ASP A 54 10.677 8.867 -6.800 1.00 39.12 H new ATOM 0 HB2 ASP A 54 8.131 8.677 -7.134 1.00 40.13 H new ATOM 0 HB3 ASP A 54 9.132 8.673 -8.572 1.00 40.13 H new ATOM 539 N SER A 55 10.232 6.447 -4.900 1.00 33.99 N ATOM 540 CA SER A 55 9.964 5.961 -3.549 1.00 31.71 C ATOM 541 C SER A 55 8.509 5.520 -3.387 1.00 28.99 C ATOM 542 O SER A 55 8.010 5.388 -2.269 1.00 29.99 O ATOM 543 CB SER A 55 10.321 7.024 -2.504 1.00 40.69 C ATOM 544 OG SER A 55 11.689 7.396 -2.597 1.00 39.56 O ATOM 0 H SER A 55 10.845 5.837 -5.441 1.00 33.99 H new ATOM 0 HA SER A 55 10.597 5.089 -3.387 1.00 31.71 H new ATOM 0 HB2 SER A 55 9.692 7.903 -2.646 1.00 40.69 H new ATOM 0 HB3 SER A 55 10.113 6.640 -1.505 1.00 40.69 H new ATOM 0 HG SER A 55 11.890 8.076 -1.921 1.00 39.56 H new ATOM 550 N LEU A 56 7.831 5.292 -4.503 1.00 31.45 N ATOM 551 CA LEU A 56 6.449 4.849 -4.464 1.00 28.30 C ATOM 552 C LEU A 56 6.398 3.329 -4.478 1.00 28.13 C ATOM 553 O LEU A 56 6.689 2.699 -5.499 1.00 30.03 O ATOM 554 CB LEU A 56 5.660 5.407 -5.654 1.00 29.92 C ATOM 555 CG LEU A 56 5.613 6.936 -5.763 1.00 28.23 C ATOM 556 CD1 LEU A 56 4.937 7.357 -7.060 1.00 31.16 C ATOM 557 CD2 LEU A 56 4.885 7.538 -4.574 1.00 29.13 C ATOM 0 H LEU A 56 8.215 5.406 -5.441 1.00 31.45 H new ATOM 0 HA LEU A 56 5.993 5.222 -3.547 1.00 28.30 H new ATOM 0 HB2 LEU A 56 6.093 5.009 -6.572 1.00 29.92 H new ATOM 0 HB3 LEU A 56 4.638 5.034 -5.595 1.00 29.92 H new ATOM 0 HG LEU A 56 6.638 7.308 -5.765 1.00 28.23 H new ATOM 0 HD11 LEU A 56 4.912 8.445 -7.121 1.00 31.16 H new ATOM 0 HD12 LEU A 56 5.495 6.959 -7.907 1.00 31.16 H new ATOM 0 HD13 LEU A 56 3.919 6.969 -7.082 1.00 31.16 H new ATOM 0 HD21 LEU A 56 4.864 8.623 -4.672 1.00 29.13 H new ATOM 0 HD22 LEU A 56 3.865 7.156 -4.541 1.00 29.13 H new ATOM 0 HD23 LEU A 56 5.404 7.267 -3.654 1.00 29.13 H new ATOM 569 N ILE A 57 6.055 2.738 -3.339 1.00 26.76 N ATOM 570 CA ILE A 57 5.960 1.290 -3.236 1.00 25.89 C ATOM 571 C ILE A 57 4.782 0.805 -4.067 1.00 27.00 C ATOM 572 O ILE A 57 3.625 0.979 -3.691 1.00 27.45 O ATOM 573 CB ILE A 57 5.794 0.825 -1.771 1.00 27.42 C ATOM 574 CG1 ILE A 57 6.812 1.522 -0.858 1.00 31.55 C ATOM 575 CG2 ILE A 57 5.938 -0.686 -1.673 1.00 28.59 C ATOM 576 CD1 ILE A 57 8.256 1.267 -1.238 1.00 37.28 C ATOM 0 H ILE A 57 5.839 3.239 -2.477 1.00 26.76 H new ATOM 0 HA ILE A 57 6.889 0.862 -3.612 1.00 25.89 H new ATOM 0 HB ILE A 57 4.794 1.101 -1.438 1.00 27.42 H new ATOM 0 HG12 ILE A 57 6.626 2.596 -0.877 1.00 31.55 H new ATOM 0 HG13 ILE A 57 6.653 1.189 0.168 1.00 31.55 H new ATOM 0 HG21 ILE A 57 5.818 -0.996 -0.635 1.00 28.59 H new ATOM 0 HG22 ILE A 57 5.174 -1.165 -2.285 1.00 28.59 H new ATOM 0 HG23 ILE A 57 6.925 -0.981 -2.028 1.00 28.59 H new ATOM 0 HD11 ILE A 57 8.913 1.793 -0.546 1.00 37.28 H new ATOM 0 HD12 ILE A 57 8.461 0.198 -1.191 1.00 37.28 H new ATOM 0 HD13 ILE A 57 8.434 1.626 -2.252 1.00 37.28 H new ATOM 588 N HIS A 58 5.081 0.213 -5.205 1.00 26.83 N ATOM 589 CA HIS A 58 4.050 -0.253 -6.113 1.00 24.25 C ATOM 590 C HIS A 58 3.632 -1.689 -5.832 1.00 29.20 C ATOM 591 O HIS A 58 4.401 -2.627 -6.049 1.00 26.43 O ATOM 592 CB HIS A 58 4.529 -0.122 -7.558 1.00 27.78 C ATOM 593 CG HIS A 58 4.393 1.265 -8.107 1.00 33.31 C ATOM 594 ND1 HIS A 58 5.387 2.218 -8.025 1.00 38.84 N ATOM 595 CD2 HIS A 58 3.367 1.855 -8.760 1.00 29.13 C ATOM 596 CE1 HIS A 58 4.977 3.330 -8.602 1.00 32.16 C ATOM 597 NE2 HIS A 58 3.754 3.139 -9.055 1.00 37.59 N ATOM 0 H HIS A 58 6.034 0.042 -5.525 1.00 26.83 H new ATOM 0 HA HIS A 58 3.173 0.375 -5.955 1.00 24.25 H new ATOM 0 HB2 HIS A 58 5.574 -0.427 -7.615 1.00 27.78 H new ATOM 0 HB3 HIS A 58 3.962 -0.810 -8.185 1.00 27.78 H new ATOM 0 HD1 HIS A 58 6.298 2.083 -7.586 1.00 38.84 H new ATOM 0 HD2 HIS A 58 2.418 1.401 -9.004 1.00 29.13 H new ATOM 0 HE1 HIS A 58 5.547 4.243 -8.689 1.00 32.16 H new ATOM 606 N PHE A 59 2.417 -1.835 -5.329 1.00 24.93 N ATOM 607 CA PHE A 59 1.838 -3.140 -5.058 1.00 24.00 C ATOM 608 C PHE A 59 0.845 -3.423 -6.170 1.00 24.90 C ATOM 609 O PHE A 59 -0.225 -2.810 -6.223 1.00 22.76 O ATOM 610 CB PHE A 59 1.143 -3.154 -3.690 1.00 22.07 C ATOM 611 CG PHE A 59 0.572 -4.490 -3.299 1.00 22.53 C ATOM 612 CD1 PHE A 59 1.343 -5.415 -2.616 1.00 23.94 C ATOM 613 CD2 PHE A 59 -0.740 -4.816 -3.609 1.00 23.49 C ATOM 614 CE1 PHE A 59 0.818 -6.641 -2.250 1.00 24.34 C ATOM 615 CE2 PHE A 59 -1.270 -6.040 -3.247 1.00 25.32 C ATOM 616 CZ PHE A 59 -0.489 -6.953 -2.567 1.00 23.59 C ATOM 0 H PHE A 59 1.805 -1.053 -5.097 1.00 24.93 H new ATOM 0 HA PHE A 59 2.612 -3.907 -5.028 1.00 24.00 H new ATOM 0 HB2 PHE A 59 1.858 -2.841 -2.929 1.00 22.07 H new ATOM 0 HB3 PHE A 59 0.340 -2.417 -3.696 1.00 22.07 H new ATOM 0 HD1 PHE A 59 2.366 -5.176 -2.366 1.00 23.94 H new ATOM 0 HD2 PHE A 59 -1.355 -4.105 -4.140 1.00 23.49 H new ATOM 0 HE1 PHE A 59 1.430 -7.354 -1.717 1.00 24.34 H new ATOM 0 HE2 PHE A 59 -2.293 -6.282 -3.496 1.00 25.32 H new ATOM 0 HZ PHE A 59 -0.900 -7.911 -2.283 1.00 23.59 H new ATOM 626 N CYS A 60 1.199 -4.319 -7.076 1.00 24.92 N ATOM 627 CA CYS A 60 0.335 -4.605 -8.204 1.00 24.28 C ATOM 628 C CYS A 60 0.116 -6.098 -8.426 1.00 22.52 C ATOM 629 O CYS A 60 0.913 -6.937 -7.998 1.00 22.77 O ATOM 630 CB CYS A 60 0.929 -3.984 -9.472 1.00 25.29 C ATOM 631 SG CYS A 60 2.110 -2.644 -9.175 1.00 29.25 S ATOM 0 H CYS A 60 2.067 -4.854 -7.052 1.00 24.92 H new ATOM 0 HA CYS A 60 -0.638 -4.169 -7.978 1.00 24.28 H new ATOM 0 HB2 CYS A 60 1.425 -4.767 -10.046 1.00 25.29 H new ATOM 0 HB3 CYS A 60 0.115 -3.603 -10.089 1.00 25.29 H new ATOM 0 HG CYS A 60 1.685 -1.556 -9.746 1.00 29.25 H new ATOM 637 N TRP A 61 -0.980 -6.407 -9.104 1.00 21.73 N ATOM 638 CA TRP A 61 -1.340 -7.774 -9.441 1.00 24.21 C ATOM 639 C TRP A 61 -1.249 -7.932 -10.952 1.00 23.19 C ATOM 640 O TRP A 61 -1.958 -7.249 -11.699 1.00 23.71 O ATOM 641 CB TRP A 61 -2.760 -8.092 -8.958 1.00 23.71 C ATOM 642 CG TRP A 61 -3.152 -9.531 -9.131 1.00 21.67 C ATOM 643 CD1 TRP A 61 -2.924 -10.551 -8.254 1.00 22.32 C ATOM 644 CD2 TRP A 61 -3.849 -10.105 -10.244 1.00 21.21 C ATOM 645 NE1 TRP A 61 -3.431 -11.725 -8.754 1.00 20.93 N ATOM 646 CE2 TRP A 61 -4.004 -11.480 -9.975 1.00 21.69 C ATOM 647 CE3 TRP A 61 -4.354 -9.594 -11.441 1.00 23.41 C ATOM 648 CZ2 TRP A 61 -4.645 -12.341 -10.860 1.00 24.22 C ATOM 649 CZ3 TRP A 61 -4.988 -10.451 -12.318 1.00 22.81 C ATOM 650 CH2 TRP A 61 -5.130 -11.814 -12.024 1.00 22.79 C ATOM 0 H TRP A 61 -1.647 -5.711 -9.437 1.00 21.73 H new ATOM 0 HA TRP A 61 -0.658 -8.468 -8.949 1.00 24.21 H new ATOM 0 HB2 TRP A 61 -2.843 -7.827 -7.904 1.00 23.71 H new ATOM 0 HB3 TRP A 61 -3.467 -7.465 -9.501 1.00 23.71 H new ATOM 0 HD1 TRP A 61 -2.418 -10.450 -7.305 1.00 22.32 H new ATOM 0 HE1 TRP A 61 -3.388 -12.633 -8.291 1.00 20.93 H new ATOM 0 HE3 TRP A 61 -4.250 -8.545 -11.677 1.00 23.41 H new ATOM 0 HZ2 TRP A 61 -4.756 -13.391 -10.635 1.00 24.22 H new ATOM 0 HZ3 TRP A 61 -5.381 -10.065 -13.247 1.00 22.81 H new ATOM 0 HH2 TRP A 61 -5.632 -12.459 -12.730 1.00 22.79 H new ATOM 661 N LYS A 62 -0.372 -8.809 -11.399 1.00 23.00 N ATOM 662 CA LYS A 62 -0.175 -9.024 -12.822 1.00 25.78 C ATOM 663 C LYS A 62 -0.729 -10.372 -13.260 1.00 27.19 C ATOM 664 O LYS A 62 -0.489 -11.391 -12.615 1.00 24.10 O ATOM 665 CB LYS A 62 1.318 -8.937 -13.151 1.00 30.99 C ATOM 666 CG LYS A 62 1.654 -9.261 -14.599 1.00 37.82 C ATOM 667 CD LYS A 62 3.155 -9.256 -14.836 1.00 35.10 C ATOM 668 CE LYS A 62 3.507 -9.788 -16.218 1.00 48.03 C ATOM 669 NZ LYS A 62 4.948 -9.618 -16.529 1.00 48.74 N ATOM 0 H LYS A 62 0.217 -9.386 -10.798 1.00 23.00 H new ATOM 0 HA LYS A 62 -0.716 -8.249 -13.365 1.00 25.78 H new ATOM 0 HB2 LYS A 62 1.671 -7.931 -12.923 1.00 30.99 H new ATOM 0 HB3 LYS A 62 1.863 -9.621 -12.501 1.00 30.99 H new ATOM 0 HG2 LYS A 62 1.247 -10.238 -14.858 1.00 37.82 H new ATOM 0 HG3 LYS A 62 1.178 -8.533 -15.256 1.00 37.82 H new ATOM 0 HD2 LYS A 62 3.537 -8.241 -14.728 1.00 35.10 H new ATOM 0 HD3 LYS A 62 3.646 -9.864 -14.076 1.00 35.10 H new ATOM 0 HE2 LYS A 62 3.246 -10.845 -16.277 1.00 48.03 H new ATOM 0 HE3 LYS A 62 2.911 -9.270 -16.969 1.00 48.03 H new ATOM 0 HZ1 LYS A 62 5.145 -9.993 -17.479 1.00 48.74 H new ATOM 0 HZ2 LYS A 62 5.193 -8.608 -16.498 1.00 48.74 H new ATOM 0 HZ3 LYS A 62 5.518 -10.134 -15.828 1.00 48.74 H new ATOM 683 N ASP A 63 -1.476 -10.369 -14.354 1.00 25.78 N ATOM 684 CA ASP A 63 -2.036 -11.599 -14.896 1.00 25.28 C ATOM 685 C ASP A 63 -0.941 -12.354 -15.635 1.00 27.61 C ATOM 686 O ASP A 63 -0.277 -11.795 -16.504 1.00 28.08 O ATOM 687 CB ASP A 63 -3.205 -11.289 -15.837 1.00 27.58 C ATOM 688 CG ASP A 63 -3.606 -12.476 -16.699 1.00 32.53 C ATOM 689 OD1 ASP A 63 -3.598 -13.618 -16.203 1.00 43.65 O ATOM 690 OD2 ASP A 63 -3.931 -12.270 -17.886 1.00 44.29 O ATOM 0 H ASP A 63 -1.709 -9.529 -14.884 1.00 25.78 H new ATOM 0 HA ASP A 63 -2.418 -12.215 -14.082 1.00 25.28 H new ATOM 0 HB2 ASP A 63 -4.064 -10.969 -15.247 1.00 27.58 H new ATOM 0 HB3 ASP A 63 -2.933 -10.454 -16.483 1.00 27.58 H new ATOM 695 N ARG A 64 -0.750 -13.619 -15.289 1.00 25.21 N ATOM 696 CA ARG A 64 0.295 -14.433 -15.907 1.00 26.58 C ATOM 697 C ARG A 64 -0.072 -14.849 -17.329 1.00 32.09 C ATOM 698 O ARG A 64 0.777 -15.328 -18.088 1.00 35.96 O ATOM 699 CB ARG A 64 0.568 -15.675 -15.057 1.00 26.02 C ATOM 700 CG ARG A 64 1.198 -15.370 -13.705 1.00 23.07 C ATOM 701 CD ARG A 64 1.457 -16.642 -12.909 1.00 26.59 C ATOM 702 NE ARG A 64 2.378 -17.545 -13.603 1.00 24.42 N ATOM 703 CZ ARG A 64 2.231 -18.869 -13.652 1.00 28.00 C ATOM 704 NH1 ARG A 64 1.243 -19.460 -12.991 1.00 26.89 N ATOM 705 NH2 ARG A 64 3.092 -19.607 -14.342 1.00 28.46 N ATOM 0 H ARG A 64 -1.303 -14.107 -14.584 1.00 25.21 H new ATOM 0 HA ARG A 64 1.196 -13.821 -15.961 1.00 26.58 H new ATOM 0 HB2 ARG A 64 -0.369 -16.208 -14.898 1.00 26.02 H new ATOM 0 HB3 ARG A 64 1.226 -16.345 -15.611 1.00 26.02 H new ATOM 0 HG2 ARG A 64 2.136 -14.835 -13.852 1.00 23.07 H new ATOM 0 HG3 ARG A 64 0.541 -14.712 -13.137 1.00 23.07 H new ATOM 0 HD2 ARG A 64 1.870 -16.382 -11.934 1.00 26.59 H new ATOM 0 HD3 ARG A 64 0.513 -17.156 -12.729 1.00 26.59 H new ATOM 0 HE ARG A 64 3.182 -17.135 -14.078 1.00 24.42 H new ATOM 0 HH11 ARG A 64 0.591 -18.901 -12.441 1.00 26.89 H new ATOM 0 HH12 ARG A 64 1.136 -20.474 -13.033 1.00 26.89 H new ATOM 0 HH21 ARG A 64 3.866 -19.161 -14.835 1.00 28.46 H new ATOM 0 HH22 ARG A 64 2.980 -20.620 -14.380 1.00 28.46 H new ATOM 719 N THR A 65 -1.329 -14.661 -17.693 1.00 33.44 N ATOM 720 CA THR A 65 -1.797 -15.032 -19.016 1.00 36.88 C ATOM 721 C THR A 65 -1.526 -13.928 -20.042 1.00 39.61 C ATOM 722 O THR A 65 -0.789 -14.134 -21.006 1.00 43.46 O ATOM 723 CB THR A 65 -3.299 -15.362 -18.993 1.00 37.93 C ATOM 724 OG1 THR A 65 -3.691 -15.755 -17.666 1.00 37.86 O ATOM 725 CG2 THR A 65 -3.618 -16.478 -19.977 1.00 41.05 C ATOM 0 H THR A 65 -2.044 -14.253 -17.090 1.00 33.44 H new ATOM 0 HA THR A 65 -1.241 -15.920 -19.315 1.00 36.88 H new ATOM 0 HB THR A 65 -3.855 -14.471 -19.286 1.00 37.93 H new ATOM 0 HG1 THR A 65 -4.037 -14.976 -17.183 1.00 37.86 H new ATOM 0 HG21 THR A 65 -4.685 -16.697 -19.946 1.00 41.05 H new ATOM 0 HG22 THR A 65 -3.341 -16.166 -20.984 1.00 41.05 H new ATOM 0 HG23 THR A 65 -3.056 -17.372 -19.707 1.00 41.05 H new ATOM 733 N SER A 66 -2.113 -12.757 -19.833 1.00 37.37 N ATOM 734 CA SER A 66 -1.932 -11.641 -20.752 1.00 38.86 C ATOM 735 C SER A 66 -0.636 -10.892 -20.462 1.00 40.19 C ATOM 736 O SER A 66 0.018 -10.383 -21.372 1.00 43.03 O ATOM 737 CB SER A 66 -3.120 -10.683 -20.650 1.00 38.83 C ATOM 738 OG SER A 66 -3.275 -10.205 -19.323 1.00 38.28 O ATOM 0 H SER A 66 -2.718 -12.555 -19.037 1.00 37.37 H new ATOM 0 HA SER A 66 -1.874 -12.042 -21.764 1.00 38.86 H new ATOM 0 HB2 SER A 66 -2.973 -9.842 -21.328 1.00 38.83 H new ATOM 0 HB3 SER A 66 -4.031 -11.192 -20.966 1.00 38.83 H new ATOM 0 HG SER A 66 -3.763 -10.868 -18.791 1.00 38.28 H new ATOM 744 N GLY A 67 -0.261 -10.841 -19.190 1.00 37.65 N ATOM 745 CA GLY A 67 0.939 -10.134 -18.803 1.00 35.24 C ATOM 746 C GLY A 67 0.645 -8.693 -18.443 1.00 32.90 C ATOM 747 O GLY A 67 1.558 -7.896 -18.219 1.00 38.76 O ATOM 0 H GLY A 67 -0.769 -11.278 -18.421 1.00 37.65 H new ATOM 0 HA2 GLY A 67 1.399 -10.636 -17.952 1.00 35.24 H new ATOM 0 HA3 GLY A 67 1.660 -10.166 -19.620 1.00 35.24 H new ATOM 751 N THR A 68 -0.637 -8.367 -18.381 1.00 35.01 N ATOM 752 CA THR A 68 -1.075 -7.020 -18.058 1.00 34.10 C ATOM 753 C THR A 68 -1.262 -6.837 -16.557 1.00 32.67 C ATOM 754 O THR A 68 -1.668 -7.765 -15.849 1.00 29.63 O ATOM 755 CB THR A 68 -2.405 -6.699 -18.765 1.00 41.04 C ATOM 756 OG1 THR A 68 -2.552 -7.530 -19.926 1.00 46.72 O ATOM 757 CG2 THR A 68 -2.464 -5.230 -19.168 1.00 41.80 C ATOM 0 H THR A 68 -1.398 -9.025 -18.552 1.00 35.01 H new ATOM 0 HA THR A 68 -0.297 -6.340 -18.403 1.00 34.10 H new ATOM 0 HB THR A 68 -3.221 -6.898 -18.071 1.00 41.04 H new ATOM 0 HG1 THR A 68 -2.907 -8.404 -19.660 1.00 46.72 H new ATOM 0 HG21 THR A 68 -3.412 -5.027 -19.666 1.00 41.80 H new ATOM 0 HG22 THR A 68 -2.380 -4.605 -18.279 1.00 41.80 H new ATOM 0 HG23 THR A 68 -1.642 -5.006 -19.848 1.00 41.80 H new ATOM 765 N VAL A 69 -0.949 -5.644 -16.078 1.00 33.44 N ATOM 766 CA VAL A 69 -1.104 -5.314 -14.674 1.00 31.48 C ATOM 767 C VAL A 69 -2.485 -4.703 -14.462 1.00 34.28 C ATOM 768 O VAL A 69 -2.721 -3.551 -14.824 1.00 37.70 O ATOM 769 CB VAL A 69 -0.021 -4.323 -14.199 1.00 33.02 C ATOM 770 CG1 VAL A 69 -0.155 -4.060 -12.709 1.00 31.05 C ATOM 771 CG2 VAL A 69 1.368 -4.851 -14.533 1.00 34.92 C ATOM 0 H VAL A 69 -0.583 -4.882 -16.649 1.00 33.44 H new ATOM 0 HA VAL A 69 -0.995 -6.228 -14.090 1.00 31.48 H new ATOM 0 HB VAL A 69 -0.162 -3.378 -14.724 1.00 33.02 H new ATOM 0 HG11 VAL A 69 0.617 -3.359 -12.392 1.00 31.05 H new ATOM 0 HG12 VAL A 69 -1.137 -3.636 -12.501 1.00 31.05 H new ATOM 0 HG13 VAL A 69 -0.041 -4.996 -12.163 1.00 31.05 H new ATOM 0 HG21 VAL A 69 2.120 -4.140 -14.191 1.00 34.92 H new ATOM 0 HG22 VAL A 69 1.522 -5.809 -14.036 1.00 34.92 H new ATOM 0 HG23 VAL A 69 1.457 -4.983 -15.611 1.00 34.92 H new ATOM 781 N GLU A 70 -3.398 -5.484 -13.903 1.00 27.61 N ATOM 782 CA GLU A 70 -4.762 -5.023 -13.677 1.00 28.48 C ATOM 783 C GLU A 70 -4.849 -4.126 -12.446 1.00 35.57 C ATOM 784 O GLU A 70 -5.249 -2.962 -12.539 1.00 36.58 O ATOM 785 CB GLU A 70 -5.705 -6.218 -13.528 1.00 34.68 C ATOM 786 CG GLU A 70 -5.723 -7.129 -14.746 1.00 39.08 C ATOM 787 CD GLU A 70 -6.861 -8.131 -14.726 1.00 33.19 C ATOM 788 OE1 GLU A 70 -7.588 -8.207 -13.711 1.00 39.04 O ATOM 789 OE2 GLU A 70 -7.041 -8.846 -15.731 1.00 44.88 O ATOM 0 H GLU A 70 -3.220 -6.441 -13.597 1.00 27.61 H new ATOM 0 HA GLU A 70 -5.065 -4.434 -14.543 1.00 28.48 H new ATOM 0 HB2 GLU A 70 -5.409 -6.798 -12.654 1.00 34.68 H new ATOM 0 HB3 GLU A 70 -6.715 -5.853 -13.341 1.00 34.68 H new ATOM 0 HG2 GLU A 70 -5.800 -6.520 -15.646 1.00 39.08 H new ATOM 0 HG3 GLU A 70 -4.776 -7.666 -14.804 1.00 39.08 H new ATOM 796 N ASP A 71 -4.478 -4.667 -11.300 1.00 27.90 N ATOM 797 CA ASP A 71 -4.516 -3.912 -10.056 1.00 27.06 C ATOM 798 C ASP A 71 -3.151 -3.315 -9.777 1.00 26.23 C ATOM 799 O ASP A 71 -2.141 -4.005 -9.876 1.00 25.29 O ATOM 800 CB ASP A 71 -4.954 -4.802 -8.889 1.00 27.28 C ATOM 801 CG ASP A 71 -6.369 -5.321 -9.054 1.00 36.49 C ATOM 802 OD1 ASP A 71 -6.571 -6.262 -9.847 1.00 33.15 O ATOM 803 OD2 ASP A 71 -7.291 -4.783 -8.400 1.00 44.65 O ATOM 0 H ASP A 71 -4.146 -5.627 -11.202 1.00 27.90 H new ATOM 0 HA ASP A 71 -5.245 -3.109 -10.160 1.00 27.06 H new ATOM 0 HB2 ASP A 71 -4.269 -5.645 -8.802 1.00 27.28 H new ATOM 0 HB3 ASP A 71 -4.884 -4.237 -7.959 1.00 27.28 H new ATOM 808 N ASP A 72 -3.129 -2.036 -9.444 1.00 28.12 N ATOM 809 CA ASP A 72 -1.884 -1.333 -9.156 1.00 27.09 C ATOM 810 C ASP A 72 -2.140 -0.216 -8.157 1.00 28.96 C ATOM 811 O ASP A 72 -2.910 0.708 -8.433 1.00 30.68 O ATOM 812 CB ASP A 72 -1.291 -0.769 -10.452 1.00 32.18 C ATOM 813 CG ASP A 72 -0.228 0.285 -10.210 1.00 37.86 C ATOM 814 OD1 ASP A 72 0.842 -0.048 -9.665 1.00 34.36 O ATOM 815 OD2 ASP A 72 -0.450 1.453 -10.591 1.00 46.72 O ATOM 0 H ASP A 72 -3.965 -1.457 -9.365 1.00 28.12 H new ATOM 0 HA ASP A 72 -1.169 -2.032 -8.722 1.00 27.09 H new ATOM 0 HB2 ASP A 72 -0.860 -1.585 -11.032 1.00 32.18 H new ATOM 0 HB3 ASP A 72 -2.091 -0.338 -11.053 1.00 32.18 H new ATOM 820 N LEU A 73 -1.520 -0.308 -6.991 1.00 27.72 N ATOM 821 CA LEU A 73 -1.707 0.695 -5.955 1.00 25.71 C ATOM 822 C LEU A 73 -0.377 1.240 -5.457 1.00 28.61 C ATOM 823 O LEU A 73 0.664 0.589 -5.579 1.00 28.34 O ATOM 824 CB LEU A 73 -2.489 0.102 -4.784 1.00 28.50 C ATOM 825 CG LEU A 73 -3.946 -0.256 -5.088 1.00 38.00 C ATOM 826 CD1 LEU A 73 -4.514 -1.138 -3.987 1.00 46.75 C ATOM 827 CD2 LEU A 73 -4.782 1.006 -5.241 1.00 41.56 C ATOM 0 H LEU A 73 -0.885 -1.065 -6.739 1.00 27.72 H new ATOM 0 HA LEU A 73 -2.270 1.520 -6.392 1.00 25.71 H new ATOM 0 HB2 LEU A 73 -1.975 -0.796 -4.442 1.00 28.50 H new ATOM 0 HB3 LEU A 73 -2.471 0.813 -3.958 1.00 28.50 H new ATOM 0 HG LEU A 73 -3.979 -0.808 -6.027 1.00 38.00 H new ATOM 0 HD11 LEU A 73 -5.551 -1.385 -4.217 1.00 46.75 H new ATOM 0 HD12 LEU A 73 -3.930 -2.055 -3.918 1.00 46.75 H new ATOM 0 HD13 LEU A 73 -4.469 -0.607 -3.036 1.00 46.75 H new ATOM 0 HD21 LEU A 73 -5.815 0.734 -5.457 1.00 41.56 H new ATOM 0 HD22 LEU A 73 -4.744 1.582 -4.316 1.00 41.56 H new ATOM 0 HD23 LEU A 73 -4.387 1.607 -6.060 1.00 41.56 H new ATOM 839 N ILE A 74 -0.428 2.441 -4.903 1.00 26.56 N ATOM 840 CA ILE A 74 0.747 3.095 -4.360 1.00 26.14 C ATOM 841 C ILE A 74 0.743 2.964 -2.844 1.00 27.51 C ATOM 842 O ILE A 74 -0.043 3.613 -2.155 1.00 28.90 O ATOM 843 CB ILE A 74 0.805 4.588 -4.751 1.00 28.52 C ATOM 844 CG1 ILE A 74 0.916 4.736 -6.271 1.00 30.04 C ATOM 845 CG2 ILE A 74 1.974 5.277 -4.058 1.00 31.95 C ATOM 846 CD1 ILE A 74 0.841 6.171 -6.746 1.00 35.26 C ATOM 0 H ILE A 74 -1.285 2.987 -4.818 1.00 26.56 H new ATOM 0 HA ILE A 74 1.627 2.607 -4.779 1.00 26.14 H new ATOM 0 HB ILE A 74 -0.117 5.068 -4.424 1.00 28.52 H new ATOM 0 HG12 ILE A 74 1.859 4.301 -6.602 1.00 30.04 H new ATOM 0 HG13 ILE A 74 0.118 4.163 -6.743 1.00 30.04 H new ATOM 0 HG21 ILE A 74 1.999 6.328 -4.345 1.00 31.95 H new ATOM 0 HG22 ILE A 74 1.854 5.199 -2.977 1.00 31.95 H new ATOM 0 HG23 ILE A 74 2.907 4.797 -4.355 1.00 31.95 H new ATOM 0 HD11 ILE A 74 0.926 6.200 -7.832 1.00 35.26 H new ATOM 0 HD12 ILE A 74 -0.113 6.604 -6.445 1.00 35.26 H new ATOM 0 HD13 ILE A 74 1.655 6.744 -6.303 1.00 35.26 H new ATOM 858 N ILE A 75 1.612 2.117 -2.337 1.00 25.23 N ATOM 859 CA ILE A 75 1.701 1.881 -0.910 1.00 23.84 C ATOM 860 C ILE A 75 2.837 2.692 -0.298 1.00 27.62 C ATOM 861 O ILE A 75 3.812 3.028 -0.971 1.00 28.33 O ATOM 862 CB ILE A 75 1.928 0.380 -0.608 1.00 26.16 C ATOM 863 CG1 ILE A 75 0.965 -0.493 -1.423 1.00 34.34 C ATOM 864 CG2 ILE A 75 1.773 0.097 0.879 1.00 27.19 C ATOM 865 CD1 ILE A 75 -0.500 -0.237 -1.136 1.00 41.17 C ATOM 0 H ILE A 75 2.272 1.576 -2.895 1.00 25.23 H new ATOM 0 HA ILE A 75 0.755 2.194 -0.468 1.00 23.84 H new ATOM 0 HB ILE A 75 2.948 0.130 -0.900 1.00 26.16 H new ATOM 0 HG12 ILE A 75 1.150 -0.326 -2.484 1.00 34.34 H new ATOM 0 HG13 ILE A 75 1.185 -1.542 -1.223 1.00 34.34 H new ATOM 0 HG21 ILE A 75 1.937 -0.964 1.066 1.00 27.19 H new ATOM 0 HG22 ILE A 75 2.503 0.682 1.439 1.00 27.19 H new ATOM 0 HG23 ILE A 75 0.767 0.371 1.199 1.00 27.19 H new ATOM 0 HD11 ILE A 75 -1.112 -0.895 -1.753 1.00 41.17 H new ATOM 0 HD12 ILE A 75 -0.704 -0.433 -0.083 1.00 41.17 H new ATOM 0 HD13 ILE A 75 -0.739 0.802 -1.365 1.00 41.17 H new ATOM 877 N PHE A 76 2.684 3.018 0.972 1.00 27.22 N ATOM 878 CA PHE A 76 3.683 3.765 1.708 1.00 29.75 C ATOM 879 C PHE A 76 3.832 3.152 3.093 1.00 28.37 C ATOM 880 O PHE A 76 2.887 2.553 3.605 1.00 30.39 O ATOM 881 CB PHE A 76 3.282 5.239 1.817 1.00 28.99 C ATOM 882 CG PHE A 76 3.910 6.113 0.769 1.00 26.06 C ATOM 883 CD1 PHE A 76 5.198 6.600 0.938 1.00 26.47 C ATOM 884 CD2 PHE A 76 3.218 6.447 -0.383 1.00 29.04 C ATOM 885 CE1 PHE A 76 5.780 7.404 -0.019 1.00 27.65 C ATOM 886 CE2 PHE A 76 3.796 7.252 -1.342 1.00 30.38 C ATOM 887 CZ PHE A 76 5.079 7.730 -1.162 1.00 29.98 C ATOM 0 H PHE A 76 1.861 2.771 1.522 1.00 27.22 H new ATOM 0 HA PHE A 76 4.635 3.716 1.180 1.00 29.75 H new ATOM 0 HB2 PHE A 76 2.197 5.318 1.742 1.00 28.99 H new ATOM 0 HB3 PHE A 76 3.561 5.611 2.803 1.00 28.99 H new ATOM 0 HD1 PHE A 76 5.751 6.346 1.830 1.00 26.47 H new ATOM 0 HD2 PHE A 76 2.216 6.073 -0.532 1.00 29.04 H new ATOM 0 HE1 PHE A 76 6.783 7.778 0.126 1.00 27.65 H new ATOM 0 HE2 PHE A 76 3.245 7.509 -2.235 1.00 30.38 H new ATOM 0 HZ PHE A 76 5.533 8.358 -1.914 1.00 29.98 H new ATOM 897 N PRO A 77 5.023 3.253 3.700 1.00 29.47 N ATOM 898 CA PRO A 77 5.274 2.706 5.034 1.00 29.23 C ATOM 899 C PRO A 77 4.217 3.130 6.053 1.00 36.32 C ATOM 900 O PRO A 77 3.838 4.302 6.112 1.00 38.20 O ATOM 901 CB PRO A 77 6.640 3.288 5.397 1.00 29.39 C ATOM 902 CG PRO A 77 7.315 3.482 4.087 1.00 32.72 C ATOM 903 CD PRO A 77 6.230 3.881 3.128 1.00 31.35 C ATOM 0 HA PRO A 77 5.242 1.617 5.042 1.00 29.23 H new ATOM 0 HB2 PRO A 77 6.541 4.230 5.937 1.00 29.39 H new ATOM 0 HB3 PRO A 77 7.203 2.611 6.039 1.00 29.39 H new ATOM 0 HG2 PRO A 77 8.083 4.253 4.152 1.00 32.72 H new ATOM 0 HG3 PRO A 77 7.809 2.567 3.761 1.00 32.72 H new ATOM 0 HD2 PRO A 77 6.128 4.964 3.064 1.00 31.35 H new ATOM 0 HD3 PRO A 77 6.432 3.520 2.120 1.00 31.35 H new ATOM 911 N ASP A 78 3.732 2.150 6.823 1.00 37.07 N ATOM 912 CA ASP A 78 2.720 2.370 7.865 1.00 38.13 C ATOM 913 C ASP A 78 1.330 2.599 7.260 1.00 38.12 C ATOM 914 O ASP A 78 0.482 3.254 7.858 1.00 41.39 O ATOM 915 CB ASP A 78 3.120 3.547 8.777 1.00 44.12 C ATOM 916 CG ASP A 78 2.225 3.696 9.995 1.00 58.24 C ATOM 917 OD1 ASP A 78 2.120 2.731 10.786 1.00 68.01 O ATOM 918 OD2 ASP A 78 1.630 4.784 10.172 1.00 63.10 O ATOM 0 H ASP A 78 4.031 1.178 6.742 1.00 37.07 H new ATOM 0 HA ASP A 78 2.671 1.466 8.472 1.00 38.13 H new ATOM 0 HB2 ASP A 78 4.150 3.408 9.106 1.00 44.12 H new ATOM 0 HB3 ASP A 78 3.092 4.471 8.199 1.00 44.12 H new ATOM 923 N ASP A 79 1.086 2.054 6.073 1.00 32.78 N ATOM 924 CA ASP A 79 -0.222 2.219 5.436 1.00 31.87 C ATOM 925 C ASP A 79 -0.831 0.882 5.022 1.00 31.67 C ATOM 926 O ASP A 79 -1.885 0.844 4.389 1.00 31.28 O ATOM 927 CB ASP A 79 -0.128 3.135 4.218 1.00 30.43 C ATOM 928 CG ASP A 79 -1.294 4.102 4.130 1.00 37.99 C ATOM 929 OD1 ASP A 79 -2.449 3.688 4.388 1.00 32.65 O ATOM 930 OD2 ASP A 79 -1.050 5.285 3.820 1.00 39.45 O ATOM 0 H ASP A 79 1.759 1.504 5.539 1.00 32.78 H new ATOM 0 HA ASP A 79 -0.875 2.675 6.180 1.00 31.87 H new ATOM 0 HB2 ASP A 79 0.805 3.698 4.261 1.00 30.43 H new ATOM 0 HB3 ASP A 79 -0.093 2.529 3.313 1.00 30.43 H new ATOM 935 N CYS A 80 -0.188 -0.219 5.384 1.00 31.58 N ATOM 936 CA CYS A 80 -0.706 -1.534 5.023 1.00 30.94 C ATOM 937 C CYS A 80 -0.366 -2.591 6.063 1.00 28.98 C ATOM 938 O CYS A 80 0.697 -2.558 6.681 1.00 31.11 O ATOM 939 CB CYS A 80 -0.170 -1.963 3.660 1.00 31.93 C ATOM 940 SG CYS A 80 -1.010 -1.175 2.273 1.00 37.05 S ATOM 0 H CYS A 80 0.680 -0.231 5.919 1.00 31.58 H new ATOM 0 HA CYS A 80 -1.792 -1.447 4.979 1.00 30.94 H new ATOM 0 HB2 CYS A 80 0.894 -1.732 3.608 1.00 31.93 H new ATOM 0 HB3 CYS A 80 -0.266 -3.045 3.565 1.00 31.93 H new ATOM 0 HG CYS A 80 -2.288 -1.129 2.509 1.00 37.05 H new ATOM 946 N GLU A 81 -1.290 -3.519 6.254 1.00 25.38 N ATOM 947 CA GLU A 81 -1.118 -4.612 7.191 1.00 28.86 C ATOM 948 C GLU A 81 -1.702 -5.889 6.605 1.00 26.91 C ATOM 949 O GLU A 81 -2.888 -5.947 6.277 1.00 29.90 O ATOM 950 CB GLU A 81 -1.800 -4.297 8.520 1.00 32.62 C ATOM 951 CG GLU A 81 -0.907 -3.576 9.512 1.00 41.20 C ATOM 952 CD GLU A 81 -1.552 -3.442 10.871 1.00 46.74 C ATOM 953 OE1 GLU A 81 -2.036 -4.463 11.408 1.00 59.83 O ATOM 954 OE2 GLU A 81 -1.589 -2.315 11.407 1.00 54.12 O ATOM 0 H GLU A 81 -2.183 -3.533 5.761 1.00 25.38 H new ATOM 0 HA GLU A 81 -0.052 -4.748 7.372 1.00 28.86 H new ATOM 0 HB2 GLU A 81 -2.682 -3.686 8.329 1.00 32.62 H new ATOM 0 HB3 GLU A 81 -2.148 -5.228 8.968 1.00 32.62 H new ATOM 0 HG2 GLU A 81 0.034 -4.117 9.611 1.00 41.20 H new ATOM 0 HG3 GLU A 81 -0.666 -2.585 9.127 1.00 41.20 H new ATOM 961 N PHE A 82 -0.867 -6.905 6.457 1.00 27.17 N ATOM 962 CA PHE A 82 -1.316 -8.174 5.909 1.00 24.89 C ATOM 963 C PHE A 82 -1.899 -9.049 7.010 1.00 26.35 C ATOM 964 O PHE A 82 -1.268 -9.262 8.045 1.00 28.01 O ATOM 965 CB PHE A 82 -0.161 -8.902 5.219 1.00 24.82 C ATOM 966 CG PHE A 82 -0.510 -9.439 3.856 1.00 26.08 C ATOM 967 CD1 PHE A 82 -1.818 -9.774 3.529 1.00 26.96 C ATOM 968 CD2 PHE A 82 0.476 -9.609 2.900 1.00 25.08 C ATOM 969 CE1 PHE A 82 -2.131 -10.263 2.275 1.00 25.16 C ATOM 970 CE2 PHE A 82 0.167 -10.099 1.644 1.00 24.61 C ATOM 971 CZ PHE A 82 -1.136 -10.426 1.331 1.00 23.81 C ATOM 0 H PHE A 82 0.121 -6.876 6.708 1.00 27.17 H new ATOM 0 HA PHE A 82 -2.091 -7.972 5.170 1.00 24.89 H new ATOM 0 HB2 PHE A 82 0.683 -8.218 5.125 1.00 24.82 H new ATOM 0 HB3 PHE A 82 0.166 -9.727 5.852 1.00 24.82 H new ATOM 0 HD1 PHE A 82 -2.600 -9.651 4.264 1.00 26.96 H new ATOM 0 HD2 PHE A 82 1.499 -9.356 3.137 1.00 25.08 H new ATOM 0 HE1 PHE A 82 -3.152 -10.517 2.033 1.00 25.16 H new ATOM 0 HE2 PHE A 82 0.947 -10.226 0.908 1.00 24.61 H new ATOM 0 HZ PHE A 82 -1.378 -10.808 0.350 1.00 23.81 H new ATOM 981 N LYS A 83 -3.109 -9.532 6.787 1.00 25.24 N ATOM 982 CA LYS A 83 -3.788 -10.390 7.745 1.00 27.67 C ATOM 983 C LYS A 83 -4.387 -11.589 7.011 1.00 24.72 C ATOM 984 O LYS A 83 -4.452 -11.592 5.784 1.00 26.15 O ATOM 985 CB LYS A 83 -4.880 -9.600 8.475 1.00 34.55 C ATOM 986 CG LYS A 83 -4.821 -9.709 9.993 1.00 49.96 C ATOM 987 CD LYS A 83 -3.512 -9.173 10.562 1.00 44.98 C ATOM 988 CE LYS A 83 -3.355 -7.677 10.322 1.00 55.29 C ATOM 989 NZ LYS A 83 -2.158 -7.131 11.017 1.00 57.71 N ATOM 0 H LYS A 83 -3.647 -9.342 5.941 1.00 25.24 H new ATOM 0 HA LYS A 83 -3.075 -10.749 8.487 1.00 27.67 H new ATOM 0 HB2 LYS A 83 -4.802 -8.550 8.194 1.00 34.55 H new ATOM 0 HB3 LYS A 83 -5.855 -9.950 8.135 1.00 34.55 H new ATOM 0 HG2 LYS A 83 -5.656 -9.158 10.427 1.00 49.96 H new ATOM 0 HG3 LYS A 83 -4.941 -10.752 10.285 1.00 49.96 H new ATOM 0 HD2 LYS A 83 -3.473 -9.374 11.633 1.00 44.98 H new ATOM 0 HD3 LYS A 83 -2.675 -9.703 10.107 1.00 44.98 H new ATOM 0 HE2 LYS A 83 -3.273 -7.487 9.252 1.00 55.29 H new ATOM 0 HE3 LYS A 83 -4.247 -7.157 10.671 1.00 55.29 H new ATOM 0 HZ1 LYS A 83 -2.226 -6.094 11.063 1.00 57.71 H new ATOM 0 HZ2 LYS A 83 -2.110 -7.518 11.981 1.00 57.71 H new ATOM 0 HZ3 LYS A 83 -1.300 -7.399 10.493 1.00 57.71 H new ATOM 1003 N ARG A 84 -4.805 -12.609 7.746 1.00 26.20 N ATOM 1004 CA ARG A 84 -5.397 -13.789 7.124 1.00 24.84 C ATOM 1005 C ARG A 84 -6.866 -13.909 7.506 1.00 26.43 C ATOM 1006 O ARG A 84 -7.295 -13.370 8.527 1.00 28.19 O ATOM 1007 CB ARG A 84 -4.641 -15.059 7.528 1.00 27.68 C ATOM 1008 CG ARG A 84 -4.964 -16.259 6.649 1.00 30.59 C ATOM 1009 CD ARG A 84 -4.153 -17.487 7.033 1.00 38.05 C ATOM 1010 NE ARG A 84 -4.597 -18.074 8.296 1.00 45.74 N ATOM 1011 CZ ARG A 84 -4.732 -19.385 8.505 1.00 54.89 C ATOM 1012 NH1 ARG A 84 -4.462 -20.250 7.534 1.00 55.75 N ATOM 1013 NH2 ARG A 84 -5.132 -19.831 9.690 1.00 51.71 N ATOM 0 H ARG A 84 -4.747 -12.646 8.764 1.00 26.20 H new ATOM 0 HA ARG A 84 -5.321 -13.675 6.043 1.00 24.84 H new ATOM 0 HB2 ARG A 84 -3.569 -14.864 7.485 1.00 27.68 H new ATOM 0 HB3 ARG A 84 -4.880 -15.301 8.564 1.00 27.68 H new ATOM 0 HG2 ARG A 84 -6.027 -16.489 6.727 1.00 30.59 H new ATOM 0 HG3 ARG A 84 -4.768 -16.007 5.607 1.00 30.59 H new ATOM 0 HD2 ARG A 84 -4.230 -18.233 6.242 1.00 38.05 H new ATOM 0 HD3 ARG A 84 -3.101 -17.214 7.112 1.00 38.05 H new ATOM 0 HE ARG A 84 -4.817 -17.442 9.066 1.00 45.74 H new ATOM 0 HH11 ARG A 84 -4.150 -19.913 6.623 1.00 55.75 H new ATOM 0 HH12 ARG A 84 -4.567 -21.251 7.699 1.00 55.75 H new ATOM 0 HH21 ARG A 84 -5.336 -19.171 10.441 1.00 51.71 H new ATOM 0 HH22 ARG A 84 -5.235 -20.833 9.849 1.00 51.71 H new ATOM 1027 N VAL A 85 -7.636 -14.601 6.676 1.00 26.80 N ATOM 1028 CA VAL A 85 -9.053 -14.802 6.929 1.00 28.35 C ATOM 1029 C VAL A 85 -9.300 -16.221 7.444 1.00 26.05 C ATOM 1030 O VAL A 85 -9.371 -17.170 6.662 1.00 30.08 O ATOM 1031 CB VAL A 85 -9.895 -14.562 5.657 1.00 28.02 C ATOM 1032 CG1 VAL A 85 -11.383 -14.636 5.972 1.00 31.09 C ATOM 1033 CG2 VAL A 85 -9.543 -13.221 5.031 1.00 26.97 C ATOM 0 H VAL A 85 -7.298 -15.034 5.817 1.00 26.80 H new ATOM 0 HA VAL A 85 -9.359 -14.078 7.684 1.00 28.35 H new ATOM 0 HB VAL A 85 -9.662 -15.348 4.939 1.00 28.02 H new ATOM 0 HG11 VAL A 85 -11.957 -14.464 5.061 1.00 31.09 H new ATOM 0 HG12 VAL A 85 -11.622 -15.622 6.371 1.00 31.09 H new ATOM 0 HG13 VAL A 85 -11.637 -13.875 6.710 1.00 31.09 H new ATOM 0 HG21 VAL A 85 -10.146 -13.068 4.136 1.00 26.97 H new ATOM 0 HG22 VAL A 85 -9.744 -12.422 5.745 1.00 26.97 H new ATOM 0 HG23 VAL A 85 -8.486 -13.211 4.763 1.00 26.97 H new ATOM 1043 N PRO A 86 -9.439 -16.388 8.770 1.00 32.41 N ATOM 1044 CA PRO A 86 -9.666 -17.699 9.384 1.00 33.92 C ATOM 1045 C PRO A 86 -11.111 -18.172 9.238 1.00 37.33 C ATOM 1046 O PRO A 86 -11.484 -19.242 9.721 1.00 42.97 O ATOM 1047 CB PRO A 86 -9.325 -17.456 10.853 1.00 38.12 C ATOM 1048 CG PRO A 86 -9.646 -16.019 11.082 1.00 38.96 C ATOM 1049 CD PRO A 86 -9.384 -15.310 9.780 1.00 35.71 C ATOM 0 HA PRO A 86 -9.069 -18.481 8.914 1.00 33.92 H new ATOM 0 HB2 PRO A 86 -9.910 -18.102 11.508 1.00 38.12 H new ATOM 0 HB3 PRO A 86 -8.274 -17.664 11.056 1.00 38.12 H new ATOM 0 HG2 PRO A 86 -10.685 -15.898 11.388 1.00 38.96 H new ATOM 0 HG3 PRO A 86 -9.029 -15.606 11.880 1.00 38.96 H new ATOM 0 HD2 PRO A 86 -10.133 -14.542 9.586 1.00 35.71 H new ATOM 0 HD3 PRO A 86 -8.413 -14.815 9.783 1.00 35.71 H new ATOM 1057 N GLN A 87 -11.925 -17.359 8.579 1.00 34.50 N ATOM 1058 CA GLN A 87 -13.322 -17.697 8.353 1.00 34.12 C ATOM 1059 C GLN A 87 -13.468 -18.496 7.065 1.00 32.97 C ATOM 1060 O GLN A 87 -14.497 -19.123 6.821 1.00 29.14 O ATOM 1061 CB GLN A 87 -14.180 -16.434 8.295 1.00 35.26 C ATOM 1062 CG GLN A 87 -14.189 -15.645 9.595 1.00 42.92 C ATOM 1063 CD GLN A 87 -14.623 -16.483 10.783 1.00 54.68 C ATOM 1064 OE1 GLN A 87 -15.436 -17.399 10.652 1.00 53.82 O ATOM 1065 NE2 GLN A 87 -14.080 -16.184 11.952 1.00 56.31 N ATOM 0 H GLN A 87 -11.641 -16.459 8.191 1.00 34.50 H new ATOM 0 HA GLN A 87 -13.668 -18.308 9.186 1.00 34.12 H new ATOM 0 HB2 GLN A 87 -13.814 -15.793 7.493 1.00 35.26 H new ATOM 0 HB3 GLN A 87 -15.203 -16.711 8.041 1.00 35.26 H new ATOM 0 HG2 GLN A 87 -13.192 -15.247 9.781 1.00 42.92 H new ATOM 0 HG3 GLN A 87 -14.859 -14.791 9.493 1.00 42.92 H new ATOM 0 HE21 GLN A 87 -13.410 -15.418 12.022 1.00 56.31 H new ATOM 0 HE22 GLN A 87 -14.331 -16.719 12.783 1.00 56.31 H new ATOM 1074 N CYS A 88 -12.432 -18.466 6.245 1.00 30.59 N ATOM 1075 CA CYS A 88 -12.432 -19.193 4.988 1.00 30.96 C ATOM 1076 C CYS A 88 -11.824 -20.580 5.185 1.00 32.25 C ATOM 1077 O CYS A 88 -10.659 -20.696 5.570 1.00 33.41 O ATOM 1078 CB CYS A 88 -11.654 -18.414 3.927 1.00 32.19 C ATOM 1079 SG CYS A 88 -12.437 -16.857 3.437 1.00 39.96 S ATOM 0 H CYS A 88 -11.576 -17.943 6.429 1.00 30.59 H new ATOM 0 HA CYS A 88 -13.461 -19.309 4.647 1.00 30.96 H new ATOM 0 HB2 CYS A 88 -10.654 -18.203 4.306 1.00 32.19 H new ATOM 0 HB3 CYS A 88 -11.534 -19.042 3.044 1.00 32.19 H new ATOM 0 HG CYS A 88 -12.315 -16.695 2.153 1.00 39.96 H new ATOM 1085 N PRO A 89 -12.609 -21.645 4.929 1.00 33.30 N ATOM 1086 CA PRO A 89 -12.157 -23.041 5.086 1.00 32.59 C ATOM 1087 C PRO A 89 -10.892 -23.364 4.290 1.00 34.13 C ATOM 1088 O PRO A 89 -10.183 -24.322 4.599 1.00 38.31 O ATOM 1089 CB PRO A 89 -13.337 -23.859 4.555 1.00 37.71 C ATOM 1090 CG PRO A 89 -14.520 -22.966 4.696 1.00 38.21 C ATOM 1091 CD PRO A 89 -14.011 -21.570 4.481 1.00 32.90 C ATOM 0 HA PRO A 89 -11.891 -23.254 6.121 1.00 32.59 H new ATOM 0 HB2 PRO A 89 -13.182 -24.147 3.515 1.00 37.71 H new ATOM 0 HB3 PRO A 89 -13.467 -24.779 5.124 1.00 37.71 H new ATOM 0 HG2 PRO A 89 -15.289 -23.218 3.965 1.00 38.21 H new ATOM 0 HG3 PRO A 89 -14.972 -23.069 5.683 1.00 38.21 H new ATOM 0 HD2 PRO A 89 -14.083 -21.273 3.435 1.00 32.90 H new ATOM 0 HD3 PRO A 89 -14.579 -20.842 5.059 1.00 32.90 H new ATOM 1099 N SER A 90 -10.617 -22.567 3.266 1.00 34.04 N ATOM 1100 CA SER A 90 -9.443 -22.768 2.435 1.00 33.45 C ATOM 1101 C SER A 90 -8.162 -22.487 3.217 1.00 29.83 C ATOM 1102 O SER A 90 -7.177 -23.216 3.102 1.00 32.46 O ATOM 1103 CB SER A 90 -9.529 -21.860 1.214 1.00 33.88 C ATOM 1104 OG SER A 90 -10.213 -20.660 1.533 1.00 33.97 O ATOM 0 H SER A 90 -11.195 -21.773 2.992 1.00 34.04 H new ATOM 0 HA SER A 90 -9.414 -23.809 2.114 1.00 33.45 H new ATOM 0 HB2 SER A 90 -8.526 -21.629 0.854 1.00 33.88 H new ATOM 0 HB3 SER A 90 -10.047 -22.376 0.406 1.00 33.88 H new ATOM 0 HG SER A 90 -10.399 -20.161 0.710 1.00 33.97 H new ATOM 1110 N GLY A 91 -8.179 -21.417 4.005 1.00 27.54 N ATOM 1111 CA GLY A 91 -7.022 -21.053 4.802 1.00 29.96 C ATOM 1112 C GLY A 91 -5.958 -20.317 4.009 1.00 31.42 C ATOM 1113 O GLY A 91 -5.021 -19.769 4.586 1.00 34.09 O ATOM 0 H GLY A 91 -8.979 -20.792 4.106 1.00 27.54 H new ATOM 0 HA2 GLY A 91 -7.344 -20.427 5.634 1.00 29.96 H new ATOM 0 HA3 GLY A 91 -6.587 -21.955 5.232 1.00 29.96 H new ATOM 1117 N ARG A 92 -6.105 -20.297 2.688 1.00 27.65 N ATOM 1118 CA ARG A 92 -5.140 -19.626 1.818 1.00 24.26 C ATOM 1119 C ARG A 92 -5.608 -18.214 1.490 1.00 23.50 C ATOM 1120 O ARG A 92 -4.965 -17.499 0.723 1.00 23.58 O ATOM 1121 CB ARG A 92 -4.948 -20.407 0.510 1.00 28.75 C ATOM 1122 CG ARG A 92 -4.820 -21.911 0.690 1.00 30.87 C ATOM 1123 CD ARG A 92 -3.566 -22.293 1.462 1.00 25.34 C ATOM 1124 NE ARG A 92 -2.331 -21.855 0.801 1.00 25.37 N ATOM 1125 CZ ARG A 92 -1.838 -22.392 -0.319 1.00 27.61 C ATOM 1126 NH1 ARG A 92 -2.505 -23.347 -0.959 1.00 30.43 N ATOM 1127 NH2 ARG A 92 -0.665 -21.981 -0.789 1.00 28.83 N ATOM 0 H ARG A 92 -6.882 -20.737 2.195 1.00 27.65 H new ATOM 0 HA ARG A 92 -4.190 -19.580 2.351 1.00 24.26 H new ATOM 0 HB2 ARG A 92 -5.792 -20.203 -0.148 1.00 28.75 H new ATOM 0 HB3 ARG A 92 -4.055 -20.036 0.007 1.00 28.75 H new ATOM 0 HG2 ARG A 92 -5.697 -22.288 1.216 1.00 30.87 H new ATOM 0 HG3 ARG A 92 -4.803 -22.392 -0.288 1.00 30.87 H new ATOM 0 HD2 ARG A 92 -3.613 -21.856 2.459 1.00 25.34 H new ATOM 0 HD3 ARG A 92 -3.540 -23.375 1.589 1.00 25.34 H new ATOM 0 HE ARG A 92 -1.812 -21.087 1.226 1.00 25.37 H new ATOM 0 HH11 ARG A 92 -3.400 -23.675 -0.596 1.00 30.43 H new ATOM 0 HH12 ARG A 92 -2.122 -23.752 -1.813 1.00 30.43 H new ATOM 0 HH21 ARG A 92 -0.143 -21.257 -0.295 1.00 28.83 H new ATOM 0 HH22 ARG A 92 -0.287 -22.389 -1.644 1.00 28.83 H new ATOM 1141 N VAL A 93 -6.735 -17.828 2.072 1.00 22.88 N ATOM 1142 CA VAL A 93 -7.304 -16.509 1.834 1.00 22.13 C ATOM 1143 C VAL A 93 -6.715 -15.480 2.788 1.00 21.42 C ATOM 1144 O VAL A 93 -6.855 -15.590 4.011 1.00 22.34 O ATOM 1145 CB VAL A 93 -8.842 -16.515 1.972 1.00 22.65 C ATOM 1146 CG1 VAL A 93 -9.419 -15.125 1.729 1.00 22.64 C ATOM 1147 CG2 VAL A 93 -9.452 -17.522 1.013 1.00 26.59 C ATOM 0 H VAL A 93 -7.274 -18.410 2.713 1.00 22.88 H new ATOM 0 HA VAL A 93 -7.050 -16.237 0.810 1.00 22.13 H new ATOM 0 HB VAL A 93 -9.092 -16.808 2.992 1.00 22.65 H new ATOM 0 HG11 VAL A 93 -10.504 -15.158 1.832 1.00 22.64 H new ATOM 0 HG12 VAL A 93 -9.006 -14.427 2.458 1.00 22.64 H new ATOM 0 HG13 VAL A 93 -9.160 -14.794 0.723 1.00 22.64 H new ATOM 0 HG21 VAL A 93 -10.537 -17.516 1.121 1.00 26.59 H new ATOM 0 HG22 VAL A 93 -9.187 -17.256 -0.010 1.00 26.59 H new ATOM 0 HG23 VAL A 93 -9.070 -18.518 1.240 1.00 26.59 H new ATOM 1157 N TYR A 94 -6.050 -14.493 2.219 1.00 22.73 N ATOM 1158 CA TYR A 94 -5.437 -13.431 2.991 1.00 22.99 C ATOM 1159 C TYR A 94 -6.126 -12.108 2.699 1.00 26.07 C ATOM 1160 O TYR A 94 -6.730 -11.932 1.637 1.00 23.44 O ATOM 1161 CB TYR A 94 -3.946 -13.332 2.673 1.00 21.02 C ATOM 1162 CG TYR A 94 -3.117 -14.404 3.339 1.00 22.31 C ATOM 1163 CD1 TYR A 94 -2.881 -15.624 2.714 1.00 25.65 C ATOM 1164 CD2 TYR A 94 -2.572 -14.197 4.599 1.00 23.62 C ATOM 1165 CE1 TYR A 94 -2.124 -16.603 3.327 1.00 22.18 C ATOM 1166 CE2 TYR A 94 -1.816 -15.171 5.218 1.00 23.29 C ATOM 1167 CZ TYR A 94 -1.592 -16.371 4.581 1.00 22.64 C ATOM 1168 OH TYR A 94 -0.838 -17.344 5.198 1.00 28.22 O ATOM 0 H TYR A 94 -5.920 -14.405 1.211 1.00 22.73 H new ATOM 0 HA TYR A 94 -5.550 -13.661 4.051 1.00 22.99 H new ATOM 0 HB2 TYR A 94 -3.808 -13.395 1.594 1.00 21.02 H new ATOM 0 HB3 TYR A 94 -3.580 -12.354 2.985 1.00 21.02 H new ATOM 0 HD1 TYR A 94 -3.296 -15.809 1.734 1.00 25.65 H new ATOM 0 HD2 TYR A 94 -2.743 -13.257 5.103 1.00 23.62 H new ATOM 0 HE1 TYR A 94 -1.949 -17.545 2.829 1.00 22.18 H new ATOM 0 HE2 TYR A 94 -1.401 -14.993 6.199 1.00 23.29 H new ATOM 0 HH TYR A 94 -0.287 -16.936 5.898 1.00 28.22 H new ATOM 1178 N VAL A 95 -6.037 -11.187 3.641 1.00 24.99 N ATOM 1179 CA VAL A 95 -6.656 -9.884 3.494 1.00 23.89 C ATOM 1180 C VAL A 95 -5.652 -8.765 3.772 1.00 23.26 C ATOM 1181 O VAL A 95 -4.992 -8.736 4.815 1.00 23.44 O ATOM 1182 CB VAL A 95 -7.895 -9.738 4.416 1.00 25.51 C ATOM 1183 CG1 VAL A 95 -7.553 -10.057 5.863 1.00 27.46 C ATOM 1184 CG2 VAL A 95 -8.496 -8.345 4.303 1.00 25.26 C ATOM 0 H VAL A 95 -5.539 -11.319 4.521 1.00 24.99 H new ATOM 0 HA VAL A 95 -6.992 -9.799 2.460 1.00 23.89 H new ATOM 0 HB VAL A 95 -8.638 -10.462 4.081 1.00 25.51 H new ATOM 0 HG11 VAL A 95 -8.444 -9.945 6.481 1.00 27.46 H new ATOM 0 HG12 VAL A 95 -7.190 -11.082 5.933 1.00 27.46 H new ATOM 0 HG13 VAL A 95 -6.780 -9.373 6.213 1.00 27.46 H new ATOM 0 HG21 VAL A 95 -9.363 -8.269 4.959 1.00 25.26 H new ATOM 0 HG22 VAL A 95 -7.753 -7.603 4.596 1.00 25.26 H new ATOM 0 HG23 VAL A 95 -8.803 -8.164 3.273 1.00 25.26 H new ATOM 1194 N LEU A 96 -5.510 -7.870 2.809 1.00 23.86 N ATOM 1195 CA LEU A 96 -4.612 -6.738 2.943 1.00 23.96 C ATOM 1196 C LEU A 96 -5.396 -5.534 3.444 1.00 23.08 C ATOM 1197 O LEU A 96 -6.215 -4.967 2.718 1.00 24.63 O ATOM 1198 CB LEU A 96 -3.939 -6.422 1.603 1.00 22.80 C ATOM 1199 CG LEU A 96 -2.967 -5.241 1.618 1.00 24.99 C ATOM 1200 CD1 LEU A 96 -1.763 -5.547 2.494 1.00 27.30 C ATOM 1201 CD2 LEU A 96 -2.529 -4.898 0.204 1.00 30.96 C ATOM 0 H LEU A 96 -6.009 -7.907 1.920 1.00 23.86 H new ATOM 0 HA LEU A 96 -3.829 -6.983 3.661 1.00 23.96 H new ATOM 0 HB2 LEU A 96 -3.401 -7.309 1.268 1.00 22.80 H new ATOM 0 HB3 LEU A 96 -4.715 -6.222 0.864 1.00 22.80 H new ATOM 0 HG LEU A 96 -3.481 -4.377 2.039 1.00 24.99 H new ATOM 0 HD11 LEU A 96 -1.084 -4.694 2.491 1.00 27.30 H new ATOM 0 HD12 LEU A 96 -2.095 -5.742 3.514 1.00 27.30 H new ATOM 0 HD13 LEU A 96 -1.245 -6.424 2.107 1.00 27.30 H new ATOM 0 HD21 LEU A 96 -1.838 -4.056 0.231 1.00 30.96 H new ATOM 0 HD22 LEU A 96 -2.033 -5.760 -0.243 1.00 30.96 H new ATOM 0 HD23 LEU A 96 -3.401 -4.632 -0.393 1.00 30.96 H new ATOM 1213 N LYS A 97 -5.169 -5.169 4.694 1.00 24.23 N ATOM 1214 CA LYS A 97 -5.864 -4.045 5.292 1.00 27.23 C ATOM 1215 C LYS A 97 -5.014 -2.787 5.222 1.00 29.52 C ATOM 1216 O LYS A 97 -3.876 -2.766 5.692 1.00 33.87 O ATOM 1217 CB LYS A 97 -6.220 -4.348 6.750 1.00 30.73 C ATOM 1218 CG LYS A 97 -6.894 -3.185 7.466 1.00 37.27 C ATOM 1219 CD LYS A 97 -6.633 -3.217 8.963 1.00 43.28 C ATOM 1220 CE LYS A 97 -7.074 -1.923 9.632 1.00 47.29 C ATOM 1221 NZ LYS A 97 -6.254 -0.758 9.197 1.00 53.53 N ATOM 0 H LYS A 97 -4.508 -5.636 5.314 1.00 24.23 H new ATOM 0 HA LYS A 97 -6.783 -3.880 4.729 1.00 27.23 H new ATOM 0 HB2 LYS A 97 -6.880 -5.215 6.782 1.00 30.73 H new ATOM 0 HB3 LYS A 97 -5.312 -4.619 7.289 1.00 30.73 H new ATOM 0 HG2 LYS A 97 -6.530 -2.244 7.054 1.00 37.27 H new ATOM 0 HG3 LYS A 97 -7.968 -3.219 7.283 1.00 37.27 H new ATOM 0 HD2 LYS A 97 -7.164 -4.058 9.408 1.00 43.28 H new ATOM 0 HD3 LYS A 97 -5.571 -3.379 9.145 1.00 43.28 H new ATOM 0 HE2 LYS A 97 -8.122 -1.735 9.400 1.00 47.29 H new ATOM 0 HE3 LYS A 97 -7.002 -2.032 10.714 1.00 47.29 H new ATOM 0 HZ1 LYS A 97 -6.460 0.059 9.807 1.00 53.53 H new ATOM 0 HZ2 LYS A 97 -5.245 -0.998 9.269 1.00 53.53 H new ATOM 0 HZ3 LYS A 97 -6.484 -0.520 8.211 1.00 53.53 H new ATOM 1235 N PHE A 98 -5.565 -1.748 4.623 1.00 28.54 N ATOM 1236 CA PHE A 98 -4.872 -0.478 4.519 1.00 32.00 C ATOM 1237 C PHE A 98 -5.118 0.314 5.794 1.00 41.30 C ATOM 1238 O PHE A 98 -6.133 0.108 6.468 1.00 40.71 O ATOM 1239 CB PHE A 98 -5.364 0.314 3.302 1.00 34.75 C ATOM 1240 CG PHE A 98 -5.214 -0.418 1.999 1.00 36.16 C ATOM 1241 CD1 PHE A 98 -4.035 -0.342 1.280 1.00 39.29 C ATOM 1242 CD2 PHE A 98 -6.254 -1.178 1.492 1.00 38.20 C ATOM 1243 CE1 PHE A 98 -3.895 -1.012 0.081 1.00 37.59 C ATOM 1244 CE2 PHE A 98 -6.121 -1.849 0.295 1.00 37.36 C ATOM 1245 CZ PHE A 98 -4.939 -1.765 -0.412 1.00 41.72 C ATOM 0 H PHE A 98 -6.493 -1.759 4.200 1.00 28.54 H new ATOM 0 HA PHE A 98 -3.805 -0.658 4.390 1.00 32.00 H new ATOM 0 HB2 PHE A 98 -6.414 0.568 3.446 1.00 34.75 H new ATOM 0 HB3 PHE A 98 -4.814 1.253 3.245 1.00 34.75 H new ATOM 0 HD1 PHE A 98 -3.215 0.248 1.661 1.00 39.29 H new ATOM 0 HD2 PHE A 98 -7.181 -1.246 2.041 1.00 38.20 H new ATOM 0 HE1 PHE A 98 -2.968 -0.946 -0.470 1.00 37.59 H new ATOM 0 HE2 PHE A 98 -6.940 -2.439 -0.089 1.00 37.36 H new ATOM 0 HZ PHE A 98 -4.832 -2.289 -1.350 1.00 41.72 H new ATOM 1255 N LYS A 99 -4.199 1.198 6.145 1.00 39.61 N ATOM 1256 CA LYS A 99 -4.369 2.001 7.345 1.00 51.59 C ATOM 1257 C LYS A 99 -5.266 3.187 7.035 1.00 53.57 C ATOM 1258 O LYS A 99 -6.245 3.440 7.739 1.00 58.09 O ATOM 1259 CB LYS A 99 -3.020 2.454 7.903 1.00 54.03 C ATOM 1260 CG LYS A 99 -2.120 1.294 8.309 1.00 57.71 C ATOM 1261 CD LYS A 99 -1.398 1.575 9.616 1.00 58.04 C ATOM 1262 CE LYS A 99 -0.376 0.496 9.941 1.00 58.77 C ATOM 1263 NZ LYS A 99 0.325 0.765 11.225 1.00 59.82 N ATOM 0 H LYS A 99 -3.340 1.377 5.625 1.00 39.61 H new ATOM 0 HA LYS A 99 -4.843 1.393 8.115 1.00 51.59 H new ATOM 0 HB2 LYS A 99 -2.508 3.058 7.154 1.00 54.03 H new ATOM 0 HB3 LYS A 99 -3.189 3.095 8.768 1.00 54.03 H new ATOM 0 HG2 LYS A 99 -2.717 0.388 8.411 1.00 57.71 H new ATOM 0 HG3 LYS A 99 -1.389 1.107 7.522 1.00 57.71 H new ATOM 0 HD2 LYS A 99 -0.899 2.542 9.555 1.00 58.04 H new ATOM 0 HD3 LYS A 99 -2.125 1.643 10.425 1.00 58.04 H new ATOM 0 HE2 LYS A 99 -0.875 -0.472 9.995 1.00 58.77 H new ATOM 0 HE3 LYS A 99 0.355 0.433 9.135 1.00 58.77 H new ATOM 0 HZ1 LYS A 99 1.025 0.016 11.402 1.00 59.82 H new ATOM 0 HZ2 LYS A 99 0.808 1.684 11.171 1.00 59.82 H new ATOM 0 HZ3 LYS A 99 -0.367 0.783 12.001 1.00 59.82 H new ATOM 1277 N ALA A 100 -4.942 3.899 5.967 1.00 57.45 N ATOM 1278 CA ALA A 100 -5.748 5.031 5.547 1.00 59.65 C ATOM 1279 C ALA A 100 -6.963 4.531 4.778 1.00 62.53 C ATOM 1280 O ALA A 100 -6.865 3.571 4.017 1.00 66.68 O ATOM 1281 CB ALA A 100 -4.933 5.979 4.685 1.00 58.23 C ATOM 0 H ALA A 100 -4.130 3.713 5.378 1.00 57.45 H new ATOM 0 HA ALA A 100 -6.079 5.577 6.430 1.00 59.65 H new ATOM 0 HB1 ALA A 100 -5.556 6.820 4.381 1.00 58.23 H new ATOM 0 HB2 ALA A 100 -4.080 6.346 5.255 1.00 58.23 H new ATOM 0 HB3 ALA A 100 -4.578 5.452 3.800 1.00 58.23 H new ATOM 1287 N GLY A 101 -8.113 5.148 5.002 1.00 63.08 N ATOM 1288 CA GLY A 101 -9.321 4.739 4.306 1.00 61.32 C ATOM 1289 C GLY A 101 -9.967 3.505 4.911 1.00 61.66 C ATOM 1290 O GLY A 101 -11.182 3.339 4.829 1.00 64.05 O ATOM 0 H GLY A 101 -8.234 5.924 5.652 1.00 63.08 H new ATOM 0 HA2 GLY A 101 -10.037 5.561 4.320 1.00 61.32 H new ATOM 0 HA3 GLY A 101 -9.082 4.542 3.261 1.00 61.32 H new ATOM 1294 N SER A 102 -9.144 2.643 5.509 1.00 58.97 N ATOM 1295 CA SER A 102 -9.610 1.413 6.146 1.00 58.40 C ATOM 1296 C SER A 102 -10.201 0.437 5.127 1.00 54.28 C ATOM 1297 O SER A 102 -11.200 -0.231 5.395 1.00 53.70 O ATOM 1298 CB SER A 102 -10.631 1.737 7.242 1.00 61.16 C ATOM 1299 OG SER A 102 -10.178 2.818 8.045 1.00 65.44 O ATOM 0 H SER A 102 -8.135 2.779 5.565 1.00 58.97 H new ATOM 0 HA SER A 102 -8.748 0.925 6.601 1.00 58.40 H new ATOM 0 HB2 SER A 102 -11.590 1.990 6.790 1.00 61.16 H new ATOM 0 HB3 SER A 102 -10.795 0.858 7.865 1.00 61.16 H new ATOM 0 HG SER A 102 -10.843 3.012 8.738 1.00 65.44 H new ATOM 1305 N LYS A 103 -9.576 0.352 3.957 1.00 42.18 N ATOM 1306 CA LYS A 103 -10.038 -0.560 2.917 1.00 39.27 C ATOM 1307 C LYS A 103 -9.316 -1.900 3.050 1.00 32.13 C ATOM 1308 O LYS A 103 -8.273 -1.985 3.703 1.00 30.46 O ATOM 1309 CB LYS A 103 -9.803 0.035 1.522 1.00 41.30 C ATOM 1310 CG LYS A 103 -10.484 -0.748 0.407 1.00 45.61 C ATOM 1311 CD LYS A 103 -10.028 -0.298 -0.970 1.00 48.56 C ATOM 1312 CE LYS A 103 -10.582 -1.209 -2.056 1.00 52.94 C ATOM 1313 NZ LYS A 103 -10.372 -0.653 -3.418 1.00 56.96 N ATOM 0 H LYS A 103 -8.753 0.900 3.706 1.00 42.18 H new ATOM 0 HA LYS A 103 -11.110 -0.715 3.041 1.00 39.27 H new ATOM 0 HB2 LYS A 103 -10.166 1.063 1.508 1.00 41.30 H new ATOM 0 HB3 LYS A 103 -8.731 0.073 1.327 1.00 41.30 H new ATOM 0 HG2 LYS A 103 -10.272 -1.810 0.529 1.00 45.61 H new ATOM 0 HG3 LYS A 103 -11.564 -0.627 0.488 1.00 45.61 H new ATOM 0 HD2 LYS A 103 -10.356 0.726 -1.148 1.00 48.56 H new ATOM 0 HD3 LYS A 103 -8.939 -0.296 -1.013 1.00 48.56 H new ATOM 0 HE2 LYS A 103 -10.104 -2.186 -1.987 1.00 52.94 H new ATOM 0 HE3 LYS A 103 -11.648 -1.363 -1.889 1.00 52.94 H new ATOM 0 HZ1 LYS A 103 -10.765 -1.307 -4.124 1.00 56.96 H new ATOM 0 HZ2 LYS A 103 -10.850 0.267 -3.495 1.00 56.96 H new ATOM 0 HZ3 LYS A 103 -9.354 -0.530 -3.589 1.00 56.96 H new ATOM 1327 N ARG A 104 -9.875 -2.942 2.447 1.00 31.79 N ATOM 1328 CA ARG A 104 -9.282 -4.269 2.506 1.00 29.38 C ATOM 1329 C ARG A 104 -9.294 -4.934 1.133 1.00 27.45 C ATOM 1330 O ARG A 104 -10.149 -4.639 0.300 1.00 30.91 O ATOM 1331 CB ARG A 104 -10.050 -5.148 3.494 1.00 29.71 C ATOM 1332 CG ARG A 104 -10.051 -4.626 4.921 1.00 34.22 C ATOM 1333 CD ARG A 104 -11.124 -5.307 5.752 1.00 37.47 C ATOM 1334 NE ARG A 104 -11.200 -4.766 7.108 1.00 40.87 N ATOM 1335 CZ ARG A 104 -12.112 -3.875 7.505 1.00 41.17 C ATOM 1336 NH1 ARG A 104 -13.003 -3.393 6.646 1.00 43.44 N ATOM 1337 NH2 ARG A 104 -12.126 -3.453 8.763 1.00 45.95 N ATOM 0 H ARG A 104 -10.741 -2.892 1.910 1.00 31.79 H new ATOM 0 HA ARG A 104 -8.249 -4.158 2.837 1.00 29.38 H new ATOM 0 HB2 ARG A 104 -11.081 -5.243 3.153 1.00 29.71 H new ATOM 0 HB3 ARG A 104 -9.618 -6.149 3.485 1.00 29.71 H new ATOM 0 HG2 ARG A 104 -9.074 -4.795 5.374 1.00 34.22 H new ATOM 0 HG3 ARG A 104 -10.219 -3.549 4.917 1.00 34.22 H new ATOM 0 HD2 ARG A 104 -12.090 -5.189 5.261 1.00 37.47 H new ATOM 0 HD3 ARG A 104 -10.919 -6.376 5.800 1.00 37.47 H new ATOM 0 HE ARG A 104 -10.515 -5.088 7.792 1.00 40.87 H new ATOM 0 HH11 ARG A 104 -12.994 -3.703 5.674 1.00 43.44 H new ATOM 0 HH12 ARG A 104 -13.696 -2.713 6.958 1.00 43.44 H new ATOM 0 HH21 ARG A 104 -11.440 -3.809 9.428 1.00 45.95 H new ATOM 0 HH22 ARG A 104 -12.823 -2.772 9.065 1.00 45.95 H new ATOM 1351 N LEU A 105 -8.327 -5.810 0.906 1.00 23.75 N ATOM 1352 CA LEU A 105 -8.226 -6.557 -0.343 1.00 24.35 C ATOM 1353 C LEU A 105 -8.079 -8.040 -0.024 1.00 24.13 C ATOM 1354 O LEU A 105 -7.413 -8.400 0.942 1.00 23.73 O ATOM 1355 CB LEU A 105 -7.033 -6.077 -1.177 1.00 25.87 C ATOM 1356 CG LEU A 105 -7.248 -4.777 -1.958 1.00 32.66 C ATOM 1357 CD1 LEU A 105 -5.993 -4.417 -2.739 1.00 35.05 C ATOM 1358 CD2 LEU A 105 -8.443 -4.906 -2.896 1.00 35.88 C ATOM 0 H LEU A 105 -7.591 -6.024 1.579 1.00 23.75 H new ATOM 0 HA LEU A 105 -9.130 -6.391 -0.928 1.00 24.35 H new ATOM 0 HB2 LEU A 105 -6.179 -5.943 -0.513 1.00 25.87 H new ATOM 0 HB3 LEU A 105 -6.767 -6.864 -1.883 1.00 25.87 H new ATOM 0 HG LEU A 105 -7.456 -3.977 -1.248 1.00 32.66 H new ATOM 0 HD11 LEU A 105 -6.160 -3.491 -3.289 1.00 35.05 H new ATOM 0 HD12 LEU A 105 -5.160 -4.283 -2.048 1.00 35.05 H new ATOM 0 HD13 LEU A 105 -5.758 -5.218 -3.440 1.00 35.05 H new ATOM 0 HD21 LEU A 105 -8.580 -3.972 -3.442 1.00 35.88 H new ATOM 0 HD22 LEU A 105 -8.265 -5.717 -3.602 1.00 35.88 H new ATOM 0 HD23 LEU A 105 -9.340 -5.121 -2.315 1.00 35.88 H new ATOM 1370 N PHE A 106 -8.693 -8.897 -0.824 1.00 21.94 N ATOM 1371 CA PHE A 106 -8.628 -10.332 -0.581 1.00 21.33 C ATOM 1372 C PHE A 106 -7.846 -11.045 -1.675 1.00 21.73 C ATOM 1373 O PHE A 106 -8.038 -10.780 -2.866 1.00 21.19 O ATOM 1374 CB PHE A 106 -10.039 -10.913 -0.481 1.00 22.93 C ATOM 1375 CG PHE A 106 -10.868 -10.303 0.614 1.00 22.29 C ATOM 1376 CD1 PHE A 106 -10.741 -10.742 1.922 1.00 23.36 C ATOM 1377 CD2 PHE A 106 -11.777 -9.293 0.337 1.00 24.62 C ATOM 1378 CE1 PHE A 106 -11.503 -10.185 2.931 1.00 24.37 C ATOM 1379 CE2 PHE A 106 -12.541 -8.733 1.341 1.00 25.44 C ATOM 1380 CZ PHE A 106 -12.404 -9.180 2.642 1.00 26.43 C ATOM 0 H PHE A 106 -9.239 -8.628 -1.642 1.00 21.94 H new ATOM 0 HA PHE A 106 -8.106 -10.489 0.363 1.00 21.33 H new ATOM 0 HB2 PHE A 106 -10.549 -10.770 -1.433 1.00 22.93 H new ATOM 0 HB3 PHE A 106 -9.969 -11.988 -0.315 1.00 22.93 H new ATOM 0 HD1 PHE A 106 -10.039 -11.528 2.155 1.00 23.36 H new ATOM 0 HD2 PHE A 106 -11.889 -8.940 -0.678 1.00 24.62 H new ATOM 0 HE1 PHE A 106 -11.394 -10.536 3.946 1.00 24.37 H new ATOM 0 HE2 PHE A 106 -13.245 -7.947 1.111 1.00 25.44 H new ATOM 0 HZ PHE A 106 -13.000 -8.744 3.430 1.00 26.43 H new ATOM 1390 N PHE A 107 -6.955 -11.938 -1.258 1.00 22.09 N ATOM 1391 CA PHE A 107 -6.130 -12.711 -2.180 1.00 20.70 C ATOM 1392 C PHE A 107 -6.000 -14.148 -1.685 1.00 23.14 C ATOM 1393 O PHE A 107 -5.957 -14.391 -0.479 1.00 23.83 O ATOM 1394 CB PHE A 107 -4.722 -12.105 -2.299 1.00 22.84 C ATOM 1395 CG PHE A 107 -4.682 -10.693 -2.812 1.00 24.08 C ATOM 1396 CD1 PHE A 107 -4.718 -10.438 -4.173 1.00 23.22 C ATOM 1397 CD2 PHE A 107 -4.595 -9.622 -1.936 1.00 23.74 C ATOM 1398 CE1 PHE A 107 -4.669 -9.144 -4.652 1.00 24.41 C ATOM 1399 CE2 PHE A 107 -4.548 -8.324 -2.409 1.00 23.14 C ATOM 1400 CZ PHE A 107 -4.585 -8.086 -3.768 1.00 23.57 C ATOM 0 H PHE A 107 -6.784 -12.146 -0.274 1.00 22.09 H new ATOM 0 HA PHE A 107 -6.614 -12.691 -3.157 1.00 20.70 H new ATOM 0 HB2 PHE A 107 -4.246 -12.134 -1.319 1.00 22.84 H new ATOM 0 HB3 PHE A 107 -4.127 -12.734 -2.961 1.00 22.84 H new ATOM 0 HD1 PHE A 107 -4.785 -11.262 -4.868 1.00 23.22 H new ATOM 0 HD2 PHE A 107 -4.564 -9.804 -0.872 1.00 23.74 H new ATOM 0 HE1 PHE A 107 -4.696 -8.959 -5.716 1.00 24.41 H new ATOM 0 HE2 PHE A 107 -4.482 -7.498 -1.717 1.00 23.14 H new ATOM 0 HZ PHE A 107 -4.548 -7.073 -4.140 1.00 23.57 H new ATOM 1410 N TRP A 108 -5.949 -15.101 -2.604 1.00 23.10 N ATOM 1411 CA TRP A 108 -5.786 -16.495 -2.225 1.00 21.46 C ATOM 1412 C TRP A 108 -4.510 -17.051 -2.853 1.00 22.39 C ATOM 1413 O TRP A 108 -4.317 -16.977 -4.069 1.00 23.19 O ATOM 1414 CB TRP A 108 -7.020 -17.342 -2.590 1.00 25.96 C ATOM 1415 CG TRP A 108 -7.379 -17.362 -4.051 1.00 24.14 C ATOM 1416 CD1 TRP A 108 -8.063 -16.406 -4.744 1.00 25.63 C ATOM 1417 CD2 TRP A 108 -7.096 -18.410 -4.987 1.00 26.30 C ATOM 1418 NE1 TRP A 108 -8.207 -16.787 -6.058 1.00 26.49 N ATOM 1419 CE2 TRP A 108 -7.625 -18.016 -6.229 1.00 25.85 C ATOM 1420 CE3 TRP A 108 -6.442 -19.641 -4.893 1.00 27.47 C ATOM 1421 CZ2 TRP A 108 -7.520 -18.811 -7.369 1.00 28.46 C ATOM 1422 CZ3 TRP A 108 -6.339 -20.430 -6.023 1.00 29.27 C ATOM 1423 CH2 TRP A 108 -6.874 -20.012 -7.246 1.00 28.29 C ATOM 0 H TRP A 108 -6.017 -14.936 -3.608 1.00 23.10 H new ATOM 0 HA TRP A 108 -5.694 -16.549 -1.140 1.00 21.46 H new ATOM 0 HB2 TRP A 108 -6.846 -18.367 -2.262 1.00 25.96 H new ATOM 0 HB3 TRP A 108 -7.876 -16.968 -2.028 1.00 25.96 H new ATOM 0 HD1 TRP A 108 -8.437 -15.485 -4.322 1.00 25.63 H new ATOM 0 HE1 TRP A 108 -8.671 -16.244 -6.786 1.00 26.49 H new ATOM 0 HE3 TRP A 108 -6.024 -19.970 -3.953 1.00 27.47 H new ATOM 0 HZ2 TRP A 108 -7.933 -18.492 -8.314 1.00 28.46 H new ATOM 0 HZ3 TRP A 108 -5.837 -21.384 -5.961 1.00 29.27 H new ATOM 0 HH2 TRP A 108 -6.775 -20.650 -8.112 1.00 28.29 H new ATOM 1434 N MET A 109 -3.629 -17.567 -2.005 1.00 22.47 N ATOM 1435 CA MET A 109 -2.343 -18.109 -2.442 1.00 22.63 C ATOM 1436 C MET A 109 -2.507 -19.223 -3.469 1.00 23.51 C ATOM 1437 O MET A 109 -3.273 -20.165 -3.265 1.00 25.87 O ATOM 1438 CB MET A 109 -1.549 -18.632 -1.243 1.00 22.83 C ATOM 1439 CG MET A 109 -1.153 -17.548 -0.254 1.00 24.26 C ATOM 1440 SD MET A 109 0.128 -16.448 -0.892 1.00 28.54 S ATOM 1441 CE MET A 109 0.183 -15.218 0.410 1.00 27.29 C ATOM 0 H MET A 109 -3.782 -17.623 -0.998 1.00 22.47 H new ATOM 0 HA MET A 109 -1.799 -17.293 -2.917 1.00 22.63 H new ATOM 0 HB2 MET A 109 -2.143 -19.385 -0.725 1.00 22.83 H new ATOM 0 HB3 MET A 109 -0.649 -19.129 -1.604 1.00 22.83 H new ATOM 0 HG2 MET A 109 -2.034 -16.960 0.005 1.00 24.26 H new ATOM 0 HG3 MET A 109 -0.799 -18.014 0.666 1.00 24.26 H new ATOM 0 HE1 MET A 109 0.942 -14.472 0.174 1.00 27.29 H new ATOM 0 HE2 MET A 109 -0.789 -14.732 0.493 1.00 27.29 H new ATOM 0 HE3 MET A 109 0.429 -15.700 1.356 1.00 27.29 H new ATOM 1451 N GLN A 110 -1.783 -19.104 -4.576 1.00 23.09 N ATOM 1452 CA GLN A 110 -1.819 -20.102 -5.635 1.00 24.00 C ATOM 1453 C GLN A 110 -0.560 -20.951 -5.572 1.00 32.58 C ATOM 1454 O GLN A 110 -0.347 -21.840 -6.398 1.00 41.60 O ATOM 1455 CB GLN A 110 -1.941 -19.440 -7.010 1.00 22.67 C ATOM 1456 CG GLN A 110 -3.323 -18.881 -7.290 1.00 25.04 C ATOM 1457 CD GLN A 110 -3.425 -18.197 -8.640 1.00 22.04 C ATOM 1458 OE1 GLN A 110 -2.446 -17.655 -9.156 1.00 24.50 O ATOM 1459 NE2 GLN A 110 -4.614 -18.213 -9.220 1.00 24.22 N ATOM 0 H GLN A 110 -1.159 -18.319 -4.763 1.00 23.09 H new ATOM 0 HA GLN A 110 -2.694 -20.735 -5.489 1.00 24.00 H new ATOM 0 HB2 GLN A 110 -1.210 -18.635 -7.083 1.00 22.67 H new ATOM 0 HB3 GLN A 110 -1.690 -20.170 -7.780 1.00 22.67 H new ATOM 0 HG2 GLN A 110 -4.052 -19.690 -7.243 1.00 25.04 H new ATOM 0 HG3 GLN A 110 -3.586 -18.169 -6.508 1.00 25.04 H new ATOM 0 HE21 GLN A 110 -5.400 -18.673 -8.760 1.00 24.22 H new ATOM 0 HE22 GLN A 110 -4.745 -17.766 -10.127 1.00 24.22 H new ATOM 1468 N GLU A 111 0.275 -20.654 -4.584 1.00 34.19 N ATOM 1469 CA GLU A 111 1.514 -21.381 -4.377 1.00 41.70 C ATOM 1470 C GLU A 111 1.204 -22.830 -4.014 1.00 40.45 C ATOM 1471 O GLU A 111 0.279 -23.100 -3.241 1.00 39.75 O ATOM 1472 CB GLU A 111 2.335 -20.709 -3.277 1.00 41.38 C ATOM 1473 CG GLU A 111 2.696 -19.266 -3.593 1.00 49.79 C ATOM 1474 CD GLU A 111 3.974 -19.145 -4.402 1.00 48.44 C ATOM 1475 OE1 GLU A 111 5.063 -19.284 -3.809 1.00 43.83 O ATOM 1476 OE2 GLU A 111 3.901 -18.891 -5.621 1.00 32.00 O ATOM 0 H GLU A 111 0.111 -19.907 -3.909 1.00 34.19 H new ATOM 0 HA GLU A 111 2.100 -21.371 -5.296 1.00 41.70 H new ATOM 0 HB2 GLU A 111 1.773 -20.740 -2.344 1.00 41.38 H new ATOM 0 HB3 GLU A 111 3.250 -21.279 -3.117 1.00 41.38 H new ATOM 0 HG2 GLU A 111 1.877 -18.803 -4.144 1.00 49.79 H new ATOM 0 HG3 GLU A 111 2.807 -18.711 -2.661 1.00 49.79 H new ATOM 1483 N PRO A 112 1.961 -23.777 -4.582 1.00 48.55 N ATOM 1484 CA PRO A 112 1.756 -25.212 -4.347 1.00 46.93 C ATOM 1485 C PRO A 112 2.060 -25.649 -2.915 1.00 45.48 C ATOM 1486 O PRO A 112 1.507 -26.639 -2.439 1.00 48.59 O ATOM 1487 CB PRO A 112 2.733 -25.877 -5.321 1.00 49.91 C ATOM 1488 CG PRO A 112 3.776 -24.849 -5.581 1.00 50.19 C ATOM 1489 CD PRO A 112 3.071 -23.525 -5.519 1.00 49.44 C ATOM 0 HA PRO A 112 0.712 -25.487 -4.498 1.00 46.93 H new ATOM 0 HB2 PRO A 112 3.167 -26.779 -4.890 1.00 49.91 H new ATOM 0 HB3 PRO A 112 2.232 -26.173 -6.243 1.00 49.91 H new ATOM 0 HG2 PRO A 112 4.572 -24.903 -4.838 1.00 50.19 H new ATOM 0 HG3 PRO A 112 4.239 -25.000 -6.556 1.00 50.19 H new ATOM 0 HD2 PRO A 112 3.730 -22.735 -5.159 1.00 49.44 H new ATOM 0 HD3 PRO A 112 2.708 -23.216 -6.499 1.00 49.44 H new ATOM 1497 N LYS A 113 2.925 -24.919 -2.226 1.00 45.43 N ATOM 1498 CA LYS A 113 3.285 -25.279 -0.863 1.00 45.69 C ATOM 1499 C LYS A 113 2.938 -24.172 0.122 1.00 44.46 C ATOM 1500 O LYS A 113 3.228 -22.999 -0.112 1.00 42.11 O ATOM 1501 CB LYS A 113 4.773 -25.614 -0.773 1.00 48.90 C ATOM 1502 CG LYS A 113 5.120 -26.967 -1.372 1.00 48.99 C ATOM 1503 CD LYS A 113 6.537 -27.385 -1.032 1.00 65.37 C ATOM 1504 CE LYS A 113 6.842 -28.780 -1.549 1.00 71.52 C ATOM 1505 NZ LYS A 113 8.239 -29.189 -1.253 1.00 69.62 N ATOM 0 H LYS A 113 3.386 -24.083 -2.584 1.00 45.43 H new ATOM 0 HA LYS A 113 2.703 -26.161 -0.594 1.00 45.69 H new ATOM 0 HB2 LYS A 113 5.345 -24.840 -1.285 1.00 48.90 H new ATOM 0 HB3 LYS A 113 5.080 -25.598 0.273 1.00 48.90 H new ATOM 0 HG2 LYS A 113 4.421 -27.718 -1.004 1.00 48.99 H new ATOM 0 HG3 LYS A 113 5.003 -26.926 -2.455 1.00 48.99 H new ATOM 0 HD2 LYS A 113 7.241 -26.673 -1.463 1.00 65.37 H new ATOM 0 HD3 LYS A 113 6.677 -27.357 0.049 1.00 65.37 H new ATOM 0 HE2 LYS A 113 6.152 -29.493 -1.098 1.00 71.52 H new ATOM 0 HE3 LYS A 113 6.675 -28.812 -2.626 1.00 71.52 H new ATOM 0 HZ1 LYS A 113 8.406 -30.147 -1.622 1.00 69.62 H new ATOM 0 HZ2 LYS A 113 8.899 -28.524 -1.705 1.00 69.62 H new ATOM 0 HZ3 LYS A 113 8.392 -29.183 -0.224 1.00 69.62 H new ATOM 1519 N THR A 114 2.333 -24.566 1.231 1.00 40.64 N ATOM 1520 CA THR A 114 1.928 -23.638 2.274 1.00 36.42 C ATOM 1521 C THR A 114 3.104 -23.264 3.170 1.00 31.64 C ATOM 1522 O THR A 114 2.983 -22.416 4.053 1.00 32.89 O ATOM 1523 CB THR A 114 0.833 -24.267 3.146 1.00 39.21 C ATOM 1524 OG1 THR A 114 0.977 -25.695 3.135 1.00 43.02 O ATOM 1525 CG2 THR A 114 -0.551 -23.893 2.650 1.00 38.60 C ATOM 0 H THR A 114 2.109 -25.540 1.433 1.00 40.64 H new ATOM 0 HA THR A 114 1.552 -22.740 1.784 1.00 36.42 H new ATOM 0 HB THR A 114 0.944 -23.886 4.161 1.00 39.21 H new ATOM 0 HG1 THR A 114 0.280 -26.098 3.693 1.00 43.02 H new ATOM 0 HG21 THR A 114 -1.304 -24.355 3.289 1.00 38.60 H new ATOM 0 HG22 THR A 114 -0.667 -22.810 2.677 1.00 38.60 H new ATOM 0 HG23 THR A 114 -0.678 -24.246 1.627 1.00 38.60 H new ATOM 1533 N ASP A 115 4.245 -23.894 2.927 1.00 30.92 N ATOM 1534 CA ASP A 115 5.450 -23.657 3.721 1.00 38.80 C ATOM 1535 C ASP A 115 6.017 -22.259 3.483 1.00 35.23 C ATOM 1536 O ASP A 115 6.907 -21.811 4.207 1.00 36.70 O ATOM 1537 CB ASP A 115 6.511 -24.717 3.412 1.00 44.02 C ATOM 1538 CG ASP A 115 6.133 -26.080 3.954 1.00 54.03 C ATOM 1539 OD1 ASP A 115 5.462 -26.849 3.235 1.00 54.30 O ATOM 1540 OD2 ASP A 115 6.501 -26.389 5.107 1.00 66.15 O ATOM 0 H ASP A 115 4.365 -24.579 2.181 1.00 30.92 H new ATOM 0 HA ASP A 115 5.170 -23.728 4.772 1.00 38.80 H new ATOM 0 HB2 ASP A 115 6.652 -24.783 2.333 1.00 44.02 H new ATOM 0 HB3 ASP A 115 7.465 -24.409 3.840 1.00 44.02 H new ATOM 1545 N GLN A 116 5.504 -21.572 2.470 1.00 32.65 N ATOM 1546 CA GLN A 116 5.960 -20.221 2.158 1.00 32.85 C ATOM 1547 C GLN A 116 4.802 -19.228 2.187 1.00 25.51 C ATOM 1548 O GLN A 116 4.981 -18.049 1.887 1.00 27.64 O ATOM 1549 CB GLN A 116 6.637 -20.184 0.788 1.00 36.33 C ATOM 1550 CG GLN A 116 8.094 -20.609 0.816 1.00 43.53 C ATOM 1551 CD GLN A 116 8.772 -20.448 -0.529 1.00 46.84 C ATOM 1552 OE1 GLN A 116 8.400 -19.587 -1.330 1.00 54.73 O ATOM 1553 NE2 GLN A 116 9.765 -21.280 -0.788 1.00 50.07 N ATOM 0 H GLN A 116 4.774 -21.926 1.851 1.00 32.65 H new ATOM 0 HA GLN A 116 6.683 -19.933 2.921 1.00 32.85 H new ATOM 0 HB2 GLN A 116 6.091 -20.835 0.105 1.00 36.33 H new ATOM 0 HB3 GLN A 116 6.570 -19.173 0.387 1.00 36.33 H new ATOM 0 HG2 GLN A 116 8.627 -20.018 1.561 1.00 43.53 H new ATOM 0 HG3 GLN A 116 8.159 -21.651 1.130 1.00 43.53 H new ATOM 0 HE21 GLN A 116 10.040 -21.977 -0.096 1.00 50.07 H new ATOM 0 HE22 GLN A 116 10.257 -21.225 -1.680 1.00 50.07 H new ATOM 1562 N ASP A 117 3.625 -19.711 2.567 1.00 25.38 N ATOM 1563 CA ASP A 117 2.420 -18.876 2.634 1.00 24.59 C ATOM 1564 C ASP A 117 2.629 -17.679 3.557 1.00 23.14 C ATOM 1565 O ASP A 117 2.471 -16.524 3.150 1.00 23.30 O ATOM 1566 CB ASP A 117 1.229 -19.701 3.129 1.00 24.94 C ATOM 1567 CG ASP A 117 0.287 -20.117 2.011 1.00 26.91 C ATOM 1568 OD1 ASP A 117 0.769 -20.545 0.943 1.00 27.07 O ATOM 1569 OD2 ASP A 117 -0.945 -20.035 2.207 1.00 29.31 O ATOM 0 H ASP A 117 3.474 -20.683 2.836 1.00 25.38 H new ATOM 0 HA ASP A 117 2.215 -18.508 1.629 1.00 24.59 H new ATOM 0 HB2 ASP A 117 1.598 -20.593 3.636 1.00 24.94 H new ATOM 0 HB3 ASP A 117 0.674 -19.121 3.867 1.00 24.94 H new ATOM 1574 N GLU A 118 3.001 -17.961 4.796 1.00 27.03 N ATOM 1575 CA GLU A 118 3.240 -16.917 5.782 1.00 26.55 C ATOM 1576 C GLU A 118 4.476 -16.105 5.413 1.00 23.71 C ATOM 1577 O GLU A 118 4.501 -14.887 5.585 1.00 25.11 O ATOM 1578 CB GLU A 118 3.418 -17.533 7.169 1.00 32.75 C ATOM 1579 CG GLU A 118 2.170 -18.213 7.704 1.00 36.67 C ATOM 1580 CD GLU A 118 1.165 -17.227 8.261 1.00 51.49 C ATOM 1581 OE1 GLU A 118 1.361 -16.756 9.399 1.00 61.12 O ATOM 1582 OE2 GLU A 118 0.174 -16.917 7.567 1.00 49.04 O ATOM 0 H GLU A 118 3.145 -18.909 5.144 1.00 27.03 H new ATOM 0 HA GLU A 118 2.376 -16.252 5.795 1.00 26.55 H new ATOM 0 HB2 GLU A 118 4.229 -18.261 7.132 1.00 32.75 H new ATOM 0 HB3 GLU A 118 3.722 -16.752 7.866 1.00 32.75 H new ATOM 0 HG2 GLU A 118 1.704 -18.790 6.905 1.00 36.67 H new ATOM 0 HG3 GLU A 118 2.452 -18.920 8.485 1.00 36.67 H new ATOM 1589 N GLU A 119 5.491 -16.793 4.898 1.00 24.14 N ATOM 1590 CA GLU A 119 6.738 -16.155 4.493 1.00 26.98 C ATOM 1591 C GLU A 119 6.478 -15.044 3.478 1.00 25.13 C ATOM 1592 O GLU A 119 7.041 -13.953 3.576 1.00 27.83 O ATOM 1593 CB GLU A 119 7.691 -17.197 3.905 1.00 28.20 C ATOM 1594 CG GLU A 119 9.081 -16.663 3.611 1.00 27.24 C ATOM 1595 CD GLU A 119 9.783 -16.141 4.848 1.00 28.47 C ATOM 1596 OE1 GLU A 119 9.655 -16.765 5.923 1.00 27.86 O ATOM 1597 OE2 GLU A 119 10.480 -15.113 4.749 1.00 30.36 O ATOM 0 H GLU A 119 5.472 -17.802 4.751 1.00 24.14 H new ATOM 0 HA GLU A 119 7.198 -15.708 5.374 1.00 26.98 H new ATOM 0 HB2 GLU A 119 7.773 -18.033 4.600 1.00 28.20 H new ATOM 0 HB3 GLU A 119 7.261 -17.589 2.984 1.00 28.20 H new ATOM 0 HG2 GLU A 119 9.682 -17.455 3.164 1.00 27.24 H new ATOM 0 HG3 GLU A 119 9.010 -15.863 2.874 1.00 27.24 H new ATOM 1604 N HIS A 120 5.612 -15.331 2.511 1.00 21.73 N ATOM 1605 CA HIS A 120 5.261 -14.359 1.481 1.00 22.27 C ATOM 1606 C HIS A 120 4.657 -13.105 2.105 1.00 22.52 C ATOM 1607 O HIS A 120 5.051 -11.987 1.783 1.00 24.30 O ATOM 1608 CB HIS A 120 4.266 -14.963 0.483 1.00 22.36 C ATOM 1609 CG HIS A 120 4.861 -16.002 -0.420 1.00 23.53 C ATOM 1610 ND1 HIS A 120 6.161 -15.951 -0.872 1.00 29.14 N ATOM 1611 CD2 HIS A 120 4.326 -17.125 -0.957 1.00 27.13 C ATOM 1612 CE1 HIS A 120 6.402 -16.996 -1.641 1.00 30.02 C ATOM 1613 NE2 HIS A 120 5.307 -17.724 -1.712 1.00 30.38 N ATOM 0 H HIS A 120 5.140 -16.230 2.419 1.00 21.73 H new ATOM 0 HA HIS A 120 6.176 -14.088 0.953 1.00 22.27 H new ATOM 0 HB2 HIS A 120 3.438 -15.408 1.035 1.00 22.36 H new ATOM 0 HB3 HIS A 120 3.848 -14.162 -0.127 1.00 22.36 H new ATOM 0 HD2 HIS A 120 3.317 -17.483 -0.818 1.00 27.13 H new ATOM 0 HE1 HIS A 120 7.339 -17.217 -2.130 1.00 30.02 H new ATOM 0 HE2 HIS A 120 5.203 -18.590 -2.240 1.00 30.38 H new ATOM 1622 N CYS A 121 3.723 -13.311 3.023 1.00 21.37 N ATOM 1623 CA CYS A 121 3.048 -12.209 3.695 1.00 22.64 C ATOM 1624 C CYS A 121 4.014 -11.385 4.541 1.00 24.68 C ATOM 1625 O CYS A 121 3.876 -10.165 4.637 1.00 24.70 O ATOM 1626 CB CYS A 121 1.922 -12.756 4.568 1.00 26.11 C ATOM 1627 SG CYS A 121 0.876 -13.960 3.721 1.00 28.52 S ATOM 0 H CYS A 121 3.414 -14.236 3.321 1.00 21.37 H new ATOM 0 HA CYS A 121 2.636 -11.549 2.931 1.00 22.64 H new ATOM 0 HB2 CYS A 121 2.353 -13.221 5.455 1.00 26.11 H new ATOM 0 HB3 CYS A 121 1.303 -11.927 4.912 1.00 26.11 H new ATOM 0 HG CYS A 121 -0.286 -14.010 4.302 1.00 28.52 H new ATOM 1633 N ARG A 122 4.993 -12.050 5.143 1.00 25.35 N ATOM 1634 CA ARG A 122 5.973 -11.370 5.979 1.00 25.95 C ATOM 1635 C ARG A 122 6.808 -10.396 5.159 1.00 23.36 C ATOM 1636 O ARG A 122 6.998 -9.244 5.555 1.00 26.33 O ATOM 1637 CB ARG A 122 6.884 -12.379 6.675 1.00 27.25 C ATOM 1638 CG ARG A 122 6.241 -13.035 7.882 1.00 37.10 C ATOM 1639 CD ARG A 122 7.259 -13.811 8.702 1.00 28.22 C ATOM 1640 NE ARG A 122 7.700 -15.030 8.024 1.00 35.74 N ATOM 1641 CZ ARG A 122 7.132 -16.223 8.194 1.00 30.48 C ATOM 1642 NH1 ARG A 122 6.082 -16.351 8.993 1.00 31.71 N ATOM 1643 NH2 ARG A 122 7.615 -17.283 7.561 1.00 40.70 N ATOM 0 H ARG A 122 5.129 -13.058 5.068 1.00 25.35 H new ATOM 0 HA ARG A 122 5.428 -10.807 6.737 1.00 25.95 H new ATOM 0 HB2 ARG A 122 7.172 -13.151 5.961 1.00 27.25 H new ATOM 0 HB3 ARG A 122 7.799 -11.876 6.988 1.00 27.25 H new ATOM 0 HG2 ARG A 122 5.774 -12.273 8.506 1.00 37.10 H new ATOM 0 HG3 ARG A 122 5.448 -13.707 7.553 1.00 37.10 H new ATOM 0 HD2 ARG A 122 8.122 -13.176 8.902 1.00 28.22 H new ATOM 0 HD3 ARG A 122 6.824 -14.071 9.667 1.00 28.22 H new ATOM 0 HE ARG A 122 8.490 -14.962 7.382 1.00 35.74 H new ATOM 0 HH11 ARG A 122 5.708 -15.536 9.478 1.00 31.71 H new ATOM 0 HH12 ARG A 122 5.648 -17.265 9.122 1.00 31.71 H new ATOM 0 HH21 ARG A 122 8.421 -17.185 6.944 1.00 40.70 H new ATOM 0 HH22 ARG A 122 7.180 -18.197 7.691 1.00 40.70 H new ATOM 1657 N LYS A 123 7.287 -10.855 4.009 1.00 22.81 N ATOM 1658 CA LYS A 123 8.097 -10.019 3.132 1.00 24.60 C ATOM 1659 C LYS A 123 7.279 -8.839 2.622 1.00 24.94 C ATOM 1660 O LYS A 123 7.775 -7.712 2.536 1.00 25.77 O ATOM 1661 CB LYS A 123 8.629 -10.832 1.952 1.00 27.36 C ATOM 1662 CG LYS A 123 9.424 -12.059 2.366 1.00 28.78 C ATOM 1663 CD LYS A 123 10.302 -12.556 1.231 1.00 35.71 C ATOM 1664 CE LYS A 123 10.881 -13.930 1.529 1.00 44.84 C ATOM 1665 NZ LYS A 123 11.751 -13.921 2.735 1.00 55.57 N ATOM 0 H LYS A 123 7.129 -11.801 3.662 1.00 22.81 H new ATOM 0 HA LYS A 123 8.944 -9.643 3.706 1.00 24.60 H new ATOM 0 HB2 LYS A 123 7.790 -11.146 1.331 1.00 27.36 H new ATOM 0 HB3 LYS A 123 9.260 -10.192 1.336 1.00 27.36 H new ATOM 0 HG2 LYS A 123 10.044 -11.819 3.230 1.00 28.78 H new ATOM 0 HG3 LYS A 123 8.741 -12.851 2.674 1.00 28.78 H new ATOM 0 HD2 LYS A 123 9.719 -12.598 0.311 1.00 35.71 H new ATOM 0 HD3 LYS A 123 11.113 -11.848 1.061 1.00 35.71 H new ATOM 0 HE2 LYS A 123 10.068 -14.642 1.674 1.00 44.84 H new ATOM 0 HE3 LYS A 123 11.457 -14.274 0.670 1.00 44.84 H new ATOM 0 HZ1 LYS A 123 12.436 -14.701 2.674 1.00 55.57 H new ATOM 0 HZ2 LYS A 123 12.260 -13.016 2.789 1.00 55.57 H new ATOM 0 HZ3 LYS A 123 11.166 -14.040 3.586 1.00 55.57 H new ATOM 1679 N VAL A 124 6.022 -9.106 2.290 1.00 23.64 N ATOM 1680 CA VAL A 124 5.122 -8.073 1.801 1.00 22.10 C ATOM 1681 C VAL A 124 4.891 -7.015 2.874 1.00 22.85 C ATOM 1682 O VAL A 124 5.013 -5.819 2.615 1.00 24.21 O ATOM 1683 CB VAL A 124 3.762 -8.668 1.368 1.00 22.81 C ATOM 1684 CG1 VAL A 124 2.741 -7.571 1.094 1.00 23.59 C ATOM 1685 CG2 VAL A 124 3.929 -9.551 0.143 1.00 24.46 C ATOM 0 H VAL A 124 5.603 -10.034 2.351 1.00 23.64 H new ATOM 0 HA VAL A 124 5.594 -7.615 0.932 1.00 22.10 H new ATOM 0 HB VAL A 124 3.390 -9.278 2.191 1.00 22.81 H new ATOM 0 HG11 VAL A 124 1.795 -8.021 0.792 1.00 23.59 H new ATOM 0 HG12 VAL A 124 2.589 -6.981 1.998 1.00 23.59 H new ATOM 0 HG13 VAL A 124 3.107 -6.925 0.296 1.00 23.59 H new ATOM 0 HG21 VAL A 124 2.961 -9.960 -0.146 1.00 24.46 H new ATOM 0 HG22 VAL A 124 4.333 -8.960 -0.679 1.00 24.46 H new ATOM 0 HG23 VAL A 124 4.613 -10.367 0.374 1.00 24.46 H new ATOM 1695 N ASN A 125 4.588 -7.469 4.085 1.00 23.90 N ATOM 1696 CA ASN A 125 4.333 -6.570 5.207 1.00 25.34 C ATOM 1697 C ASN A 125 5.526 -5.655 5.461 1.00 27.59 C ATOM 1698 O ASN A 125 5.353 -4.478 5.764 1.00 26.42 O ATOM 1699 CB ASN A 125 4.015 -7.372 6.469 1.00 25.30 C ATOM 1700 CG ASN A 125 3.404 -6.522 7.571 1.00 26.31 C ATOM 1701 OD1 ASN A 125 2.187 -6.322 7.613 1.00 30.74 O ATOM 1702 ND2 ASN A 125 4.236 -6.028 8.476 1.00 26.69 N ATOM 0 H ASN A 125 4.512 -8.459 4.317 1.00 23.90 H new ATOM 0 HA ASN A 125 3.474 -5.950 4.950 1.00 25.34 H new ATOM 0 HB2 ASN A 125 3.328 -8.180 6.217 1.00 25.30 H new ATOM 0 HB3 ASN A 125 4.930 -7.835 6.839 1.00 25.30 H new ATOM 0 HD21 ASN A 125 3.877 -5.459 9.243 1.00 26.69 H new ATOM 0 HD22 ASN A 125 5.236 -6.216 8.406 1.00 26.69 H new ATOM 1709 N GLU A 126 6.731 -6.197 5.319 1.00 26.42 N ATOM 1710 CA GLU A 126 7.944 -5.418 5.533 1.00 28.43 C ATOM 1711 C GLU A 126 8.098 -4.342 4.467 1.00 31.22 C ATOM 1712 O GLU A 126 8.327 -3.176 4.778 1.00 33.04 O ATOM 1713 CB GLU A 126 9.180 -6.321 5.521 1.00 30.84 C ATOM 1714 CG GLU A 126 9.267 -7.274 6.700 1.00 32.00 C ATOM 1715 CD GLU A 126 10.645 -7.883 6.854 1.00 38.76 C ATOM 1716 OE1 GLU A 126 11.350 -8.050 5.834 1.00 35.92 O ATOM 1717 OE2 GLU A 126 11.033 -8.201 7.999 1.00 44.64 O ATOM 0 H GLU A 126 6.893 -7.170 5.057 1.00 26.42 H new ATOM 0 HA GLU A 126 7.857 -4.941 6.509 1.00 28.43 H new ATOM 0 HB2 GLU A 126 9.183 -6.901 4.598 1.00 30.84 H new ATOM 0 HB3 GLU A 126 10.073 -5.696 5.507 1.00 30.84 H new ATOM 0 HG2 GLU A 126 9.005 -6.741 7.614 1.00 32.00 H new ATOM 0 HG3 GLU A 126 8.534 -8.070 6.574 1.00 32.00 H new ATOM 1724 N CYS A 127 7.947 -4.735 3.211 1.00 27.47 N ATOM 1725 CA CYS A 127 8.096 -3.811 2.091 1.00 28.50 C ATOM 1726 C CYS A 127 6.995 -2.752 2.066 1.00 30.91 C ATOM 1727 O CYS A 127 7.196 -1.654 1.548 1.00 35.43 O ATOM 1728 CB CYS A 127 8.110 -4.582 0.773 1.00 31.38 C ATOM 1729 SG CYS A 127 9.342 -5.902 0.713 1.00 46.40 S ATOM 0 H CYS A 127 7.720 -5.691 2.939 1.00 27.47 H new ATOM 0 HA CYS A 127 9.045 -3.292 2.222 1.00 28.50 H new ATOM 0 HB2 CYS A 127 7.123 -5.011 0.604 1.00 31.38 H new ATOM 0 HB3 CYS A 127 8.298 -3.885 -0.043 1.00 31.38 H new ATOM 0 HG CYS A 127 8.946 -6.899 1.447 1.00 46.40 H new ATOM 1735 N LEU A 128 5.837 -3.076 2.624 1.00 26.38 N ATOM 1736 CA LEU A 128 4.724 -2.137 2.645 1.00 27.69 C ATOM 1737 C LEU A 128 4.739 -1.286 3.915 1.00 35.20 C ATOM 1738 O LEU A 128 3.895 -0.407 4.091 1.00 35.19 O ATOM 1739 CB LEU A 128 3.387 -2.877 2.530 1.00 27.68 C ATOM 1740 CG LEU A 128 3.192 -3.715 1.258 1.00 27.47 C ATOM 1741 CD1 LEU A 128 1.728 -4.092 1.093 1.00 27.78 C ATOM 1742 CD2 LEU A 128 3.688 -2.974 0.024 1.00 27.78 C ATOM 0 H LEU A 128 5.644 -3.975 3.065 1.00 26.38 H new ATOM 0 HA LEU A 128 4.838 -1.475 1.786 1.00 27.69 H new ATOM 0 HB2 LEU A 128 3.281 -3.533 3.394 1.00 27.68 H new ATOM 0 HB3 LEU A 128 2.582 -2.144 2.586 1.00 27.68 H new ATOM 0 HG LEU A 128 3.783 -4.625 1.363 1.00 27.47 H new ATOM 0 HD11 LEU A 128 1.605 -4.686 0.187 1.00 27.78 H new ATOM 0 HD12 LEU A 128 1.403 -4.674 1.955 1.00 27.78 H new ATOM 0 HD13 LEU A 128 1.125 -3.187 1.018 1.00 27.78 H new ATOM 0 HD21 LEU A 128 3.535 -3.595 -0.859 1.00 27.78 H new ATOM 0 HD22 LEU A 128 3.134 -2.042 -0.088 1.00 27.78 H new ATOM 0 HD23 LEU A 128 4.750 -2.754 0.134 1.00 27.78 H new ATOM 1754 N ASN A 129 5.689 -1.546 4.805 1.00 31.80 N ATOM 1755 CA ASN A 129 5.783 -0.783 6.045 1.00 41.40 C ATOM 1756 C ASN A 129 7.167 -0.185 6.232 1.00 46.78 C ATOM 1757 O ASN A 129 7.421 0.506 7.219 1.00 58.88 O ATOM 1758 CB ASN A 129 5.424 -1.649 7.252 1.00 39.28 C ATOM 1759 CG ASN A 129 3.926 -1.782 7.431 1.00 45.62 C ATOM 1760 OD1 ASN A 129 3.266 -0.884 7.955 1.00 53.22 O ATOM 1761 ND2 ASN A 129 3.380 -2.906 7.006 1.00 37.18 N ATOM 0 H ASN A 129 6.398 -2.271 4.694 1.00 31.80 H new ATOM 0 HA ASN A 129 5.065 0.034 5.971 1.00 41.40 H new ATOM 0 HB2 ASN A 129 5.864 -2.639 7.131 1.00 39.28 H new ATOM 0 HB3 ASN A 129 5.859 -1.215 8.152 1.00 39.28 H new ATOM 0 HD21 ASN A 129 2.376 -3.055 7.106 1.00 37.18 H new ATOM 0 HD22 ASN A 129 3.962 -3.625 6.577 1.00 37.18 H new ATOM 1768 N ASN A 130 8.051 -0.439 5.281 1.00 54.30 N ATOM 1769 CA ASN A 130 9.416 0.074 5.341 1.00 56.86 C ATOM 1770 C ASN A 130 10.067 -0.006 3.968 1.00 60.77 C ATOM 1771 O ASN A 130 9.643 -0.798 3.120 1.00 59.36 O ATOM 1772 CB ASN A 130 10.244 -0.720 6.359 1.00 60.10 C ATOM 1773 CG ASN A 130 11.520 -0.009 6.769 1.00 66.88 C ATOM 1774 OD1 ASN A 130 12.122 0.728 5.990 1.00 72.02 O ATOM 1775 ND2 ASN A 130 11.944 -0.227 8.003 1.00 69.88 N ATOM 0 H ASN A 130 7.849 -1.000 4.453 1.00 54.30 H new ATOM 0 HA ASN A 130 9.379 1.116 5.657 1.00 56.86 H new ATOM 0 HB2 ASN A 130 9.638 -0.907 7.245 1.00 60.10 H new ATOM 0 HB3 ASN A 130 10.496 -1.692 5.935 1.00 60.10 H new ATOM 0 HD21 ASN A 130 12.797 0.223 8.336 1.00 69.88 H new ATOM 0 HD22 ASN A 130 11.418 -0.845 8.621 1.00 69.88 H new TER 1782 ASN A 130 ATOM 1783 N MET B 1 -16.519 18.832 7.071 1.00 9.67 N ATOM 1784 CA MET B 1 -16.359 17.550 7.789 1.00 10.38 C ATOM 1785 C MET B 1 -14.958 17.450 8.375 1.00 9.62 C ATOM 1786 O MET B 1 -14.009 18.021 7.836 1.00 9.62 O ATOM 1787 CB MET B 1 -16.622 16.366 6.849 1.00 13.77 C ATOM 1788 CG MET B 1 -15.580 16.200 5.753 1.00 16.29 C ATOM 1789 SD MET B 1 -16.006 14.902 4.576 1.00 17.17 S ATOM 1790 CE MET B 1 -14.567 14.926 3.510 1.00 16.11 C ATOM 0 H1 MET B 1 -17.507 18.936 6.762 1.00 9.67 H new ATOM 0 H2 MET B 1 -16.269 19.618 7.704 1.00 9.67 H new ATOM 0 H3 MET B 1 -15.894 18.845 6.240 1.00 9.67 H new ATOM 0 HA MET B 1 -17.087 17.516 8.599 1.00 10.38 H new ATOM 0 HB2 MET B 1 -16.663 15.450 7.438 1.00 13.77 H new ATOM 0 HB3 MET B 1 -17.602 16.492 6.388 1.00 13.77 H new ATOM 0 HG2 MET B 1 -15.466 17.144 5.220 1.00 16.29 H new ATOM 0 HG3 MET B 1 -14.616 15.971 6.206 1.00 16.29 H new ATOM 0 HE1 MET B 1 -14.681 14.175 2.728 1.00 16.11 H new ATOM 0 HE2 MET B 1 -14.468 15.911 3.055 1.00 16.11 H new ATOM 0 HE3 MET B 1 -13.675 14.706 4.097 1.00 16.11 H new ATOM 1802 N GLN B 2 -14.834 16.737 9.480 1.00 9.27 N ATOM 1803 CA GLN B 2 -13.548 16.567 10.137 1.00 9.07 C ATOM 1804 C GLN B 2 -12.823 15.343 9.595 1.00 8.72 C ATOM 1805 O GLN B 2 -13.433 14.297 9.380 1.00 8.22 O ATOM 1806 CB GLN B 2 -13.736 16.422 11.647 1.00 14.46 C ATOM 1807 CG GLN B 2 -14.274 17.673 12.320 1.00 17.01 C ATOM 1808 CD GLN B 2 -13.250 18.787 12.406 1.00 20.10 C ATOM 1809 OE1 GLN B 2 -12.047 18.542 12.471 1.00 21.89 O ATOM 1810 NE2 GLN B 2 -13.718 20.021 12.416 1.00 19.49 N ATOM 0 H GLN B 2 -15.610 16.265 9.943 1.00 9.27 H new ATOM 0 HA GLN B 2 -12.946 17.453 9.933 1.00 9.07 H new ATOM 0 HB2 GLN B 2 -14.418 15.594 11.841 1.00 14.46 H new ATOM 0 HB3 GLN B 2 -12.780 16.160 12.099 1.00 14.46 H new ATOM 0 HG2 GLN B 2 -15.145 18.029 11.769 1.00 17.01 H new ATOM 0 HG3 GLN B 2 -14.614 17.421 13.325 1.00 17.01 H new ATOM 0 HE21 GLN B 2 -14.723 20.186 12.360 1.00 19.49 H new ATOM 0 HE22 GLN B 2 -13.075 20.810 12.479 1.00 19.49 H new ATOM 1819 N ILE B 3 -11.531 15.488 9.355 1.00 5.87 N ATOM 1820 CA ILE B 3 -10.718 14.386 8.863 1.00 5.07 C ATOM 1821 C ILE B 3 -9.535 14.172 9.793 1.00 4.01 C ATOM 1822 O ILE B 3 -9.058 15.118 10.423 1.00 4.61 O ATOM 1823 CB ILE B 3 -10.206 14.625 7.425 1.00 6.55 C ATOM 1824 CG1 ILE B 3 -9.363 15.901 7.354 1.00 4.72 C ATOM 1825 CG2 ILE B 3 -11.372 14.700 6.448 1.00 5.58 C ATOM 1826 CD1 ILE B 3 -8.549 16.022 6.084 1.00 10.83 C ATOM 0 H ILE B 3 -11.020 16.360 9.493 1.00 5.87 H new ATOM 0 HA ILE B 3 -11.352 13.499 8.841 1.00 5.07 H new ATOM 0 HB ILE B 3 -9.574 13.783 7.144 1.00 6.55 H new ATOM 0 HG12 ILE B 3 -10.021 16.766 7.437 1.00 4.72 H new ATOM 0 HG13 ILE B 3 -8.690 15.929 8.211 1.00 4.72 H new ATOM 0 HG21 ILE B 3 -10.992 14.869 5.440 1.00 5.58 H new ATOM 0 HG22 ILE B 3 -11.929 13.763 6.474 1.00 5.58 H new ATOM 0 HG23 ILE B 3 -12.031 15.522 6.730 1.00 5.58 H new ATOM 0 HD11 ILE B 3 -7.978 16.950 6.105 1.00 10.83 H new ATOM 0 HD12 ILE B 3 -7.865 15.177 6.008 1.00 10.83 H new ATOM 0 HD13 ILE B 3 -9.217 16.026 5.223 1.00 10.83 H new ATOM 1838 N PHE B 4 -9.068 12.937 9.893 1.00 4.55 N ATOM 1839 CA PHE B 4 -7.945 12.625 10.765 1.00 4.68 C ATOM 1840 C PHE B 4 -6.736 12.184 9.955 1.00 5.30 C ATOM 1841 O PHE B 4 -6.635 11.026 9.556 1.00 5.58 O ATOM 1842 CB PHE B 4 -8.328 11.526 11.760 1.00 4.83 C ATOM 1843 CG PHE B 4 -9.559 11.836 12.561 1.00 7.97 C ATOM 1844 CD1 PHE B 4 -9.529 12.796 13.556 1.00 6.69 C ATOM 1845 CD2 PHE B 4 -10.746 11.162 12.318 1.00 8.34 C ATOM 1846 CE1 PHE B 4 -10.661 13.080 14.296 1.00 9.10 C ATOM 1847 CE2 PHE B 4 -11.880 11.444 13.054 1.00 10.61 C ATOM 1848 CZ PHE B 4 -11.837 12.403 14.044 1.00 8.90 C ATOM 0 H PHE B 4 -9.446 12.138 9.384 1.00 4.55 H new ATOM 0 HA PHE B 4 -7.687 13.530 11.315 1.00 4.68 H new ATOM 0 HB2 PHE B 4 -8.485 10.595 11.216 1.00 4.83 H new ATOM 0 HB3 PHE B 4 -7.494 11.360 12.442 1.00 4.83 H new ATOM 0 HD1 PHE B 4 -8.612 13.329 13.757 1.00 6.69 H new ATOM 0 HD2 PHE B 4 -10.784 10.409 11.545 1.00 8.34 H new ATOM 0 HE1 PHE B 4 -10.625 13.831 15.071 1.00 9.10 H new ATOM 0 HE2 PHE B 4 -12.800 10.914 12.854 1.00 10.61 H new ATOM 0 HZ PHE B 4 -12.722 12.624 14.621 1.00 8.90 H new ATOM 1858 N VAL B 5 -5.828 13.111 9.701 1.00 4.44 N ATOM 1859 CA VAL B 5 -4.624 12.810 8.941 1.00 3.87 C ATOM 1860 C VAL B 5 -3.529 12.304 9.874 1.00 4.93 C ATOM 1861 O VAL B 5 -2.908 13.081 10.597 1.00 6.84 O ATOM 1862 CB VAL B 5 -4.112 14.045 8.169 1.00 2.99 C ATOM 1863 CG1 VAL B 5 -2.908 13.684 7.314 1.00 5.28 C ATOM 1864 CG2 VAL B 5 -5.219 14.643 7.311 1.00 9.13 C ATOM 0 H VAL B 5 -5.901 14.080 10.010 1.00 4.44 H new ATOM 0 HA VAL B 5 -4.878 12.037 8.215 1.00 3.87 H new ATOM 0 HB VAL B 5 -3.802 14.795 8.897 1.00 2.99 H new ATOM 0 HG11 VAL B 5 -2.563 14.569 6.779 1.00 5.28 H new ATOM 0 HG12 VAL B 5 -2.107 13.311 7.952 1.00 5.28 H new ATOM 0 HG13 VAL B 5 -3.189 12.913 6.597 1.00 5.28 H new ATOM 0 HG21 VAL B 5 -4.836 15.512 6.776 1.00 9.13 H new ATOM 0 HG22 VAL B 5 -5.565 13.899 6.594 1.00 9.13 H new ATOM 0 HG23 VAL B 5 -6.049 14.947 7.948 1.00 9.13 H new ATOM 1874 N LYS B 6 -3.306 11.002 9.865 1.00 6.04 N ATOM 1875 CA LYS B 6 -2.296 10.399 10.716 1.00 6.12 C ATOM 1876 C LYS B 6 -0.941 10.392 10.019 1.00 6.57 C ATOM 1877 O LYS B 6 -0.774 9.788 8.958 1.00 5.76 O ATOM 1878 CB LYS B 6 -2.705 8.974 11.102 1.00 7.45 C ATOM 1879 CG LYS B 6 -2.067 8.481 12.391 1.00 11.12 C ATOM 1880 CD LYS B 6 -2.546 7.084 12.745 1.00 14.54 C ATOM 1881 CE LYS B 6 -2.119 6.686 14.150 1.00 18.84 C ATOM 1882 NZ LYS B 6 -2.771 7.526 15.190 1.00 20.55 N ATOM 0 H LYS B 6 -3.812 10.341 9.276 1.00 6.04 H new ATOM 0 HA LYS B 6 -2.212 10.995 11.625 1.00 6.12 H new ATOM 0 HB2 LYS B 6 -3.789 8.932 11.205 1.00 7.45 H new ATOM 0 HB3 LYS B 6 -2.436 8.296 10.292 1.00 7.45 H new ATOM 0 HG2 LYS B 6 -0.982 8.480 12.285 1.00 11.12 H new ATOM 0 HG3 LYS B 6 -2.307 9.167 13.204 1.00 11.12 H new ATOM 0 HD2 LYS B 6 -3.632 7.041 12.668 1.00 14.54 H new ATOM 0 HD3 LYS B 6 -2.147 6.369 12.026 1.00 14.54 H new ATOM 0 HE2 LYS B 6 -2.368 5.639 14.321 1.00 18.84 H new ATOM 0 HE3 LYS B 6 -1.036 6.775 14.239 1.00 18.84 H new ATOM 0 HZ1 LYS B 6 -2.934 6.956 16.044 1.00 20.55 H new ATOM 0 HZ2 LYS B 6 -2.155 8.331 15.423 1.00 20.55 H new ATOM 0 HZ3 LYS B 6 -3.681 7.879 14.831 1.00 20.55 H new ATOM 1896 N THR B 7 0.018 11.078 10.611 1.00 7.41 N ATOM 1897 CA THR B 7 1.362 11.153 10.064 1.00 7.48 C ATOM 1898 C THR B 7 2.194 9.960 10.518 1.00 8.75 C ATOM 1899 O THR B 7 1.713 9.106 11.270 1.00 8.58 O ATOM 1900 CB THR B 7 2.057 12.445 10.526 1.00 9.61 C ATOM 1901 OG1 THR B 7 1.606 12.787 11.842 1.00 11.78 O ATOM 1902 CG2 THR B 7 1.777 13.592 9.572 1.00 9.17 C ATOM 0 H THR B 7 -0.110 11.597 11.480 1.00 7.41 H new ATOM 0 HA THR B 7 1.281 11.147 8.977 1.00 7.48 H new ATOM 0 HB THR B 7 3.133 12.270 10.538 1.00 9.61 H new ATOM 0 HG1 THR B 7 2.026 13.626 12.124 1.00 11.78 H new ATOM 0 HG21 THR B 7 2.282 14.491 9.926 1.00 9.17 H new ATOM 0 HG22 THR B 7 2.145 13.337 8.578 1.00 9.17 H new ATOM 0 HG23 THR B 7 0.703 13.773 9.526 1.00 9.17 H new ATOM 1910 N LEU B 8 3.444 9.904 10.066 1.00 9.84 N ATOM 1911 CA LEU B 8 4.350 8.829 10.458 1.00 14.15 C ATOM 1912 C LEU B 8 4.695 8.957 11.937 1.00 17.37 C ATOM 1913 O LEU B 8 5.149 8.008 12.575 1.00 17.01 O ATOM 1914 CB LEU B 8 5.628 8.864 9.616 1.00 16.63 C ATOM 1915 CG LEU B 8 5.476 8.401 8.167 1.00 18.88 C ATOM 1916 CD1 LEU B 8 6.776 8.615 7.408 1.00 19.31 C ATOM 1917 CD2 LEU B 8 5.061 6.939 8.114 1.00 18.59 C ATOM 0 H LEU B 8 3.852 10.589 9.429 1.00 9.84 H new ATOM 0 HA LEU B 8 3.852 7.875 10.286 1.00 14.15 H new ATOM 0 HB2 LEU B 8 6.013 9.884 9.614 1.00 16.63 H new ATOM 0 HB3 LEU B 8 6.379 8.240 10.101 1.00 16.63 H new ATOM 0 HG LEU B 8 4.695 8.995 7.693 1.00 18.88 H new ATOM 0 HD11 LEU B 8 6.655 8.281 6.377 1.00 19.31 H new ATOM 0 HD12 LEU B 8 7.033 9.674 7.419 1.00 19.31 H new ATOM 0 HD13 LEU B 8 7.573 8.043 7.883 1.00 19.31 H new ATOM 0 HD21 LEU B 8 4.958 6.628 7.075 1.00 18.59 H new ATOM 0 HD22 LEU B 8 5.820 6.327 8.602 1.00 18.59 H new ATOM 0 HD23 LEU B 8 4.108 6.813 8.627 1.00 18.59 H new ATOM 1929 N THR B 9 4.469 10.151 12.469 1.00 18.33 N ATOM 1930 CA THR B 9 4.722 10.441 13.868 1.00 19.24 C ATOM 1931 C THR B 9 3.596 9.895 14.750 1.00 19.48 C ATOM 1932 O THR B 9 3.702 9.884 15.977 1.00 23.14 O ATOM 1933 CB THR B 9 4.851 11.960 14.072 1.00 18.97 C ATOM 1934 OG1 THR B 9 4.697 12.628 12.809 1.00 20.24 O ATOM 1935 CG2 THR B 9 6.201 12.316 14.676 1.00 19.70 C ATOM 0 H THR B 9 4.105 10.944 11.940 1.00 18.33 H new ATOM 0 HA THR B 9 5.654 9.955 14.156 1.00 19.24 H new ATOM 0 HB THR B 9 4.071 12.284 14.761 1.00 18.97 H new ATOM 0 HG1 THR B 9 3.744 12.704 12.593 1.00 20.24 H new ATOM 0 HG21 THR B 9 6.266 13.396 14.810 1.00 19.70 H new ATOM 0 HG22 THR B 9 6.309 11.823 15.642 1.00 19.70 H new ATOM 0 HG23 THR B 9 6.997 11.984 14.009 1.00 19.70 H new ATOM 1943 N GLY B 10 2.512 9.454 14.114 1.00 19.43 N ATOM 1944 CA GLY B 10 1.386 8.902 14.846 1.00 18.74 C ATOM 1945 C GLY B 10 0.343 9.948 15.182 1.00 17.62 C ATOM 1946 O GLY B 10 -0.757 9.620 15.633 1.00 19.74 O ATOM 0 H GLY B 10 2.395 9.470 13.101 1.00 19.43 H new ATOM 0 HA2 GLY B 10 0.925 8.111 14.255 1.00 18.74 H new ATOM 0 HA3 GLY B 10 1.745 8.443 15.767 1.00 18.74 H new ATOM 1950 N LYS B 11 0.684 11.204 14.938 1.00 13.56 N ATOM 1951 CA LYS B 11 -0.212 12.315 15.225 1.00 11.91 C ATOM 1952 C LYS B 11 -1.393 12.320 14.260 1.00 10.18 C ATOM 1953 O LYS B 11 -1.232 12.050 13.071 1.00 9.10 O ATOM 1954 CB LYS B 11 0.550 13.640 15.138 1.00 13.43 C ATOM 1955 CG LYS B 11 -0.227 14.826 15.686 1.00 16.69 C ATOM 1956 CD LYS B 11 0.616 16.088 15.693 1.00 17.92 C ATOM 1957 CE LYS B 11 -0.164 17.273 16.236 1.00 20.81 C ATOM 1958 NZ LYS B 11 0.600 18.543 16.109 1.00 21.93 N ATOM 0 H LYS B 11 1.581 11.481 14.539 1.00 13.56 H new ATOM 0 HA LYS B 11 -0.599 12.194 16.237 1.00 11.91 H new ATOM 0 HB2 LYS B 11 1.488 13.547 15.685 1.00 13.43 H new ATOM 0 HB3 LYS B 11 0.807 13.834 14.097 1.00 13.43 H new ATOM 0 HG2 LYS B 11 -1.120 14.987 15.083 1.00 16.69 H new ATOM 0 HG3 LYS B 11 -0.562 14.606 16.699 1.00 16.69 H new ATOM 0 HD2 LYS B 11 1.507 15.928 16.300 1.00 17.92 H new ATOM 0 HD3 LYS B 11 0.955 16.307 14.680 1.00 17.92 H new ATOM 0 HE2 LYS B 11 -1.109 17.362 15.700 1.00 20.81 H new ATOM 0 HE3 LYS B 11 -0.407 17.098 17.284 1.00 20.81 H new ATOM 0 HZ1 LYS B 11 1.008 18.797 17.032 1.00 21.93 H new ATOM 0 HZ2 LYS B 11 1.364 18.420 15.415 1.00 21.93 H new ATOM 0 HZ3 LYS B 11 -0.037 19.301 15.792 1.00 21.93 H new ATOM 1972 N THR B 12 -2.574 12.619 14.781 1.00 9.63 N ATOM 1973 CA THR B 12 -3.781 12.662 13.976 1.00 9.85 C ATOM 1974 C THR B 12 -4.211 14.101 13.720 1.00 11.66 C ATOM 1975 O THR B 12 -5.010 14.666 14.473 1.00 12.33 O ATOM 1976 CB THR B 12 -4.926 11.902 14.668 1.00 10.85 C ATOM 1977 OG1 THR B 12 -4.706 11.884 16.087 1.00 10.91 O ATOM 1978 CG2 THR B 12 -5.030 10.477 14.146 1.00 9.63 C ATOM 0 H THR B 12 -2.720 12.837 15.767 1.00 9.63 H new ATOM 0 HA THR B 12 -3.559 12.182 13.023 1.00 9.85 H new ATOM 0 HB THR B 12 -5.862 12.416 14.448 1.00 10.85 H new ATOM 0 HG1 THR B 12 -5.437 11.401 16.525 1.00 10.91 H new ATOM 0 HG21 THR B 12 -5.847 9.963 14.652 1.00 9.63 H new ATOM 0 HG22 THR B 12 -5.222 10.496 13.073 1.00 9.63 H new ATOM 0 HG23 THR B 12 -4.095 9.950 14.338 1.00 9.63 H new ATOM 1986 N ILE B 13 -3.671 14.690 12.662 1.00 10.42 N ATOM 1987 CA ILE B 13 -3.996 16.062 12.302 1.00 11.84 C ATOM 1988 C ILE B 13 -5.456 16.154 11.881 1.00 10.55 C ATOM 1989 O ILE B 13 -5.856 15.606 10.854 1.00 11.92 O ATOM 1990 CB ILE B 13 -3.092 16.579 11.161 1.00 14.86 C ATOM 1991 CG1 ILE B 13 -1.619 16.324 11.496 1.00 14.87 C ATOM 1992 CG2 ILE B 13 -3.334 18.066 10.918 1.00 17.08 C ATOM 1993 CD1 ILE B 13 -0.711 16.326 10.286 1.00 16.46 C ATOM 0 H ILE B 13 -3.004 14.237 12.037 1.00 10.42 H new ATOM 0 HA ILE B 13 -3.824 16.687 13.178 1.00 11.84 H new ATOM 0 HB ILE B 13 -3.341 16.038 10.248 1.00 14.86 H new ATOM 0 HG12 ILE B 13 -1.278 17.086 12.197 1.00 14.87 H new ATOM 0 HG13 ILE B 13 -1.532 15.363 12.003 1.00 14.87 H new ATOM 0 HG21 ILE B 13 -2.689 18.413 10.111 1.00 17.08 H new ATOM 0 HG22 ILE B 13 -4.377 18.225 10.642 1.00 17.08 H new ATOM 0 HG23 ILE B 13 -3.110 18.624 11.827 1.00 17.08 H new ATOM 0 HD11 ILE B 13 0.316 16.139 10.601 1.00 16.46 H new ATOM 0 HD12 ILE B 13 -1.026 15.545 9.594 1.00 16.46 H new ATOM 0 HD13 ILE B 13 -0.768 17.295 9.790 1.00 16.46 H new ATOM 2005 N THR B 14 -6.249 16.829 12.693 1.00 9.39 N ATOM 2006 CA THR B 14 -7.666 16.981 12.426 1.00 9.63 C ATOM 2007 C THR B 14 -7.945 18.288 11.692 1.00 11.20 C ATOM 2008 O THR B 14 -7.554 19.364 12.149 1.00 11.63 O ATOM 2009 CB THR B 14 -8.457 16.931 13.742 1.00 10.38 C ATOM 2010 OG1 THR B 14 -7.813 16.010 14.636 1.00 16.30 O ATOM 2011 CG2 THR B 14 -9.893 16.490 13.499 1.00 11.66 C ATOM 0 H THR B 14 -5.932 17.284 13.549 1.00 9.39 H new ATOM 0 HA THR B 14 -7.985 16.158 11.787 1.00 9.63 H new ATOM 0 HB THR B 14 -8.479 17.929 14.179 1.00 10.38 H new ATOM 0 HG1 THR B 14 -8.309 15.972 15.480 1.00 16.30 H new ATOM 0 HG21 THR B 14 -10.431 16.463 14.447 1.00 11.66 H new ATOM 0 HG22 THR B 14 -10.381 17.194 12.825 1.00 11.66 H new ATOM 0 HG23 THR B 14 -9.898 15.496 13.051 1.00 11.66 H new ATOM 2019 N LEU B 15 -8.605 18.190 10.548 1.00 8.29 N ATOM 2020 CA LEU B 15 -8.915 19.364 9.748 1.00 9.03 C ATOM 2021 C LEU B 15 -10.391 19.408 9.367 1.00 8.59 C ATOM 2022 O LEU B 15 -11.021 18.371 9.146 1.00 7.79 O ATOM 2023 CB LEU B 15 -8.062 19.376 8.475 1.00 11.08 C ATOM 2024 CG LEU B 15 -6.549 19.273 8.694 1.00 15.79 C ATOM 2025 CD1 LEU B 15 -5.837 18.986 7.381 1.00 15.88 C ATOM 2026 CD2 LEU B 15 -6.010 20.549 9.323 1.00 15.27 C ATOM 0 H LEU B 15 -8.936 17.310 10.153 1.00 8.29 H new ATOM 0 HA LEU B 15 -8.689 20.242 10.353 1.00 9.03 H new ATOM 0 HB2 LEU B 15 -8.377 18.548 7.840 1.00 11.08 H new ATOM 0 HB3 LEU B 15 -8.271 20.295 7.927 1.00 11.08 H new ATOM 0 HG LEU B 15 -6.359 18.446 9.378 1.00 15.79 H new ATOM 0 HD11 LEU B 15 -4.764 18.916 7.557 1.00 15.88 H new ATOM 0 HD12 LEU B 15 -6.199 18.044 6.969 1.00 15.88 H new ATOM 0 HD13 LEU B 15 -6.037 19.792 6.675 1.00 15.88 H new ATOM 0 HD21 LEU B 15 -4.934 20.456 9.470 1.00 15.27 H new ATOM 0 HD22 LEU B 15 -6.214 21.394 8.665 1.00 15.27 H new ATOM 0 HD23 LEU B 15 -6.495 20.713 10.285 1.00 15.27 H new ATOM 2038 N GLU B 16 -10.928 20.618 9.295 1.00 11.04 N ATOM 2039 CA GLU B 16 -12.317 20.834 8.918 1.00 11.50 C ATOM 2040 C GLU B 16 -12.371 21.196 7.435 1.00 10.13 C ATOM 2041 O GLU B 16 -12.215 22.361 7.060 1.00 9.83 O ATOM 2042 CB GLU B 16 -12.928 21.949 9.781 1.00 17.22 C ATOM 2043 CG GLU B 16 -14.294 22.438 9.317 1.00 23.33 C ATOM 2044 CD GLU B 16 -15.421 21.477 9.642 1.00 26.99 C ATOM 2045 OE1 GLU B 16 -15.832 21.413 10.819 1.00 28.86 O ATOM 2046 OE2 GLU B 16 -15.918 20.804 8.716 1.00 28.90 O ATOM 0 H GLU B 16 -10.414 21.476 9.496 1.00 11.04 H new ATOM 0 HA GLU B 16 -12.898 19.927 9.085 1.00 11.50 H new ATOM 0 HB2 GLU B 16 -13.015 21.589 10.806 1.00 17.22 H new ATOM 0 HB3 GLU B 16 -12.241 22.795 9.797 1.00 17.22 H new ATOM 0 HG2 GLU B 16 -14.503 23.402 9.781 1.00 23.33 H new ATOM 0 HG3 GLU B 16 -14.266 22.602 8.240 1.00 23.33 H new ATOM 2053 N VAL B 17 -12.562 20.193 6.596 1.00 8.99 N ATOM 2054 CA VAL B 17 -12.608 20.400 5.153 1.00 8.85 C ATOM 2055 C VAL B 17 -13.903 19.869 4.565 1.00 8.04 C ATOM 2056 O VAL B 17 -14.633 19.122 5.216 1.00 8.99 O ATOM 2057 CB VAL B 17 -11.426 19.702 4.446 1.00 9.78 C ATOM 2058 CG1 VAL B 17 -10.171 20.550 4.527 1.00 12.05 C ATOM 2059 CG2 VAL B 17 -11.181 18.328 5.046 1.00 10.54 C ATOM 0 H VAL B 17 -12.688 19.224 6.887 1.00 8.99 H new ATOM 0 HA VAL B 17 -12.544 21.476 4.989 1.00 8.85 H new ATOM 0 HB VAL B 17 -11.685 19.578 3.394 1.00 9.78 H new ATOM 0 HG11 VAL B 17 -9.352 20.037 4.022 1.00 12.05 H new ATOM 0 HG12 VAL B 17 -10.350 21.511 4.045 1.00 12.05 H new ATOM 0 HG13 VAL B 17 -9.908 20.712 5.572 1.00 12.05 H new ATOM 0 HG21 VAL B 17 -10.344 17.852 4.535 1.00 10.54 H new ATOM 0 HG22 VAL B 17 -10.948 18.430 6.106 1.00 10.54 H new ATOM 0 HG23 VAL B 17 -12.075 17.715 4.928 1.00 10.54 H new ATOM 2069 N GLU B 18 -14.186 20.256 3.335 1.00 7.29 N ATOM 2070 CA GLU B 18 -15.383 19.806 2.649 1.00 7.08 C ATOM 2071 C GLU B 18 -15.005 18.775 1.592 1.00 6.45 C ATOM 2072 O GLU B 18 -13.864 18.746 1.147 1.00 5.28 O ATOM 2073 CB GLU B 18 -16.107 20.990 2.004 1.00 10.28 C ATOM 2074 CG GLU B 18 -16.777 21.910 3.009 1.00 12.65 C ATOM 2075 CD GLU B 18 -17.793 21.186 3.867 1.00 14.15 C ATOM 2076 OE1 GLU B 18 -18.956 21.048 3.436 1.00 14.33 O ATOM 2077 OE2 GLU B 18 -17.439 20.748 4.981 1.00 18.17 O ATOM 0 H GLU B 18 -13.599 20.885 2.787 1.00 7.29 H new ATOM 0 HA GLU B 18 -16.058 19.348 3.372 1.00 7.08 H new ATOM 0 HB2 GLU B 18 -15.393 21.566 1.416 1.00 10.28 H new ATOM 0 HB3 GLU B 18 -16.859 20.612 1.311 1.00 10.28 H new ATOM 0 HG2 GLU B 18 -16.018 22.358 3.650 1.00 12.65 H new ATOM 0 HG3 GLU B 18 -17.269 22.726 2.479 1.00 12.65 H new ATOM 2084 N PRO B 19 -15.940 17.904 1.179 1.00 7.24 N ATOM 2085 CA PRO B 19 -15.662 16.882 0.160 1.00 7.07 C ATOM 2086 C PRO B 19 -15.193 17.490 -1.164 1.00 6.65 C ATOM 2087 O PRO B 19 -14.544 16.821 -1.971 1.00 6.37 O ATOM 2088 CB PRO B 19 -17.008 16.168 -0.015 1.00 7.61 C ATOM 2089 CG PRO B 19 -17.759 16.452 1.239 1.00 8.16 C ATOM 2090 CD PRO B 19 -17.323 17.821 1.677 1.00 7.49 C ATOM 0 HA PRO B 19 -14.854 16.216 0.464 1.00 7.07 H new ATOM 0 HB2 PRO B 19 -17.542 16.541 -0.889 1.00 7.61 H new ATOM 0 HB3 PRO B 19 -16.871 15.096 -0.159 1.00 7.61 H new ATOM 0 HG2 PRO B 19 -18.835 16.421 1.066 1.00 8.16 H new ATOM 0 HG3 PRO B 19 -17.538 15.708 2.004 1.00 8.16 H new ATOM 0 HD2 PRO B 19 -17.953 18.601 1.250 1.00 7.49 H new ATOM 0 HD3 PRO B 19 -17.369 17.932 2.760 1.00 7.49 H new ATOM 2098 N SER B 20 -15.508 18.761 -1.371 1.00 6.80 N ATOM 2099 CA SER B 20 -15.123 19.460 -2.588 1.00 6.28 C ATOM 2100 C SER B 20 -13.786 20.183 -2.415 1.00 8.45 C ATOM 2101 O SER B 20 -13.348 20.920 -3.300 1.00 7.26 O ATOM 2102 CB SER B 20 -16.218 20.456 -2.969 1.00 8.57 C ATOM 2103 OG SER B 20 -17.198 20.551 -1.943 1.00 11.13 O ATOM 0 H SER B 20 -16.032 19.331 -0.707 1.00 6.80 H new ATOM 0 HA SER B 20 -15.001 18.727 -3.385 1.00 6.28 H new ATOM 0 HB2 SER B 20 -15.777 21.437 -3.148 1.00 8.57 H new ATOM 0 HB3 SER B 20 -16.690 20.144 -3.901 1.00 8.57 H new ATOM 0 HG SER B 20 -17.888 21.195 -2.208 1.00 11.13 H new ATOM 2109 N ASP B 21 -13.134 19.967 -1.277 1.00 7.50 N ATOM 2110 CA ASP B 21 -11.851 20.604 -1.004 1.00 7.70 C ATOM 2111 C ASP B 21 -10.739 19.923 -1.782 1.00 7.08 C ATOM 2112 O ASP B 21 -10.723 18.698 -1.927 1.00 8.11 O ATOM 2113 CB ASP B 21 -11.524 20.571 0.492 1.00 11.00 C ATOM 2114 CG ASP B 21 -11.596 21.939 1.142 1.00 15.32 C ATOM 2115 OD1 ASP B 21 -10.806 22.830 0.762 1.00 18.03 O ATOM 2116 OD2 ASP B 21 -12.443 22.125 2.044 1.00 14.36 O ATOM 0 H ASP B 21 -13.472 19.358 -0.532 1.00 7.50 H new ATOM 0 HA ASP B 21 -11.927 21.644 -1.322 1.00 7.70 H new ATOM 0 HB2 ASP B 21 -12.218 19.898 0.996 1.00 11.00 H new ATOM 0 HB3 ASP B 21 -10.524 20.160 0.631 1.00 11.00 H new ATOM 2121 N THR B 22 -9.829 20.725 -2.296 1.00 5.37 N ATOM 2122 CA THR B 22 -8.700 20.224 -3.057 1.00 6.01 C ATOM 2123 C THR B 22 -7.621 19.693 -2.113 1.00 8.01 C ATOM 2124 O THR B 22 -7.429 20.232 -1.023 1.00 8.11 O ATOM 2125 CB THR B 22 -8.114 21.345 -3.934 1.00 8.92 C ATOM 2126 OG1 THR B 22 -9.174 22.171 -4.436 1.00 10.22 O ATOM 2127 CG2 THR B 22 -7.316 20.780 -5.100 1.00 9.65 C ATOM 0 H THR B 22 -9.850 21.740 -2.199 1.00 5.37 H new ATOM 0 HA THR B 22 -9.045 19.412 -3.697 1.00 6.01 H new ATOM 0 HB THR B 22 -7.440 21.938 -3.315 1.00 8.92 H new ATOM 0 HG1 THR B 22 -8.797 22.884 -4.992 1.00 10.22 H new ATOM 0 HG21 THR B 22 -6.917 21.599 -5.698 1.00 9.65 H new ATOM 0 HG22 THR B 22 -6.494 20.175 -4.719 1.00 9.65 H new ATOM 0 HG23 THR B 22 -7.965 20.161 -5.719 1.00 9.65 H new ATOM 2135 N ILE B 23 -6.924 18.640 -2.530 1.00 8.32 N ATOM 2136 CA ILE B 23 -5.860 18.043 -1.719 1.00 9.92 C ATOM 2137 C ILE B 23 -4.807 19.092 -1.361 1.00 10.01 C ATOM 2138 O ILE B 23 -4.243 19.079 -0.266 1.00 8.71 O ATOM 2139 CB ILE B 23 -5.185 16.861 -2.457 1.00 10.78 C ATOM 2140 CG1 ILE B 23 -6.215 15.782 -2.818 1.00 11.38 C ATOM 2141 CG2 ILE B 23 -4.067 16.261 -1.612 1.00 10.90 C ATOM 2142 CD1 ILE B 23 -6.978 15.234 -1.630 1.00 12.30 C ATOM 0 H ILE B 23 -7.075 18.179 -3.427 1.00 8.32 H new ATOM 0 HA ILE B 23 -6.317 17.664 -0.805 1.00 9.92 H new ATOM 0 HB ILE B 23 -4.752 17.247 -3.380 1.00 10.78 H new ATOM 0 HG12 ILE B 23 -6.926 16.198 -3.532 1.00 11.38 H new ATOM 0 HG13 ILE B 23 -5.704 14.960 -3.319 1.00 11.38 H new ATOM 0 HG21 ILE B 23 -3.608 15.432 -2.151 1.00 10.90 H new ATOM 0 HG22 ILE B 23 -3.315 17.023 -1.409 1.00 10.90 H new ATOM 0 HG23 ILE B 23 -4.478 15.898 -0.670 1.00 10.90 H new ATOM 0 HD11 ILE B 23 -7.685 14.477 -1.969 1.00 12.30 H new ATOM 0 HD12 ILE B 23 -6.279 14.786 -0.924 1.00 12.30 H new ATOM 0 HD13 ILE B 23 -7.520 16.043 -1.141 1.00 12.30 H new ATOM 2154 N GLU B 24 -4.567 20.010 -2.288 1.00 9.54 N ATOM 2155 CA GLU B 24 -3.600 21.078 -2.080 1.00 11.81 C ATOM 2156 C GLU B 24 -4.016 21.955 -0.899 1.00 11.14 C ATOM 2157 O GLU B 24 -3.175 22.398 -0.118 1.00 10.62 O ATOM 2158 CB GLU B 24 -3.478 21.924 -3.344 1.00 19.24 C ATOM 2159 CG GLU B 24 -2.282 22.854 -3.337 1.00 27.76 C ATOM 2160 CD GLU B 24 -2.358 23.893 -4.429 1.00 32.92 C ATOM 2161 OE1 GLU B 24 -2.552 23.516 -5.606 1.00 34.80 O ATOM 2162 OE2 GLU B 24 -2.230 25.094 -4.113 1.00 36.51 O ATOM 0 H GLU B 24 -5.032 20.036 -3.196 1.00 9.54 H new ATOM 0 HA GLU B 24 -2.631 20.632 -1.855 1.00 11.81 H new ATOM 0 HB2 GLU B 24 -3.409 21.263 -4.208 1.00 19.24 H new ATOM 0 HB3 GLU B 24 -4.386 22.514 -3.465 1.00 19.24 H new ATOM 0 HG2 GLU B 24 -2.217 23.351 -2.369 1.00 27.76 H new ATOM 0 HG3 GLU B 24 -1.370 22.270 -3.457 1.00 27.76 H new ATOM 2169 N ASN B 25 -5.323 22.179 -0.767 1.00 9.43 N ATOM 2170 CA ASN B 25 -5.856 22.994 0.319 1.00 10.96 C ATOM 2171 C ASN B 25 -5.615 22.305 1.651 1.00 9.68 C ATOM 2172 O ASN B 25 -5.352 22.952 2.664 1.00 9.33 O ATOM 2173 CB ASN B 25 -7.356 23.252 0.135 1.00 16.78 C ATOM 2174 CG ASN B 25 -7.664 24.169 -1.037 1.00 22.31 C ATOM 2175 OD1 ASN B 25 -7.067 24.060 -2.108 1.00 25.66 O ATOM 2176 ND2 ASN B 25 -8.599 25.087 -0.839 1.00 24.70 N ATOM 0 H ASN B 25 -6.031 21.806 -1.400 1.00 9.43 H new ATOM 0 HA ASN B 25 -5.339 23.954 0.305 1.00 10.96 H new ATOM 0 HB2 ASN B 25 -7.867 22.300 -0.012 1.00 16.78 H new ATOM 0 HB3 ASN B 25 -7.758 23.692 1.048 1.00 16.78 H new ATOM 0 HD21 ASN B 25 -8.845 25.734 -1.588 1.00 24.70 H new ATOM 0 HD22 ASN B 25 -9.072 25.147 0.063 1.00 24.70 H new ATOM 2183 N VAL B 26 -5.707 20.980 1.637 1.00 6.52 N ATOM 2184 CA VAL B 26 -5.474 20.182 2.830 1.00 5.53 C ATOM 2185 C VAL B 26 -4.021 20.339 3.265 1.00 4.42 C ATOM 2186 O VAL B 26 -3.732 20.546 4.444 1.00 3.40 O ATOM 2187 CB VAL B 26 -5.783 18.691 2.582 1.00 3.86 C ATOM 2188 CG1 VAL B 26 -5.598 17.876 3.853 1.00 7.25 C ATOM 2189 CG2 VAL B 26 -7.193 18.517 2.040 1.00 8.12 C ATOM 0 H VAL B 26 -5.943 20.436 0.807 1.00 6.52 H new ATOM 0 HA VAL B 26 -6.142 20.537 3.615 1.00 5.53 H new ATOM 0 HB VAL B 26 -5.078 18.323 1.837 1.00 3.86 H new ATOM 0 HG11 VAL B 26 -5.822 16.829 3.650 1.00 7.25 H new ATOM 0 HG12 VAL B 26 -4.567 17.966 4.196 1.00 7.25 H new ATOM 0 HG13 VAL B 26 -6.271 18.248 4.625 1.00 7.25 H new ATOM 0 HG21 VAL B 26 -7.390 17.458 1.872 1.00 8.12 H new ATOM 0 HG22 VAL B 26 -7.911 18.910 2.760 1.00 8.12 H new ATOM 0 HG23 VAL B 26 -7.290 19.058 1.099 1.00 8.12 H new ATOM 2199 N LYS B 27 -3.121 20.274 2.287 1.00 2.64 N ATOM 2200 CA LYS B 27 -1.690 20.423 2.537 1.00 4.14 C ATOM 2201 C LYS B 27 -1.394 21.778 3.167 1.00 5.58 C ATOM 2202 O LYS B 27 -0.608 21.883 4.111 1.00 4.11 O ATOM 2203 CB LYS B 27 -0.904 20.298 1.232 1.00 3.97 C ATOM 2204 CG LYS B 27 -0.848 18.891 0.668 1.00 7.45 C ATOM 2205 CD LYS B 27 0.123 18.817 -0.496 1.00 9.02 C ATOM 2206 CE LYS B 27 0.400 17.385 -0.907 1.00 12.90 C ATOM 2207 NZ LYS B 27 1.501 17.303 -1.900 1.00 15.47 N ATOM 0 H LYS B 27 -3.360 20.118 1.308 1.00 2.64 H new ATOM 0 HA LYS B 27 -1.386 19.632 3.222 1.00 4.14 H new ATOM 0 HB2 LYS B 27 -1.351 20.957 0.488 1.00 3.97 H new ATOM 0 HB3 LYS B 27 0.114 20.650 1.400 1.00 3.97 H new ATOM 0 HG2 LYS B 27 -0.542 18.193 1.448 1.00 7.45 H new ATOM 0 HG3 LYS B 27 -1.841 18.586 0.339 1.00 7.45 H new ATOM 0 HD2 LYS B 27 -0.284 19.367 -1.345 1.00 9.02 H new ATOM 0 HD3 LYS B 27 1.059 19.304 -0.220 1.00 9.02 H new ATOM 0 HE2 LYS B 27 0.659 16.797 -0.026 1.00 12.90 H new ATOM 0 HE3 LYS B 27 -0.504 16.946 -1.329 1.00 12.90 H new ATOM 0 HZ1 LYS B 27 1.606 16.319 -2.221 1.00 15.47 H new ATOM 0 HZ2 LYS B 27 1.280 17.912 -2.714 1.00 15.47 H new ATOM 0 HZ3 LYS B 27 2.389 17.620 -1.461 1.00 15.47 H new ATOM 2221 N ALA B 28 -2.040 22.812 2.635 1.00 6.61 N ATOM 2222 CA ALA B 28 -1.864 24.171 3.125 1.00 7.74 C ATOM 2223 C ALA B 28 -2.285 24.290 4.587 1.00 9.17 C ATOM 2224 O ALA B 28 -1.652 25.000 5.370 1.00 11.45 O ATOM 2225 CB ALA B 28 -2.654 25.144 2.264 1.00 7.68 C ATOM 0 H ALA B 28 -2.695 22.730 1.858 1.00 6.61 H new ATOM 0 HA ALA B 28 -0.805 24.421 3.061 1.00 7.74 H new ATOM 0 HB1 ALA B 28 -2.515 26.158 2.640 1.00 7.68 H new ATOM 0 HB2 ALA B 28 -2.302 25.087 1.234 1.00 7.68 H new ATOM 0 HB3 ALA B 28 -3.712 24.885 2.300 1.00 7.68 H new ATOM 2231 N LYS B 29 -3.351 23.590 4.954 1.00 8.96 N ATOM 2232 CA LYS B 29 -3.841 23.620 6.328 1.00 7.90 C ATOM 2233 C LYS B 29 -2.869 22.888 7.248 1.00 6.92 C ATOM 2234 O LYS B 29 -2.665 23.282 8.398 1.00 6.87 O ATOM 2235 CB LYS B 29 -5.241 23.017 6.407 1.00 10.28 C ATOM 2236 CG LYS B 29 -6.284 23.842 5.666 1.00 14.94 C ATOM 2237 CD LYS B 29 -7.641 23.163 5.656 1.00 19.69 C ATOM 2238 CE LYS B 29 -8.517 23.685 4.528 1.00 22.63 C ATOM 2239 NZ LYS B 29 -8.949 25.095 4.738 1.00 24.98 N ATOM 0 H LYS B 29 -3.891 22.997 4.324 1.00 8.96 H new ATOM 0 HA LYS B 29 -3.906 24.656 6.660 1.00 7.90 H new ATOM 0 HB2 LYS B 29 -5.221 22.009 5.993 1.00 10.28 H new ATOM 0 HB3 LYS B 29 -5.533 22.926 7.453 1.00 10.28 H new ATOM 0 HG2 LYS B 29 -6.372 24.822 6.135 1.00 14.94 H new ATOM 0 HG3 LYS B 29 -5.954 24.008 4.641 1.00 14.94 H new ATOM 0 HD2 LYS B 29 -7.510 22.086 5.548 1.00 19.69 H new ATOM 0 HD3 LYS B 29 -8.139 23.329 6.611 1.00 19.69 H new ATOM 0 HE2 LYS B 29 -7.971 23.613 3.587 1.00 22.63 H new ATOM 0 HE3 LYS B 29 -9.398 23.050 4.435 1.00 22.63 H new ATOM 0 HZ1 LYS B 29 -9.543 25.399 3.940 1.00 24.98 H new ATOM 0 HZ2 LYS B 29 -9.494 25.163 5.621 1.00 24.98 H new ATOM 0 HZ3 LYS B 29 -8.112 25.709 4.800 1.00 24.98 H new ATOM 2253 N ILE B 30 -2.255 21.829 6.731 1.00 4.57 N ATOM 2254 CA ILE B 30 -1.269 21.073 7.490 1.00 5.58 C ATOM 2255 C ILE B 30 -0.018 21.932 7.665 1.00 7.26 C ATOM 2256 O ILE B 30 0.678 21.861 8.679 1.00 9.46 O ATOM 2257 CB ILE B 30 -0.914 19.737 6.794 1.00 5.36 C ATOM 2258 CG1 ILE B 30 -2.158 18.847 6.708 1.00 2.94 C ATOM 2259 CG2 ILE B 30 0.208 19.020 7.537 1.00 2.78 C ATOM 2260 CD1 ILE B 30 -1.947 17.572 5.920 1.00 2.00 C ATOM 0 H ILE B 30 -2.424 21.476 5.789 1.00 4.57 H new ATOM 0 HA ILE B 30 -1.691 20.825 8.464 1.00 5.58 H new ATOM 0 HB ILE B 30 -0.564 19.952 5.785 1.00 5.36 H new ATOM 0 HG12 ILE B 30 -2.479 18.590 7.717 1.00 2.94 H new ATOM 0 HG13 ILE B 30 -2.968 19.415 6.251 1.00 2.94 H new ATOM 0 HG21 ILE B 30 0.440 18.084 7.029 1.00 2.78 H new ATOM 0 HG22 ILE B 30 1.095 19.653 7.555 1.00 2.78 H new ATOM 0 HG23 ILE B 30 -0.108 18.810 8.559 1.00 2.78 H new ATOM 0 HD11 ILE B 30 -2.872 16.996 5.905 1.00 2.00 H new ATOM 0 HD12 ILE B 30 -1.657 17.819 4.899 1.00 2.00 H new ATOM 0 HD13 ILE B 30 -1.160 16.981 6.388 1.00 2.00 H new ATOM 2272 N GLN B 31 0.237 22.769 6.667 1.00 7.06 N ATOM 2273 CA GLN B 31 1.371 23.684 6.688 1.00 8.67 C ATOM 2274 C GLN B 31 1.120 24.801 7.704 1.00 10.90 C ATOM 2275 O GLN B 31 2.046 25.452 8.182 1.00 9.63 O ATOM 2276 CB GLN B 31 1.585 24.279 5.294 1.00 9.12 C ATOM 2277 CG GLN B 31 2.780 25.213 5.192 1.00 10.76 C ATOM 2278 CD GLN B 31 2.627 26.228 4.076 1.00 13.78 C ATOM 2279 OE1 GLN B 31 1.987 25.959 3.057 1.00 14.48 O ATOM 2280 NE2 GLN B 31 3.204 27.404 4.261 1.00 14.76 N ATOM 0 H GLN B 31 -0.334 22.833 5.824 1.00 7.06 H new ATOM 0 HA GLN B 31 2.267 23.136 6.980 1.00 8.67 H new ATOM 0 HB2 GLN B 31 1.712 23.466 4.580 1.00 9.12 H new ATOM 0 HB3 GLN B 31 0.687 24.823 5.002 1.00 9.12 H new ATOM 0 HG2 GLN B 31 2.911 25.736 6.139 1.00 10.76 H new ATOM 0 HG3 GLN B 31 3.683 24.626 5.024 1.00 10.76 H new ATOM 0 HE21 GLN B 31 3.725 27.587 5.119 1.00 14.76 H new ATOM 0 HE22 GLN B 31 3.128 28.128 3.546 1.00 14.76 H new ATOM 2289 N ASP B 32 -0.147 25.003 8.033 1.00 10.93 N ATOM 2290 CA ASP B 32 -0.539 26.027 8.993 1.00 14.01 C ATOM 2291 C ASP B 32 -0.487 25.479 10.414 1.00 14.04 C ATOM 2292 O ASP B 32 0.136 26.072 11.293 1.00 13.39 O ATOM 2293 CB ASP B 32 -1.949 26.538 8.684 1.00 18.01 C ATOM 2294 CG ASP B 32 -2.563 27.298 9.843 1.00 24.33 C ATOM 2295 OD1 ASP B 32 -2.086 28.409 10.154 1.00 25.17 O ATOM 2296 OD2 ASP B 32 -3.534 26.789 10.444 1.00 26.29 O ATOM 0 H ASP B 32 -0.926 24.469 7.648 1.00 10.93 H new ATOM 0 HA ASP B 32 0.164 26.856 8.911 1.00 14.01 H new ATOM 0 HB2 ASP B 32 -1.912 27.186 7.809 1.00 18.01 H new ATOM 0 HB3 ASP B 32 -2.589 25.694 8.429 1.00 18.01 H new ATOM 2301 N LYS B 33 -1.133 24.338 10.629 1.00 14.22 N ATOM 2302 CA LYS B 33 -1.171 23.720 11.951 1.00 14.00 C ATOM 2303 C LYS B 33 0.185 23.145 12.346 1.00 12.37 C ATOM 2304 O LYS B 33 0.718 23.465 13.409 1.00 12.17 O ATOM 2305 CB LYS B 33 -2.240 22.626 12.005 1.00 18.62 C ATOM 2306 CG LYS B 33 -3.659 23.166 12.086 1.00 24.00 C ATOM 2307 CD LYS B 33 -4.639 22.102 12.554 1.00 27.61 C ATOM 2308 CE LYS B 33 -6.021 22.688 12.792 1.00 27.64 C ATOM 2309 NZ LYS B 33 -6.942 21.703 13.420 1.00 30.06 N ATOM 0 H LYS B 33 -1.637 23.823 9.907 1.00 14.22 H new ATOM 0 HA LYS B 33 -1.425 24.502 12.666 1.00 14.00 H new ATOM 0 HB2 LYS B 33 -2.149 21.997 11.119 1.00 18.62 H new ATOM 0 HB3 LYS B 33 -2.053 21.989 12.869 1.00 18.62 H new ATOM 0 HG2 LYS B 33 -3.687 24.014 12.771 1.00 24.00 H new ATOM 0 HG3 LYS B 33 -3.964 23.537 11.107 1.00 24.00 H new ATOM 0 HD2 LYS B 33 -4.702 21.309 11.808 1.00 27.61 H new ATOM 0 HD3 LYS B 33 -4.272 21.646 13.474 1.00 27.61 H new ATOM 0 HE2 LYS B 33 -5.937 23.566 13.432 1.00 27.64 H new ATOM 0 HE3 LYS B 33 -6.441 23.024 11.844 1.00 27.64 H new ATOM 0 HZ1 LYS B 33 -7.840 22.170 13.658 1.00 30.06 H new ATOM 0 HZ2 LYS B 33 -7.123 20.924 12.755 1.00 30.06 H new ATOM 0 HZ3 LYS B 33 -6.508 21.325 14.286 1.00 30.06 H new ATOM 2323 N GLU B 34 0.746 22.302 11.493 1.00 10.11 N ATOM 2324 CA GLU B 34 2.034 21.684 11.777 1.00 10.07 C ATOM 2325 C GLU B 34 3.176 22.572 11.305 1.00 9.32 C ATOM 2326 O GLU B 34 4.062 22.931 12.084 1.00 11.61 O ATOM 2327 CB GLU B 34 2.125 20.315 11.099 1.00 14.77 C ATOM 2328 CG GLU B 34 1.016 19.358 11.503 1.00 18.75 C ATOM 2329 CD GLU B 34 0.928 19.172 13.002 1.00 22.28 C ATOM 2330 OE1 GLU B 34 1.745 18.415 13.560 1.00 21.95 O ATOM 2331 OE2 GLU B 34 0.050 19.789 13.636 1.00 25.19 O ATOM 0 H GLU B 34 0.332 22.030 10.601 1.00 10.11 H new ATOM 0 HA GLU B 34 2.119 21.555 12.856 1.00 10.07 H new ATOM 0 HB2 GLU B 34 2.098 20.452 10.018 1.00 14.77 H new ATOM 0 HB3 GLU B 34 3.088 19.864 11.339 1.00 14.77 H new ATOM 0 HG2 GLU B 34 0.063 19.733 11.130 1.00 18.75 H new ATOM 0 HG3 GLU B 34 1.185 18.391 11.029 1.00 18.75 H new ATOM 2338 N GLY B 35 3.139 22.939 10.032 1.00 7.22 N ATOM 2339 CA GLY B 35 4.183 23.776 9.470 1.00 6.29 C ATOM 2340 C GLY B 35 4.973 23.052 8.404 1.00 6.93 C ATOM 2341 O GLY B 35 5.900 23.607 7.816 1.00 7.41 O ATOM 0 H GLY B 35 2.404 22.672 9.376 1.00 7.22 H new ATOM 0 HA2 GLY B 35 3.738 24.675 9.044 1.00 6.29 H new ATOM 0 HA3 GLY B 35 4.856 24.099 10.264 1.00 6.29 H new ATOM 2345 N ILE B 36 4.593 21.807 8.157 1.00 5.86 N ATOM 2346 CA ILE B 36 5.259 20.977 7.162 1.00 6.07 C ATOM 2347 C ILE B 36 4.973 21.487 5.753 1.00 6.36 C ATOM 2348 O ILE B 36 3.815 21.649 5.377 1.00 6.18 O ATOM 2349 CB ILE B 36 4.795 19.510 7.271 1.00 7.47 C ATOM 2350 CG1 ILE B 36 4.890 19.031 8.723 1.00 8.52 C ATOM 2351 CG2 ILE B 36 5.623 18.614 6.356 1.00 7.36 C ATOM 2352 CD1 ILE B 36 4.250 17.681 8.962 1.00 9.49 C ATOM 0 H ILE B 36 3.820 21.345 8.636 1.00 5.86 H new ATOM 0 HA ILE B 36 6.331 21.030 7.355 1.00 6.07 H new ATOM 0 HB ILE B 36 3.754 19.452 6.953 1.00 7.47 H new ATOM 0 HG12 ILE B 36 5.940 18.982 9.012 1.00 8.52 H new ATOM 0 HG13 ILE B 36 4.415 19.768 9.371 1.00 8.52 H new ATOM 0 HG21 ILE B 36 5.280 17.584 6.448 1.00 7.36 H new ATOM 0 HG22 ILE B 36 5.509 18.944 5.323 1.00 7.36 H new ATOM 0 HG23 ILE B 36 6.673 18.673 6.642 1.00 7.36 H new ATOM 0 HD11 ILE B 36 4.357 17.408 10.012 1.00 9.49 H new ATOM 0 HD12 ILE B 36 3.192 17.730 8.706 1.00 9.49 H new ATOM 0 HD13 ILE B 36 4.740 16.931 8.341 1.00 9.49 H new ATOM 2364 N PRO B 37 6.023 21.769 4.968 1.00 8.65 N ATOM 2365 CA PRO B 37 5.869 22.246 3.592 1.00 9.18 C ATOM 2366 C PRO B 37 5.129 21.227 2.725 1.00 9.85 C ATOM 2367 O PRO B 37 5.422 20.032 2.785 1.00 8.51 O ATOM 2368 CB PRO B 37 7.312 22.412 3.098 1.00 11.42 C ATOM 2369 CG PRO B 37 8.145 22.490 4.328 1.00 9.27 C ATOM 2370 CD PRO B 37 7.438 21.660 5.360 1.00 8.33 C ATOM 0 HA PRO B 37 5.285 23.165 3.539 1.00 9.18 H new ATOM 0 HB2 PRO B 37 7.612 21.571 2.473 1.00 11.42 H new ATOM 0 HB3 PRO B 37 7.419 23.313 2.493 1.00 11.42 H new ATOM 0 HG2 PRO B 37 9.150 22.110 4.143 1.00 9.27 H new ATOM 0 HG3 PRO B 37 8.251 23.522 4.663 1.00 9.27 H new ATOM 0 HD2 PRO B 37 7.781 20.625 5.348 1.00 8.33 H new ATOM 0 HD3 PRO B 37 7.607 22.040 6.367 1.00 8.33 H new ATOM 2378 N PRO B 38 4.154 21.687 1.920 1.00 8.71 N ATOM 2379 CA PRO B 38 3.362 20.820 1.028 1.00 9.08 C ATOM 2380 C PRO B 38 4.219 19.903 0.147 1.00 9.28 C ATOM 2381 O PRO B 38 3.780 18.818 -0.245 1.00 6.50 O ATOM 2382 CB PRO B 38 2.598 21.821 0.160 1.00 10.31 C ATOM 2383 CG PRO B 38 2.466 23.032 1.015 1.00 10.81 C ATOM 2384 CD PRO B 38 3.725 23.098 1.833 1.00 12.00 C ATOM 0 HA PRO B 38 2.730 20.138 1.597 1.00 9.08 H new ATOM 0 HB2 PRO B 38 3.139 22.042 -0.760 1.00 10.31 H new ATOM 0 HB3 PRO B 38 1.622 21.431 -0.130 1.00 10.31 H new ATOM 0 HG2 PRO B 38 2.348 23.929 0.407 1.00 10.81 H new ATOM 0 HG3 PRO B 38 1.587 22.964 1.656 1.00 10.81 H new ATOM 0 HD2 PRO B 38 4.482 23.719 1.355 1.00 12.00 H new ATOM 0 HD3 PRO B 38 3.541 23.523 2.820 1.00 12.00 H new ATOM 2392 N ASP B 39 5.440 20.341 -0.146 1.00 11.20 N ATOM 2393 CA ASP B 39 6.366 19.567 -0.974 1.00 14.96 C ATOM 2394 C ASP B 39 6.806 18.288 -0.276 1.00 13.99 C ATOM 2395 O ASP B 39 7.155 17.307 -0.926 1.00 13.75 O ATOM 2396 CB ASP B 39 7.603 20.394 -1.318 1.00 24.16 C ATOM 2397 CG ASP B 39 7.494 21.076 -2.663 1.00 31.06 C ATOM 2398 OD1 ASP B 39 7.494 20.372 -3.694 1.00 35.55 O ATOM 2399 OD2 ASP B 39 7.420 22.324 -2.689 1.00 34.22 O ATOM 0 H ASP B 39 5.815 21.232 0.179 1.00 11.20 H new ATOM 0 HA ASP B 39 5.833 19.304 -1.888 1.00 14.96 H new ATOM 0 HB2 ASP B 39 7.758 21.147 -0.545 1.00 24.16 H new ATOM 0 HB3 ASP B 39 8.480 19.747 -1.313 1.00 24.16 H new ATOM 2404 N GLN B 40 6.785 18.300 1.046 1.00 11.60 N ATOM 2405 CA GLN B 40 7.197 17.137 1.821 1.00 10.76 C ATOM 2406 C GLN B 40 5.983 16.365 2.310 1.00 8.01 C ATOM 2407 O GLN B 40 6.101 15.459 3.131 1.00 8.96 O ATOM 2408 CB GLN B 40 8.046 17.563 3.023 1.00 11.14 C ATOM 2409 CG GLN B 40 9.155 18.544 2.677 1.00 14.85 C ATOM 2410 CD GLN B 40 10.069 18.828 3.853 1.00 16.11 C ATOM 2411 OE1 GLN B 40 9.660 18.735 5.012 1.00 20.52 O ATOM 2412 NE2 GLN B 40 11.309 19.190 3.565 1.00 18.16 N ATOM 0 H GLN B 40 6.488 19.099 1.606 1.00 11.60 H new ATOM 0 HA GLN B 40 7.793 16.495 1.172 1.00 10.76 H new ATOM 0 HB2 GLN B 40 7.396 18.014 3.773 1.00 11.14 H new ATOM 0 HB3 GLN B 40 8.488 16.676 3.476 1.00 11.14 H new ATOM 0 HG2 GLN B 40 9.744 18.144 1.852 1.00 14.85 H new ATOM 0 HG3 GLN B 40 8.714 19.478 2.330 1.00 14.85 H new ATOM 0 HE21 GLN B 40 11.608 19.255 2.592 1.00 18.16 H new ATOM 0 HE22 GLN B 40 11.965 19.404 4.316 1.00 18.16 H new ATOM 2421 N GLN B 41 4.821 16.728 1.795 1.00 6.52 N ATOM 2422 CA GLN B 41 3.581 16.085 2.191 1.00 3.87 C ATOM 2423 C GLN B 41 3.093 15.104 1.133 1.00 4.79 C ATOM 2424 O GLN B 41 2.695 15.504 0.040 1.00 6.34 O ATOM 2425 CB GLN B 41 2.493 17.130 2.436 1.00 4.20 C ATOM 2426 CG GLN B 41 2.772 18.071 3.594 1.00 3.20 C ATOM 2427 CD GLN B 41 1.560 18.916 3.930 1.00 4.89 C ATOM 2428 OE1 GLN B 41 0.425 18.474 3.775 1.00 5.21 O ATOM 2429 NE2 GLN B 41 1.785 20.136 4.385 1.00 7.13 N ATOM 0 H GLN B 41 4.711 17.466 1.100 1.00 6.52 H new ATOM 0 HA GLN B 41 3.784 15.535 3.110 1.00 3.87 H new ATOM 0 HB2 GLN B 41 2.363 17.720 1.529 1.00 4.20 H new ATOM 0 HB3 GLN B 41 1.549 16.617 2.621 1.00 4.20 H new ATOM 0 HG2 GLN B 41 3.068 17.493 4.470 1.00 3.20 H new ATOM 0 HG3 GLN B 41 3.611 18.720 3.342 1.00 3.20 H new ATOM 0 HE21 GLN B 41 2.742 20.469 4.501 1.00 7.13 H new ATOM 0 HE22 GLN B 41 1.001 20.745 4.621 1.00 7.13 H new ATOM 2438 N ARG B 42 3.140 13.823 1.455 1.00 5.73 N ATOM 2439 CA ARG B 42 2.652 12.800 0.550 1.00 6.97 C ATOM 2440 C ARG B 42 1.479 12.085 1.210 1.00 7.15 C ATOM 2441 O ARG B 42 1.663 11.206 2.055 1.00 7.33 O ATOM 2442 CB ARG B 42 3.768 11.821 0.176 1.00 13.23 C ATOM 2443 CG ARG B 42 4.246 11.996 -1.257 1.00 21.27 C ATOM 2444 CD ARG B 42 5.593 11.334 -1.490 1.00 26.14 C ATOM 2445 NE ARG B 42 5.982 11.377 -2.900 1.00 32.26 N ATOM 2446 CZ ARG B 42 6.815 10.511 -3.479 1.00 34.32 C ATOM 2447 NH1 ARG B 42 7.391 9.550 -2.766 1.00 35.30 N ATOM 2448 NH2 ARG B 42 7.080 10.611 -4.776 1.00 36.39 N ATOM 0 H ARG B 42 3.511 13.468 2.336 1.00 5.73 H new ATOM 0 HA ARG B 42 2.314 13.261 -0.378 1.00 6.97 H new ATOM 0 HB2 ARG B 42 4.610 11.959 0.855 1.00 13.23 H new ATOM 0 HB3 ARG B 42 3.412 10.800 0.314 1.00 13.23 H new ATOM 0 HG2 ARG B 42 3.510 11.571 -1.940 1.00 21.27 H new ATOM 0 HG3 ARG B 42 4.319 13.059 -1.488 1.00 21.27 H new ATOM 0 HD2 ARG B 42 6.352 11.833 -0.888 1.00 26.14 H new ATOM 0 HD3 ARG B 42 5.551 10.297 -1.156 1.00 26.14 H new ATOM 0 HE ARG B 42 5.590 12.119 -3.479 1.00 32.26 H new ATOM 0 HH11 ARG B 42 7.198 9.470 -1.768 1.00 35.30 H new ATOM 0 HH12 ARG B 42 8.027 8.892 -3.217 1.00 35.30 H new ATOM 0 HH21 ARG B 42 6.647 11.350 -5.330 1.00 36.39 H new ATOM 0 HH22 ARG B 42 7.717 9.949 -5.219 1.00 36.39 H new ATOM 2462 N LEU B 43 0.273 12.504 0.843 1.00 4.65 N ATOM 2463 CA LEU B 43 -0.953 11.949 1.408 1.00 3.51 C ATOM 2464 C LEU B 43 -1.374 10.661 0.713 1.00 5.56 C ATOM 2465 O LEU B 43 -1.334 10.557 -0.515 1.00 4.19 O ATOM 2466 CB LEU B 43 -2.082 12.978 1.304 1.00 3.74 C ATOM 2467 CG LEU B 43 -2.049 14.102 2.340 1.00 6.32 C ATOM 2468 CD1 LEU B 43 -2.962 15.245 1.920 1.00 9.55 C ATOM 2469 CD2 LEU B 43 -2.456 13.571 3.707 1.00 6.41 C ATOM 0 H LEU B 43 0.117 13.235 0.149 1.00 4.65 H new ATOM 0 HA LEU B 43 -0.754 11.712 2.453 1.00 3.51 H new ATOM 0 HB2 LEU B 43 -2.053 13.424 0.310 1.00 3.74 H new ATOM 0 HB3 LEU B 43 -3.035 12.456 1.391 1.00 3.74 H new ATOM 0 HG LEU B 43 -1.030 14.484 2.403 1.00 6.32 H new ATOM 0 HD11 LEU B 43 -2.925 16.035 2.670 1.00 9.55 H new ATOM 0 HD12 LEU B 43 -2.631 15.641 0.960 1.00 9.55 H new ATOM 0 HD13 LEU B 43 -3.985 14.879 1.829 1.00 9.55 H new ATOM 0 HD21 LEU B 43 -2.428 14.382 4.435 1.00 6.41 H new ATOM 0 HD22 LEU B 43 -3.466 13.166 3.654 1.00 6.41 H new ATOM 0 HD23 LEU B 43 -1.765 12.785 4.012 1.00 6.41 H new ATOM 2481 N ILE B 44 -1.779 9.683 1.510 1.00 4.58 N ATOM 2482 CA ILE B 44 -2.228 8.399 0.993 1.00 5.55 C ATOM 2483 C ILE B 44 -3.582 8.038 1.598 1.00 5.46 C ATOM 2484 O ILE B 44 -3.868 8.379 2.751 1.00 6.04 O ATOM 2485 CB ILE B 44 -1.223 7.260 1.295 1.00 6.80 C ATOM 2486 CG1 ILE B 44 0.221 7.754 1.171 1.00 10.31 C ATOM 2487 CG2 ILE B 44 -1.460 6.081 0.361 1.00 7.39 C ATOM 2488 CD1 ILE B 44 0.883 8.033 2.505 1.00 13.90 C ATOM 0 H ILE B 44 -1.806 9.756 2.527 1.00 4.58 H new ATOM 0 HA ILE B 44 -2.308 8.501 -0.089 1.00 5.55 H new ATOM 0 HB ILE B 44 -1.383 6.932 2.322 1.00 6.80 H new ATOM 0 HG12 ILE B 44 0.806 7.008 0.633 1.00 10.31 H new ATOM 0 HG13 ILE B 44 0.235 8.664 0.571 1.00 10.31 H new ATOM 0 HG21 ILE B 44 -0.746 5.289 0.586 1.00 7.39 H new ATOM 0 HG22 ILE B 44 -2.474 5.705 0.499 1.00 7.39 H new ATOM 0 HG23 ILE B 44 -1.330 6.403 -0.672 1.00 7.39 H new ATOM 0 HD11 ILE B 44 1.903 8.379 2.340 1.00 13.90 H new ATOM 0 HD12 ILE B 44 0.321 8.801 3.037 1.00 13.90 H new ATOM 0 HD13 ILE B 44 0.902 7.120 3.100 1.00 13.90 H new ATOM 2500 N PHE B 45 -4.418 7.379 0.810 1.00 6.75 N ATOM 2501 CA PHE B 45 -5.736 6.967 1.261 1.00 4.70 C ATOM 2502 C PHE B 45 -6.095 5.606 0.669 1.00 6.34 C ATOM 2503 O PHE B 45 -6.461 5.515 -0.499 1.00 5.45 O ATOM 2504 CB PHE B 45 -6.780 8.012 0.857 1.00 5.51 C ATOM 2505 CG PHE B 45 -8.121 7.828 1.511 1.00 5.98 C ATOM 2506 CD1 PHE B 45 -8.330 8.237 2.820 1.00 6.86 C ATOM 2507 CD2 PHE B 45 -9.176 7.256 0.817 1.00 5.87 C ATOM 2508 CE1 PHE B 45 -9.565 8.081 3.422 1.00 6.68 C ATOM 2509 CE2 PHE B 45 -10.412 7.096 1.414 1.00 6.64 C ATOM 2510 CZ PHE B 45 -10.605 7.510 2.717 1.00 6.84 C ATOM 0 H PHE B 45 -4.203 7.117 -0.152 1.00 6.75 H new ATOM 0 HA PHE B 45 -5.725 6.883 2.348 1.00 4.70 H new ATOM 0 HB2 PHE B 45 -6.400 9.003 1.105 1.00 5.51 H new ATOM 0 HB3 PHE B 45 -6.909 7.981 -0.225 1.00 5.51 H new ATOM 0 HD1 PHE B 45 -7.518 8.683 3.376 1.00 6.86 H new ATOM 0 HD2 PHE B 45 -9.030 6.931 -0.203 1.00 5.87 H new ATOM 0 HE1 PHE B 45 -9.715 8.405 4.441 1.00 6.68 H new ATOM 0 HE2 PHE B 45 -11.225 6.648 0.862 1.00 6.64 H new ATOM 0 HZ PHE B 45 -11.571 7.387 3.185 1.00 6.84 H new ATOM 2520 N ALA B 46 -5.956 4.554 1.476 1.00 6.53 N ATOM 2521 CA ALA B 46 -6.269 3.186 1.054 1.00 7.15 C ATOM 2522 C ALA B 46 -5.410 2.745 -0.128 1.00 9.00 C ATOM 2523 O ALA B 46 -5.903 2.111 -1.061 1.00 11.15 O ATOM 2524 CB ALA B 46 -7.753 3.049 0.726 1.00 8.99 C ATOM 0 H ALA B 46 -5.624 4.624 2.438 1.00 6.53 H new ATOM 0 HA ALA B 46 -6.036 2.525 1.889 1.00 7.15 H new ATOM 0 HB1 ALA B 46 -7.964 2.026 0.415 1.00 8.99 H new ATOM 0 HB2 ALA B 46 -8.345 3.289 1.610 1.00 8.99 H new ATOM 0 HB3 ALA B 46 -8.012 3.734 -0.081 1.00 8.99 H new ATOM 2530 N GLY B 47 -4.125 3.075 -0.078 1.00 9.35 N ATOM 2531 CA GLY B 47 -3.221 2.700 -1.152 1.00 11.68 C ATOM 2532 C GLY B 47 -3.318 3.634 -2.341 1.00 11.14 C ATOM 2533 O GLY B 47 -2.759 3.368 -3.407 1.00 13.93 O ATOM 0 H GLY B 47 -3.692 3.595 0.685 1.00 9.35 H new ATOM 0 HA2 GLY B 47 -2.197 2.698 -0.778 1.00 11.68 H new ATOM 0 HA3 GLY B 47 -3.445 1.683 -1.473 1.00 11.68 H new ATOM 2537 N LYS B 48 -4.047 4.725 -2.169 1.00 10.47 N ATOM 2538 CA LYS B 48 -4.208 5.706 -3.226 1.00 8.82 C ATOM 2539 C LYS B 48 -3.508 7.001 -2.850 1.00 7.68 C ATOM 2540 O LYS B 48 -3.893 7.666 -1.888 1.00 6.47 O ATOM 2541 CB LYS B 48 -5.692 5.976 -3.493 1.00 9.74 C ATOM 2542 CG LYS B 48 -6.507 4.721 -3.761 1.00 14.14 C ATOM 2543 CD LYS B 48 -7.974 5.044 -4.016 1.00 16.32 C ATOM 2544 CE LYS B 48 -8.640 5.668 -2.798 1.00 20.04 C ATOM 2545 NZ LYS B 48 -10.124 5.669 -2.914 1.00 23.92 N ATOM 0 H LYS B 48 -4.537 4.952 -1.304 1.00 10.47 H new ATOM 0 HA LYS B 48 -3.758 5.306 -4.135 1.00 8.82 H new ATOM 0 HB2 LYS B 48 -6.117 6.497 -2.635 1.00 9.74 H new ATOM 0 HB3 LYS B 48 -5.781 6.645 -4.349 1.00 9.74 H new ATOM 0 HG2 LYS B 48 -6.095 4.197 -4.623 1.00 14.14 H new ATOM 0 HG3 LYS B 48 -6.426 4.046 -2.909 1.00 14.14 H new ATOM 0 HD2 LYS B 48 -8.053 5.727 -4.862 1.00 16.32 H new ATOM 0 HD3 LYS B 48 -8.504 4.132 -4.291 1.00 16.32 H new ATOM 0 HE2 LYS B 48 -8.347 5.119 -1.903 1.00 20.04 H new ATOM 0 HE3 LYS B 48 -8.285 6.691 -2.675 1.00 20.04 H new ATOM 0 HZ1 LYS B 48 -10.502 6.559 -2.531 1.00 23.92 H new ATOM 0 HZ2 LYS B 48 -10.394 5.580 -3.914 1.00 23.92 H new ATOM 0 HZ3 LYS B 48 -10.515 4.868 -2.377 1.00 23.92 H new ATOM 2559 N GLN B 49 -2.467 7.343 -3.592 1.00 8.89 N ATOM 2560 CA GLN B 49 -1.730 8.569 -3.344 1.00 7.18 C ATOM 2561 C GLN B 49 -2.574 9.749 -3.799 1.00 8.23 C ATOM 2562 O GLN B 49 -3.015 9.796 -4.949 1.00 9.70 O ATOM 2563 CB GLN B 49 -0.388 8.544 -4.079 1.00 11.67 C ATOM 2564 CG GLN B 49 0.792 8.959 -3.215 1.00 15.82 C ATOM 2565 CD GLN B 49 1.091 10.444 -3.299 1.00 20.21 C ATOM 2566 OE1 GLN B 49 1.864 10.887 -4.144 1.00 23.23 O ATOM 2567 NE2 GLN B 49 0.486 11.224 -2.421 1.00 20.67 N ATOM 0 H GLN B 49 -2.114 6.788 -4.371 1.00 8.89 H new ATOM 0 HA GLN B 49 -1.522 8.664 -2.278 1.00 7.18 H new ATOM 0 HB2 GLN B 49 -0.212 7.538 -4.460 1.00 11.67 H new ATOM 0 HB3 GLN B 49 -0.445 9.206 -4.943 1.00 11.67 H new ATOM 0 HG2 GLN B 49 0.588 8.693 -2.178 1.00 15.82 H new ATOM 0 HG3 GLN B 49 1.675 8.398 -3.521 1.00 15.82 H new ATOM 0 HE21 GLN B 49 -0.150 10.820 -1.733 1.00 20.67 H new ATOM 0 HE22 GLN B 49 0.655 12.230 -2.431 1.00 20.67 H new ATOM 2576 N LEU B 50 -2.821 10.676 -2.886 1.00 6.51 N ATOM 2577 CA LEU B 50 -3.636 11.844 -3.183 1.00 7.41 C ATOM 2578 C LEU B 50 -2.852 12.873 -3.986 1.00 8.27 C ATOM 2579 O LEU B 50 -1.894 13.471 -3.487 1.00 8.34 O ATOM 2580 CB LEU B 50 -4.162 12.483 -1.892 1.00 7.13 C ATOM 2581 CG LEU B 50 -4.758 11.513 -0.865 1.00 7.53 C ATOM 2582 CD1 LEU B 50 -5.448 12.280 0.252 1.00 8.14 C ATOM 2583 CD2 LEU B 50 -5.734 10.555 -1.524 1.00 9.11 C ATOM 0 H LEU B 50 -2.467 10.642 -1.930 1.00 6.51 H new ATOM 0 HA LEU B 50 -4.482 11.509 -3.783 1.00 7.41 H new ATOM 0 HB2 LEU B 50 -3.345 13.027 -1.419 1.00 7.13 H new ATOM 0 HB3 LEU B 50 -4.923 13.217 -2.156 1.00 7.13 H new ATOM 0 HG LEU B 50 -3.942 10.930 -0.439 1.00 7.53 H new ATOM 0 HD11 LEU B 50 -5.866 11.577 0.972 1.00 8.14 H new ATOM 0 HD12 LEU B 50 -4.725 12.925 0.752 1.00 8.14 H new ATOM 0 HD13 LEU B 50 -6.249 12.890 -0.166 1.00 8.14 H new ATOM 0 HD21 LEU B 50 -6.142 9.878 -0.774 1.00 9.11 H new ATOM 0 HD22 LEU B 50 -6.545 11.120 -1.982 1.00 9.11 H new ATOM 0 HD23 LEU B 50 -5.216 9.978 -2.290 1.00 9.11 H new ATOM 2595 N GLU B 51 -3.259 13.064 -5.232 1.00 9.43 N ATOM 2596 CA GLU B 51 -2.616 14.021 -6.116 1.00 11.90 C ATOM 2597 C GLU B 51 -2.992 15.444 -5.713 1.00 11.49 C ATOM 2598 O GLU B 51 -4.096 15.687 -5.229 1.00 9.88 O ATOM 2599 CB GLU B 51 -3.019 13.749 -7.568 1.00 16.56 C ATOM 2600 CG GLU B 51 -2.614 12.370 -8.061 1.00 26.06 C ATOM 2601 CD GLU B 51 -2.976 12.140 -9.512 1.00 29.86 C ATOM 2602 OE1 GLU B 51 -2.330 12.746 -10.392 1.00 33.44 O ATOM 2603 OE2 GLU B 51 -3.906 11.351 -9.782 1.00 32.13 O ATOM 0 H GLU B 51 -4.040 12.563 -5.656 1.00 9.43 H new ATOM 0 HA GLU B 51 -1.535 13.912 -6.030 1.00 11.90 H new ATOM 0 HB2 GLU B 51 -4.099 13.857 -7.663 1.00 16.56 H new ATOM 0 HB3 GLU B 51 -2.565 14.504 -8.210 1.00 16.56 H new ATOM 0 HG2 GLU B 51 -1.539 12.245 -7.935 1.00 26.06 H new ATOM 0 HG3 GLU B 51 -3.098 11.612 -7.445 1.00 26.06 H new ATOM 2610 N ASP B 52 -2.071 16.374 -5.920 1.00 12.71 N ATOM 2611 CA ASP B 52 -2.285 17.774 -5.565 1.00 16.56 C ATOM 2612 C ASP B 52 -3.440 18.374 -6.357 1.00 15.83 C ATOM 2613 O ASP B 52 -4.140 19.263 -5.871 1.00 17.21 O ATOM 2614 CB ASP B 52 -1.013 18.590 -5.813 1.00 21.05 C ATOM 2615 CG ASP B 52 0.172 18.087 -5.015 1.00 25.12 C ATOM 2616 OD1 ASP B 52 0.801 17.093 -5.443 1.00 28.37 O ATOM 2617 OD2 ASP B 52 0.487 18.680 -3.961 1.00 25.82 O ATOM 0 H ASP B 52 -1.159 16.184 -6.336 1.00 12.71 H new ATOM 0 HA ASP B 52 -2.536 17.811 -4.505 1.00 16.56 H new ATOM 0 HB2 ASP B 52 -0.769 18.560 -6.875 1.00 21.05 H new ATOM 0 HB3 ASP B 52 -1.200 19.633 -5.558 1.00 21.05 H new ATOM 2622 N GLY B 53 -3.629 17.889 -7.575 1.00 15.00 N ATOM 2623 CA GLY B 53 -4.702 18.385 -8.416 1.00 11.77 C ATOM 2624 C GLY B 53 -5.939 17.513 -8.355 1.00 11.10 C ATOM 2625 O GLY B 53 -6.500 17.153 -9.390 1.00 11.25 O ATOM 0 H GLY B 53 -3.057 17.158 -7.998 1.00 15.00 H new ATOM 0 HA2 GLY B 53 -4.961 19.398 -8.109 1.00 11.77 H new ATOM 0 HA3 GLY B 53 -4.353 18.443 -9.447 1.00 11.77 H new ATOM 2629 N ARG B 54 -6.353 17.155 -7.148 1.00 8.53 N ATOM 2630 CA ARG B 54 -7.532 16.323 -6.955 1.00 9.05 C ATOM 2631 C ARG B 54 -8.301 16.784 -5.727 1.00 8.96 C ATOM 2632 O ARG B 54 -7.792 17.576 -4.929 1.00 11.60 O ATOM 2633 CB ARG B 54 -7.138 14.852 -6.789 1.00 7.97 C ATOM 2634 CG ARG B 54 -6.688 14.177 -8.075 1.00 9.62 C ATOM 2635 CD ARG B 54 -7.807 14.117 -9.103 1.00 12.20 C ATOM 2636 NE ARG B 54 -7.420 13.347 -10.284 1.00 18.23 N ATOM 2637 CZ ARG B 54 -6.751 13.853 -11.322 1.00 22.08 C ATOM 2638 NH1 ARG B 54 -6.390 15.134 -11.336 1.00 25.50 N ATOM 2639 NH2 ARG B 54 -6.435 13.074 -12.347 1.00 23.38 N ATOM 0 H ARG B 54 -5.887 17.430 -6.283 1.00 8.53 H new ATOM 0 HA ARG B 54 -8.164 16.419 -7.838 1.00 9.05 H new ATOM 0 HB2 ARG B 54 -6.334 14.784 -6.056 1.00 7.97 H new ATOM 0 HB3 ARG B 54 -7.988 14.304 -6.383 1.00 7.97 H new ATOM 0 HG2 ARG B 54 -5.840 14.719 -8.492 1.00 9.62 H new ATOM 0 HG3 ARG B 54 -6.343 13.167 -7.854 1.00 9.62 H new ATOM 0 HD2 ARG B 54 -8.692 13.669 -8.651 1.00 12.20 H new ATOM 0 HD3 ARG B 54 -8.080 15.129 -9.402 1.00 12.20 H new ATOM 0 HE ARG B 54 -7.678 12.361 -10.317 1.00 18.23 H new ATOM 0 HH11 ARG B 54 -6.624 15.739 -10.549 1.00 25.50 H new ATOM 0 HH12 ARG B 54 -5.879 15.511 -12.134 1.00 25.50 H new ATOM 0 HH21 ARG B 54 -6.703 12.090 -12.341 1.00 23.38 H new ATOM 0 HH22 ARG B 54 -5.924 13.459 -13.141 1.00 23.38 H new ATOM 2653 N THR B 55 -9.521 16.294 -5.577 1.00 9.05 N ATOM 2654 CA THR B 55 -10.350 16.649 -4.436 1.00 9.03 C ATOM 2655 C THR B 55 -10.537 15.448 -3.513 1.00 8.15 C ATOM 2656 O THR B 55 -10.207 14.320 -3.877 1.00 5.91 O ATOM 2657 CB THR B 55 -11.729 17.175 -4.882 1.00 11.15 C ATOM 2658 OG1 THR B 55 -12.336 16.260 -5.804 1.00 11.95 O ATOM 2659 CG2 THR B 55 -11.602 18.542 -5.532 1.00 11.71 C ATOM 0 H THR B 55 -9.960 15.648 -6.233 1.00 9.05 H new ATOM 0 HA THR B 55 -9.835 17.444 -3.896 1.00 9.03 H new ATOM 0 HB THR B 55 -12.358 17.265 -3.996 1.00 11.15 H new ATOM 0 HG1 THR B 55 -11.742 16.127 -6.572 1.00 11.95 H new ATOM 0 HG21 THR B 55 -12.588 18.892 -5.838 1.00 11.71 H new ATOM 0 HG22 THR B 55 -11.172 19.245 -4.819 1.00 11.71 H new ATOM 0 HG23 THR B 55 -10.955 18.471 -6.406 1.00 11.71 H new ATOM 2667 N LEU B 56 -11.066 15.696 -2.323 1.00 6.91 N ATOM 2668 CA LEU B 56 -11.291 14.633 -1.349 1.00 8.29 C ATOM 2669 C LEU B 56 -12.331 13.627 -1.844 1.00 8.05 C ATOM 2670 O LEU B 56 -12.222 12.425 -1.583 1.00 10.17 O ATOM 2671 CB LEU B 56 -11.733 15.231 -0.014 1.00 6.60 C ATOM 2672 CG LEU B 56 -10.708 16.152 0.652 1.00 7.73 C ATOM 2673 CD1 LEU B 56 -11.357 16.955 1.762 1.00 9.85 C ATOM 2674 CD2 LEU B 56 -9.538 15.352 1.200 1.00 8.64 C ATOM 0 H LEU B 56 -11.348 16.624 -2.007 1.00 6.91 H new ATOM 0 HA LEU B 56 -10.350 14.100 -1.213 1.00 8.29 H new ATOM 0 HB2 LEU B 56 -12.655 15.791 -0.171 1.00 6.60 H new ATOM 0 HB3 LEU B 56 -11.968 14.417 0.672 1.00 6.60 H new ATOM 0 HG LEU B 56 -10.331 16.840 -0.104 1.00 7.73 H new ATOM 0 HD11 LEU B 56 -10.613 17.604 2.224 1.00 9.85 H new ATOM 0 HD12 LEU B 56 -12.162 17.562 1.349 1.00 9.85 H new ATOM 0 HD13 LEU B 56 -11.763 16.277 2.512 1.00 9.85 H new ATOM 0 HD21 LEU B 56 -8.823 16.028 1.669 1.00 8.64 H new ATOM 0 HD22 LEU B 56 -9.900 14.638 1.939 1.00 8.64 H new ATOM 0 HD23 LEU B 56 -9.051 14.816 0.386 1.00 8.64 H new ATOM 2686 N SER B 57 -13.329 14.115 -2.572 1.00 8.92 N ATOM 2687 CA SER B 57 -14.383 13.259 -3.099 1.00 9.00 C ATOM 2688 C SER B 57 -13.854 12.357 -4.208 1.00 9.44 C ATOM 2689 O SER B 57 -14.424 11.299 -4.485 1.00 10.91 O ATOM 2690 CB SER B 57 -15.542 14.113 -3.615 1.00 10.32 C ATOM 2691 OG SER B 57 -15.065 15.329 -4.173 1.00 13.59 O ATOM 0 H SER B 57 -13.430 15.102 -2.811 1.00 8.92 H new ATOM 0 HA SER B 57 -14.743 12.622 -2.291 1.00 9.00 H new ATOM 0 HB2 SER B 57 -16.102 13.558 -4.368 1.00 10.32 H new ATOM 0 HB3 SER B 57 -16.232 14.328 -2.799 1.00 10.32 H new ATOM 0 HG SER B 57 -14.980 16.002 -3.466 1.00 13.59 H new ATOM 2697 N ASP B 58 -12.742 12.763 -4.820 1.00 9.11 N ATOM 2698 CA ASP B 58 -12.129 11.995 -5.903 1.00 7.91 C ATOM 2699 C ASP B 58 -11.607 10.660 -5.398 1.00 9.12 C ATOM 2700 O ASP B 58 -11.452 9.709 -6.164 1.00 8.61 O ATOM 2701 CB ASP B 58 -10.967 12.768 -6.534 1.00 8.41 C ATOM 2702 CG ASP B 58 -11.416 13.787 -7.557 1.00 11.50 C ATOM 2703 OD1 ASP B 58 -12.249 13.444 -8.418 1.00 10.05 O ATOM 2704 OD2 ASP B 58 -10.925 14.934 -7.512 1.00 11.70 O ATOM 0 H ASP B 58 -12.246 13.622 -4.583 1.00 9.11 H new ATOM 0 HA ASP B 58 -12.903 11.823 -6.652 1.00 7.91 H new ATOM 0 HB2 ASP B 58 -10.406 13.274 -5.748 1.00 8.41 H new ATOM 0 HB3 ASP B 58 -10.285 12.063 -7.008 1.00 8.41 H new ATOM 2709 N TYR B 59 -11.328 10.594 -4.106 1.00 7.97 N ATOM 2710 CA TYR B 59 -10.803 9.378 -3.507 1.00 8.45 C ATOM 2711 C TYR B 59 -11.818 8.749 -2.565 1.00 10.98 C ATOM 2712 O TYR B 59 -11.487 7.838 -1.804 1.00 12.95 O ATOM 2713 CB TYR B 59 -9.501 9.680 -2.773 1.00 7.94 C ATOM 2714 CG TYR B 59 -8.417 10.191 -3.693 1.00 6.91 C ATOM 2715 CD1 TYR B 59 -7.659 9.315 -4.462 1.00 4.59 C ATOM 2716 CD2 TYR B 59 -8.153 11.552 -3.796 1.00 6.98 C ATOM 2717 CE1 TYR B 59 -6.669 9.781 -5.307 1.00 5.39 C ATOM 2718 CE2 TYR B 59 -7.165 12.025 -4.639 1.00 6.52 C ATOM 2719 CZ TYR B 59 -6.426 11.137 -5.390 1.00 6.76 C ATOM 2720 OH TYR B 59 -5.442 11.608 -6.230 1.00 7.63 O ATOM 0 H TYR B 59 -11.456 11.367 -3.453 1.00 7.97 H new ATOM 0 HA TYR B 59 -10.601 8.661 -4.302 1.00 8.45 H new ATOM 0 HB2 TYR B 59 -9.690 10.420 -1.996 1.00 7.94 H new ATOM 0 HB3 TYR B 59 -9.152 8.776 -2.274 1.00 7.94 H new ATOM 0 HD1 TYR B 59 -7.847 8.253 -4.398 1.00 4.59 H new ATOM 0 HD2 TYR B 59 -8.729 12.251 -3.208 1.00 6.98 H new ATOM 0 HE1 TYR B 59 -6.089 9.088 -5.899 1.00 5.39 H new ATOM 0 HE2 TYR B 59 -6.973 13.086 -4.709 1.00 6.52 H new ATOM 0 HH TYR B 59 -5.557 11.216 -7.121 1.00 7.63 H new ATOM 2730 N ASN B 60 -13.051 9.239 -2.638 1.00 12.38 N ATOM 2731 CA ASN B 60 -14.154 8.740 -1.811 1.00 13.94 C ATOM 2732 C ASN B 60 -13.895 8.950 -0.320 1.00 14.16 C ATOM 2733 O ASN B 60 -14.221 8.095 0.503 1.00 14.26 O ATOM 2734 CB ASN B 60 -14.422 7.257 -2.094 1.00 19.23 C ATOM 2735 CG ASN B 60 -15.347 7.045 -3.278 1.00 22.65 C ATOM 2736 OD1 ASN B 60 -16.243 7.852 -3.540 1.00 25.45 O ATOM 2737 ND2 ASN B 60 -15.131 5.962 -4.008 1.00 24.09 N ATOM 0 H ASN B 60 -13.318 9.993 -3.271 1.00 12.38 H new ATOM 0 HA ASN B 60 -15.038 9.319 -2.080 1.00 13.94 H new ATOM 0 HB2 ASN B 60 -13.475 6.750 -2.282 1.00 19.23 H new ATOM 0 HB3 ASN B 60 -14.860 6.796 -1.209 1.00 19.23 H new ATOM 0 HD21 ASN B 60 -15.716 5.770 -4.821 1.00 24.09 H new ATOM 0 HD22 ASN B 60 -14.379 5.320 -3.757 1.00 24.09 H new ATOM 2744 N ILE B 61 -13.316 10.092 0.028 1.00 11.08 N ATOM 2745 CA ILE B 61 -13.043 10.407 1.422 1.00 11.78 C ATOM 2746 C ILE B 61 -14.300 10.971 2.078 1.00 13.74 C ATOM 2747 O ILE B 61 -14.932 11.883 1.541 1.00 14.60 O ATOM 2748 CB ILE B 61 -11.877 11.412 1.554 1.00 11.80 C ATOM 2749 CG1 ILE B 61 -10.613 10.827 0.917 1.00 11.56 C ATOM 2750 CG2 ILE B 61 -11.627 11.763 3.016 1.00 13.29 C ATOM 2751 CD1 ILE B 61 -9.437 11.779 0.896 1.00 11.42 C ATOM 0 H ILE B 61 -13.028 10.812 -0.634 1.00 11.08 H new ATOM 0 HA ILE B 61 -12.749 9.488 1.929 1.00 11.78 H new ATOM 0 HB ILE B 61 -12.145 12.330 1.030 1.00 11.80 H new ATOM 0 HG12 ILE B 61 -10.328 9.926 1.461 1.00 11.56 H new ATOM 0 HG13 ILE B 61 -10.840 10.524 -0.105 1.00 11.56 H new ATOM 0 HG21 ILE B 61 -10.802 12.472 3.084 1.00 13.29 H new ATOM 0 HG22 ILE B 61 -12.525 12.210 3.442 1.00 13.29 H new ATOM 0 HG23 ILE B 61 -11.375 10.858 3.569 1.00 13.29 H new ATOM 0 HD11 ILE B 61 -8.582 11.290 0.430 1.00 11.42 H new ATOM 0 HD12 ILE B 61 -9.701 12.670 0.327 1.00 11.42 H new ATOM 0 HD13 ILE B 61 -9.180 12.063 1.917 1.00 11.42 H new ATOM 2763 N GLN B 62 -14.671 10.407 3.221 1.00 13.97 N ATOM 2764 CA GLN B 62 -15.863 10.836 3.941 1.00 15.52 C ATOM 2765 C GLN B 62 -15.496 11.473 5.276 1.00 13.94 C ATOM 2766 O GLN B 62 -14.317 11.643 5.592 1.00 12.15 O ATOM 2767 CB GLN B 62 -16.788 9.636 4.165 1.00 19.53 C ATOM 2768 CG GLN B 62 -17.252 8.984 2.874 1.00 26.38 C ATOM 2769 CD GLN B 62 -17.659 7.538 3.060 1.00 30.61 C ATOM 2770 OE1 GLN B 62 -18.178 7.152 4.107 1.00 33.23 O ATOM 2771 NE2 GLN B 62 -17.428 6.726 2.042 1.00 32.71 N ATOM 0 H GLN B 62 -14.160 9.647 3.671 1.00 13.97 H new ATOM 0 HA GLN B 62 -16.380 11.585 3.341 1.00 15.52 H new ATOM 0 HB2 GLN B 62 -16.269 8.894 4.772 1.00 19.53 H new ATOM 0 HB3 GLN B 62 -17.660 9.960 4.734 1.00 19.53 H new ATOM 0 HG2 GLN B 62 -18.095 9.545 2.472 1.00 26.38 H new ATOM 0 HG3 GLN B 62 -16.451 9.039 2.136 1.00 26.38 H new ATOM 0 HE21 GLN B 62 -16.996 7.085 1.191 1.00 32.71 H new ATOM 0 HE22 GLN B 62 -17.682 5.740 2.108 1.00 32.71 H new ATOM 2780 N LYS B 63 -16.508 11.814 6.058 1.00 11.73 N ATOM 2781 CA LYS B 63 -16.301 12.435 7.358 1.00 11.97 C ATOM 2782 C LYS B 63 -15.678 11.458 8.353 1.00 10.41 C ATOM 2783 O LYS B 63 -15.975 10.261 8.336 1.00 9.59 O ATOM 2784 CB LYS B 63 -17.628 12.966 7.916 1.00 13.73 C ATOM 2785 CG LYS B 63 -18.698 11.897 8.072 1.00 16.98 C ATOM 2786 CD LYS B 63 -19.930 12.431 8.784 1.00 20.19 C ATOM 2787 CE LYS B 63 -20.961 11.335 9.003 1.00 23.42 C ATOM 2788 NZ LYS B 63 -22.037 11.759 9.938 1.00 25.97 N ATOM 0 H LYS B 63 -17.488 11.670 5.813 1.00 11.73 H new ATOM 0 HA LYS B 63 -15.610 13.266 7.217 1.00 11.97 H new ATOM 0 HB2 LYS B 63 -17.445 13.428 8.886 1.00 13.73 H new ATOM 0 HB3 LYS B 63 -18.002 13.748 7.256 1.00 13.73 H new ATOM 0 HG2 LYS B 63 -18.981 11.520 7.089 1.00 16.98 H new ATOM 0 HG3 LYS B 63 -18.291 11.055 8.632 1.00 16.98 H new ATOM 0 HD2 LYS B 63 -19.641 12.858 9.744 1.00 20.19 H new ATOM 0 HD3 LYS B 63 -20.371 13.236 8.197 1.00 20.19 H new ATOM 0 HE2 LYS B 63 -21.402 11.056 8.046 1.00 23.42 H new ATOM 0 HE3 LYS B 63 -20.467 10.447 9.398 1.00 23.42 H new ATOM 0 HZ1 LYS B 63 -22.718 10.982 10.059 1.00 25.97 H new ATOM 0 HZ2 LYS B 63 -21.621 12.001 10.860 1.00 25.97 H new ATOM 0 HZ3 LYS B 63 -22.526 12.591 9.550 1.00 25.97 H new ATOM 2802 N GLU B 64 -14.797 11.987 9.200 1.00 10.04 N ATOM 2803 CA GLU B 64 -14.121 11.212 10.241 1.00 10.94 C ATOM 2804 C GLU B 64 -13.290 10.067 9.662 1.00 9.74 C ATOM 2805 O GLU B 64 -13.064 9.051 10.326 1.00 9.42 O ATOM 2806 CB GLU B 64 -15.140 10.690 11.256 1.00 18.31 C ATOM 2807 CG GLU B 64 -15.925 11.802 11.930 1.00 24.16 C ATOM 2808 CD GLU B 64 -16.926 11.288 12.939 1.00 29.00 C ATOM 2809 OE1 GLU B 64 -17.730 10.398 12.589 1.00 31.72 O ATOM 2810 OE2 GLU B 64 -16.926 11.780 14.086 1.00 32.61 O ATOM 0 H GLU B 64 -14.530 12.971 9.184 1.00 10.04 H new ATOM 0 HA GLU B 64 -13.425 11.880 10.749 1.00 10.94 H new ATOM 0 HB2 GLU B 64 -15.833 10.016 10.753 1.00 18.31 H new ATOM 0 HB3 GLU B 64 -14.622 10.106 12.016 1.00 18.31 H new ATOM 0 HG2 GLU B 64 -15.231 12.480 12.427 1.00 24.16 H new ATOM 0 HG3 GLU B 64 -16.448 12.382 11.170 1.00 24.16 H new ATOM 2817 N SER B 65 -12.827 10.237 8.432 1.00 6.85 N ATOM 2818 CA SER B 65 -12.011 9.224 7.787 1.00 6.90 C ATOM 2819 C SER B 65 -10.551 9.382 8.195 1.00 4.72 C ATOM 2820 O SER B 65 -10.065 10.499 8.389 1.00 3.91 O ATOM 2821 CB SER B 65 -12.140 9.312 6.265 1.00 7.28 C ATOM 2822 OG SER B 65 -13.476 9.072 5.853 1.00 10.56 O ATOM 0 H SER B 65 -13.003 11.065 7.864 1.00 6.85 H new ATOM 0 HA SER B 65 -12.366 8.245 8.109 1.00 6.90 H new ATOM 0 HB2 SER B 65 -11.823 10.298 5.926 1.00 7.28 H new ATOM 0 HB3 SER B 65 -11.475 8.585 5.798 1.00 7.28 H new ATOM 0 HG SER B 65 -13.482 8.401 5.138 1.00 10.56 H new ATOM 2828 N THR B 66 -9.867 8.262 8.337 1.00 4.48 N ATOM 2829 CA THR B 66 -8.471 8.266 8.716 1.00 3.80 C ATOM 2830 C THR B 66 -7.580 8.364 7.484 1.00 4.60 C ATOM 2831 O THR B 66 -7.612 7.494 6.610 1.00 5.33 O ATOM 2832 CB THR B 66 -8.108 6.996 9.506 1.00 2.85 C ATOM 2833 OG1 THR B 66 -9.139 6.705 10.459 1.00 2.15 O ATOM 2834 CG2 THR B 66 -6.775 7.162 10.224 1.00 3.40 C ATOM 0 H THR B 66 -10.262 7.332 8.194 1.00 4.48 H new ATOM 0 HA THR B 66 -8.306 9.136 9.351 1.00 3.80 H new ATOM 0 HB THR B 66 -8.018 6.169 8.802 1.00 2.85 H new ATOM 0 HG1 THR B 66 -8.904 5.895 10.958 1.00 2.15 H new ATOM 0 HG21 THR B 66 -6.542 6.250 10.775 1.00 3.40 H new ATOM 0 HG22 THR B 66 -5.990 7.355 9.493 1.00 3.40 H new ATOM 0 HG23 THR B 66 -6.838 7.999 10.919 1.00 3.40 H new ATOM 2842 N LEU B 67 -6.815 9.438 7.409 1.00 4.17 N ATOM 2843 CA LEU B 67 -5.893 9.655 6.307 1.00 3.85 C ATOM 2844 C LEU B 67 -4.483 9.364 6.792 1.00 3.80 C ATOM 2845 O LEU B 67 -4.248 9.284 7.997 1.00 5.54 O ATOM 2846 CB LEU B 67 -5.984 11.096 5.788 1.00 7.18 C ATOM 2847 CG LEU B 67 -7.125 11.386 4.801 1.00 9.67 C ATOM 2848 CD1 LEU B 67 -8.452 11.508 5.533 1.00 8.12 C ATOM 2849 CD2 LEU B 67 -6.830 12.658 4.016 1.00 11.66 C ATOM 0 H LEU B 67 -6.814 10.182 8.107 1.00 4.17 H new ATOM 0 HA LEU B 67 -6.154 8.989 5.484 1.00 3.85 H new ATOM 0 HB2 LEU B 67 -6.092 11.763 6.643 1.00 7.18 H new ATOM 0 HB3 LEU B 67 -5.040 11.347 5.305 1.00 7.18 H new ATOM 0 HG LEU B 67 -7.198 10.552 4.102 1.00 9.67 H new ATOM 0 HD11 LEU B 67 -9.246 11.713 4.815 1.00 8.12 H new ATOM 0 HD12 LEU B 67 -8.667 10.575 6.055 1.00 8.12 H new ATOM 0 HD13 LEU B 67 -8.396 12.323 6.255 1.00 8.12 H new ATOM 0 HD21 LEU B 67 -7.646 12.853 3.320 1.00 11.66 H new ATOM 0 HD22 LEU B 67 -6.733 13.497 4.705 1.00 11.66 H new ATOM 0 HD23 LEU B 67 -5.900 12.535 3.460 1.00 11.66 H new ATOM 2861 N HIS B 68 -3.550 9.201 5.872 1.00 2.94 N ATOM 2862 CA HIS B 68 -2.172 8.915 6.242 1.00 4.17 C ATOM 2863 C HIS B 68 -1.225 9.847 5.498 1.00 5.32 C ATOM 2864 O HIS B 68 -1.344 10.028 4.286 1.00 7.70 O ATOM 2865 CB HIS B 68 -1.847 7.449 5.940 1.00 5.57 C ATOM 2866 CG HIS B 68 -0.604 6.941 6.601 1.00 9.95 C ATOM 2867 ND1 HIS B 68 0.441 6.403 5.897 1.00 13.74 N ATOM 2868 CD2 HIS B 68 -0.255 6.864 7.908 1.00 12.79 C ATOM 2869 CE1 HIS B 68 1.383 6.016 6.733 1.00 14.75 C ATOM 2870 NE2 HIS B 68 0.988 6.283 7.968 1.00 16.30 N ATOM 0 H HIS B 68 -3.718 9.261 4.868 1.00 2.94 H new ATOM 0 HA HIS B 68 -2.044 9.084 7.311 1.00 4.17 H new ATOM 0 HB2 HIS B 68 -2.689 6.831 6.253 1.00 5.57 H new ATOM 0 HB3 HIS B 68 -1.746 7.327 4.862 1.00 5.57 H new ATOM 0 HD1 HIS B 68 0.483 6.315 4.882 1.00 13.74 H new ATOM 0 HD2 HIS B 68 -0.846 7.198 8.748 1.00 12.79 H new ATOM 0 HE1 HIS B 68 2.321 5.557 6.457 1.00 14.75 H new ATOM 0 HE2 HIS B 68 1.517 6.090 8.819 1.00 16.30 H new ATOM 2879 N LEU B 69 -0.302 10.458 6.229 1.00 5.29 N ATOM 2880 CA LEU B 69 0.650 11.382 5.629 1.00 3.97 C ATOM 2881 C LEU B 69 2.088 10.923 5.846 1.00 5.07 C ATOM 2882 O LEU B 69 2.516 10.685 6.979 1.00 4.34 O ATOM 2883 CB LEU B 69 0.453 12.786 6.209 1.00 6.08 C ATOM 2884 CG LEU B 69 1.402 13.863 5.671 1.00 7.37 C ATOM 2885 CD1 LEU B 69 1.188 14.075 4.183 1.00 6.87 C ATOM 2886 CD2 LEU B 69 1.202 15.171 6.416 1.00 9.96 C ATOM 0 H LEU B 69 -0.193 10.331 7.235 1.00 5.29 H new ATOM 0 HA LEU B 69 0.465 11.404 4.555 1.00 3.97 H new ATOM 0 HB2 LEU B 69 -0.572 13.100 6.014 1.00 6.08 H new ATOM 0 HB3 LEU B 69 0.569 12.732 7.291 1.00 6.08 H new ATOM 0 HG LEU B 69 2.425 13.521 5.830 1.00 7.37 H new ATOM 0 HD11 LEU B 69 1.872 14.843 3.823 1.00 6.87 H new ATOM 0 HD12 LEU B 69 1.378 13.142 3.652 1.00 6.87 H new ATOM 0 HD13 LEU B 69 0.160 14.392 4.005 1.00 6.87 H new ATOM 0 HD21 LEU B 69 1.884 15.923 6.020 1.00 9.96 H new ATOM 0 HD22 LEU B 69 0.174 15.510 6.287 1.00 9.96 H new ATOM 0 HD23 LEU B 69 1.404 15.020 7.476 1.00 9.96 H new ATOM 2898 N VAL B 70 2.821 10.803 4.752 1.00 4.29 N ATOM 2899 CA VAL B 70 4.216 10.396 4.792 1.00 6.26 C ATOM 2900 C VAL B 70 5.095 11.559 4.337 1.00 9.22 C ATOM 2901 O VAL B 70 4.789 12.217 3.342 1.00 9.36 O ATOM 2902 CB VAL B 70 4.462 9.158 3.894 1.00 8.69 C ATOM 2903 CG1 VAL B 70 5.948 8.943 3.638 1.00 9.76 C ATOM 2904 CG2 VAL B 70 3.852 7.916 4.523 1.00 8.54 C ATOM 0 H VAL B 70 2.467 10.984 3.813 1.00 4.29 H new ATOM 0 HA VAL B 70 4.471 10.122 5.816 1.00 6.26 H new ATOM 0 HB VAL B 70 3.979 9.343 2.934 1.00 8.69 H new ATOM 0 HG11 VAL B 70 6.085 8.066 3.005 1.00 9.76 H new ATOM 0 HG12 VAL B 70 6.362 9.819 3.139 1.00 9.76 H new ATOM 0 HG13 VAL B 70 6.462 8.789 4.587 1.00 9.76 H new ATOM 0 HG21 VAL B 70 4.034 7.055 3.879 1.00 8.54 H new ATOM 0 HG22 VAL B 70 4.306 7.742 5.499 1.00 8.54 H new ATOM 0 HG23 VAL B 70 2.778 8.059 4.643 1.00 8.54 H new ATOM 2914 N LEU B 71 6.165 11.826 5.078 1.00 12.71 N ATOM 2915 CA LEU B 71 7.069 12.918 4.739 1.00 16.06 C ATOM 2916 C LEU B 71 8.134 12.450 3.753 1.00 18.09 C ATOM 2917 O LEU B 71 8.285 11.250 3.512 1.00 19.26 O ATOM 2918 CB LEU B 71 7.739 13.475 5.998 1.00 17.10 C ATOM 2919 CG LEU B 71 6.781 13.955 7.091 1.00 19.37 C ATOM 2920 CD1 LEU B 71 7.554 14.590 8.237 1.00 17.51 C ATOM 2921 CD2 LEU B 71 5.767 14.938 6.524 1.00 19.57 C ATOM 0 H LEU B 71 6.427 11.303 5.914 1.00 12.71 H new ATOM 0 HA LEU B 71 6.480 13.708 4.273 1.00 16.06 H new ATOM 0 HB2 LEU B 71 8.385 12.704 6.417 1.00 17.10 H new ATOM 0 HB3 LEU B 71 8.381 14.307 5.710 1.00 17.10 H new ATOM 0 HG LEU B 71 6.241 13.090 7.476 1.00 19.37 H new ATOM 0 HD11 LEU B 71 6.857 14.925 9.005 1.00 17.51 H new ATOM 0 HD12 LEU B 71 8.239 13.857 8.664 1.00 17.51 H new ATOM 0 HD13 LEU B 71 8.121 15.443 7.865 1.00 17.51 H new ATOM 0 HD21 LEU B 71 5.096 15.267 7.317 1.00 19.57 H new ATOM 0 HD22 LEU B 71 6.289 15.801 6.110 1.00 19.57 H new ATOM 0 HD23 LEU B 71 5.189 14.452 5.738 1.00 19.57 H new ATOM 2933 N ARG B 72 8.870 13.395 3.188 1.00 21.47 N ATOM 2934 CA ARG B 72 9.917 13.072 2.231 1.00 25.83 C ATOM 2935 C ARG B 72 11.124 13.979 2.430 1.00 27.74 C ATOM 2936 O ARG B 72 10.995 15.203 2.466 1.00 30.65 O ATOM 2937 CB ARG B 72 9.392 13.203 0.800 1.00 28.49 C ATOM 2938 CG ARG B 72 10.305 12.574 -0.239 1.00 31.79 C ATOM 2939 CD ARG B 72 9.739 12.723 -1.641 1.00 34.05 C ATOM 2940 NE ARG B 72 10.419 11.851 -2.596 1.00 35.08 N ATOM 2941 CZ ARG B 72 10.267 11.926 -3.916 1.00 34.67 C ATOM 2942 NH1 ARG B 72 9.466 12.843 -4.450 1.00 34.97 N ATOM 2943 NH2 ARG B 72 10.923 11.087 -4.704 1.00 35.02 N ATOM 0 H ARG B 72 8.762 14.392 3.376 1.00 21.47 H new ATOM 0 HA ARG B 72 10.226 12.040 2.399 1.00 25.83 H new ATOM 0 HB2 ARG B 72 8.408 12.737 0.738 1.00 28.49 H new ATOM 0 HB3 ARG B 72 9.260 14.259 0.565 1.00 28.49 H new ATOM 0 HG2 ARG B 72 11.289 13.041 -0.191 1.00 31.79 H new ATOM 0 HG3 ARG B 72 10.443 11.517 -0.012 1.00 31.79 H new ATOM 0 HD2 ARG B 72 8.674 12.490 -1.630 1.00 34.05 H new ATOM 0 HD3 ARG B 72 9.835 13.760 -1.963 1.00 34.05 H new ATOM 0 HE ARG B 72 11.050 11.140 -2.228 1.00 35.08 H new ATOM 0 HH11 ARG B 72 8.963 13.495 -3.847 1.00 34.97 H new ATOM 0 HH12 ARG B 72 9.354 12.895 -5.463 1.00 34.97 H new ATOM 0 HH21 ARG B 72 11.543 10.386 -4.299 1.00 35.02 H new ATOM 0 HH22 ARG B 72 10.808 11.142 -5.716 1.00 35.02 H new ATOM 2957 N LEU B 73 12.291 13.371 2.574 1.00 28.93 N ATOM 2958 CA LEU B 73 13.526 14.115 2.761 1.00 30.76 C ATOM 2959 C LEU B 73 14.352 14.080 1.478 1.00 32.18 C ATOM 2960 O LEU B 73 14.151 13.211 0.629 1.00 32.31 O ATOM 2961 CB LEU B 73 14.325 13.533 3.933 1.00 30.53 C ATOM 2962 CG LEU B 73 13.606 13.553 5.288 1.00 30.16 C ATOM 2963 CD1 LEU B 73 14.409 12.799 6.338 1.00 29.57 C ATOM 2964 CD2 LEU B 73 13.351 14.985 5.735 1.00 29.11 C ATOM 0 H LEU B 73 12.409 12.358 2.565 1.00 28.93 H new ATOM 0 HA LEU B 73 13.285 15.152 2.993 1.00 30.76 H new ATOM 0 HB2 LEU B 73 14.590 12.503 3.695 1.00 30.53 H new ATOM 0 HB3 LEU B 73 15.258 14.088 4.027 1.00 30.53 H new ATOM 0 HG LEU B 73 12.645 13.052 5.172 1.00 30.16 H new ATOM 0 HD11 LEU B 73 13.879 12.827 7.290 1.00 29.57 H new ATOM 0 HD12 LEU B 73 14.537 11.763 6.024 1.00 29.57 H new ATOM 0 HD13 LEU B 73 15.387 13.266 6.453 1.00 29.57 H new ATOM 0 HD21 LEU B 73 12.840 14.980 6.698 1.00 29.11 H new ATOM 0 HD22 LEU B 73 14.301 15.511 5.831 1.00 29.11 H new ATOM 0 HD23 LEU B 73 12.729 15.491 4.997 1.00 29.11 H new ATOM 2976 N ARG B 74 15.272 15.024 1.333 1.00 33.82 N ATOM 2977 CA ARG B 74 16.111 15.090 0.141 1.00 35.33 C ATOM 2978 C ARG B 74 17.519 14.593 0.442 1.00 36.22 C ATOM 2979 O ARG B 74 18.082 13.792 -0.303 1.00 36.70 O ATOM 2980 CB ARG B 74 16.174 16.522 -0.386 1.00 36.91 C ATOM 2981 CG ARG B 74 14.814 17.133 -0.676 1.00 38.62 C ATOM 2982 CD ARG B 74 14.079 16.379 -1.773 1.00 39.75 C ATOM 2983 NE ARG B 74 12.781 16.977 -2.054 1.00 41.13 N ATOM 2984 CZ ARG B 74 11.985 16.596 -3.048 1.00 41.91 C ATOM 2985 NH1 ARG B 74 12.341 15.593 -3.844 1.00 41.93 N ATOM 2986 NH2 ARG B 74 10.828 17.213 -3.236 1.00 42.75 N ATOM 0 H ARG B 74 15.457 15.753 2.022 1.00 33.82 H new ATOM 0 HA ARG B 74 15.667 14.447 -0.619 1.00 35.33 H new ATOM 0 HB2 ARG B 74 16.693 17.144 0.343 1.00 36.91 H new ATOM 0 HB3 ARG B 74 16.770 16.537 -1.299 1.00 36.91 H new ATOM 0 HG2 ARG B 74 14.213 17.130 0.233 1.00 38.62 H new ATOM 0 HG3 ARG B 74 14.939 18.175 -0.972 1.00 38.62 H new ATOM 0 HD2 ARG B 74 14.683 16.375 -2.680 1.00 39.75 H new ATOM 0 HD3 ARG B 74 13.945 15.339 -1.474 1.00 39.75 H new ATOM 0 HE ARG B 74 12.463 17.735 -1.450 1.00 41.13 H new ATOM 0 HH11 ARG B 74 13.228 15.112 -3.693 1.00 41.93 H new ATOM 0 HH12 ARG B 74 11.727 15.304 -4.606 1.00 41.93 H new ATOM 0 HH21 ARG B 74 10.551 17.977 -2.619 1.00 42.75 H new ATOM 0 HH22 ARG B 74 10.214 16.924 -3.997 1.00 42.75 H new ATOM 3000 N GLY B 75 18.083 15.080 1.534 1.00 36.31 N ATOM 3001 CA GLY B 75 19.415 14.681 1.917 1.00 36.07 C ATOM 3002 C GLY B 75 19.417 13.377 2.680 1.00 36.16 C ATOM 3003 O GLY B 75 18.373 12.922 3.151 1.00 36.26 O ATOM 0 H GLY B 75 17.638 15.748 2.164 1.00 36.31 H new ATOM 0 HA2 GLY B 75 20.034 14.580 1.025 1.00 36.07 H new ATOM 0 HA3 GLY B 75 19.865 15.461 2.531 1.00 36.07 H new ATOM 3007 N GLY B 76 20.583 12.771 2.789 1.00 36.05 N ATOM 3008 CA GLY B 76 20.714 11.520 3.501 1.00 36.19 C ATOM 3009 C GLY B 76 22.125 11.326 3.999 1.00 36.20 C ATOM 3010 O GLY B 76 22.318 10.638 5.021 1.00 0.00 O ATOM 3011 OXT GLY B 76 23.051 11.889 3.375 1.00 0.00 O ATOM 0 H GLY B 76 21.453 13.127 2.392 1.00 36.05 H new ATOM 0 HA2 GLY B 76 20.022 11.503 4.343 1.00 36.19 H new ATOM 0 HA3 GLY B 76 20.439 10.694 2.845 1.00 36.19 H new TER 3015 GLY B 76