USER MOD reduce.3.24.130724 H: found=0, std=0, add=1083, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1079 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 HIS : no HE2:sc= 1.16 K(o=2.4,f=-7.2!) USER MOD Set 1.2: A 136 SER OG : rot 63:sc= 1.2 USER MOD Set 2.1: A 110 SER OG : rot -133:sc= 1.3 USER MOD Set 2.2: A 114 LYS NZ :NH3+ -167:sc= 1.05 (180deg=0.835) USER MOD Single : A 15 MET CE :methyl -164:sc= -0.0605 (180deg=-0.428) USER MOD Single : A 17 THR OG1 : rot -160:sc= -0.845 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -65:sc= 1.24 USER MOD Single : A 34 LYS NZ :NH3+ 160:sc= 1.28 (180deg=1.12) USER MOD Single : A 35 SER OG : rot 180:sc= 0.0582 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -1.39 K(o=-1.4,f=-6.1!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.9!) USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 52 HIS : no HE2:sc= 0.0702 K(o=0.07,f=-1.6!) USER MOD Single : A 57 TYR OH : rot 77:sc= 0.791 USER MOD Single : A 59 ASN : amide:sc= -1.39! K(o=-1.4!,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.832 X(o=-0.83,f=-0.37) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 65 THR OG1 : rot 147:sc= 1.32 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.00679 USER MOD Single : A 70 GLN : amide:sc= -0.681 K(o=-0.68,f=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.0014) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0.19 X(o=0.19,f=-0.0084) USER MOD Single : A 90 SER OG : rot 118:sc= 0.196 USER MOD Single : A 92 LYS NZ :NH3+ -174:sc= 1.03 (180deg=0.956) USER MOD Single : A 94 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0244) USER MOD Single : A 99 TYR OH : rot 180:sc= 0.373 USER MOD Single : A 100 LYS NZ :NH3+ 178:sc= 1.32 (180deg=1.32) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.35) USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 TYR OH : rot 49:sc= 0.673 USER MOD Single : A 128 LYS NZ :NH3+ -161:sc= -0.149 (180deg=-0.621) USER MOD Single : A 131 SER OG : rot -96:sc= 1.36 USER MOD Single : A 132 CYS SG : rot -130:sc= -3.16! USER MOD Single : A 138 LYS NZ :NH3+ -174:sc= 1.03 (180deg=0.643) USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot -14:sc= 1.01 USER MOD Single : A 143 LYS NZ :NH3+ 155:sc= 1.24 (180deg=-0.127!) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 14 -20.988 17.479 11.080 1.00 11.00 N ATOM 2 CA ASP A 14 -21.923 16.396 11.423 1.00 43.05 C ATOM 3 C ASP A 14 -21.196 15.299 12.161 1.00 12.23 C ATOM 4 O ASP A 14 -20.253 14.712 11.636 1.00 11.24 O ATOM 5 CB ASP A 14 -22.566 15.790 10.170 1.00 14.14 C ATOM 6 CG ASP A 14 -23.421 16.740 9.407 1.00 54.31 C ATOM 7 OD1 ASP A 14 -22.887 17.534 8.624 1.00 10.32 O ATOM 8 OD2 ASP A 14 -24.657 16.698 9.554 1.00 61.30 O ATOM 0 HA ASP A 14 -22.703 16.828 12.050 1.00 43.05 H new ATOM 0 HB2 ASP A 14 -21.779 15.419 9.514 1.00 14.14 H new ATOM 0 HB3 ASP A 14 -23.169 14.930 10.463 1.00 14.14 H new ATOM 13 N MET A 15 -21.642 14.985 13.357 1.00 32.33 N ATOM 14 CA MET A 15 -21.002 13.942 14.158 1.00 11.55 C ATOM 15 C MET A 15 -21.319 12.571 13.619 1.00 24.11 C ATOM 16 O MET A 15 -20.525 11.634 13.728 1.00 32.21 O ATOM 17 CB MET A 15 -21.347 14.055 15.647 1.00 4.54 C ATOM 18 CG MET A 15 -20.732 12.955 16.514 1.00 72.24 C ATOM 19 SD MET A 15 -21.214 13.058 18.249 1.00 61.53 S ATOM 20 CE MET A 15 -20.486 14.623 18.708 1.00 61.31 C ATOM 0 H MET A 15 -22.443 15.431 13.804 1.00 32.33 H new ATOM 0 HA MET A 15 -19.926 14.094 14.076 1.00 11.55 H new ATOM 0 HB2 MET A 15 -21.010 15.024 16.015 1.00 4.54 H new ATOM 0 HB3 MET A 15 -22.431 14.030 15.761 1.00 4.54 H new ATOM 0 HG2 MET A 15 -21.028 11.983 16.119 1.00 72.24 H new ATOM 0 HG3 MET A 15 -19.646 13.011 16.442 1.00 72.24 H new ATOM 0 HE1 MET A 15 -20.445 14.700 19.794 1.00 61.31 H new ATOM 0 HE2 MET A 15 -19.477 14.688 18.301 1.00 61.31 H new ATOM 0 HE3 MET A 15 -21.091 15.437 18.309 1.00 61.31 H new ATOM 30 N VAL A 16 -22.431 12.490 12.992 1.00 14.53 N ATOM 31 CA VAL A 16 -22.909 11.250 12.403 1.00 32.15 C ATOM 32 C VAL A 16 -21.932 10.750 11.320 1.00 13.40 C ATOM 33 O VAL A 16 -21.716 9.553 11.177 1.00 14.11 O ATOM 34 CB VAL A 16 -24.347 11.411 11.828 1.00 70.35 C ATOM 35 CG1 VAL A 16 -24.385 12.485 10.763 1.00 24.35 C ATOM 36 CG2 VAL A 16 -24.890 10.089 11.295 1.00 44.22 C ATOM 0 H VAL A 16 -23.061 13.281 12.859 1.00 14.53 H new ATOM 0 HA VAL A 16 -22.955 10.501 13.193 1.00 32.15 H new ATOM 0 HB VAL A 16 -24.996 11.722 12.646 1.00 70.35 H new ATOM 0 HG11 VAL A 16 -25.400 12.579 10.377 1.00 24.35 H new ATOM 0 HG12 VAL A 16 -24.072 13.436 11.194 1.00 24.35 H new ATOM 0 HG13 VAL A 16 -23.711 12.215 9.950 1.00 24.35 H new ATOM 0 HG21 VAL A 16 -25.895 10.241 10.902 1.00 44.22 H new ATOM 0 HG22 VAL A 16 -24.241 9.723 10.500 1.00 44.22 H new ATOM 0 HG23 VAL A 16 -24.923 9.357 12.102 1.00 44.22 H new ATOM 46 N THR A 17 -21.294 11.683 10.620 1.00 54.43 N ATOM 47 CA THR A 17 -20.356 11.345 9.588 1.00 21.24 C ATOM 48 C THR A 17 -19.128 10.703 10.213 1.00 23.12 C ATOM 49 O THR A 17 -18.610 9.726 9.717 1.00 54.20 O ATOM 50 CB THR A 17 -19.915 12.601 8.859 1.00 65.35 C ATOM 51 OG1 THR A 17 -21.049 13.455 8.674 1.00 72.54 O ATOM 52 CG2 THR A 17 -19.334 12.246 7.509 1.00 73.21 C ATOM 0 H THR A 17 -21.421 12.685 10.761 1.00 54.43 H new ATOM 0 HA THR A 17 -20.833 10.657 8.890 1.00 21.24 H new ATOM 0 HB THR A 17 -19.153 13.109 9.450 1.00 65.35 H new ATOM 0 HG1 THR A 17 -20.864 14.093 7.954 1.00 72.54 H new ATOM 0 HG21 THR A 17 -19.022 13.156 6.997 1.00 73.21 H new ATOM 0 HG22 THR A 17 -18.473 11.592 7.644 1.00 73.21 H new ATOM 0 HG23 THR A 17 -20.088 11.734 6.912 1.00 73.21 H new ATOM 60 N ASP A 18 -18.715 11.233 11.348 1.00 73.12 N ATOM 61 CA ASP A 18 -17.540 10.736 12.040 1.00 3.22 C ATOM 62 C ASP A 18 -17.823 9.372 12.626 1.00 52.24 C ATOM 63 O ASP A 18 -16.952 8.492 12.651 1.00 44.44 O ATOM 64 CB ASP A 18 -17.117 11.699 13.126 1.00 0.20 C ATOM 65 CG ASP A 18 -15.833 11.277 13.785 1.00 14.24 C ATOM 66 OD1 ASP A 18 -14.762 11.415 13.155 1.00 22.44 O ATOM 67 OD2 ASP A 18 -15.857 10.816 14.937 1.00 61.11 O ATOM 0 H ASP A 18 -19.179 12.013 11.814 1.00 73.12 H new ATOM 0 HA ASP A 18 -16.723 10.648 11.323 1.00 3.22 H new ATOM 0 HB2 ASP A 18 -16.995 12.695 12.700 1.00 0.20 H new ATOM 0 HB3 ASP A 18 -17.904 11.767 13.877 1.00 0.20 H new ATOM 72 N LEU A 19 -19.060 9.196 13.071 1.00 50.22 N ATOM 73 CA LEU A 19 -19.548 7.929 13.572 1.00 21.21 C ATOM 74 C LEU A 19 -19.501 6.912 12.425 1.00 3.32 C ATOM 75 O LEU A 19 -19.083 5.767 12.599 1.00 1.34 O ATOM 76 CB LEU A 19 -20.996 8.128 14.134 1.00 20.43 C ATOM 77 CG LEU A 19 -21.729 6.930 14.809 1.00 4.51 C ATOM 78 CD1 LEU A 19 -22.202 5.887 13.804 1.00 4.32 C ATOM 79 CD2 LEU A 19 -20.855 6.284 15.872 1.00 0.22 C ATOM 0 H LEU A 19 -19.757 9.941 13.092 1.00 50.22 H new ATOM 0 HA LEU A 19 -18.930 7.553 14.387 1.00 21.21 H new ATOM 0 HB2 LEU A 19 -20.955 8.938 14.862 1.00 20.43 H new ATOM 0 HB3 LEU A 19 -21.622 8.471 13.310 1.00 20.43 H new ATOM 0 HG LEU A 19 -22.618 7.342 15.285 1.00 4.51 H new ATOM 0 HD11 LEU A 19 -22.705 5.076 14.331 1.00 4.32 H new ATOM 0 HD12 LEU A 19 -22.895 6.348 13.100 1.00 4.32 H new ATOM 0 HD13 LEU A 19 -21.344 5.490 13.261 1.00 4.32 H new ATOM 0 HD21 LEU A 19 -21.391 5.451 16.327 1.00 0.22 H new ATOM 0 HD22 LEU A 19 -19.936 5.918 15.414 1.00 0.22 H new ATOM 0 HD23 LEU A 19 -20.610 7.020 16.638 1.00 0.22 H new ATOM 91 N ASP A 20 -19.854 7.380 11.249 1.00 72.21 N ATOM 92 CA ASP A 20 -19.882 6.555 10.051 1.00 31.22 C ATOM 93 C ASP A 20 -18.464 6.147 9.669 1.00 35.31 C ATOM 94 O ASP A 20 -18.197 4.984 9.348 1.00 21.13 O ATOM 95 CB ASP A 20 -20.571 7.322 8.911 1.00 73.43 C ATOM 96 CG ASP A 20 -20.647 6.559 7.610 1.00 72.11 C ATOM 97 OD1 ASP A 20 -19.845 6.847 6.694 1.00 13.34 O ATOM 98 OD2 ASP A 20 -21.540 5.688 7.459 1.00 10.44 O ATOM 0 H ASP A 20 -20.132 8.348 11.091 1.00 72.21 H new ATOM 0 HA ASP A 20 -20.453 5.646 10.243 1.00 31.22 H new ATOM 0 HB2 ASP A 20 -21.581 7.586 9.224 1.00 73.43 H new ATOM 0 HB3 ASP A 20 -20.036 8.256 8.741 1.00 73.43 H new ATOM 103 N VAL A 21 -17.551 7.099 9.768 1.00 13.02 N ATOM 104 CA VAL A 21 -16.143 6.864 9.479 1.00 23.21 C ATOM 105 C VAL A 21 -15.530 5.879 10.484 1.00 13.11 C ATOM 106 O VAL A 21 -14.842 4.941 10.092 1.00 63.52 O ATOM 107 CB VAL A 21 -15.315 8.185 9.471 1.00 5.10 C ATOM 108 CG1 VAL A 21 -13.844 7.920 9.158 1.00 3.31 C ATOM 109 CG2 VAL A 21 -15.890 9.167 8.473 1.00 55.34 C ATOM 0 H VAL A 21 -17.763 8.056 10.050 1.00 13.02 H new ATOM 0 HA VAL A 21 -16.100 6.431 8.479 1.00 23.21 H new ATOM 0 HB VAL A 21 -15.376 8.617 10.470 1.00 5.10 H new ATOM 0 HG11 VAL A 21 -13.296 8.862 9.160 1.00 3.31 H new ATOM 0 HG12 VAL A 21 -13.425 7.255 9.913 1.00 3.31 H new ATOM 0 HG13 VAL A 21 -13.759 7.454 8.177 1.00 3.31 H new ATOM 0 HG21 VAL A 21 -15.299 10.083 8.482 1.00 55.34 H new ATOM 0 HG22 VAL A 21 -15.865 8.729 7.475 1.00 55.34 H new ATOM 0 HG23 VAL A 21 -16.921 9.398 8.742 1.00 55.34 H new ATOM 119 N LYS A 22 -15.814 6.065 11.774 1.00 13.32 N ATOM 120 CA LYS A 22 -15.244 5.187 12.801 1.00 21.41 C ATOM 121 C LYS A 22 -15.879 3.801 12.724 1.00 71.24 C ATOM 122 O LYS A 22 -15.280 2.812 13.127 1.00 21.40 O ATOM 123 CB LYS A 22 -15.381 5.782 14.222 1.00 62.54 C ATOM 124 CG LYS A 22 -16.803 5.828 14.764 1.00 35.32 C ATOM 125 CD LYS A 22 -16.892 6.534 16.112 1.00 10.35 C ATOM 126 CE LYS A 22 -16.514 8.003 15.999 1.00 50.42 C ATOM 127 NZ LYS A 22 -16.672 8.717 17.271 1.00 15.22 N ATOM 0 H LYS A 22 -16.424 6.801 12.130 1.00 13.32 H new ATOM 0 HA LYS A 22 -14.176 5.097 12.600 1.00 21.41 H new ATOM 0 HB2 LYS A 22 -14.766 5.197 14.906 1.00 62.54 H new ATOM 0 HB3 LYS A 22 -14.977 6.794 14.217 1.00 62.54 H new ATOM 0 HG2 LYS A 22 -17.445 6.339 14.047 1.00 35.32 H new ATOM 0 HG3 LYS A 22 -17.183 4.811 14.864 1.00 35.32 H new ATOM 0 HD2 LYS A 22 -17.906 6.447 16.503 1.00 10.35 H new ATOM 0 HD3 LYS A 22 -16.232 6.041 16.826 1.00 10.35 H new ATOM 0 HE2 LYS A 22 -15.480 8.085 15.665 1.00 50.42 H new ATOM 0 HE3 LYS A 22 -17.134 8.478 15.239 1.00 50.42 H new ATOM 0 HZ1 LYS A 22 -16.403 9.714 17.145 1.00 15.22 H new ATOM 0 HZ2 LYS A 22 -17.664 8.662 17.579 1.00 15.22 H new ATOM 0 HZ3 LYS A 22 -16.061 8.282 17.992 1.00 15.22 H new ATOM 141 N GLY A 23 -17.099 3.739 12.211 1.00 45.22 N ATOM 142 CA GLY A 23 -17.752 2.467 12.007 1.00 4.51 C ATOM 143 C GLY A 23 -17.079 1.709 10.891 1.00 42.24 C ATOM 144 O GLY A 23 -16.765 0.531 11.022 1.00 41.33 O ATOM 0 H GLY A 23 -17.649 4.552 11.932 1.00 45.22 H new ATOM 0 HA2 GLY A 23 -17.719 1.881 12.926 1.00 4.51 H new ATOM 0 HA3 GLY A 23 -18.804 2.624 11.767 1.00 4.51 H new ATOM 148 N LEU A 24 -16.817 2.422 9.818 1.00 61.13 N ATOM 149 CA LEU A 24 -16.152 1.920 8.648 1.00 71.40 C ATOM 150 C LEU A 24 -14.723 1.482 9.009 1.00 1.24 C ATOM 151 O LEU A 24 -14.307 0.357 8.701 1.00 31.44 O ATOM 152 CB LEU A 24 -16.131 3.066 7.629 1.00 20.34 C ATOM 153 CG LEU A 24 -15.514 2.802 6.278 1.00 42.12 C ATOM 154 CD1 LEU A 24 -16.439 1.958 5.424 1.00 13.35 C ATOM 155 CD2 LEU A 24 -15.130 4.107 5.574 1.00 44.22 C ATOM 0 H LEU A 24 -17.074 3.406 9.739 1.00 61.13 H new ATOM 0 HA LEU A 24 -16.666 1.051 8.236 1.00 71.40 H new ATOM 0 HB2 LEU A 24 -17.160 3.389 7.469 1.00 20.34 H new ATOM 0 HB3 LEU A 24 -15.600 3.904 8.080 1.00 20.34 H new ATOM 0 HG LEU A 24 -14.593 2.239 6.431 1.00 42.12 H new ATOM 0 HD11 LEU A 24 -15.976 1.779 4.454 1.00 13.35 H new ATOM 0 HD12 LEU A 24 -16.623 1.005 5.920 1.00 13.35 H new ATOM 0 HD13 LEU A 24 -17.384 2.483 5.284 1.00 13.35 H new ATOM 0 HD21 LEU A 24 -14.688 3.881 4.604 1.00 44.22 H new ATOM 0 HD22 LEU A 24 -16.020 4.720 5.433 1.00 44.22 H new ATOM 0 HD23 LEU A 24 -14.408 4.650 6.183 1.00 44.22 H new ATOM 167 N GLY A 25 -14.002 2.371 9.685 1.00 61.54 N ATOM 168 CA GLY A 25 -12.646 2.096 10.110 1.00 21.45 C ATOM 169 C GLY A 25 -12.573 0.904 11.032 1.00 34.11 C ATOM 170 O GLY A 25 -11.704 0.045 10.881 1.00 15.31 O ATOM 0 H GLY A 25 -14.344 3.295 9.949 1.00 61.54 H new ATOM 0 HA2 GLY A 25 -12.021 1.916 9.235 1.00 21.45 H new ATOM 0 HA3 GLY A 25 -12.240 2.972 10.617 1.00 21.45 H new ATOM 174 N TYR A 26 -13.503 0.829 11.973 1.00 71.24 N ATOM 175 CA TYR A 26 -13.547 -0.290 12.881 1.00 2.45 C ATOM 176 C TYR A 26 -13.883 -1.573 12.153 1.00 53.10 C ATOM 177 O TYR A 26 -13.303 -2.593 12.454 1.00 61.11 O ATOM 178 CB TYR A 26 -14.529 -0.068 14.039 1.00 12.42 C ATOM 179 CG TYR A 26 -14.607 -1.244 15.004 1.00 4.22 C ATOM 180 CD1 TYR A 26 -15.601 -2.210 14.878 1.00 30.23 C ATOM 181 CD2 TYR A 26 -13.680 -1.394 16.024 1.00 22.33 C ATOM 182 CE1 TYR A 26 -15.666 -3.283 15.736 1.00 60.44 C ATOM 183 CE2 TYR A 26 -13.741 -2.467 16.890 1.00 42.53 C ATOM 184 CZ TYR A 26 -14.736 -3.406 16.739 1.00 14.25 C ATOM 185 OH TYR A 26 -14.802 -4.474 17.602 1.00 33.32 O ATOM 0 H TYR A 26 -14.230 1.529 12.121 1.00 71.24 H new ATOM 0 HA TYR A 26 -12.548 -0.377 13.309 1.00 2.45 H new ATOM 0 HB2 TYR A 26 -14.233 0.825 14.590 1.00 12.42 H new ATOM 0 HB3 TYR A 26 -15.522 0.124 13.631 1.00 12.42 H new ATOM 0 HD1 TYR A 26 -16.335 -2.115 14.092 1.00 30.23 H new ATOM 0 HD2 TYR A 26 -12.897 -0.659 16.143 1.00 22.33 H new ATOM 0 HE1 TYR A 26 -16.443 -4.024 15.622 1.00 60.44 H new ATOM 0 HE2 TYR A 26 -13.013 -2.569 17.681 1.00 42.53 H new ATOM 0 HH TYR A 26 -14.072 -4.414 18.253 1.00 33.32 H new ATOM 195 N ASP A 27 -14.802 -1.517 11.188 1.00 4.45 N ATOM 196 CA ASP A 27 -15.208 -2.729 10.460 1.00 11.33 C ATOM 197 C ASP A 27 -13.999 -3.306 9.761 1.00 32.31 C ATOM 198 O ASP A 27 -13.688 -4.502 9.893 1.00 44.31 O ATOM 199 CB ASP A 27 -16.313 -2.437 9.436 1.00 3.45 C ATOM 200 CG ASP A 27 -17.025 -3.699 8.937 1.00 32.41 C ATOM 201 OD1 ASP A 27 -16.396 -4.598 8.349 1.00 25.42 O ATOM 202 OD2 ASP A 27 -18.261 -3.792 9.123 1.00 45.11 O ATOM 0 H ASP A 27 -15.275 -0.663 10.893 1.00 4.45 H new ATOM 0 HA ASP A 27 -15.610 -3.444 11.178 1.00 11.33 H new ATOM 0 HB2 ASP A 27 -17.047 -1.767 9.885 1.00 3.45 H new ATOM 0 HB3 ASP A 27 -15.880 -1.911 8.585 1.00 3.45 H new ATOM 207 N PHE A 28 -13.274 -2.421 9.110 1.00 52.41 N ATOM 208 CA PHE A 28 -12.067 -2.748 8.407 1.00 65.23 C ATOM 209 C PHE A 28 -11.016 -3.302 9.377 1.00 71.11 C ATOM 210 O PHE A 28 -10.487 -4.386 9.180 1.00 2.51 O ATOM 211 CB PHE A 28 -11.562 -1.478 7.715 1.00 21.24 C ATOM 212 CG PHE A 28 -10.195 -1.566 7.122 1.00 21.41 C ATOM 213 CD1 PHE A 28 -10.001 -1.947 5.804 1.00 51.35 C ATOM 214 CD2 PHE A 28 -9.099 -1.238 7.888 1.00 5.44 C ATOM 215 CE1 PHE A 28 -8.731 -1.998 5.272 1.00 73.22 C ATOM 216 CE2 PHE A 28 -7.840 -1.296 7.366 1.00 63.23 C ATOM 217 CZ PHE A 28 -7.651 -1.672 6.053 1.00 21.51 C ATOM 0 H PHE A 28 -13.520 -1.432 9.058 1.00 52.41 H new ATOM 0 HA PHE A 28 -12.260 -3.520 7.662 1.00 65.23 H new ATOM 0 HB2 PHE A 28 -12.265 -1.212 6.925 1.00 21.24 H new ATOM 0 HB3 PHE A 28 -11.573 -0.663 8.439 1.00 21.24 H new ATOM 0 HD1 PHE A 28 -10.851 -2.206 5.190 1.00 51.35 H new ATOM 0 HD2 PHE A 28 -9.238 -0.931 8.914 1.00 5.44 H new ATOM 0 HE1 PHE A 28 -8.586 -2.294 4.243 1.00 73.22 H new ATOM 0 HE2 PHE A 28 -6.989 -1.047 7.983 1.00 63.23 H new ATOM 0 HZ PHE A 28 -6.654 -1.710 5.640 1.00 21.51 H new ATOM 227 N ILE A 29 -10.739 -2.560 10.421 1.00 21.50 N ATOM 228 CA ILE A 29 -9.744 -2.950 11.406 1.00 54.40 C ATOM 229 C ILE A 29 -10.103 -4.248 12.112 1.00 54.35 C ATOM 230 O ILE A 29 -9.218 -5.074 12.376 1.00 54.31 O ATOM 231 CB ILE A 29 -9.434 -1.791 12.398 1.00 44.04 C ATOM 232 CG1 ILE A 29 -8.556 -0.725 11.729 1.00 50.22 C ATOM 233 CG2 ILE A 29 -8.818 -2.263 13.722 1.00 40.31 C ATOM 234 CD1 ILE A 29 -7.232 -1.253 11.214 1.00 13.53 C ATOM 0 H ILE A 29 -11.193 -1.668 10.617 1.00 21.50 H new ATOM 0 HA ILE A 29 -8.821 -3.154 10.864 1.00 54.40 H new ATOM 0 HB ILE A 29 -10.395 -1.348 12.659 1.00 44.04 H new ATOM 0 HG12 ILE A 29 -9.107 -0.283 10.899 1.00 50.22 H new ATOM 0 HG13 ILE A 29 -8.363 0.074 12.445 1.00 50.22 H new ATOM 0 HG21 ILE A 29 -8.629 -1.402 14.363 1.00 40.31 H new ATOM 0 HG22 ILE A 29 -9.508 -2.943 14.222 1.00 40.31 H new ATOM 0 HG23 ILE A 29 -7.879 -2.780 13.523 1.00 40.31 H new ATOM 0 HD11 ILE A 29 -6.670 -0.440 10.755 1.00 13.53 H new ATOM 0 HD12 ILE A 29 -6.659 -1.668 12.043 1.00 13.53 H new ATOM 0 HD13 ILE A 29 -7.414 -2.031 10.473 1.00 13.53 H new ATOM 246 N ASP A 30 -11.375 -4.466 12.365 1.00 23.21 N ATOM 247 CA ASP A 30 -11.793 -5.698 12.984 1.00 22.42 C ATOM 248 C ASP A 30 -11.589 -6.834 12.040 1.00 21.31 C ATOM 249 O ASP A 30 -11.068 -7.863 12.426 1.00 22.02 O ATOM 250 CB ASP A 30 -13.241 -5.660 13.468 1.00 14.34 C ATOM 251 CG ASP A 30 -13.677 -6.994 14.037 1.00 63.14 C ATOM 252 OD1 ASP A 30 -13.341 -7.300 15.199 1.00 2.14 O ATOM 253 OD2 ASP A 30 -14.354 -7.762 13.334 1.00 73.21 O ATOM 0 H ASP A 30 -12.128 -3.812 12.153 1.00 23.21 H new ATOM 0 HA ASP A 30 -11.174 -5.838 13.870 1.00 22.42 H new ATOM 0 HB2 ASP A 30 -13.350 -4.887 14.229 1.00 14.34 H new ATOM 0 HB3 ASP A 30 -13.895 -5.387 12.640 1.00 14.34 H new ATOM 258 N LEU A 31 -11.905 -6.626 10.777 1.00 74.34 N ATOM 259 CA LEU A 31 -11.774 -7.686 9.839 1.00 32.01 C ATOM 260 C LEU A 31 -10.306 -8.017 9.558 1.00 41.01 C ATOM 261 O LEU A 31 -9.973 -9.149 9.232 1.00 74.13 O ATOM 262 CB LEU A 31 -12.625 -7.472 8.576 1.00 54.15 C ATOM 263 CG LEU A 31 -12.248 -6.342 7.627 1.00 62.52 C ATOM 264 CD1 LEU A 31 -11.053 -6.716 6.770 1.00 42.01 C ATOM 265 CD2 LEU A 31 -13.428 -5.959 6.775 1.00 54.40 C ATOM 0 H LEU A 31 -12.247 -5.744 10.396 1.00 74.34 H new ATOM 0 HA LEU A 31 -12.193 -8.580 10.300 1.00 32.01 H new ATOM 0 HB2 LEU A 31 -12.612 -8.401 8.006 1.00 54.15 H new ATOM 0 HB3 LEU A 31 -13.655 -7.308 8.894 1.00 54.15 H new ATOM 0 HG LEU A 31 -11.961 -5.477 8.225 1.00 62.52 H new ATOM 0 HD11 LEU A 31 -10.810 -5.888 6.104 1.00 42.01 H new ATOM 0 HD12 LEU A 31 -10.198 -6.929 7.411 1.00 42.01 H new ATOM 0 HD13 LEU A 31 -11.292 -7.600 6.178 1.00 42.01 H new ATOM 0 HD21 LEU A 31 -13.144 -5.150 6.102 1.00 54.40 H new ATOM 0 HD22 LEU A 31 -13.750 -6.821 6.191 1.00 54.40 H new ATOM 0 HD23 LEU A 31 -14.246 -5.628 7.414 1.00 54.40 H new ATOM 277 N VAL A 32 -9.441 -7.024 9.700 1.00 43.33 N ATOM 278 CA VAL A 32 -8.019 -7.229 9.565 1.00 42.21 C ATOM 279 C VAL A 32 -7.494 -8.041 10.771 1.00 43.54 C ATOM 280 O VAL A 32 -6.506 -8.769 10.671 1.00 53.04 O ATOM 281 CB VAL A 32 -7.273 -5.851 9.446 1.00 43.53 C ATOM 282 CG1 VAL A 32 -5.761 -6.011 9.513 1.00 41.43 C ATOM 283 CG2 VAL A 32 -7.640 -5.170 8.136 1.00 73.15 C ATOM 0 H VAL A 32 -9.709 -6.063 9.910 1.00 43.33 H new ATOM 0 HA VAL A 32 -7.823 -7.793 8.653 1.00 42.21 H new ATOM 0 HB VAL A 32 -7.590 -5.241 10.292 1.00 43.53 H new ATOM 0 HG11 VAL A 32 -5.287 -5.033 9.427 1.00 41.43 H new ATOM 0 HG12 VAL A 32 -5.485 -6.465 10.465 1.00 41.43 H new ATOM 0 HG13 VAL A 32 -5.426 -6.650 8.696 1.00 41.43 H new ATOM 0 HG21 VAL A 32 -7.118 -4.216 8.063 1.00 73.15 H new ATOM 0 HG22 VAL A 32 -7.350 -5.807 7.301 1.00 73.15 H new ATOM 0 HG23 VAL A 32 -8.716 -4.998 8.104 1.00 73.15 H new ATOM 293 N THR A 33 -8.206 -7.972 11.884 1.00 32.41 N ATOM 294 CA THR A 33 -7.770 -8.622 13.102 1.00 52.53 C ATOM 295 C THR A 33 -8.736 -9.737 13.514 1.00 52.42 C ATOM 296 O THR A 33 -8.756 -10.147 14.688 1.00 71.25 O ATOM 297 CB THR A 33 -7.649 -7.581 14.237 1.00 65.52 C ATOM 298 OG1 THR A 33 -8.888 -6.850 14.361 1.00 20.20 O ATOM 299 CG2 THR A 33 -6.515 -6.608 13.950 1.00 65.12 C ATOM 0 H THR A 33 -9.090 -7.470 11.966 1.00 32.41 H new ATOM 0 HA THR A 33 -6.795 -9.073 12.917 1.00 52.53 H new ATOM 0 HB THR A 33 -7.436 -8.106 15.168 1.00 65.52 H new ATOM 0 HG1 THR A 33 -9.038 -6.320 13.550 1.00 20.20 H new ATOM 0 HG21 THR A 33 -6.445 -5.882 14.760 1.00 65.12 H new ATOM 0 HG22 THR A 33 -5.576 -7.156 13.872 1.00 65.12 H new ATOM 0 HG23 THR A 33 -6.711 -6.088 13.012 1.00 65.12 H new ATOM 307 N LYS A 34 -9.506 -10.236 12.534 1.00 34.44 N ATOM 308 CA LYS A 34 -10.527 -11.269 12.729 1.00 25.55 C ATOM 309 C LYS A 34 -10.123 -12.439 13.602 1.00 64.11 C ATOM 310 O LYS A 34 -8.947 -12.841 13.676 1.00 22.10 O ATOM 311 CB LYS A 34 -11.031 -11.838 11.399 1.00 31.35 C ATOM 312 CG LYS A 34 -12.069 -11.034 10.650 1.00 51.41 C ATOM 313 CD LYS A 34 -13.255 -10.630 11.538 1.00 61.31 C ATOM 314 CE LYS A 34 -14.362 -9.971 10.721 1.00 33.01 C ATOM 315 NZ LYS A 34 -15.441 -9.420 11.566 1.00 1.20 N ATOM 0 H LYS A 34 -9.432 -9.924 11.566 1.00 34.44 H new ATOM 0 HA LYS A 34 -11.312 -10.726 13.255 1.00 25.55 H new ATOM 0 HB2 LYS A 34 -10.171 -11.974 10.743 1.00 31.35 H new ATOM 0 HB3 LYS A 34 -11.445 -12.828 11.591 1.00 31.35 H new ATOM 0 HG2 LYS A 34 -11.603 -10.137 10.241 1.00 51.41 H new ATOM 0 HG3 LYS A 34 -12.435 -11.617 9.805 1.00 51.41 H new ATOM 0 HD2 LYS A 34 -13.649 -11.511 12.044 1.00 61.31 H new ATOM 0 HD3 LYS A 34 -12.914 -9.943 12.313 1.00 61.31 H new ATOM 0 HE2 LYS A 34 -13.935 -9.171 10.116 1.00 33.01 H new ATOM 0 HE3 LYS A 34 -14.783 -10.702 10.031 1.00 33.01 H new ATOM 0 HZ1 LYS A 34 -15.976 -8.710 11.027 1.00 1.20 H new ATOM 0 HZ2 LYS A 34 -16.080 -10.187 11.857 1.00 1.20 H new ATOM 0 HZ3 LYS A 34 -15.028 -8.975 12.410 1.00 1.20 H new ATOM 329 N SER A 35 -11.132 -12.961 14.258 1.00 43.33 N ATOM 330 CA SER A 35 -11.071 -14.152 15.035 1.00 0.10 C ATOM 331 C SER A 35 -10.670 -15.313 14.105 1.00 31.34 C ATOM 332 O SER A 35 -10.956 -15.256 12.901 1.00 25.24 O ATOM 333 CB SER A 35 -12.478 -14.367 15.587 1.00 70.13 C ATOM 334 OG SER A 35 -13.023 -13.116 16.026 1.00 33.32 O ATOM 0 H SER A 35 -12.059 -12.536 14.257 1.00 43.33 H new ATOM 0 HA SER A 35 -10.346 -14.093 15.847 1.00 0.10 H new ATOM 0 HB2 SER A 35 -13.117 -14.803 14.819 1.00 70.13 H new ATOM 0 HB3 SER A 35 -12.449 -15.073 16.417 1.00 70.13 H new ATOM 0 HG SER A 35 -13.927 -13.258 16.378 1.00 33.32 H new ATOM 340 N PRO A 36 -10.045 -16.390 14.642 1.00 32.12 N ATOM 341 CA PRO A 36 -9.559 -17.538 13.840 1.00 3.33 C ATOM 342 C PRO A 36 -10.680 -18.247 13.071 1.00 2.21 C ATOM 343 O PRO A 36 -10.421 -19.118 12.226 1.00 63.21 O ATOM 344 CB PRO A 36 -8.938 -18.480 14.883 1.00 15.54 C ATOM 345 CG PRO A 36 -9.503 -18.045 16.187 1.00 12.14 C ATOM 346 CD PRO A 36 -9.746 -16.572 16.070 1.00 14.41 C ATOM 0 HA PRO A 36 -8.858 -17.216 13.071 1.00 3.33 H new ATOM 0 HB2 PRO A 36 -9.188 -19.520 14.673 1.00 15.54 H new ATOM 0 HB3 PRO A 36 -7.850 -18.407 14.881 1.00 15.54 H new ATOM 0 HG2 PRO A 36 -10.430 -18.576 16.406 1.00 12.14 H new ATOM 0 HG3 PRO A 36 -8.812 -18.261 17.002 1.00 12.14 H new ATOM 0 HD2 PRO A 36 -10.576 -16.250 16.699 1.00 14.41 H new ATOM 0 HD3 PRO A 36 -8.873 -15.995 16.375 1.00 14.41 H new ATOM 354 N ASP A 37 -11.916 -17.865 13.368 1.00 31.54 N ATOM 355 CA ASP A 37 -13.091 -18.384 12.644 1.00 64.35 C ATOM 356 C ASP A 37 -13.108 -17.832 11.215 1.00 73.14 C ATOM 357 O ASP A 37 -13.592 -18.475 10.280 1.00 24.15 O ATOM 358 CB ASP A 37 -14.392 -18.015 13.364 1.00 54.43 C ATOM 359 CG ASP A 37 -15.625 -18.464 12.606 1.00 22.33 C ATOM 360 OD1 ASP A 37 -15.811 -19.688 12.415 1.00 32.34 O ATOM 361 OD2 ASP A 37 -16.437 -17.613 12.207 1.00 13.45 O ATOM 0 H ASP A 37 -12.141 -17.197 14.105 1.00 31.54 H new ATOM 0 HA ASP A 37 -13.019 -19.471 12.612 1.00 64.35 H new ATOM 0 HB2 ASP A 37 -14.395 -18.467 14.356 1.00 54.43 H new ATOM 0 HB3 ASP A 37 -14.431 -16.935 13.506 1.00 54.43 H new ATOM 366 N SER A 38 -12.522 -16.675 11.050 1.00 65.31 N ATOM 367 CA SER A 38 -12.353 -16.074 9.770 1.00 33.12 C ATOM 368 C SER A 38 -10.858 -15.931 9.516 1.00 0.14 C ATOM 369 O SER A 38 -10.256 -14.884 9.767 1.00 70.12 O ATOM 370 CB SER A 38 -13.081 -14.724 9.688 1.00 72.04 C ATOM 371 OG SER A 38 -14.486 -14.887 9.875 1.00 41.44 O ATOM 0 H SER A 38 -12.145 -16.121 11.820 1.00 65.31 H new ATOM 0 HA SER A 38 -12.796 -16.702 8.997 1.00 33.12 H new ATOM 0 HB2 SER A 38 -12.686 -14.047 10.446 1.00 72.04 H new ATOM 0 HB3 SER A 38 -12.891 -14.263 8.719 1.00 72.04 H new ATOM 0 HG SER A 38 -14.927 -14.013 9.820 1.00 41.44 H new ATOM 377 N VAL A 39 -10.250 -17.024 9.079 1.00 0.22 N ATOM 378 CA VAL A 39 -8.805 -17.092 8.891 1.00 33.23 C ATOM 379 C VAL A 39 -8.419 -16.459 7.554 1.00 61.54 C ATOM 380 O VAL A 39 -7.237 -16.297 7.215 1.00 42.44 O ATOM 381 CB VAL A 39 -8.300 -18.568 8.985 1.00 14.33 C ATOM 382 CG1 VAL A 39 -8.778 -19.411 7.809 1.00 3.31 C ATOM 383 CG2 VAL A 39 -6.784 -18.646 9.157 1.00 21.11 C ATOM 0 H VAL A 39 -10.741 -17.887 8.845 1.00 0.22 H new ATOM 0 HA VAL A 39 -8.322 -16.529 9.689 1.00 33.23 H new ATOM 0 HB VAL A 39 -8.745 -18.993 9.885 1.00 14.33 H new ATOM 0 HG11 VAL A 39 -8.404 -20.429 7.915 1.00 3.31 H new ATOM 0 HG12 VAL A 39 -9.868 -19.425 7.791 1.00 3.31 H new ATOM 0 HG13 VAL A 39 -8.405 -18.983 6.879 1.00 3.31 H new ATOM 0 HG21 VAL A 39 -6.478 -19.690 9.218 1.00 21.11 H new ATOM 0 HG22 VAL A 39 -6.296 -18.174 8.304 1.00 21.11 H new ATOM 0 HG23 VAL A 39 -6.495 -18.129 10.072 1.00 21.11 H new ATOM 393 N ASN A 40 -9.413 -16.096 6.818 1.00 44.51 N ATOM 394 CA ASN A 40 -9.226 -15.483 5.558 1.00 45.24 C ATOM 395 C ASN A 40 -9.781 -14.078 5.651 1.00 52.32 C ATOM 396 O ASN A 40 -10.912 -13.779 5.246 1.00 13.11 O ATOM 397 CB ASN A 40 -9.895 -16.316 4.480 1.00 74.44 C ATOM 398 CG ASN A 40 -9.517 -15.914 3.081 1.00 4.33 C ATOM 399 OD1 ASN A 40 -10.179 -15.109 2.442 1.00 52.11 O ATOM 400 ND2 ASN A 40 -8.457 -16.482 2.588 1.00 12.23 N ATOM 0 H ASN A 40 -10.390 -16.221 7.083 1.00 44.51 H new ATOM 0 HA ASN A 40 -8.172 -15.422 5.286 1.00 45.24 H new ATOM 0 HB2 ASN A 40 -9.635 -17.364 4.630 1.00 74.44 H new ATOM 0 HB3 ASN A 40 -10.976 -16.237 4.591 1.00 74.44 H new ATOM 0 HD21 ASN A 40 -8.154 -16.260 1.640 1.00 12.23 H new ATOM 0 HD22 ASN A 40 -7.928 -17.149 3.150 1.00 12.23 H new ATOM 407 N SER A 41 -8.997 -13.240 6.259 1.00 51.41 N ATOM 408 CA SER A 41 -9.362 -11.885 6.579 1.00 54.43 C ATOM 409 C SER A 41 -9.545 -11.051 5.303 1.00 44.10 C ATOM 410 O SER A 41 -10.340 -10.089 5.262 1.00 22.22 O ATOM 411 CB SER A 41 -8.284 -11.314 7.491 1.00 74.44 C ATOM 412 OG SER A 41 -8.069 -12.210 8.593 1.00 12.32 O ATOM 0 H SER A 41 -8.053 -13.485 6.558 1.00 51.41 H new ATOM 0 HA SER A 41 -10.321 -11.858 7.097 1.00 54.43 H new ATOM 0 HB2 SER A 41 -7.357 -11.175 6.934 1.00 74.44 H new ATOM 0 HB3 SER A 41 -8.585 -10.333 7.859 1.00 74.44 H new ATOM 0 HG SER A 41 -7.374 -11.845 9.180 1.00 12.32 H new ATOM 418 N GLU A 42 -8.876 -11.469 4.249 1.00 4.50 N ATOM 419 CA GLU A 42 -8.973 -10.833 2.977 1.00 4.13 C ATOM 420 C GLU A 42 -10.365 -11.050 2.372 1.00 52.11 C ATOM 421 O GLU A 42 -10.817 -10.253 1.554 1.00 25.10 O ATOM 422 CB GLU A 42 -7.856 -11.286 2.011 1.00 5.32 C ATOM 423 CG GLU A 42 -7.772 -12.791 1.732 1.00 13.11 C ATOM 424 CD GLU A 42 -6.984 -13.592 2.754 1.00 20.42 C ATOM 425 OE1 GLU A 42 -6.092 -14.332 2.347 1.00 10.13 O ATOM 426 OE2 GLU A 42 -7.264 -13.515 3.965 1.00 61.40 O ATOM 0 H GLU A 42 -8.245 -12.271 4.265 1.00 4.50 H new ATOM 0 HA GLU A 42 -8.831 -9.763 3.132 1.00 4.13 H new ATOM 0 HB2 GLU A 42 -7.994 -10.769 1.062 1.00 5.32 H new ATOM 0 HB3 GLU A 42 -6.899 -10.959 2.417 1.00 5.32 H new ATOM 0 HG2 GLU A 42 -8.784 -13.192 1.681 1.00 13.11 H new ATOM 0 HG3 GLU A 42 -7.320 -12.938 0.751 1.00 13.11 H new ATOM 433 N HIS A 43 -11.057 -12.110 2.814 1.00 61.42 N ATOM 434 CA HIS A 43 -12.431 -12.385 2.370 1.00 44.42 C ATOM 435 C HIS A 43 -13.324 -11.255 2.837 1.00 53.50 C ATOM 436 O HIS A 43 -14.070 -10.645 2.050 1.00 3.23 O ATOM 437 CB HIS A 43 -12.934 -13.722 2.964 1.00 52.33 C ATOM 438 CG HIS A 43 -14.343 -14.098 2.604 1.00 73.13 C ATOM 439 ND1 HIS A 43 -15.432 -13.910 3.439 1.00 12.31 N ATOM 440 CD2 HIS A 43 -14.830 -14.685 1.484 1.00 64.11 C ATOM 441 CE1 HIS A 43 -16.509 -14.377 2.816 1.00 23.04 C ATOM 442 NE2 HIS A 43 -16.202 -14.861 1.619 1.00 50.32 N ATOM 0 H HIS A 43 -10.688 -12.790 3.478 1.00 61.42 H new ATOM 0 HA HIS A 43 -12.453 -12.461 1.283 1.00 44.42 H new ATOM 0 HB2 HIS A 43 -12.268 -14.520 2.635 1.00 52.33 H new ATOM 0 HB3 HIS A 43 -12.856 -13.670 4.050 1.00 52.33 H new ATOM 0 HD1 HIS A 43 -15.411 -13.488 4.367 1.00 12.31 H new ATOM 0 HD2 HIS A 43 -14.245 -14.971 0.623 1.00 64.11 H new ATOM 0 HE1 HIS A 43 -17.506 -14.364 3.231 1.00 23.04 H new ATOM 450 N GLU A 44 -13.199 -10.954 4.109 1.00 21.52 N ATOM 451 CA GLU A 44 -13.960 -9.932 4.739 1.00 33.52 C ATOM 452 C GLU A 44 -13.597 -8.591 4.161 1.00 3.34 C ATOM 453 O GLU A 44 -14.458 -7.763 3.945 1.00 44.33 O ATOM 454 CB GLU A 44 -13.675 -9.967 6.216 1.00 34.22 C ATOM 455 CG GLU A 44 -13.919 -11.327 6.823 1.00 21.12 C ATOM 456 CD GLU A 44 -15.350 -11.757 6.692 1.00 61.13 C ATOM 457 OE1 GLU A 44 -16.221 -11.176 7.366 1.00 73.24 O ATOM 458 OE2 GLU A 44 -15.632 -12.693 5.919 1.00 32.02 O ATOM 0 H GLU A 44 -12.550 -11.429 4.736 1.00 21.52 H new ATOM 0 HA GLU A 44 -15.024 -10.096 4.569 1.00 33.52 H new ATOM 0 HB2 GLU A 44 -12.639 -9.677 6.389 1.00 34.22 H new ATOM 0 HB3 GLU A 44 -14.301 -9.231 6.720 1.00 34.22 H new ATOM 0 HG2 GLU A 44 -13.275 -12.060 6.338 1.00 21.12 H new ATOM 0 HG3 GLU A 44 -13.642 -11.308 7.877 1.00 21.12 H new ATOM 465 N LEU A 45 -12.321 -8.400 3.874 1.00 61.23 N ATOM 466 CA LEU A 45 -11.864 -7.169 3.306 1.00 24.13 C ATOM 467 C LEU A 45 -12.447 -6.969 1.909 1.00 11.25 C ATOM 468 O LEU A 45 -12.919 -5.886 1.581 1.00 11.52 O ATOM 469 CB LEU A 45 -10.343 -7.117 3.283 1.00 45.24 C ATOM 470 CG LEU A 45 -9.747 -5.818 2.768 1.00 51.22 C ATOM 471 CD1 LEU A 45 -10.247 -4.644 3.584 1.00 70.45 C ATOM 472 CD2 LEU A 45 -8.233 -5.882 2.778 1.00 14.22 C ATOM 0 H LEU A 45 -11.589 -9.093 4.030 1.00 61.23 H new ATOM 0 HA LEU A 45 -12.215 -6.350 3.934 1.00 24.13 H new ATOM 0 HB2 LEU A 45 -9.974 -7.291 4.294 1.00 45.24 H new ATOM 0 HB3 LEU A 45 -9.977 -7.936 2.664 1.00 45.24 H new ATOM 0 HG LEU A 45 -10.070 -5.675 1.737 1.00 51.22 H new ATOM 0 HD11 LEU A 45 -9.810 -3.722 3.201 1.00 70.45 H new ATOM 0 HD12 LEU A 45 -11.333 -4.587 3.513 1.00 70.45 H new ATOM 0 HD13 LEU A 45 -9.958 -4.776 4.627 1.00 70.45 H new ATOM 0 HD21 LEU A 45 -7.827 -4.942 2.405 1.00 14.22 H new ATOM 0 HD22 LEU A 45 -7.883 -6.051 3.796 1.00 14.22 H new ATOM 0 HD23 LEU A 45 -7.899 -6.700 2.139 1.00 14.22 H new ATOM 484 N ALA A 46 -12.458 -8.031 1.119 1.00 4.51 N ATOM 485 CA ALA A 46 -13.024 -7.995 -0.224 1.00 75.34 C ATOM 486 C ALA A 46 -14.520 -7.722 -0.163 1.00 14.35 C ATOM 487 O ALA A 46 -15.087 -7.074 -1.040 1.00 31.45 O ATOM 488 CB ALA A 46 -12.747 -9.298 -0.963 1.00 32.44 C ATOM 0 H ALA A 46 -12.077 -8.939 1.387 1.00 4.51 H new ATOM 0 HA ALA A 46 -12.546 -7.185 -0.775 1.00 75.34 H new ATOM 0 HB1 ALA A 46 -13.179 -9.248 -1.963 1.00 32.44 H new ATOM 0 HB2 ALA A 46 -11.671 -9.451 -1.040 1.00 32.44 H new ATOM 0 HB3 ALA A 46 -13.193 -10.128 -0.416 1.00 32.44 H new ATOM 494 N HIS A 47 -15.138 -8.203 0.889 1.00 4.02 N ATOM 495 CA HIS A 47 -16.558 -7.999 1.108 1.00 11.54 C ATOM 496 C HIS A 47 -16.806 -6.546 1.549 1.00 24.23 C ATOM 497 O HIS A 47 -17.784 -5.915 1.143 1.00 21.54 O ATOM 498 CB HIS A 47 -17.072 -8.986 2.178 1.00 20.22 C ATOM 499 CG HIS A 47 -18.568 -9.043 2.302 1.00 31.03 C ATOM 500 ND1 HIS A 47 -19.351 -9.989 1.683 1.00 35.11 N ATOM 501 CD2 HIS A 47 -19.419 -8.250 2.989 1.00 13.25 C ATOM 502 CE1 HIS A 47 -20.621 -9.749 1.994 1.00 32.13 C ATOM 503 NE2 HIS A 47 -20.722 -8.697 2.790 1.00 43.45 N ATOM 0 H HIS A 47 -14.676 -8.746 1.618 1.00 4.02 H new ATOM 0 HA HIS A 47 -17.100 -8.183 0.180 1.00 11.54 H new ATOM 0 HB2 HIS A 47 -16.701 -9.984 1.943 1.00 20.22 H new ATOM 0 HB3 HIS A 47 -16.650 -8.708 3.144 1.00 20.22 H new ATOM 0 HD2 HIS A 47 -19.134 -7.404 3.596 1.00 13.25 H new ATOM 0 HE1 HIS A 47 -21.458 -10.334 1.644 1.00 32.13 H new ATOM 0 HE2 HIS A 47 -21.577 -8.297 3.177 1.00 43.45 H new ATOM 511 N PHE A 48 -15.886 -6.026 2.337 1.00 55.31 N ATOM 512 CA PHE A 48 -15.947 -4.685 2.887 1.00 75.31 C ATOM 513 C PHE A 48 -15.794 -3.643 1.798 1.00 73.00 C ATOM 514 O PHE A 48 -16.509 -2.648 1.764 1.00 24.02 O ATOM 515 CB PHE A 48 -14.836 -4.547 3.930 1.00 62.35 C ATOM 516 CG PHE A 48 -14.593 -3.168 4.445 1.00 44.52 C ATOM 517 CD1 PHE A 48 -13.560 -2.411 3.927 1.00 60.14 C ATOM 518 CD2 PHE A 48 -15.381 -2.634 5.438 1.00 62.32 C ATOM 519 CE1 PHE A 48 -13.316 -1.141 4.388 1.00 14.35 C ATOM 520 CE2 PHE A 48 -15.145 -1.362 5.907 1.00 53.13 C ATOM 521 CZ PHE A 48 -14.108 -0.615 5.378 1.00 4.45 C ATOM 0 H PHE A 48 -15.051 -6.539 2.621 1.00 55.31 H new ATOM 0 HA PHE A 48 -16.919 -4.521 3.353 1.00 75.31 H new ATOM 0 HB2 PHE A 48 -15.075 -5.193 4.775 1.00 62.35 H new ATOM 0 HB3 PHE A 48 -13.908 -4.921 3.496 1.00 62.35 H new ATOM 0 HD1 PHE A 48 -12.936 -2.824 3.149 1.00 60.14 H new ATOM 0 HD2 PHE A 48 -16.190 -3.217 5.852 1.00 62.32 H new ATOM 0 HE1 PHE A 48 -12.506 -0.559 3.974 1.00 14.35 H new ATOM 0 HE2 PHE A 48 -15.768 -0.948 6.686 1.00 53.13 H new ATOM 0 HZ PHE A 48 -13.921 0.384 5.744 1.00 4.45 H new ATOM 531 N LEU A 49 -14.869 -3.882 0.904 1.00 62.41 N ATOM 532 CA LEU A 49 -14.617 -2.961 -0.178 1.00 24.13 C ATOM 533 C LEU A 49 -15.617 -3.156 -1.309 1.00 21.35 C ATOM 534 O LEU A 49 -15.624 -2.410 -2.254 1.00 71.40 O ATOM 535 CB LEU A 49 -13.153 -3.059 -0.649 1.00 54.15 C ATOM 536 CG LEU A 49 -12.673 -4.428 -1.140 1.00 72.12 C ATOM 537 CD1 LEU A 49 -13.128 -4.724 -2.549 1.00 71.21 C ATOM 538 CD2 LEU A 49 -11.184 -4.551 -1.010 1.00 41.25 C ATOM 0 H LEU A 49 -14.274 -4.711 0.903 1.00 62.41 H new ATOM 0 HA LEU A 49 -14.762 -1.945 0.188 1.00 24.13 H new ATOM 0 HB2 LEU A 49 -13.007 -2.339 -1.455 1.00 54.15 H new ATOM 0 HB3 LEU A 49 -12.510 -2.750 0.175 1.00 54.15 H new ATOM 0 HG LEU A 49 -13.134 -5.179 -0.499 1.00 72.12 H new ATOM 0 HD11 LEU A 49 -12.762 -5.705 -2.851 1.00 71.21 H new ATOM 0 HD12 LEU A 49 -14.217 -4.714 -2.589 1.00 71.21 H new ATOM 0 HD13 LEU A 49 -12.733 -3.966 -3.226 1.00 71.21 H new ATOM 0 HD21 LEU A 49 -10.868 -5.532 -1.365 1.00 41.25 H new ATOM 0 HD22 LEU A 49 -10.702 -3.776 -1.606 1.00 41.25 H new ATOM 0 HD23 LEU A 49 -10.899 -4.434 0.036 1.00 41.25 H new ATOM 550 N GLY A 50 -16.453 -4.175 -1.173 1.00 53.14 N ATOM 551 CA GLY A 50 -17.524 -4.467 -2.137 1.00 11.21 C ATOM 552 C GLY A 50 -18.317 -3.219 -2.584 1.00 3.24 C ATOM 553 O GLY A 50 -18.455 -2.983 -3.776 1.00 53.00 O ATOM 0 H GLY A 50 -16.414 -4.829 -0.391 1.00 53.14 H new ATOM 0 HA2 GLY A 50 -17.089 -4.944 -3.016 1.00 11.21 H new ATOM 0 HA3 GLY A 50 -18.214 -5.185 -1.693 1.00 11.21 H new ATOM 557 N PRO A 51 -18.878 -2.427 -1.650 1.00 50.31 N ATOM 558 CA PRO A 51 -19.543 -1.163 -1.962 1.00 2.44 C ATOM 559 C PRO A 51 -18.559 0.034 -2.044 1.00 33.01 C ATOM 560 O PRO A 51 -18.956 1.156 -2.379 1.00 24.25 O ATOM 561 CB PRO A 51 -20.525 -0.961 -0.783 1.00 2.12 C ATOM 562 CG PRO A 51 -20.345 -2.148 0.115 1.00 34.14 C ATOM 563 CD PRO A 51 -19.006 -2.727 -0.218 1.00 11.24 C ATOM 0 HA PRO A 51 -20.024 -1.203 -2.939 1.00 2.44 H new ATOM 0 HB2 PRO A 51 -20.310 -0.034 -0.251 1.00 2.12 H new ATOM 0 HB3 PRO A 51 -21.553 -0.894 -1.139 1.00 2.12 H new ATOM 0 HG2 PRO A 51 -20.391 -1.853 1.163 1.00 34.14 H new ATOM 0 HG3 PRO A 51 -21.136 -2.880 -0.045 1.00 34.14 H new ATOM 0 HD2 PRO A 51 -18.208 -2.267 0.366 1.00 11.24 H new ATOM 0 HD3 PRO A 51 -18.967 -3.799 -0.023 1.00 11.24 H new ATOM 571 N HIS A 52 -17.284 -0.205 -1.758 1.00 31.11 N ATOM 572 CA HIS A 52 -16.318 0.879 -1.554 1.00 2.42 C ATOM 573 C HIS A 52 -15.079 0.663 -2.417 1.00 21.11 C ATOM 574 O HIS A 52 -13.990 1.081 -2.045 1.00 54.51 O ATOM 575 CB HIS A 52 -15.888 0.940 -0.058 1.00 14.33 C ATOM 576 CG HIS A 52 -17.000 1.200 0.940 1.00 12.51 C ATOM 577 ND1 HIS A 52 -17.449 2.457 1.305 1.00 2.32 N ATOM 578 CD2 HIS A 52 -17.739 0.326 1.666 1.00 4.40 C ATOM 579 CE1 HIS A 52 -18.416 2.305 2.211 1.00 14.22 C ATOM 580 NE2 HIS A 52 -18.635 1.030 2.468 1.00 21.34 N ATOM 0 H HIS A 52 -16.890 -1.141 -1.661 1.00 31.11 H new ATOM 0 HA HIS A 52 -16.796 1.816 -1.838 1.00 2.42 H new ATOM 0 HB2 HIS A 52 -15.407 -0.003 0.201 1.00 14.33 H new ATOM 0 HB3 HIS A 52 -15.137 1.722 0.053 1.00 14.33 H new ATOM 0 HD1 HIS A 52 -17.101 3.345 0.944 1.00 2.32 H new ATOM 0 HD2 HIS A 52 -17.648 -0.749 1.629 1.00 4.40 H new ATOM 0 HE1 HIS A 52 -18.951 3.121 2.674 1.00 14.22 H new ATOM 588 N ASP A 53 -15.278 0.044 -3.582 1.00 62.33 N ATOM 589 CA ASP A 53 -14.201 -0.308 -4.527 1.00 54.45 C ATOM 590 C ASP A 53 -13.363 0.907 -4.943 1.00 12.12 C ATOM 591 O ASP A 53 -13.862 1.811 -5.633 1.00 45.32 O ATOM 592 CB ASP A 53 -14.789 -0.912 -5.808 1.00 71.23 C ATOM 593 CG ASP A 53 -15.369 -2.298 -5.694 1.00 54.53 C ATOM 594 OD1 ASP A 53 -14.695 -3.216 -5.218 1.00 31.25 O ATOM 595 OD2 ASP A 53 -16.508 -2.507 -6.179 1.00 71.31 O ATOM 0 H ASP A 53 -16.204 -0.234 -3.906 1.00 62.33 H new ATOM 0 HA ASP A 53 -13.565 -1.022 -4.004 1.00 54.45 H new ATOM 0 HB2 ASP A 53 -15.570 -0.245 -6.172 1.00 71.23 H new ATOM 0 HB3 ASP A 53 -14.006 -0.931 -6.566 1.00 71.23 H new ATOM 600 N PRO A 54 -12.090 0.956 -4.522 1.00 12.05 N ATOM 601 CA PRO A 54 -11.164 2.009 -4.887 1.00 61.31 C ATOM 602 C PRO A 54 -10.130 1.515 -5.931 1.00 23.31 C ATOM 603 O PRO A 54 -10.350 0.506 -6.626 1.00 65.21 O ATOM 604 CB PRO A 54 -10.479 2.238 -3.542 1.00 32.53 C ATOM 605 CG PRO A 54 -10.365 0.859 -2.939 1.00 43.14 C ATOM 606 CD PRO A 54 -11.444 0.010 -3.590 1.00 22.32 C ATOM 0 HA PRO A 54 -11.631 2.885 -5.337 1.00 61.31 H new ATOM 0 HB2 PRO A 54 -9.499 2.699 -3.668 1.00 32.53 H new ATOM 0 HB3 PRO A 54 -11.064 2.903 -2.906 1.00 32.53 H new ATOM 0 HG2 PRO A 54 -9.377 0.437 -3.122 1.00 43.14 H new ATOM 0 HG3 PRO A 54 -10.501 0.896 -1.858 1.00 43.14 H new ATOM 0 HD2 PRO A 54 -11.022 -0.848 -4.113 1.00 22.32 H new ATOM 0 HD3 PRO A 54 -12.149 -0.379 -2.856 1.00 22.32 H new ATOM 614 N GLU A 55 -9.012 2.218 -6.031 1.00 33.12 N ATOM 615 CA GLU A 55 -7.931 1.803 -6.896 1.00 12.33 C ATOM 616 C GLU A 55 -7.033 0.910 -6.120 1.00 51.50 C ATOM 617 O GLU A 55 -6.557 1.277 -5.040 1.00 41.14 O ATOM 618 CB GLU A 55 -7.156 2.988 -7.447 1.00 74.52 C ATOM 619 CG GLU A 55 -7.928 3.827 -8.436 1.00 24.35 C ATOM 620 CD GLU A 55 -7.116 4.972 -8.963 1.00 0.11 C ATOM 621 OE1 GLU A 55 -6.280 4.764 -9.878 1.00 41.22 O ATOM 622 OE2 GLU A 55 -7.291 6.100 -8.476 1.00 11.32 O ATOM 0 H GLU A 55 -8.834 3.082 -5.519 1.00 33.12 H new ATOM 0 HA GLU A 55 -8.346 1.275 -7.755 1.00 12.33 H new ATOM 0 HB2 GLU A 55 -6.844 3.621 -6.617 1.00 74.52 H new ATOM 0 HB3 GLU A 55 -6.249 2.622 -7.928 1.00 74.52 H new ATOM 0 HG2 GLU A 55 -8.251 3.200 -9.267 1.00 24.35 H new ATOM 0 HG3 GLU A 55 -8.829 4.212 -7.958 1.00 24.35 H new ATOM 629 N ILE A 56 -6.822 -0.251 -6.617 1.00 42.22 N ATOM 630 CA ILE A 56 -6.042 -1.205 -5.929 1.00 14.34 C ATOM 631 C ILE A 56 -4.729 -1.311 -6.643 1.00 50.40 C ATOM 632 O ILE A 56 -4.682 -1.697 -7.745 1.00 52.41 O ATOM 633 CB ILE A 56 -6.778 -2.558 -5.931 1.00 22.23 C ATOM 634 CG1 ILE A 56 -8.171 -2.375 -5.288 1.00 33.33 C ATOM 635 CG2 ILE A 56 -5.958 -3.586 -5.175 1.00 21.31 C ATOM 636 CD1 ILE A 56 -9.146 -3.495 -5.548 1.00 45.30 C ATOM 0 H ILE A 56 -7.187 -0.566 -7.516 1.00 42.22 H new ATOM 0 HA ILE A 56 -5.876 -0.912 -4.892 1.00 14.34 H new ATOM 0 HB ILE A 56 -6.908 -2.914 -6.953 1.00 22.23 H new ATOM 0 HG12 ILE A 56 -8.046 -2.266 -4.211 1.00 33.33 H new ATOM 0 HG13 ILE A 56 -8.604 -1.444 -5.655 1.00 33.33 H new ATOM 0 HG21 ILE A 56 -6.481 -4.542 -5.178 1.00 21.31 H new ATOM 0 HG22 ILE A 56 -4.987 -3.702 -5.656 1.00 21.31 H new ATOM 0 HG23 ILE A 56 -5.816 -3.253 -4.147 1.00 21.31 H new ATOM 0 HD11 ILE A 56 -10.093 -3.274 -5.056 1.00 45.30 H new ATOM 0 HD12 ILE A 56 -9.309 -3.594 -6.621 1.00 45.30 H new ATOM 0 HD13 ILE A 56 -8.742 -4.428 -5.155 1.00 45.30 H new ATOM 648 N TYR A 57 -3.696 -0.899 -6.044 1.00 64.01 N ATOM 649 CA TYR A 57 -2.420 -0.950 -6.680 1.00 24.13 C ATOM 650 C TYR A 57 -1.693 -2.161 -6.216 1.00 0.50 C ATOM 651 O TYR A 57 -1.732 -2.480 -5.070 1.00 10.22 O ATOM 652 CB TYR A 57 -1.618 0.314 -6.389 1.00 51.21 C ATOM 653 CG TYR A 57 -2.252 1.571 -6.934 1.00 13.03 C ATOM 654 CD1 TYR A 57 -1.978 2.010 -8.219 1.00 24.20 C ATOM 655 CD2 TYR A 57 -3.137 2.314 -6.166 1.00 21.45 C ATOM 656 CE1 TYR A 57 -2.566 3.157 -8.719 1.00 3.25 C ATOM 657 CE2 TYR A 57 -3.725 3.453 -6.664 1.00 70.11 C ATOM 658 CZ TYR A 57 -3.442 3.869 -7.934 1.00 31.52 C ATOM 659 OH TYR A 57 -4.018 5.028 -8.411 1.00 11.21 O ATOM 0 H TYR A 57 -3.691 -0.514 -5.100 1.00 64.01 H new ATOM 0 HA TYR A 57 -2.557 -1.007 -7.760 1.00 24.13 H new ATOM 0 HB2 TYR A 57 -1.496 0.417 -5.311 1.00 51.21 H new ATOM 0 HB3 TYR A 57 -0.620 0.207 -6.814 1.00 51.21 H new ATOM 0 HD1 TYR A 57 -1.295 1.448 -8.839 1.00 24.20 H new ATOM 0 HD2 TYR A 57 -3.368 1.993 -5.161 1.00 21.45 H new ATOM 0 HE1 TYR A 57 -2.339 3.492 -9.720 1.00 3.25 H new ATOM 0 HE2 TYR A 57 -4.411 4.019 -6.051 1.00 70.11 H new ATOM 0 HH TYR A 57 -4.736 4.802 -9.039 1.00 11.21 H new ATOM 669 N VAL A 58 -1.080 -2.852 -7.111 1.00 34.22 N ATOM 670 CA VAL A 58 -0.300 -4.025 -6.788 1.00 62.14 C ATOM 671 C VAL A 58 1.015 -3.897 -7.502 1.00 14.50 C ATOM 672 O VAL A 58 1.050 -3.787 -8.722 1.00 32.13 O ATOM 673 CB VAL A 58 -1.027 -5.339 -7.179 1.00 62.33 C ATOM 674 CG1 VAL A 58 -0.109 -6.550 -7.068 1.00 41.23 C ATOM 675 CG2 VAL A 58 -2.241 -5.559 -6.304 1.00 32.50 C ATOM 0 H VAL A 58 -1.098 -2.627 -8.106 1.00 34.22 H new ATOM 0 HA VAL A 58 -0.150 -4.082 -5.710 1.00 62.14 H new ATOM 0 HB VAL A 58 -1.336 -5.231 -8.219 1.00 62.33 H new ATOM 0 HG11 VAL A 58 -0.657 -7.449 -7.350 1.00 41.23 H new ATOM 0 HG12 VAL A 58 0.745 -6.421 -7.733 1.00 41.23 H new ATOM 0 HG13 VAL A 58 0.243 -6.647 -6.041 1.00 41.23 H new ATOM 0 HG21 VAL A 58 -2.736 -6.486 -6.595 1.00 32.50 H new ATOM 0 HG22 VAL A 58 -1.931 -5.625 -5.261 1.00 32.50 H new ATOM 0 HG23 VAL A 58 -2.932 -4.725 -6.425 1.00 32.50 H new ATOM 685 N ASN A 59 2.080 -3.827 -6.719 1.00 74.43 N ATOM 686 CA ASN A 59 3.461 -3.571 -7.199 1.00 44.21 C ATOM 687 C ASN A 59 3.554 -2.177 -7.780 1.00 25.24 C ATOM 688 O ASN A 59 4.461 -1.857 -8.537 1.00 65.52 O ATOM 689 CB ASN A 59 3.967 -4.615 -8.224 1.00 34.44 C ATOM 690 CG ASN A 59 4.249 -5.967 -7.612 1.00 51.32 C ATOM 691 OD1 ASN A 59 5.339 -6.208 -7.091 1.00 33.12 O ATOM 692 ND2 ASN A 59 3.315 -6.873 -7.714 1.00 5.11 N ATOM 0 H ASN A 59 2.025 -3.947 -5.708 1.00 74.43 H new ATOM 0 HA ASN A 59 4.113 -3.661 -6.330 1.00 44.21 H new ATOM 0 HB2 ASN A 59 3.223 -4.729 -9.013 1.00 34.44 H new ATOM 0 HB3 ASN A 59 4.876 -4.240 -8.695 1.00 34.44 H new ATOM 0 HD21 ASN A 59 3.477 -7.814 -7.356 1.00 5.11 H new ATOM 0 HD22 ASN A 59 2.424 -6.640 -8.151 1.00 5.11 H new ATOM 699 N GLY A 60 2.610 -1.341 -7.377 1.00 13.24 N ATOM 700 CA GLY A 60 2.542 0.014 -7.864 1.00 75.22 C ATOM 701 C GLY A 60 1.760 0.099 -9.154 1.00 40.03 C ATOM 702 O GLY A 60 1.634 1.160 -9.737 1.00 41.24 O ATOM 0 H GLY A 60 1.879 -1.586 -6.709 1.00 13.24 H new ATOM 0 HA2 GLY A 60 2.075 0.649 -7.111 1.00 75.22 H new ATOM 0 HA3 GLY A 60 3.550 0.396 -8.023 1.00 75.22 H new ATOM 706 N LYS A 61 1.220 -1.027 -9.586 1.00 3.33 N ATOM 707 CA LYS A 61 0.490 -1.088 -10.811 1.00 32.41 C ATOM 708 C LYS A 61 -0.965 -1.046 -10.487 1.00 10.34 C ATOM 709 O LYS A 61 -1.419 -1.781 -9.605 1.00 21.33 O ATOM 710 CB LYS A 61 0.831 -2.365 -11.587 1.00 72.52 C ATOM 711 CG LYS A 61 2.322 -2.582 -11.812 1.00 31.12 C ATOM 712 CD LYS A 61 2.948 -1.392 -12.500 1.00 34.00 C ATOM 713 CE LYS A 61 4.416 -1.618 -12.787 1.00 45.41 C ATOM 714 NZ LYS A 61 5.023 -0.461 -13.468 1.00 21.04 N ATOM 0 H LYS A 61 1.283 -1.915 -9.089 1.00 3.33 H new ATOM 0 HA LYS A 61 0.758 -0.242 -11.443 1.00 32.41 H new ATOM 0 HB2 LYS A 61 0.428 -3.222 -11.048 1.00 72.52 H new ATOM 0 HB3 LYS A 61 0.330 -2.333 -12.555 1.00 72.52 H new ATOM 0 HG2 LYS A 61 2.816 -2.754 -10.856 1.00 31.12 H new ATOM 0 HG3 LYS A 61 2.475 -3.477 -12.415 1.00 31.12 H new ATOM 0 HD2 LYS A 61 2.421 -1.193 -13.433 1.00 34.00 H new ATOM 0 HD3 LYS A 61 2.832 -0.507 -11.874 1.00 34.00 H new ATOM 0 HE2 LYS A 61 4.944 -1.809 -11.853 1.00 45.41 H new ATOM 0 HE3 LYS A 61 4.533 -2.507 -13.406 1.00 45.41 H new ATOM 0 HZ1 LYS A 61 6.029 -0.653 -13.648 1.00 21.04 H new ATOM 0 HZ2 LYS A 61 4.535 -0.295 -14.371 1.00 21.04 H new ATOM 0 HZ3 LYS A 61 4.934 0.382 -12.866 1.00 21.04 H new ATOM 728 N ILE A 62 -1.678 -0.192 -11.158 1.00 12.44 N ATOM 729 CA ILE A 62 -3.077 0.010 -10.897 1.00 40.14 C ATOM 730 C ILE A 62 -3.896 -1.244 -11.312 1.00 71.40 C ATOM 731 O ILE A 62 -3.818 -1.741 -12.443 1.00 65.04 O ATOM 732 CB ILE A 62 -3.580 1.341 -11.583 1.00 65.31 C ATOM 733 CG1 ILE A 62 -4.878 1.921 -10.944 1.00 2.33 C ATOM 734 CG2 ILE A 62 -3.740 1.188 -13.082 1.00 54.24 C ATOM 735 CD1 ILE A 62 -6.128 1.090 -11.065 1.00 13.40 C ATOM 0 H ILE A 62 -1.305 0.390 -11.908 1.00 12.44 H new ATOM 0 HA ILE A 62 -3.232 0.137 -9.826 1.00 40.14 H new ATOM 0 HB ILE A 62 -2.790 2.069 -11.398 1.00 65.31 H new ATOM 0 HG12 ILE A 62 -4.687 2.093 -9.885 1.00 2.33 H new ATOM 0 HG13 ILE A 62 -5.073 2.894 -11.395 1.00 2.33 H new ATOM 0 HG21 ILE A 62 -4.088 2.129 -13.509 1.00 54.24 H new ATOM 0 HG22 ILE A 62 -2.780 0.921 -13.525 1.00 54.24 H new ATOM 0 HG23 ILE A 62 -4.467 0.404 -13.292 1.00 54.24 H new ATOM 0 HD11 ILE A 62 -6.956 1.606 -10.580 1.00 13.40 H new ATOM 0 HD12 ILE A 62 -6.363 0.937 -12.118 1.00 13.40 H new ATOM 0 HD13 ILE A 62 -5.971 0.124 -10.584 1.00 13.40 H new ATOM 747 N GLN A 63 -4.620 -1.749 -10.384 1.00 0.13 N ATOM 748 CA GLN A 63 -5.449 -2.903 -10.552 1.00 25.21 C ATOM 749 C GLN A 63 -6.865 -2.502 -10.172 1.00 13.04 C ATOM 750 O GLN A 63 -7.084 -1.676 -9.244 1.00 43.41 O ATOM 751 CB GLN A 63 -5.013 -4.044 -9.607 1.00 30.53 C ATOM 752 CG GLN A 63 -3.527 -4.358 -9.580 1.00 4.33 C ATOM 753 CD GLN A 63 -2.958 -4.816 -10.898 1.00 24.33 C ATOM 754 OE1 GLN A 63 -3.638 -5.432 -11.716 1.00 23.40 O ATOM 755 NE2 GLN A 63 -1.699 -4.529 -11.105 1.00 23.01 N ATOM 0 H GLN A 63 -4.659 -1.359 -9.442 1.00 0.13 H new ATOM 0 HA GLN A 63 -5.375 -3.252 -11.582 1.00 25.21 H new ATOM 0 HB2 GLN A 63 -5.329 -3.791 -8.595 1.00 30.53 H new ATOM 0 HB3 GLN A 63 -5.550 -4.949 -9.891 1.00 30.53 H new ATOM 0 HG2 GLN A 63 -2.987 -3.468 -9.256 1.00 4.33 H new ATOM 0 HG3 GLN A 63 -3.346 -5.131 -8.833 1.00 4.33 H new ATOM 0 HE21 GLN A 63 -1.170 -4.016 -10.400 1.00 23.01 H new ATOM 0 HE22 GLN A 63 -1.246 -4.818 -11.972 1.00 23.01 H new ATOM 764 N THR A 64 -7.802 -3.027 -10.877 1.00 61.02 N ATOM 765 CA THR A 64 -9.174 -2.788 -10.582 1.00 24.33 C ATOM 766 C THR A 64 -9.653 -3.824 -9.548 1.00 34.21 C ATOM 767 O THR A 64 -8.916 -4.787 -9.220 1.00 44.45 O ATOM 768 CB THR A 64 -10.040 -2.851 -11.887 1.00 61.42 C ATOM 769 OG1 THR A 64 -11.432 -2.583 -11.611 1.00 33.41 O ATOM 770 CG2 THR A 64 -9.906 -4.206 -12.574 1.00 61.55 C ATOM 0 H THR A 64 -7.641 -3.637 -11.678 1.00 61.02 H new ATOM 0 HA THR A 64 -9.288 -1.788 -10.164 1.00 24.33 H new ATOM 0 HB THR A 64 -9.662 -2.078 -12.556 1.00 61.42 H new ATOM 0 HG1 THR A 64 -11.945 -2.628 -12.445 1.00 33.41 H new ATOM 0 HG21 THR A 64 -10.518 -4.219 -13.476 1.00 61.55 H new ATOM 0 HG22 THR A 64 -8.863 -4.377 -12.841 1.00 61.55 H new ATOM 0 HG23 THR A 64 -10.241 -4.992 -11.897 1.00 61.55 H new ATOM 778 N THR A 65 -10.850 -3.622 -9.044 1.00 55.40 N ATOM 779 CA THR A 65 -11.488 -4.503 -8.099 1.00 72.30 C ATOM 780 C THR A 65 -11.529 -5.956 -8.621 1.00 53.44 C ATOM 781 O THR A 65 -11.342 -6.905 -7.854 1.00 63.44 O ATOM 782 CB THR A 65 -12.914 -3.976 -7.744 1.00 0.51 C ATOM 783 OG1 THR A 65 -13.592 -4.876 -6.873 1.00 74.44 O ATOM 784 CG2 THR A 65 -13.756 -3.726 -8.993 1.00 44.13 C ATOM 0 H THR A 65 -11.422 -2.814 -9.290 1.00 55.40 H new ATOM 0 HA THR A 65 -10.895 -4.513 -7.185 1.00 72.30 H new ATOM 0 HB THR A 65 -12.779 -3.024 -7.231 1.00 0.51 H new ATOM 0 HG1 THR A 65 -14.176 -4.370 -6.270 1.00 74.44 H new ATOM 0 HG21 THR A 65 -14.740 -3.360 -8.701 1.00 44.13 H new ATOM 0 HG22 THR A 65 -13.264 -2.983 -9.621 1.00 44.13 H new ATOM 0 HG23 THR A 65 -13.865 -4.656 -9.550 1.00 44.13 H new ATOM 792 N THR A 66 -11.720 -6.108 -9.927 1.00 73.11 N ATOM 793 CA THR A 66 -11.741 -7.397 -10.572 1.00 75.34 C ATOM 794 C THR A 66 -10.381 -8.102 -10.405 1.00 41.51 C ATOM 795 O THR A 66 -10.318 -9.242 -9.971 1.00 4.31 O ATOM 796 CB THR A 66 -12.041 -7.206 -12.062 1.00 41.03 C ATOM 797 OG1 THR A 66 -13.178 -6.333 -12.201 1.00 74.11 O ATOM 798 CG2 THR A 66 -12.332 -8.538 -12.730 1.00 22.34 C ATOM 0 H THR A 66 -11.865 -5.326 -10.566 1.00 73.11 H new ATOM 0 HA THR A 66 -12.513 -8.015 -10.113 1.00 75.34 H new ATOM 0 HB THR A 66 -11.169 -6.766 -12.546 1.00 41.03 H new ATOM 0 HG1 THR A 66 -13.377 -6.203 -13.152 1.00 74.11 H new ATOM 0 HG21 THR A 66 -12.542 -8.377 -13.787 1.00 22.34 H new ATOM 0 HG22 THR A 66 -11.467 -9.193 -12.628 1.00 22.34 H new ATOM 0 HG23 THR A 66 -13.196 -9.002 -12.255 1.00 22.34 H new ATOM 806 N ALA A 67 -9.308 -7.389 -10.729 1.00 0.44 N ATOM 807 CA ALA A 67 -7.943 -7.893 -10.627 1.00 32.31 C ATOM 808 C ALA A 67 -7.632 -8.315 -9.207 1.00 44.31 C ATOM 809 O ALA A 67 -7.115 -9.403 -8.989 1.00 61.15 O ATOM 810 CB ALA A 67 -6.962 -6.832 -11.088 1.00 4.21 C ATOM 0 H ALA A 67 -9.363 -6.431 -11.075 1.00 0.44 H new ATOM 0 HA ALA A 67 -7.848 -8.767 -11.271 1.00 32.31 H new ATOM 0 HB1 ALA A 67 -5.945 -7.217 -11.008 1.00 4.21 H new ATOM 0 HB2 ALA A 67 -7.170 -6.570 -12.125 1.00 4.21 H new ATOM 0 HB3 ALA A 67 -7.064 -5.945 -10.462 1.00 4.21 H new ATOM 816 N PHE A 68 -7.963 -7.452 -8.255 1.00 61.32 N ATOM 817 CA PHE A 68 -7.796 -7.746 -6.829 1.00 73.34 C ATOM 818 C PHE A 68 -8.492 -9.034 -6.477 1.00 14.23 C ATOM 819 O PHE A 68 -7.882 -9.941 -5.920 1.00 25.10 O ATOM 820 CB PHE A 68 -8.385 -6.615 -6.006 1.00 63.43 C ATOM 821 CG PHE A 68 -8.501 -6.873 -4.511 1.00 62.31 C ATOM 822 CD1 PHE A 68 -9.692 -7.346 -3.971 1.00 33.43 C ATOM 823 CD2 PHE A 68 -7.439 -6.641 -3.660 1.00 14.21 C ATOM 824 CE1 PHE A 68 -9.811 -7.584 -2.625 1.00 62.40 C ATOM 825 CE2 PHE A 68 -7.557 -6.879 -2.302 1.00 40.23 C ATOM 826 CZ PHE A 68 -8.744 -7.353 -1.786 1.00 14.02 C ATOM 0 H PHE A 68 -8.354 -6.529 -8.444 1.00 61.32 H new ATOM 0 HA PHE A 68 -6.733 -7.846 -6.612 1.00 73.34 H new ATOM 0 HB2 PHE A 68 -7.773 -5.726 -6.155 1.00 63.43 H new ATOM 0 HB3 PHE A 68 -9.378 -6.388 -6.394 1.00 63.43 H new ATOM 0 HD1 PHE A 68 -10.535 -7.529 -4.620 1.00 33.43 H new ATOM 0 HD2 PHE A 68 -6.506 -6.270 -4.058 1.00 14.21 H new ATOM 0 HE1 PHE A 68 -10.743 -7.953 -2.223 1.00 62.40 H new ATOM 0 HE2 PHE A 68 -6.719 -6.693 -1.646 1.00 40.23 H new ATOM 0 HZ PHE A 68 -8.837 -7.543 -0.727 1.00 14.02 H new ATOM 836 N LEU A 69 -9.774 -9.086 -6.793 1.00 23.31 N ATOM 837 CA LEU A 69 -10.605 -10.274 -6.562 1.00 71.40 C ATOM 838 C LEU A 69 -9.938 -11.526 -7.167 1.00 71.21 C ATOM 839 O LEU A 69 -9.928 -12.598 -6.548 1.00 14.11 O ATOM 840 CB LEU A 69 -12.035 -10.040 -7.122 1.00 3.51 C ATOM 841 CG LEU A 69 -13.179 -11.010 -6.704 1.00 21.22 C ATOM 842 CD1 LEU A 69 -13.046 -12.398 -7.314 1.00 5.31 C ATOM 843 CD2 LEU A 69 -13.267 -11.103 -5.191 1.00 54.04 C ATOM 0 H LEU A 69 -10.278 -8.308 -7.219 1.00 23.31 H new ATOM 0 HA LEU A 69 -10.697 -10.448 -5.490 1.00 71.40 H new ATOM 0 HB2 LEU A 69 -12.338 -9.032 -6.838 1.00 3.51 H new ATOM 0 HB3 LEU A 69 -11.969 -10.059 -8.210 1.00 3.51 H new ATOM 0 HG LEU A 69 -14.102 -10.587 -7.099 1.00 21.22 H new ATOM 0 HD11 LEU A 69 -13.875 -13.023 -6.982 1.00 5.31 H new ATOM 0 HD12 LEU A 69 -13.063 -12.321 -8.401 1.00 5.31 H new ATOM 0 HD13 LEU A 69 -12.104 -12.846 -6.997 1.00 5.31 H new ATOM 0 HD21 LEU A 69 -14.071 -11.785 -4.915 1.00 54.04 H new ATOM 0 HD22 LEU A 69 -12.323 -11.476 -4.794 1.00 54.04 H new ATOM 0 HD23 LEU A 69 -13.470 -10.115 -4.777 1.00 54.04 H new ATOM 855 N GLN A 70 -9.365 -11.378 -8.344 1.00 22.23 N ATOM 856 CA GLN A 70 -8.651 -12.440 -8.989 1.00 1.51 C ATOM 857 C GLN A 70 -7.439 -12.879 -8.154 1.00 13.24 C ATOM 858 O GLN A 70 -7.288 -14.056 -7.854 1.00 41.11 O ATOM 859 CB GLN A 70 -8.238 -12.035 -10.397 1.00 60.23 C ATOM 860 CG GLN A 70 -9.403 -11.847 -11.352 1.00 42.10 C ATOM 861 CD GLN A 70 -8.962 -11.657 -12.785 1.00 3.44 C ATOM 862 OE1 GLN A 70 -8.829 -12.626 -13.530 1.00 72.11 O ATOM 863 NE2 GLN A 70 -8.762 -10.435 -13.194 1.00 73.41 N ATOM 0 H GLN A 70 -9.387 -10.508 -8.876 1.00 22.23 H new ATOM 0 HA GLN A 70 -9.319 -13.297 -9.071 1.00 1.51 H new ATOM 0 HB2 GLN A 70 -7.671 -11.106 -10.345 1.00 60.23 H new ATOM 0 HB3 GLN A 70 -7.569 -12.795 -10.801 1.00 60.23 H new ATOM 0 HG2 GLN A 70 -10.060 -12.714 -11.291 1.00 42.10 H new ATOM 0 HG3 GLN A 70 -9.987 -10.982 -11.039 1.00 42.10 H new ATOM 0 HE21 GLN A 70 -8.882 -9.655 -12.548 1.00 73.41 H new ATOM 0 HE22 GLN A 70 -8.486 -10.259 -14.160 1.00 73.41 H new ATOM 872 N PHE A 71 -6.632 -11.927 -7.713 1.00 30.01 N ATOM 873 CA PHE A 71 -5.444 -12.241 -6.912 1.00 71.33 C ATOM 874 C PHE A 71 -5.860 -12.873 -5.578 1.00 71.31 C ATOM 875 O PHE A 71 -5.210 -13.784 -5.064 1.00 3.11 O ATOM 876 CB PHE A 71 -4.586 -10.988 -6.661 1.00 42.04 C ATOM 877 CG PHE A 71 -4.060 -10.321 -7.901 1.00 3.23 C ATOM 878 CD1 PHE A 71 -3.378 -11.045 -8.865 1.00 60.24 C ATOM 879 CD2 PHE A 71 -4.239 -8.962 -8.094 1.00 34.05 C ATOM 880 CE1 PHE A 71 -2.892 -10.428 -9.998 1.00 3.43 C ATOM 881 CE2 PHE A 71 -3.758 -8.338 -9.225 1.00 31.31 C ATOM 882 CZ PHE A 71 -3.084 -9.071 -10.180 1.00 14.24 C ATOM 0 H PHE A 71 -6.771 -10.932 -7.892 1.00 30.01 H new ATOM 0 HA PHE A 71 -4.839 -12.952 -7.474 1.00 71.33 H new ATOM 0 HB2 PHE A 71 -5.180 -10.265 -6.102 1.00 42.04 H new ATOM 0 HB3 PHE A 71 -3.742 -11.264 -6.029 1.00 42.04 H new ATOM 0 HD1 PHE A 71 -3.225 -12.105 -8.727 1.00 60.24 H new ATOM 0 HD2 PHE A 71 -4.763 -8.383 -7.348 1.00 34.05 H new ATOM 0 HE1 PHE A 71 -2.362 -11.004 -10.742 1.00 3.43 H new ATOM 0 HE2 PHE A 71 -3.908 -7.278 -9.363 1.00 31.31 H new ATOM 0 HZ PHE A 71 -2.707 -8.586 -11.068 1.00 14.24 H new ATOM 892 N PHE A 72 -6.950 -12.388 -5.056 1.00 32.32 N ATOM 893 CA PHE A 72 -7.560 -12.880 -3.847 1.00 24.01 C ATOM 894 C PHE A 72 -7.928 -14.352 -3.982 1.00 23.54 C ATOM 895 O PHE A 72 -7.461 -15.188 -3.200 1.00 54.31 O ATOM 896 CB PHE A 72 -8.788 -12.002 -3.515 1.00 12.33 C ATOM 897 CG PHE A 72 -9.812 -12.635 -2.625 1.00 32.01 C ATOM 898 CD1 PHE A 72 -9.657 -12.666 -1.261 1.00 55.32 C ATOM 899 CD2 PHE A 72 -10.940 -13.203 -3.181 1.00 3.13 C ATOM 900 CE1 PHE A 72 -10.614 -13.261 -0.461 1.00 34.21 C ATOM 901 CE2 PHE A 72 -11.898 -13.796 -2.397 1.00 64.44 C ATOM 902 CZ PHE A 72 -11.736 -13.828 -1.031 1.00 21.13 C ATOM 0 H PHE A 72 -7.460 -11.610 -5.474 1.00 32.32 H new ATOM 0 HA PHE A 72 -6.851 -12.814 -3.022 1.00 24.01 H new ATOM 0 HB2 PHE A 72 -8.439 -11.084 -3.042 1.00 12.33 H new ATOM 0 HB3 PHE A 72 -9.271 -11.716 -4.449 1.00 12.33 H new ATOM 0 HD1 PHE A 72 -8.781 -12.222 -0.810 1.00 55.32 H new ATOM 0 HD2 PHE A 72 -11.071 -13.181 -4.253 1.00 3.13 H new ATOM 0 HE1 PHE A 72 -10.484 -13.282 0.611 1.00 34.21 H new ATOM 0 HE2 PHE A 72 -12.774 -14.235 -2.850 1.00 64.44 H new ATOM 0 HZ PHE A 72 -12.484 -14.295 -0.407 1.00 21.13 H new ATOM 912 N ARG A 73 -8.695 -14.675 -5.014 1.00 22.04 N ATOM 913 CA ARG A 73 -9.169 -16.027 -5.213 1.00 51.42 C ATOM 914 C ARG A 73 -8.013 -16.952 -5.578 1.00 41.44 C ATOM 915 O ARG A 73 -8.072 -18.156 -5.329 1.00 25.13 O ATOM 916 CB ARG A 73 -10.291 -16.071 -6.268 1.00 41.34 C ATOM 917 CG ARG A 73 -9.834 -15.778 -7.682 1.00 71.03 C ATOM 918 CD ARG A 73 -10.989 -15.495 -8.622 1.00 40.41 C ATOM 919 NE ARG A 73 -11.968 -16.587 -8.705 1.00 63.23 N ATOM 920 CZ ARG A 73 -12.753 -16.821 -9.768 1.00 3.13 C ATOM 921 NH1 ARG A 73 -12.519 -16.201 -10.938 1.00 62.25 N ATOM 922 NH2 ARG A 73 -13.735 -17.704 -9.668 1.00 65.25 N ATOM 0 H ARG A 73 -9.000 -14.012 -5.726 1.00 22.04 H new ATOM 0 HA ARG A 73 -9.595 -16.384 -4.275 1.00 51.42 H new ATOM 0 HB2 ARG A 73 -10.755 -17.057 -6.246 1.00 41.34 H new ATOM 0 HB3 ARG A 73 -11.061 -15.351 -5.992 1.00 41.34 H new ATOM 0 HG2 ARG A 73 -9.161 -14.921 -7.672 1.00 71.03 H new ATOM 0 HG3 ARG A 73 -9.264 -16.627 -8.059 1.00 71.03 H new ATOM 0 HD2 ARG A 73 -11.497 -14.588 -8.295 1.00 40.41 H new ATOM 0 HD3 ARG A 73 -10.594 -15.297 -9.618 1.00 40.41 H new ATOM 0 HE ARG A 73 -12.057 -17.209 -7.901 1.00 63.23 H new ATOM 0 HH11 ARG A 73 -11.740 -15.548 -11.022 1.00 62.25 H new ATOM 0 HH12 ARG A 73 -13.120 -16.384 -11.741 1.00 62.25 H new ATOM 0 HH21 ARG A 73 -13.889 -18.198 -8.789 1.00 65.25 H new ATOM 0 HH22 ARG A 73 -14.338 -17.890 -10.470 1.00 65.25 H new ATOM 936 N GLN A 74 -6.952 -16.378 -6.136 1.00 21.43 N ATOM 937 CA GLN A 74 -5.777 -17.148 -6.485 1.00 10.33 C ATOM 938 C GLN A 74 -4.794 -17.287 -5.301 1.00 63.31 C ATOM 939 O GLN A 74 -3.727 -17.902 -5.434 1.00 52.30 O ATOM 940 CB GLN A 74 -5.096 -16.590 -7.736 1.00 50.12 C ATOM 941 CG GLN A 74 -6.002 -16.594 -8.958 1.00 13.32 C ATOM 942 CD GLN A 74 -5.340 -16.057 -10.199 1.00 25.41 C ATOM 943 OE1 GLN A 74 -5.361 -14.854 -10.467 1.00 43.20 O ATOM 944 NE2 GLN A 74 -4.780 -16.928 -10.988 1.00 32.22 N ATOM 0 H GLN A 74 -6.888 -15.384 -6.354 1.00 21.43 H new ATOM 0 HA GLN A 74 -6.114 -18.157 -6.722 1.00 10.33 H new ATOM 0 HB2 GLN A 74 -4.766 -15.570 -7.539 1.00 50.12 H new ATOM 0 HB3 GLN A 74 -4.204 -17.178 -7.950 1.00 50.12 H new ATOM 0 HG2 GLN A 74 -6.338 -17.613 -9.148 1.00 13.32 H new ATOM 0 HG3 GLN A 74 -6.890 -16.000 -8.744 1.00 13.32 H new ATOM 0 HE21 GLN A 74 -4.779 -17.917 -10.738 1.00 32.22 H new ATOM 0 HE22 GLN A 74 -4.342 -16.622 -11.857 1.00 32.22 H new ATOM 953 N GLY A 75 -5.140 -16.692 -4.157 1.00 50.23 N ATOM 954 CA GLY A 75 -4.375 -16.903 -2.940 1.00 43.41 C ATOM 955 C GLY A 75 -3.233 -15.933 -2.714 1.00 52.31 C ATOM 956 O GLY A 75 -2.410 -16.149 -1.827 1.00 22.42 O ATOM 0 H GLY A 75 -5.939 -16.067 -4.054 1.00 50.23 H new ATOM 0 HA2 GLY A 75 -5.054 -16.843 -2.089 1.00 43.41 H new ATOM 0 HA3 GLY A 75 -3.972 -17.916 -2.955 1.00 43.41 H new ATOM 960 N LEU A 76 -3.198 -14.859 -3.460 1.00 52.42 N ATOM 961 CA LEU A 76 -2.105 -13.879 -3.366 1.00 13.14 C ATOM 962 C LEU A 76 -2.057 -13.179 -2.012 1.00 4.43 C ATOM 963 O LEU A 76 -0.994 -12.984 -1.451 1.00 1.14 O ATOM 964 CB LEU A 76 -2.198 -12.824 -4.486 1.00 34.13 C ATOM 965 CG LEU A 76 -1.692 -13.197 -5.904 1.00 54.43 C ATOM 966 CD1 LEU A 76 -0.184 -13.370 -5.914 1.00 62.34 C ATOM 967 CD2 LEU A 76 -2.356 -14.454 -6.447 1.00 74.15 C ATOM 0 H LEU A 76 -3.912 -14.625 -4.150 1.00 52.42 H new ATOM 0 HA LEU A 76 -1.183 -14.449 -3.482 1.00 13.14 H new ATOM 0 HB2 LEU A 76 -3.243 -12.528 -4.575 1.00 34.13 H new ATOM 0 HB3 LEU A 76 -1.644 -11.944 -4.158 1.00 34.13 H new ATOM 0 HG LEU A 76 -1.966 -12.368 -6.557 1.00 54.43 H new ATOM 0 HD11 LEU A 76 0.146 -13.631 -6.920 1.00 62.34 H new ATOM 0 HD12 LEU A 76 0.291 -12.438 -5.607 1.00 62.34 H new ATOM 0 HD13 LEU A 76 0.096 -14.165 -5.223 1.00 62.34 H new ATOM 0 HD21 LEU A 76 -1.966 -14.671 -7.442 1.00 74.15 H new ATOM 0 HD22 LEU A 76 -2.144 -15.293 -5.784 1.00 74.15 H new ATOM 0 HD23 LEU A 76 -3.434 -14.300 -6.505 1.00 74.15 H new ATOM 979 N PHE A 77 -3.205 -12.849 -1.468 1.00 31.21 N ATOM 980 CA PHE A 77 -3.241 -12.070 -0.235 1.00 22.45 C ATOM 981 C PHE A 77 -3.235 -12.945 1.007 1.00 42.54 C ATOM 982 O PHE A 77 -3.128 -12.440 2.126 1.00 34.43 O ATOM 983 CB PHE A 77 -4.429 -11.105 -0.238 1.00 32.23 C ATOM 984 CG PHE A 77 -4.419 -10.190 -1.431 1.00 61.00 C ATOM 985 CD1 PHE A 77 -3.424 -9.240 -1.582 1.00 65.31 C ATOM 986 CD2 PHE A 77 -5.390 -10.295 -2.407 1.00 11.01 C ATOM 987 CE1 PHE A 77 -3.398 -8.416 -2.685 1.00 72.03 C ATOM 988 CE2 PHE A 77 -5.373 -9.471 -3.509 1.00 43.21 C ATOM 989 CZ PHE A 77 -4.374 -8.532 -3.651 1.00 54.02 C ATOM 0 H PHE A 77 -4.118 -13.099 -1.847 1.00 31.21 H new ATOM 0 HA PHE A 77 -2.324 -11.482 -0.199 1.00 22.45 H new ATOM 0 HB2 PHE A 77 -5.358 -11.676 -0.229 1.00 32.23 H new ATOM 0 HB3 PHE A 77 -4.412 -10.509 0.674 1.00 32.23 H new ATOM 0 HD1 PHE A 77 -2.659 -9.144 -0.826 1.00 65.31 H new ATOM 0 HD2 PHE A 77 -6.172 -11.033 -2.304 1.00 11.01 H new ATOM 0 HE1 PHE A 77 -2.615 -7.681 -2.793 1.00 72.03 H new ATOM 0 HE2 PHE A 77 -6.142 -9.560 -4.262 1.00 43.21 H new ATOM 0 HZ PHE A 77 -4.356 -7.888 -4.518 1.00 54.02 H new ATOM 999 N LYS A 78 -3.241 -14.260 0.794 1.00 30.43 N ATOM 1000 CA LYS A 78 -3.285 -15.235 1.892 1.00 70.11 C ATOM 1001 C LYS A 78 -2.034 -15.207 2.752 1.00 54.34 C ATOM 1002 O LYS A 78 -2.002 -15.776 3.850 1.00 2.42 O ATOM 1003 CB LYS A 78 -3.513 -16.647 1.375 1.00 3.24 C ATOM 1004 CG LYS A 78 -4.866 -16.892 0.754 1.00 61.13 C ATOM 1005 CD LYS A 78 -5.016 -18.351 0.390 1.00 33.01 C ATOM 1006 CE LYS A 78 -6.380 -18.646 -0.183 1.00 74.34 C ATOM 1007 NZ LYS A 78 -6.544 -20.084 -0.477 1.00 4.34 N ATOM 0 H LYS A 78 -3.216 -14.681 -0.135 1.00 30.43 H new ATOM 0 HA LYS A 78 -4.128 -14.940 2.516 1.00 70.11 H new ATOM 0 HB2 LYS A 78 -2.745 -16.875 0.636 1.00 3.24 H new ATOM 0 HB3 LYS A 78 -3.378 -17.346 2.201 1.00 3.24 H new ATOM 0 HG2 LYS A 78 -5.652 -16.601 1.451 1.00 61.13 H new ATOM 0 HG3 LYS A 78 -4.983 -16.274 -0.136 1.00 61.13 H new ATOM 0 HD2 LYS A 78 -4.250 -18.626 -0.335 1.00 33.01 H new ATOM 0 HD3 LYS A 78 -4.853 -18.966 1.275 1.00 33.01 H new ATOM 0 HE2 LYS A 78 -7.148 -18.328 0.522 1.00 74.34 H new ATOM 0 HE3 LYS A 78 -6.525 -18.068 -1.096 1.00 74.34 H new ATOM 0 HZ1 LYS A 78 -7.492 -20.252 -0.869 1.00 4.34 H new ATOM 0 HZ2 LYS A 78 -5.826 -20.381 -1.168 1.00 4.34 H new ATOM 0 HZ3 LYS A 78 -6.430 -20.633 0.399 1.00 4.34 H new ATOM 1021 N LYS A 79 -1.006 -14.576 2.256 1.00 73.44 N ATOM 1022 CA LYS A 79 0.239 -14.465 2.977 1.00 44.01 C ATOM 1023 C LYS A 79 0.117 -13.416 4.066 1.00 64.34 C ATOM 1024 O LYS A 79 0.567 -13.612 5.204 1.00 53.23 O ATOM 1025 CB LYS A 79 1.368 -14.059 2.023 1.00 13.45 C ATOM 1026 CG LYS A 79 1.569 -14.971 0.823 1.00 20.41 C ATOM 1027 CD LYS A 79 2.094 -16.337 1.223 1.00 72.34 C ATOM 1028 CE LYS A 79 2.316 -17.215 0.001 1.00 0.11 C ATOM 1029 NZ LYS A 79 2.871 -18.531 0.362 1.00 74.42 N ATOM 0 H LYS A 79 -1.004 -14.123 1.342 1.00 73.44 H new ATOM 0 HA LYS A 79 0.467 -15.434 3.422 1.00 44.01 H new ATOM 0 HB2 LYS A 79 1.170 -13.050 1.662 1.00 13.45 H new ATOM 0 HB3 LYS A 79 2.300 -14.018 2.587 1.00 13.45 H new ATOM 0 HG2 LYS A 79 0.623 -15.088 0.295 1.00 20.41 H new ATOM 0 HG3 LYS A 79 2.267 -14.505 0.127 1.00 20.41 H new ATOM 0 HD2 LYS A 79 3.030 -16.225 1.770 1.00 72.34 H new ATOM 0 HD3 LYS A 79 1.387 -16.819 1.898 1.00 72.34 H new ATOM 0 HE2 LYS A 79 1.371 -17.352 -0.524 1.00 0.11 H new ATOM 0 HE3 LYS A 79 2.994 -16.712 -0.689 1.00 0.11 H new ATOM 0 HZ1 LYS A 79 3.007 -19.098 -0.499 1.00 74.42 H new ATOM 0 HZ2 LYS A 79 3.785 -18.403 0.840 1.00 74.42 H new ATOM 0 HZ3 LYS A 79 2.213 -19.022 1.000 1.00 74.42 H new ATOM 1043 N LEU A 80 -0.589 -12.371 3.747 1.00 22.42 N ATOM 1044 CA LEU A 80 -0.610 -11.178 4.548 1.00 23.40 C ATOM 1045 C LEU A 80 -1.706 -11.257 5.615 1.00 42.44 C ATOM 1046 O LEU A 80 -1.882 -10.345 6.392 1.00 74.23 O ATOM 1047 CB LEU A 80 -0.784 -9.980 3.583 1.00 62.10 C ATOM 1048 CG LEU A 80 -0.275 -8.580 4.020 1.00 21.34 C ATOM 1049 CD1 LEU A 80 -0.003 -7.743 2.789 1.00 11.11 C ATOM 1050 CD2 LEU A 80 -1.286 -7.843 4.885 1.00 51.13 C ATOM 0 H LEU A 80 -1.174 -12.321 2.913 1.00 22.42 H new ATOM 0 HA LEU A 80 0.321 -11.055 5.102 1.00 23.40 H new ATOM 0 HB2 LEU A 80 -0.284 -10.235 2.649 1.00 62.10 H new ATOM 0 HB3 LEU A 80 -1.847 -9.889 3.361 1.00 62.10 H new ATOM 0 HG LEU A 80 0.631 -8.731 4.607 1.00 21.34 H new ATOM 0 HD11 LEU A 80 0.355 -6.758 3.090 1.00 11.11 H new ATOM 0 HD12 LEU A 80 0.754 -8.232 2.176 1.00 11.11 H new ATOM 0 HD13 LEU A 80 -0.922 -7.634 2.213 1.00 11.11 H new ATOM 0 HD21 LEU A 80 -0.884 -6.869 5.165 1.00 51.13 H new ATOM 0 HD22 LEU A 80 -2.212 -7.706 4.326 1.00 51.13 H new ATOM 0 HD23 LEU A 80 -1.488 -8.425 5.785 1.00 51.13 H new ATOM 1062 N LYS A 81 -2.362 -12.404 5.715 1.00 25.42 N ATOM 1063 CA LYS A 81 -3.489 -12.560 6.671 1.00 22.51 C ATOM 1064 C LYS A 81 -3.052 -12.470 8.152 1.00 12.52 C ATOM 1065 O LYS A 81 -3.888 -12.354 9.059 1.00 10.20 O ATOM 1066 CB LYS A 81 -4.334 -13.833 6.372 1.00 75.11 C ATOM 1067 CG LYS A 81 -3.632 -15.199 6.516 1.00 23.43 C ATOM 1068 CD LYS A 81 -3.469 -15.642 7.969 1.00 72.43 C ATOM 1069 CE LYS A 81 -2.930 -17.065 8.067 1.00 10.10 C ATOM 1070 NZ LYS A 81 -2.770 -17.503 9.473 1.00 4.53 N ATOM 0 H LYS A 81 -2.152 -13.236 5.164 1.00 25.42 H new ATOM 0 HA LYS A 81 -4.142 -11.702 6.511 1.00 22.51 H new ATOM 0 HB2 LYS A 81 -5.199 -13.827 7.035 1.00 75.11 H new ATOM 0 HB3 LYS A 81 -4.713 -13.754 5.353 1.00 75.11 H new ATOM 0 HG2 LYS A 81 -4.204 -15.953 5.975 1.00 23.43 H new ATOM 0 HG3 LYS A 81 -2.650 -15.147 6.047 1.00 23.43 H new ATOM 0 HD2 LYS A 81 -2.792 -14.960 8.484 1.00 72.43 H new ATOM 0 HD3 LYS A 81 -4.431 -15.581 8.478 1.00 72.43 H new ATOM 0 HE2 LYS A 81 -3.607 -17.745 7.550 1.00 10.10 H new ATOM 0 HE3 LYS A 81 -1.968 -17.124 7.557 1.00 10.10 H new ATOM 0 HZ1 LYS A 81 -2.402 -18.475 9.494 1.00 4.53 H new ATOM 0 HZ2 LYS A 81 -2.104 -16.870 9.960 1.00 4.53 H new ATOM 0 HZ3 LYS A 81 -3.692 -17.472 9.953 1.00 4.53 H new ATOM 1084 N ASP A 82 -1.752 -12.522 8.376 1.00 24.33 N ATOM 1085 CA ASP A 82 -1.176 -12.433 9.727 1.00 52.25 C ATOM 1086 C ASP A 82 -1.183 -10.982 10.183 1.00 71.41 C ATOM 1087 O ASP A 82 -1.466 -10.673 11.333 1.00 14.21 O ATOM 1088 CB ASP A 82 0.254 -12.985 9.711 1.00 3.41 C ATOM 1089 CG ASP A 82 0.883 -13.089 11.083 1.00 73.04 C ATOM 1090 OD1 ASP A 82 1.500 -12.125 11.551 1.00 33.32 O ATOM 1091 OD2 ASP A 82 0.794 -14.184 11.701 1.00 12.14 O ATOM 0 H ASP A 82 -1.058 -12.627 7.636 1.00 24.33 H new ATOM 0 HA ASP A 82 -1.771 -13.024 10.424 1.00 52.25 H new ATOM 0 HB2 ASP A 82 0.247 -13.972 9.249 1.00 3.41 H new ATOM 0 HB3 ASP A 82 0.874 -12.344 9.085 1.00 3.41 H new ATOM 1096 N ALA A 83 -0.936 -10.150 9.204 1.00 60.12 N ATOM 1097 CA ALA A 83 -0.865 -8.680 9.245 1.00 13.21 C ATOM 1098 C ALA A 83 -0.304 -8.007 10.499 1.00 23.34 C ATOM 1099 O ALA A 83 -0.903 -8.013 11.589 1.00 23.12 O ATOM 1100 CB ALA A 83 -2.147 -8.034 8.810 1.00 31.22 C ATOM 0 H ALA A 83 -0.761 -10.500 8.262 1.00 60.12 H new ATOM 0 HA ALA A 83 -0.081 -8.493 8.511 1.00 13.21 H new ATOM 0 HB1 ALA A 83 -2.043 -6.950 8.858 1.00 31.22 H new ATOM 0 HB2 ALA A 83 -2.375 -8.332 7.787 1.00 31.22 H new ATOM 0 HB3 ALA A 83 -2.956 -8.350 9.469 1.00 31.22 H new ATOM 1106 N GLU A 84 0.803 -7.372 10.300 1.00 13.34 N ATOM 1107 CA GLU A 84 1.447 -6.551 11.303 1.00 30.02 C ATOM 1108 C GLU A 84 1.398 -5.128 10.823 1.00 64.32 C ATOM 1109 O GLU A 84 1.875 -4.840 9.738 1.00 50.44 O ATOM 1110 CB GLU A 84 2.898 -6.949 11.490 1.00 74.22 C ATOM 1111 CG GLU A 84 3.115 -8.308 12.094 1.00 74.41 C ATOM 1112 CD GLU A 84 4.571 -8.629 12.176 1.00 43.52 C ATOM 1113 OE1 GLU A 84 5.295 -8.004 12.988 1.00 11.23 O ATOM 1114 OE2 GLU A 84 5.041 -9.494 11.413 1.00 55.31 O ATOM 0 H GLU A 84 1.308 -7.403 9.415 1.00 13.34 H new ATOM 0 HA GLU A 84 0.933 -6.677 12.256 1.00 30.02 H new ATOM 0 HB2 GLU A 84 3.395 -6.916 10.521 1.00 74.22 H new ATOM 0 HB3 GLU A 84 3.384 -6.206 12.123 1.00 74.22 H new ATOM 0 HG2 GLU A 84 2.674 -8.342 13.090 1.00 74.41 H new ATOM 0 HG3 GLU A 84 2.606 -9.062 11.494 1.00 74.41 H new ATOM 1121 N PHE A 85 0.840 -4.243 11.588 1.00 35.52 N ATOM 1122 CA PHE A 85 0.717 -2.883 11.120 1.00 23.31 C ATOM 1123 C PHE A 85 1.982 -2.076 11.355 1.00 51.35 C ATOM 1124 O PHE A 85 2.646 -2.202 12.394 1.00 75.54 O ATOM 1125 CB PHE A 85 -0.542 -2.168 11.667 1.00 33.43 C ATOM 1126 CG PHE A 85 -0.630 -2.034 13.165 1.00 23.32 C ATOM 1127 CD1 PHE A 85 -1.234 -3.018 13.928 1.00 54.43 C ATOM 1128 CD2 PHE A 85 -0.130 -0.912 13.803 1.00 11.13 C ATOM 1129 CE1 PHE A 85 -1.334 -2.884 15.295 1.00 3.34 C ATOM 1130 CE2 PHE A 85 -0.224 -0.776 15.172 1.00 74.00 C ATOM 1131 CZ PHE A 85 -0.827 -1.761 15.917 1.00 31.34 C ATOM 0 H PHE A 85 0.467 -4.423 12.520 1.00 35.52 H new ATOM 0 HA PHE A 85 0.581 -2.949 10.041 1.00 23.31 H new ATOM 0 HB2 PHE A 85 -0.587 -1.170 11.230 1.00 33.43 H new ATOM 0 HB3 PHE A 85 -1.422 -2.709 11.319 1.00 33.43 H new ATOM 0 HD1 PHE A 85 -1.631 -3.900 13.447 1.00 54.43 H new ATOM 0 HD2 PHE A 85 0.340 -0.133 13.221 1.00 11.13 H new ATOM 0 HE1 PHE A 85 -1.809 -3.657 15.880 1.00 3.34 H new ATOM 0 HE2 PHE A 85 0.175 0.102 15.658 1.00 74.00 H new ATOM 0 HZ PHE A 85 -0.904 -1.656 16.989 1.00 31.34 H new ATOM 1141 N ALA A 86 2.330 -1.301 10.369 1.00 61.23 N ATOM 1142 CA ALA A 86 3.435 -0.401 10.430 1.00 40.11 C ATOM 1143 C ALA A 86 2.859 0.984 10.585 1.00 43.54 C ATOM 1144 O ALA A 86 2.135 1.476 9.688 1.00 42.33 O ATOM 1145 CB ALA A 86 4.287 -0.502 9.172 1.00 11.24 C ATOM 0 H ALA A 86 1.836 -1.280 9.477 1.00 61.23 H new ATOM 0 HA ALA A 86 4.088 -0.643 11.268 1.00 40.11 H new ATOM 0 HB1 ALA A 86 5.123 0.194 9.242 1.00 11.24 H new ATOM 0 HB2 ALA A 86 4.668 -1.518 9.071 1.00 11.24 H new ATOM 0 HB3 ALA A 86 3.681 -0.254 8.301 1.00 11.24 H new ATOM 1151 N ILE A 87 3.132 1.599 11.706 1.00 4.20 N ATOM 1152 CA ILE A 87 2.524 2.863 12.035 1.00 32.23 C ATOM 1153 C ILE A 87 3.006 4.019 11.180 1.00 64.35 C ATOM 1154 O ILE A 87 4.174 4.401 11.183 1.00 51.02 O ATOM 1155 CB ILE A 87 2.574 3.212 13.547 1.00 72.44 C ATOM 1156 CG1 ILE A 87 4.011 3.243 14.089 1.00 55.52 C ATOM 1157 CG2 ILE A 87 1.721 2.228 14.336 1.00 63.41 C ATOM 1158 CD1 ILE A 87 4.096 3.626 15.554 1.00 62.41 C ATOM 0 H ILE A 87 3.776 1.242 12.412 1.00 4.20 H new ATOM 0 HA ILE A 87 1.473 2.714 11.788 1.00 32.23 H new ATOM 0 HB ILE A 87 2.169 4.217 13.668 1.00 72.44 H new ATOM 0 HG12 ILE A 87 4.464 2.261 13.951 1.00 55.52 H new ATOM 0 HG13 ILE A 87 4.597 3.950 13.502 1.00 55.52 H new ATOM 0 HG21 ILE A 87 1.761 2.480 15.396 1.00 63.41 H new ATOM 0 HG22 ILE A 87 0.689 2.282 13.989 1.00 63.41 H new ATOM 0 HG23 ILE A 87 2.101 1.217 14.188 1.00 63.41 H new ATOM 0 HD11 ILE A 87 5.139 3.628 15.870 1.00 62.41 H new ATOM 0 HD12 ILE A 87 3.672 4.620 15.695 1.00 62.41 H new ATOM 0 HD13 ILE A 87 3.537 2.905 16.151 1.00 62.41 H new ATOM 1170 N ASN A 88 2.096 4.518 10.416 1.00 12.33 N ATOM 1171 CA ASN A 88 2.278 5.678 9.595 1.00 23.05 C ATOM 1172 C ASN A 88 1.286 6.667 10.107 1.00 72.22 C ATOM 1173 O ASN A 88 0.141 6.292 10.405 1.00 71.41 O ATOM 1174 CB ASN A 88 2.052 5.333 8.117 1.00 63.14 C ATOM 1175 CG ASN A 88 3.226 4.573 7.501 1.00 52.21 C ATOM 1176 OD1 ASN A 88 4.093 5.167 6.857 1.00 23.12 O ATOM 1177 ND2 ASN A 88 3.317 3.281 7.737 1.00 62.41 N ATOM 0 H ASN A 88 1.162 4.115 10.339 1.00 12.33 H new ATOM 0 HA ASN A 88 3.291 6.078 9.646 1.00 23.05 H new ATOM 0 HB2 ASN A 88 1.147 4.733 8.023 1.00 63.14 H new ATOM 0 HB3 ASN A 88 1.885 6.252 7.555 1.00 63.14 H new ATOM 0 HD21 ASN A 88 4.116 2.753 7.385 1.00 62.41 H new ATOM 0 HD22 ASN A 88 2.589 2.808 8.272 1.00 62.41 H new ATOM 1184 N VAL A 89 1.681 7.891 10.250 1.00 41.22 N ATOM 1185 CA VAL A 89 0.866 8.813 10.996 1.00 23.15 C ATOM 1186 C VAL A 89 -0.085 9.648 10.171 1.00 3.23 C ATOM 1187 O VAL A 89 0.178 10.011 9.024 1.00 11.21 O ATOM 1188 CB VAL A 89 1.692 9.716 11.949 1.00 72.22 C ATOM 1189 CG1 VAL A 89 2.503 8.871 12.916 1.00 21.41 C ATOM 1190 CG2 VAL A 89 2.590 10.678 11.187 1.00 72.43 C ATOM 0 H VAL A 89 2.546 8.277 9.871 1.00 41.22 H new ATOM 0 HA VAL A 89 0.240 8.154 11.597 1.00 23.15 H new ATOM 0 HB VAL A 89 0.986 10.319 12.520 1.00 72.22 H new ATOM 0 HG11 VAL A 89 3.076 9.522 13.576 1.00 21.41 H new ATOM 0 HG12 VAL A 89 1.831 8.252 13.510 1.00 21.41 H new ATOM 0 HG13 VAL A 89 3.185 8.231 12.356 1.00 21.41 H new ATOM 0 HG21 VAL A 89 3.150 11.291 11.894 1.00 72.43 H new ATOM 0 HG22 VAL A 89 3.285 10.113 10.567 1.00 72.43 H new ATOM 0 HG23 VAL A 89 1.979 11.321 10.553 1.00 72.43 H new ATOM 1200 N SER A 90 -1.192 9.902 10.778 1.00 71.12 N ATOM 1201 CA SER A 90 -2.204 10.766 10.299 1.00 21.54 C ATOM 1202 C SER A 90 -2.728 11.429 11.554 1.00 23.44 C ATOM 1203 O SER A 90 -3.080 10.729 12.525 1.00 21.54 O ATOM 1204 CB SER A 90 -3.308 9.960 9.573 1.00 24.42 C ATOM 1205 OG SER A 90 -4.302 10.801 9.013 1.00 60.21 O ATOM 0 H SER A 90 -1.425 9.483 11.678 1.00 71.12 H new ATOM 0 HA SER A 90 -1.844 11.491 9.568 1.00 21.54 H new ATOM 0 HB2 SER A 90 -2.857 9.358 8.784 1.00 24.42 H new ATOM 0 HB3 SER A 90 -3.773 9.269 10.276 1.00 24.42 H new ATOM 0 HG SER A 90 -4.309 10.695 8.039 1.00 60.21 H new ATOM 1211 N GLY A 91 -2.672 12.726 11.599 1.00 20.31 N ATOM 1212 CA GLY A 91 -3.073 13.444 12.769 1.00 23.05 C ATOM 1213 C GLY A 91 -4.560 13.524 12.887 1.00 3.50 C ATOM 1214 O GLY A 91 -5.275 13.391 11.895 1.00 70.35 O ATOM 0 H GLY A 91 -2.349 13.313 10.830 1.00 20.31 H new ATOM 0 HA2 GLY A 91 -2.664 12.956 13.653 1.00 23.05 H new ATOM 0 HA3 GLY A 91 -2.656 14.451 12.739 1.00 23.05 H new ATOM 1218 N LYS A 92 -5.045 13.761 14.081 1.00 11.11 N ATOM 1219 CA LYS A 92 -6.478 13.879 14.320 1.00 42.41 C ATOM 1220 C LYS A 92 -6.959 15.294 13.957 1.00 45.40 C ATOM 1221 O LYS A 92 -7.746 15.924 14.701 1.00 51.24 O ATOM 1222 CB LYS A 92 -6.824 13.570 15.783 1.00 0.35 C ATOM 1223 CG LYS A 92 -6.200 14.531 16.802 1.00 52.42 C ATOM 1224 CD LYS A 92 -6.870 14.433 18.164 1.00 2.23 C ATOM 1225 CE LYS A 92 -8.378 14.733 18.093 1.00 51.14 C ATOM 1226 NZ LYS A 92 -8.675 16.022 17.414 1.00 44.23 N ATOM 0 H LYS A 92 -4.469 13.878 14.915 1.00 11.11 H new ATOM 0 HA LYS A 92 -6.986 13.151 13.688 1.00 42.41 H new ATOM 0 HB2 LYS A 92 -7.908 13.591 15.899 1.00 0.35 H new ATOM 0 HB3 LYS A 92 -6.499 12.555 16.013 1.00 0.35 H new ATOM 0 HG2 LYS A 92 -5.137 14.311 16.904 1.00 52.42 H new ATOM 0 HG3 LYS A 92 -6.279 15.553 16.432 1.00 52.42 H new ATOM 0 HD2 LYS A 92 -6.719 13.433 18.570 1.00 2.23 H new ATOM 0 HD3 LYS A 92 -6.394 15.132 18.852 1.00 2.23 H new ATOM 0 HE2 LYS A 92 -8.881 13.924 17.563 1.00 51.14 H new ATOM 0 HE3 LYS A 92 -8.788 14.756 19.103 1.00 51.14 H new ATOM 0 HZ1 LYS A 92 -9.693 16.224 17.483 1.00 44.23 H new ATOM 0 HZ2 LYS A 92 -8.138 16.787 17.871 1.00 44.23 H new ATOM 0 HZ3 LYS A 92 -8.402 15.958 16.413 1.00 44.23 H new ATOM 1240 N VAL A 93 -6.504 15.769 12.815 1.00 53.43 N ATOM 1241 CA VAL A 93 -6.840 17.073 12.329 1.00 52.24 C ATOM 1242 C VAL A 93 -8.349 17.182 12.155 1.00 30.31 C ATOM 1243 O VAL A 93 -8.980 16.358 11.477 1.00 61.13 O ATOM 1244 CB VAL A 93 -6.071 17.432 11.011 1.00 74.14 C ATOM 1245 CG1 VAL A 93 -4.573 17.501 11.275 1.00 3.54 C ATOM 1246 CG2 VAL A 93 -6.343 16.421 9.902 1.00 43.41 C ATOM 0 H VAL A 93 -5.883 15.246 12.198 1.00 53.43 H new ATOM 0 HA VAL A 93 -6.521 17.807 13.069 1.00 52.24 H new ATOM 0 HB VAL A 93 -6.433 18.406 10.681 1.00 74.14 H new ATOM 0 HG11 VAL A 93 -4.052 17.751 10.351 1.00 3.54 H new ATOM 0 HG12 VAL A 93 -4.370 18.266 12.024 1.00 3.54 H new ATOM 0 HG13 VAL A 93 -4.223 16.535 11.639 1.00 3.54 H new ATOM 0 HG21 VAL A 93 -5.791 16.706 9.006 1.00 43.41 H new ATOM 0 HG22 VAL A 93 -6.022 15.431 10.226 1.00 43.41 H new ATOM 0 HG23 VAL A 93 -7.410 16.402 9.680 1.00 43.41 H new ATOM 1256 N LYS A 94 -8.917 18.174 12.788 1.00 71.45 N ATOM 1257 CA LYS A 94 -10.354 18.364 12.839 1.00 24.41 C ATOM 1258 C LYS A 94 -10.932 18.638 11.448 1.00 63.42 C ATOM 1259 O LYS A 94 -12.106 18.397 11.194 1.00 71.43 O ATOM 1260 CB LYS A 94 -10.671 19.487 13.824 1.00 13.34 C ATOM 1261 CG LYS A 94 -12.137 19.685 14.147 1.00 12.22 C ATOM 1262 CD LYS A 94 -12.288 20.711 15.249 1.00 31.43 C ATOM 1263 CE LYS A 94 -13.731 20.917 15.657 1.00 62.22 C ATOM 1264 NZ LYS A 94 -14.551 21.502 14.582 1.00 52.22 N ATOM 0 H LYS A 94 -8.391 18.888 13.293 1.00 71.45 H new ATOM 0 HA LYS A 94 -10.829 17.447 13.189 1.00 24.41 H new ATOM 0 HB2 LYS A 94 -10.137 19.291 14.754 1.00 13.34 H new ATOM 0 HB3 LYS A 94 -10.278 20.420 13.421 1.00 13.34 H new ATOM 0 HG2 LYS A 94 -12.673 20.013 13.257 1.00 12.22 H new ATOM 0 HG3 LYS A 94 -12.581 18.739 14.456 1.00 12.22 H new ATOM 0 HD2 LYS A 94 -11.710 20.394 16.117 1.00 31.43 H new ATOM 0 HD3 LYS A 94 -11.869 21.661 14.916 1.00 31.43 H new ATOM 0 HE2 LYS A 94 -14.160 19.960 15.955 1.00 62.22 H new ATOM 0 HE3 LYS A 94 -13.767 21.568 16.530 1.00 62.22 H new ATOM 0 HZ1 LYS A 94 -15.511 21.684 14.938 1.00 52.22 H new ATOM 0 HZ2 LYS A 94 -14.124 22.396 14.267 1.00 52.22 H new ATOM 0 HZ3 LYS A 94 -14.598 20.840 13.782 1.00 52.22 H new ATOM 1278 N GLU A 95 -10.097 19.116 10.550 1.00 3.14 N ATOM 1279 CA GLU A 95 -10.515 19.358 9.178 1.00 31.54 C ATOM 1280 C GLU A 95 -10.604 18.039 8.397 1.00 3.52 C ATOM 1281 O GLU A 95 -11.382 17.913 7.451 1.00 64.24 O ATOM 1282 CB GLU A 95 -9.566 20.340 8.490 1.00 2.41 C ATOM 1283 CG GLU A 95 -8.117 19.889 8.461 1.00 40.22 C ATOM 1284 CD GLU A 95 -7.220 20.898 7.821 1.00 11.31 C ATOM 1285 OE1 GLU A 95 -7.015 20.839 6.602 1.00 75.41 O ATOM 1286 OE2 GLU A 95 -6.695 21.769 8.531 1.00 62.31 O ATOM 0 H GLU A 95 -9.122 19.346 10.742 1.00 3.14 H new ATOM 0 HA GLU A 95 -11.509 19.806 9.196 1.00 31.54 H new ATOM 0 HB2 GLU A 95 -9.906 20.499 7.467 1.00 2.41 H new ATOM 0 HB3 GLU A 95 -9.625 21.302 8.999 1.00 2.41 H new ATOM 0 HG2 GLU A 95 -7.778 19.699 9.479 1.00 40.22 H new ATOM 0 HG3 GLU A 95 -8.043 18.946 7.919 1.00 40.22 H new ATOM 1293 N GLY A 96 -9.835 17.060 8.834 1.00 54.20 N ATOM 1294 CA GLY A 96 -9.810 15.772 8.186 1.00 3.14 C ATOM 1295 C GLY A 96 -8.769 15.680 7.086 1.00 52.32 C ATOM 1296 O GLY A 96 -8.555 16.634 6.341 1.00 22.00 O ATOM 0 H GLY A 96 -9.217 17.138 9.641 1.00 54.20 H new ATOM 0 HA2 GLY A 96 -9.612 15.001 8.931 1.00 3.14 H new ATOM 0 HA3 GLY A 96 -10.794 15.564 7.765 1.00 3.14 H new ATOM 1300 N GLU A 97 -8.122 14.543 6.999 1.00 54.01 N ATOM 1301 CA GLU A 97 -7.165 14.261 5.958 1.00 21.30 C ATOM 1302 C GLU A 97 -7.238 12.783 5.675 1.00 15.32 C ATOM 1303 O GLU A 97 -8.016 12.068 6.326 1.00 74.15 O ATOM 1304 CB GLU A 97 -5.721 14.635 6.348 1.00 52.24 C ATOM 1305 CG GLU A 97 -5.129 13.819 7.490 1.00 53.22 C ATOM 1306 CD GLU A 97 -3.633 13.978 7.572 1.00 43.34 C ATOM 1307 OE1 GLU A 97 -3.149 14.841 8.316 1.00 21.22 O ATOM 1308 OE2 GLU A 97 -2.908 13.244 6.853 1.00 20.33 O ATOM 0 H GLU A 97 -8.248 13.776 7.660 1.00 54.01 H new ATOM 0 HA GLU A 97 -7.414 14.863 5.084 1.00 21.30 H new ATOM 0 HB2 GLU A 97 -5.083 14.521 5.472 1.00 52.24 H new ATOM 0 HB3 GLU A 97 -5.697 15.689 6.625 1.00 52.24 H new ATOM 0 HG2 GLU A 97 -5.580 14.131 8.432 1.00 53.22 H new ATOM 0 HG3 GLU A 97 -5.376 12.766 7.351 1.00 53.22 H new ATOM 1315 N GLY A 98 -6.479 12.328 4.717 1.00 64.41 N ATOM 1316 CA GLY A 98 -6.455 10.934 4.420 1.00 33.33 C ATOM 1317 C GLY A 98 -5.563 10.153 5.355 1.00 44.42 C ATOM 1318 O GLY A 98 -4.574 10.682 5.891 1.00 65.34 O ATOM 0 H GLY A 98 -5.873 12.905 4.134 1.00 64.41 H new ATOM 0 HA2 GLY A 98 -7.469 10.537 4.476 1.00 33.33 H new ATOM 0 HA3 GLY A 98 -6.113 10.791 3.395 1.00 33.33 H new ATOM 1322 N TYR A 99 -5.889 8.907 5.524 1.00 53.04 N ATOM 1323 CA TYR A 99 -5.173 8.019 6.396 1.00 44.11 C ATOM 1324 C TYR A 99 -4.386 7.073 5.525 1.00 41.13 C ATOM 1325 O TYR A 99 -4.911 6.573 4.509 1.00 51.05 O ATOM 1326 CB TYR A 99 -6.153 7.204 7.261 1.00 61.10 C ATOM 1327 CG TYR A 99 -7.273 8.024 7.862 1.00 51.12 C ATOM 1328 CD1 TYR A 99 -8.576 7.855 7.420 1.00 63.25 C ATOM 1329 CD2 TYR A 99 -7.030 8.978 8.837 1.00 63.12 C ATOM 1330 CE1 TYR A 99 -9.607 8.609 7.920 1.00 41.44 C ATOM 1331 CE2 TYR A 99 -8.056 9.741 9.358 1.00 41.52 C ATOM 1332 CZ TYR A 99 -9.343 9.561 8.898 1.00 20.44 C ATOM 1333 OH TYR A 99 -10.364 10.352 9.413 1.00 21.05 O ATOM 0 H TYR A 99 -6.678 8.467 5.050 1.00 53.04 H new ATOM 0 HA TYR A 99 -4.522 8.590 7.058 1.00 44.11 H new ATOM 0 HB2 TYR A 99 -6.585 6.410 6.652 1.00 61.10 H new ATOM 0 HB3 TYR A 99 -5.597 6.722 8.066 1.00 61.10 H new ATOM 0 HD1 TYR A 99 -8.784 7.112 6.664 1.00 63.25 H new ATOM 0 HD2 TYR A 99 -6.022 9.127 9.195 1.00 63.12 H new ATOM 0 HE1 TYR A 99 -10.614 8.464 7.557 1.00 41.44 H new ATOM 0 HE2 TYR A 99 -7.851 10.476 10.123 1.00 41.52 H new ATOM 0 HH TYR A 99 -9.997 10.961 10.088 1.00 21.05 H new ATOM 1343 N LYS A 100 -3.144 6.863 5.878 1.00 44.41 N ATOM 1344 CA LYS A 100 -2.266 5.987 5.133 1.00 44.00 C ATOM 1345 C LYS A 100 -1.741 4.953 6.092 1.00 13.01 C ATOM 1346 O LYS A 100 -0.873 5.249 6.911 1.00 34.34 O ATOM 1347 CB LYS A 100 -1.060 6.742 4.506 1.00 43.41 C ATOM 1348 CG LYS A 100 -1.397 7.966 3.649 1.00 70.34 C ATOM 1349 CD LYS A 100 -1.706 9.199 4.500 1.00 41.11 C ATOM 1350 CE LYS A 100 -2.086 10.388 3.644 1.00 41.11 C ATOM 1351 NZ LYS A 100 -2.397 11.584 4.461 1.00 53.34 N ATOM 0 H LYS A 100 -2.708 7.295 6.693 1.00 44.41 H new ATOM 0 HA LYS A 100 -2.833 5.545 4.313 1.00 44.00 H new ATOM 0 HB2 LYS A 100 -0.399 7.060 5.312 1.00 43.41 H new ATOM 0 HB3 LYS A 100 -0.498 6.039 3.892 1.00 43.41 H new ATOM 0 HG2 LYS A 100 -0.560 8.185 2.986 1.00 70.34 H new ATOM 0 HG3 LYS A 100 -2.255 7.739 3.016 1.00 70.34 H new ATOM 0 HD2 LYS A 100 -2.520 8.971 5.189 1.00 41.11 H new ATOM 0 HD3 LYS A 100 -0.836 9.450 5.106 1.00 41.11 H new ATOM 0 HE2 LYS A 100 -1.269 10.618 2.961 1.00 41.11 H new ATOM 0 HE3 LYS A 100 -2.951 10.132 3.032 1.00 41.11 H new ATOM 0 HZ1 LYS A 100 -2.619 12.384 3.835 1.00 53.34 H new ATOM 0 HZ2 LYS A 100 -3.215 11.384 5.071 1.00 53.34 H new ATOM 0 HZ3 LYS A 100 -1.575 11.824 5.051 1.00 53.34 H new ATOM 1365 N LEU A 101 -2.269 3.786 6.041 1.00 50.22 N ATOM 1366 CA LEU A 101 -1.871 2.759 6.980 1.00 41.24 C ATOM 1367 C LEU A 101 -1.284 1.584 6.240 1.00 33.12 C ATOM 1368 O LEU A 101 -1.770 1.227 5.175 1.00 74.11 O ATOM 1369 CB LEU A 101 -3.058 2.334 7.845 1.00 21.31 C ATOM 1370 CG LEU A 101 -3.668 3.410 8.755 1.00 2.04 C ATOM 1371 CD1 LEU A 101 -4.912 2.876 9.446 1.00 51.11 C ATOM 1372 CD2 LEU A 101 -2.652 3.875 9.794 1.00 30.41 C ATOM 0 H LEU A 101 -2.979 3.501 5.366 1.00 50.22 H new ATOM 0 HA LEU A 101 -1.106 3.161 7.644 1.00 41.24 H new ATOM 0 HB2 LEU A 101 -3.842 1.960 7.187 1.00 21.31 H new ATOM 0 HB3 LEU A 101 -2.742 1.499 8.470 1.00 21.31 H new ATOM 0 HG LEU A 101 -3.947 4.262 8.136 1.00 2.04 H new ATOM 0 HD11 LEU A 101 -5.333 3.650 10.087 1.00 51.11 H new ATOM 0 HD12 LEU A 101 -5.648 2.586 8.697 1.00 51.11 H new ATOM 0 HD13 LEU A 101 -4.648 2.008 10.050 1.00 51.11 H new ATOM 0 HD21 LEU A 101 -3.104 4.637 10.429 1.00 30.41 H new ATOM 0 HD22 LEU A 101 -2.345 3.028 10.407 1.00 30.41 H new ATOM 0 HD23 LEU A 101 -1.781 4.293 9.289 1.00 30.41 H new ATOM 1384 N VAL A 102 -0.241 0.994 6.792 1.00 32.03 N ATOM 1385 CA VAL A 102 0.464 -0.090 6.127 1.00 15.52 C ATOM 1386 C VAL A 102 0.476 -1.323 7.016 1.00 65.53 C ATOM 1387 O VAL A 102 0.712 -1.220 8.213 1.00 31.25 O ATOM 1388 CB VAL A 102 1.943 0.287 5.830 1.00 63.31 C ATOM 1389 CG1 VAL A 102 2.637 -0.748 4.947 1.00 32.23 C ATOM 1390 CG2 VAL A 102 2.089 1.697 5.266 1.00 73.13 C ATOM 0 H VAL A 102 0.140 1.247 7.704 1.00 32.03 H new ATOM 0 HA VAL A 102 -0.058 -0.285 5.190 1.00 15.52 H new ATOM 0 HB VAL A 102 2.453 0.282 6.793 1.00 63.31 H new ATOM 0 HG11 VAL A 102 3.667 -0.441 4.767 1.00 32.23 H new ATOM 0 HG12 VAL A 102 2.629 -1.717 5.447 1.00 32.23 H new ATOM 0 HG13 VAL A 102 2.111 -0.826 3.996 1.00 32.23 H new ATOM 0 HG21 VAL A 102 3.142 1.906 5.078 1.00 73.13 H new ATOM 0 HG22 VAL A 102 1.531 1.775 4.333 1.00 73.13 H new ATOM 0 HG23 VAL A 102 1.699 2.418 5.984 1.00 73.13 H new ATOM 1400 N TRP A 103 0.204 -2.451 6.436 1.00 60.52 N ATOM 1401 CA TRP A 103 0.267 -3.728 7.098 1.00 32.53 C ATOM 1402 C TRP A 103 1.254 -4.580 6.381 1.00 3.22 C ATOM 1403 O TRP A 103 1.353 -4.524 5.163 1.00 53.12 O ATOM 1404 CB TRP A 103 -1.085 -4.433 7.121 1.00 75.41 C ATOM 1405 CG TRP A 103 -2.097 -3.767 7.976 1.00 34.12 C ATOM 1406 CD1 TRP A 103 -2.446 -4.108 9.244 1.00 20.11 C ATOM 1407 CD2 TRP A 103 -2.889 -2.639 7.629 1.00 2.22 C ATOM 1408 NE1 TRP A 103 -3.415 -3.261 9.706 1.00 54.21 N ATOM 1409 CE2 TRP A 103 -3.704 -2.351 8.728 1.00 31.11 C ATOM 1410 CE3 TRP A 103 -2.986 -1.848 6.486 1.00 11.23 C ATOM 1411 CZ2 TRP A 103 -4.601 -1.306 8.722 1.00 71.51 C ATOM 1412 CZ3 TRP A 103 -3.879 -0.811 6.483 1.00 73.02 C ATOM 1413 CH2 TRP A 103 -4.678 -0.550 7.592 1.00 33.12 C ATOM 0 H TRP A 103 -0.077 -2.516 5.458 1.00 60.52 H new ATOM 0 HA TRP A 103 0.565 -3.563 8.133 1.00 32.53 H new ATOM 0 HB2 TRP A 103 -1.469 -4.495 6.103 1.00 75.41 H new ATOM 0 HB3 TRP A 103 -0.944 -5.456 7.471 1.00 75.41 H new ATOM 0 HD1 TRP A 103 -2.021 -4.927 9.805 1.00 20.11 H new ATOM 0 HE1 TRP A 103 -3.850 -3.302 10.628 1.00 54.21 H new ATOM 0 HE3 TRP A 103 -2.370 -2.049 5.622 1.00 11.23 H new ATOM 0 HZ2 TRP A 103 -5.220 -1.094 9.581 1.00 71.51 H new ATOM 0 HZ3 TRP A 103 -3.965 -0.186 5.607 1.00 73.02 H new ATOM 0 HH2 TRP A 103 -5.377 0.273 7.556 1.00 33.12 H new ATOM 1424 N LYS A 104 1.994 -5.326 7.112 1.00 33.05 N ATOM 1425 CA LYS A 104 2.983 -6.162 6.549 1.00 30.53 C ATOM 1426 C LYS A 104 2.619 -7.602 6.799 1.00 34.45 C ATOM 1427 O LYS A 104 2.011 -7.931 7.824 1.00 73.14 O ATOM 1428 CB LYS A 104 4.353 -5.859 7.161 1.00 50.40 C ATOM 1429 CG LYS A 104 4.680 -4.369 7.250 1.00 62.01 C ATOM 1430 CD LYS A 104 6.151 -4.119 7.553 1.00 63.11 C ATOM 1431 CE LYS A 104 6.635 -4.833 8.801 1.00 0.33 C ATOM 1432 NZ LYS A 104 8.072 -4.596 9.037 1.00 14.33 N ATOM 0 H LYS A 104 1.929 -5.374 8.129 1.00 33.05 H new ATOM 0 HA LYS A 104 3.035 -5.977 5.476 1.00 30.53 H new ATOM 0 HB2 LYS A 104 4.396 -6.290 8.161 1.00 50.40 H new ATOM 0 HB3 LYS A 104 5.122 -6.354 6.568 1.00 50.40 H new ATOM 0 HG2 LYS A 104 4.417 -3.885 6.310 1.00 62.01 H new ATOM 0 HG3 LYS A 104 4.068 -3.910 8.027 1.00 62.01 H new ATOM 0 HD2 LYS A 104 6.750 -4.442 6.702 1.00 63.11 H new ATOM 0 HD3 LYS A 104 6.314 -3.048 7.669 1.00 63.11 H new ATOM 0 HE2 LYS A 104 6.062 -4.490 9.663 1.00 0.33 H new ATOM 0 HE3 LYS A 104 6.453 -5.903 8.703 1.00 0.33 H new ATOM 0 HZ1 LYS A 104 8.370 -5.098 9.898 1.00 14.33 H new ATOM 0 HZ2 LYS A 104 8.619 -4.946 8.225 1.00 14.33 H new ATOM 0 HZ3 LYS A 104 8.241 -3.577 9.155 1.00 14.33 H new ATOM 1446 N SER A 105 2.926 -8.419 5.845 1.00 74.04 N ATOM 1447 CA SER A 105 2.766 -9.845 5.921 1.00 24.20 C ATOM 1448 C SER A 105 3.779 -10.399 6.934 1.00 42.43 C ATOM 1449 O SER A 105 4.723 -9.695 7.333 1.00 15.23 O ATOM 1450 CB SER A 105 3.059 -10.418 4.529 1.00 62.42 C ATOM 1451 OG SER A 105 2.789 -11.799 4.414 1.00 72.14 O ATOM 0 H SER A 105 3.311 -8.105 4.954 1.00 74.04 H new ATOM 0 HA SER A 105 1.758 -10.115 6.236 1.00 24.20 H new ATOM 0 HB2 SER A 105 2.465 -9.878 3.792 1.00 62.42 H new ATOM 0 HB3 SER A 105 4.107 -10.240 4.286 1.00 62.42 H new ATOM 0 HG SER A 105 2.995 -12.098 3.504 1.00 72.14 H new ATOM 1457 N ALA A 106 3.591 -11.637 7.337 1.00 31.43 N ATOM 1458 CA ALA A 106 4.503 -12.280 8.259 1.00 60.44 C ATOM 1459 C ALA A 106 5.826 -12.507 7.553 1.00 34.24 C ATOM 1460 O ALA A 106 5.846 -12.667 6.325 1.00 70.02 O ATOM 1461 CB ALA A 106 3.921 -13.602 8.742 1.00 10.42 C ATOM 0 H ALA A 106 2.810 -12.222 7.039 1.00 31.43 H new ATOM 0 HA ALA A 106 4.658 -11.644 9.130 1.00 60.44 H new ATOM 0 HB1 ALA A 106 4.617 -14.075 9.435 1.00 10.42 H new ATOM 0 HB2 ALA A 106 2.973 -13.419 9.249 1.00 10.42 H new ATOM 0 HB3 ALA A 106 3.755 -14.260 7.889 1.00 10.42 H new ATOM 1467 N ALA A 107 6.907 -12.509 8.297 1.00 3.41 N ATOM 1468 CA ALA A 107 8.222 -12.699 7.727 1.00 31.42 C ATOM 1469 C ALA A 107 8.350 -14.118 7.208 1.00 32.40 C ATOM 1470 O ALA A 107 8.386 -15.081 7.986 1.00 41.15 O ATOM 1471 CB ALA A 107 9.298 -12.397 8.755 1.00 45.31 C ATOM 0 H ALA A 107 6.902 -12.380 9.309 1.00 3.41 H new ATOM 0 HA ALA A 107 8.355 -12.008 6.895 1.00 31.42 H new ATOM 0 HB1 ALA A 107 10.281 -12.546 8.307 1.00 45.31 H new ATOM 0 HB2 ALA A 107 9.203 -11.363 9.088 1.00 45.31 H new ATOM 0 HB3 ALA A 107 9.183 -13.065 9.609 1.00 45.31 H new ATOM 1477 N GLN A 108 8.371 -14.243 5.917 1.00 64.35 N ATOM 1478 CA GLN A 108 8.423 -15.528 5.270 1.00 12.34 C ATOM 1479 C GLN A 108 9.860 -15.873 4.973 1.00 2.01 C ATOM 1480 O GLN A 108 10.623 -15.014 4.509 1.00 25.42 O ATOM 1481 CB GLN A 108 7.640 -15.503 3.949 1.00 34.14 C ATOM 1482 CG GLN A 108 6.210 -14.993 4.057 1.00 63.43 C ATOM 1483 CD GLN A 108 5.342 -15.821 4.977 1.00 41.43 C ATOM 1484 OE1 GLN A 108 5.520 -17.028 5.114 1.00 20.52 O ATOM 1485 NE2 GLN A 108 4.422 -15.175 5.635 1.00 72.11 N ATOM 0 H GLN A 108 8.353 -13.453 5.273 1.00 64.35 H new ATOM 0 HA GLN A 108 7.978 -16.270 5.933 1.00 12.34 H new ATOM 0 HB2 GLN A 108 8.179 -14.879 3.236 1.00 34.14 H new ATOM 0 HB3 GLN A 108 7.620 -16.512 3.537 1.00 34.14 H new ATOM 0 HG2 GLN A 108 6.226 -13.963 4.415 1.00 63.43 H new ATOM 0 HG3 GLN A 108 5.762 -14.978 3.063 1.00 63.43 H new ATOM 0 HE21 GLN A 108 4.304 -14.172 5.495 1.00 72.11 H new ATOM 0 HE22 GLN A 108 3.820 -15.673 6.291 1.00 72.11 H new ATOM 1494 N ARG A 109 10.234 -17.095 5.258 1.00 4.23 N ATOM 1495 CA ARG A 109 11.560 -17.583 4.944 1.00 1.12 C ATOM 1496 C ARG A 109 11.728 -17.692 3.435 1.00 0.11 C ATOM 1497 O ARG A 109 10.970 -18.407 2.761 1.00 60.42 O ATOM 1498 CB ARG A 109 11.800 -18.943 5.612 1.00 60.34 C ATOM 1499 CG ARG A 109 13.049 -19.675 5.134 1.00 1.11 C ATOM 1500 CD ARG A 109 13.209 -21.005 5.841 1.00 20.11 C ATOM 1501 NE ARG A 109 14.254 -21.830 5.231 1.00 5.43 N ATOM 1502 CZ ARG A 109 15.043 -22.696 5.878 1.00 13.04 C ATOM 1503 NH1 ARG A 109 15.009 -22.785 7.206 1.00 1.33 N ATOM 1504 NH2 ARG A 109 15.867 -23.476 5.189 1.00 55.43 N ATOM 0 H ARG A 109 9.632 -17.781 5.713 1.00 4.23 H new ATOM 0 HA ARG A 109 12.297 -16.878 5.329 1.00 1.12 H new ATOM 0 HB2 ARG A 109 11.872 -18.796 6.690 1.00 60.34 H new ATOM 0 HB3 ARG A 109 10.932 -19.578 5.434 1.00 60.34 H new ATOM 0 HG2 ARG A 109 12.989 -19.837 4.058 1.00 1.11 H new ATOM 0 HG3 ARG A 109 13.928 -19.056 5.315 1.00 1.11 H new ATOM 0 HD2 ARG A 109 13.451 -20.831 6.890 1.00 20.11 H new ATOM 0 HD3 ARG A 109 12.262 -21.544 5.817 1.00 20.11 H new ATOM 0 HE ARG A 109 14.393 -21.736 4.225 1.00 5.43 H new ATOM 0 HH11 ARG A 109 14.377 -22.189 7.741 1.00 1.33 H new ATOM 0 HH12 ARG A 109 15.615 -23.449 7.688 1.00 1.33 H new ATOM 0 HH21 ARG A 109 15.897 -23.414 4.171 1.00 55.43 H new ATOM 0 HH22 ARG A 109 16.470 -24.138 5.677 1.00 55.43 H new ATOM 1518 N SER A 110 12.679 -16.968 2.917 1.00 24.45 N ATOM 1519 CA SER A 110 12.979 -16.975 1.516 1.00 32.31 C ATOM 1520 C SER A 110 14.132 -17.958 1.282 1.00 65.34 C ATOM 1521 O SER A 110 14.855 -18.306 2.228 1.00 12.42 O ATOM 1522 CB SER A 110 13.354 -15.543 1.076 1.00 60.33 C ATOM 1523 OG SER A 110 13.507 -15.430 -0.330 1.00 74.12 O ATOM 0 H SER A 110 13.275 -16.348 3.465 1.00 24.45 H new ATOM 0 HA SER A 110 12.120 -17.293 0.925 1.00 32.31 H new ATOM 0 HB2 SER A 110 12.583 -14.849 1.411 1.00 60.33 H new ATOM 0 HB3 SER A 110 14.283 -15.248 1.564 1.00 60.33 H new ATOM 0 HG SER A 110 14.331 -14.939 -0.531 1.00 74.12 H new ATOM 1529 N HIS A 111 14.320 -18.376 0.040 1.00 54.32 N ATOM 1530 CA HIS A 111 15.337 -19.370 -0.325 1.00 31.34 C ATOM 1531 C HIS A 111 16.757 -18.868 -0.022 1.00 14.02 C ATOM 1532 O HIS A 111 17.653 -19.655 0.283 1.00 72.50 O ATOM 1533 CB HIS A 111 15.189 -19.737 -1.824 1.00 41.31 C ATOM 1534 CG HIS A 111 16.166 -20.761 -2.340 1.00 3.21 C ATOM 1535 ND1 HIS A 111 15.921 -22.110 -2.375 1.00 23.02 N ATOM 1536 CD2 HIS A 111 17.406 -20.597 -2.857 1.00 1.30 C ATOM 1537 CE1 HIS A 111 16.988 -22.709 -2.893 1.00 71.51 C ATOM 1538 NE2 HIS A 111 17.922 -21.833 -3.206 1.00 41.44 N ATOM 0 H HIS A 111 13.773 -18.038 -0.752 1.00 54.32 H new ATOM 0 HA HIS A 111 15.179 -20.262 0.281 1.00 31.34 H new ATOM 0 HB2 HIS A 111 14.178 -20.108 -1.991 1.00 41.31 H new ATOM 0 HB3 HIS A 111 15.296 -18.828 -2.415 1.00 41.31 H new ATOM 0 HD2 HIS A 111 17.913 -19.651 -2.978 1.00 1.30 H new ATOM 0 HE1 HIS A 111 17.078 -23.775 -3.039 1.00 71.51 H new ATOM 0 HE2 HIS A 111 18.834 -22.026 -3.619 1.00 41.44 H new ATOM 1546 N ASP A 112 16.929 -17.565 -0.049 1.00 4.35 N ATOM 1547 CA ASP A 112 18.247 -16.922 0.133 1.00 34.24 C ATOM 1548 C ASP A 112 18.591 -16.815 1.610 1.00 45.24 C ATOM 1549 O ASP A 112 19.569 -16.182 1.959 1.00 3.01 O ATOM 1550 CB ASP A 112 18.236 -15.490 -0.428 1.00 62.41 C ATOM 1551 CG ASP A 112 17.144 -15.242 -1.419 1.00 62.44 C ATOM 1552 OD1 ASP A 112 17.379 -15.273 -2.634 1.00 44.20 O ATOM 1553 OD2 ASP A 112 15.992 -15.007 -0.977 1.00 63.54 O ATOM 0 H ASP A 112 16.167 -16.904 -0.197 1.00 4.35 H new ATOM 0 HA ASP A 112 18.978 -17.537 -0.392 1.00 34.24 H new ATOM 0 HB2 ASP A 112 18.132 -14.786 0.398 1.00 62.41 H new ATOM 0 HB3 ASP A 112 19.197 -15.287 -0.901 1.00 62.41 H new ATOM 1558 N GLN A 113 17.737 -17.399 2.464 1.00 64.45 N ATOM 1559 CA GLN A 113 17.875 -17.389 3.941 1.00 23.53 C ATOM 1560 C GLN A 113 17.453 -16.014 4.500 1.00 4.12 C ATOM 1561 O GLN A 113 17.612 -15.715 5.691 1.00 51.43 O ATOM 1562 CB GLN A 113 19.324 -17.756 4.380 1.00 3.54 C ATOM 1563 CG GLN A 113 19.529 -17.992 5.867 1.00 72.25 C ATOM 1564 CD GLN A 113 20.991 -18.055 6.223 1.00 3.24 C ATOM 1565 OE1 GLN A 113 21.614 -19.115 6.199 1.00 23.11 O ATOM 1566 NE2 GLN A 113 21.560 -16.923 6.549 1.00 24.51 N ATOM 0 H GLN A 113 16.910 -17.905 2.147 1.00 64.45 H new ATOM 0 HA GLN A 113 17.213 -18.151 4.354 1.00 23.53 H new ATOM 0 HB2 GLN A 113 19.628 -18.655 3.844 1.00 3.54 H new ATOM 0 HB3 GLN A 113 19.992 -16.955 4.064 1.00 3.54 H new ATOM 0 HG2 GLN A 113 19.051 -17.192 6.432 1.00 72.25 H new ATOM 0 HG3 GLN A 113 19.043 -18.923 6.158 1.00 72.25 H new ATOM 0 HE21 GLN A 113 21.014 -16.062 6.559 1.00 24.51 H new ATOM 0 HE22 GLN A 113 22.550 -16.902 6.793 1.00 24.51 H new ATOM 1575 N LYS A 114 16.871 -15.193 3.647 1.00 24.33 N ATOM 1576 CA LYS A 114 16.390 -13.907 4.084 1.00 61.55 C ATOM 1577 C LYS A 114 14.918 -14.009 4.384 1.00 34.11 C ATOM 1578 O LYS A 114 14.296 -15.052 4.139 1.00 11.54 O ATOM 1579 CB LYS A 114 16.654 -12.769 3.058 1.00 0.30 C ATOM 1580 CG LYS A 114 15.894 -12.846 1.733 1.00 15.32 C ATOM 1581 CD LYS A 114 16.089 -11.548 0.952 1.00 63.04 C ATOM 1582 CE LYS A 114 15.282 -11.496 -0.346 1.00 62.23 C ATOM 1583 NZ LYS A 114 15.755 -12.431 -1.376 1.00 24.43 N ATOM 0 H LYS A 114 16.723 -15.395 2.658 1.00 24.33 H new ATOM 0 HA LYS A 114 16.947 -13.639 4.982 1.00 61.55 H new ATOM 0 HB2 LYS A 114 16.411 -11.819 3.534 1.00 0.30 H new ATOM 0 HB3 LYS A 114 17.721 -12.751 2.837 1.00 0.30 H new ATOM 0 HG2 LYS A 114 16.252 -13.692 1.146 1.00 15.32 H new ATOM 0 HG3 LYS A 114 14.833 -13.013 1.920 1.00 15.32 H new ATOM 0 HD2 LYS A 114 15.804 -10.706 1.583 1.00 63.04 H new ATOM 0 HD3 LYS A 114 17.147 -11.428 0.719 1.00 63.04 H new ATOM 0 HE2 LYS A 114 14.238 -11.714 -0.123 1.00 62.23 H new ATOM 0 HE3 LYS A 114 15.318 -10.482 -0.745 1.00 62.23 H new ATOM 0 HZ1 LYS A 114 15.316 -12.193 -2.288 1.00 24.43 H new ATOM 0 HZ2 LYS A 114 16.789 -12.361 -1.460 1.00 24.43 H new ATOM 0 HZ3 LYS A 114 15.495 -13.402 -1.109 1.00 24.43 H new ATOM 1597 N ILE A 115 14.360 -12.960 4.890 1.00 3.21 N ATOM 1598 CA ILE A 115 12.959 -12.933 5.178 1.00 65.25 C ATOM 1599 C ILE A 115 12.283 -11.939 4.285 1.00 54.01 C ATOM 1600 O ILE A 115 12.790 -10.834 4.071 1.00 32.35 O ATOM 1601 CB ILE A 115 12.575 -12.677 6.681 1.00 73.21 C ATOM 1602 CG1 ILE A 115 13.128 -11.338 7.278 1.00 41.51 C ATOM 1603 CG2 ILE A 115 12.933 -13.869 7.555 1.00 54.11 C ATOM 1604 CD1 ILE A 115 14.632 -11.269 7.524 1.00 71.53 C ATOM 0 H ILE A 115 14.857 -12.099 5.116 1.00 3.21 H new ATOM 0 HA ILE A 115 12.604 -13.944 4.980 1.00 65.25 H new ATOM 0 HB ILE A 115 11.492 -12.557 6.681 1.00 73.21 H new ATOM 0 HG12 ILE A 115 12.856 -10.526 6.603 1.00 41.51 H new ATOM 0 HG13 ILE A 115 12.619 -11.151 8.224 1.00 41.51 H new ATOM 0 HG21 ILE A 115 12.655 -13.660 8.588 1.00 54.11 H new ATOM 0 HG22 ILE A 115 12.395 -14.751 7.206 1.00 54.11 H new ATOM 0 HG23 ILE A 115 14.006 -14.052 7.499 1.00 54.11 H new ATOM 0 HD11 ILE A 115 14.889 -10.294 7.938 1.00 71.53 H new ATOM 0 HD12 ILE A 115 14.922 -12.049 8.228 1.00 71.53 H new ATOM 0 HD13 ILE A 115 15.162 -11.415 6.583 1.00 71.53 H new ATOM 1616 N ARG A 116 11.191 -12.348 3.716 1.00 64.30 N ATOM 1617 CA ARG A 116 10.436 -11.506 2.835 1.00 32.11 C ATOM 1618 C ARG A 116 9.091 -11.230 3.464 1.00 61.14 C ATOM 1619 O ARG A 116 8.619 -12.015 4.303 1.00 13.12 O ATOM 1620 CB ARG A 116 10.221 -12.180 1.464 1.00 60.23 C ATOM 1621 CG ARG A 116 9.314 -13.406 1.520 1.00 14.02 C ATOM 1622 CD ARG A 116 8.931 -13.915 0.137 1.00 23.11 C ATOM 1623 NE ARG A 116 8.372 -12.845 -0.714 1.00 70.20 N ATOM 1624 CZ ARG A 116 7.135 -12.299 -0.618 1.00 42.31 C ATOM 1625 NH1 ARG A 116 6.281 -12.669 0.349 1.00 13.20 N ATOM 1626 NH2 ARG A 116 6.757 -11.381 -1.493 1.00 51.13 N ATOM 0 H ARG A 116 10.795 -13.279 3.849 1.00 64.30 H new ATOM 0 HA ARG A 116 10.990 -10.580 2.678 1.00 32.11 H new ATOM 0 HB2 ARG A 116 9.792 -11.453 0.775 1.00 60.23 H new ATOM 0 HB3 ARG A 116 11.189 -12.473 1.057 1.00 60.23 H new ATOM 0 HG2 ARG A 116 9.818 -14.201 2.069 1.00 14.02 H new ATOM 0 HG3 ARG A 116 8.409 -13.159 2.076 1.00 14.02 H new ATOM 0 HD2 ARG A 116 9.809 -14.342 -0.348 1.00 23.11 H new ATOM 0 HD3 ARG A 116 8.200 -14.718 0.236 1.00 23.11 H new ATOM 0 HE ARG A 116 8.978 -12.480 -1.448 1.00 70.20 H new ATOM 0 HH11 ARG A 116 6.558 -13.375 1.031 1.00 13.20 H new ATOM 0 HH12 ARG A 116 5.355 -12.244 0.402 1.00 13.20 H new ATOM 0 HH21 ARG A 116 7.395 -11.089 -2.233 1.00 51.13 H new ATOM 0 HH22 ARG A 116 5.828 -10.966 -1.427 1.00 51.13 H new ATOM 1640 N TRP A 117 8.493 -10.146 3.087 1.00 71.43 N ATOM 1641 CA TRP A 117 7.181 -9.799 3.521 1.00 45.11 C ATOM 1642 C TRP A 117 6.566 -8.865 2.502 1.00 74.24 C ATOM 1643 O TRP A 117 7.262 -8.135 1.795 1.00 15.00 O ATOM 1644 CB TRP A 117 7.171 -9.182 4.945 1.00 15.12 C ATOM 1645 CG TRP A 117 7.912 -7.886 5.082 1.00 54.04 C ATOM 1646 CD1 TRP A 117 7.380 -6.644 4.972 1.00 4.14 C ATOM 1647 CD2 TRP A 117 9.307 -7.704 5.360 1.00 44.44 C ATOM 1648 NE1 TRP A 117 8.348 -5.695 5.143 1.00 22.30 N ATOM 1649 CE2 TRP A 117 9.544 -6.319 5.385 1.00 50.30 C ATOM 1650 CE3 TRP A 117 10.376 -8.574 5.583 1.00 62.14 C ATOM 1651 CZ2 TRP A 117 10.808 -5.787 5.622 1.00 11.44 C ATOM 1652 CZ3 TRP A 117 11.623 -8.039 5.821 1.00 22.50 C ATOM 1653 CH2 TRP A 117 11.827 -6.659 5.837 1.00 72.11 C ATOM 0 H TRP A 117 8.913 -9.464 2.456 1.00 71.43 H new ATOM 0 HA TRP A 117 6.583 -10.707 3.592 1.00 45.11 H new ATOM 0 HB2 TRP A 117 6.136 -9.025 5.249 1.00 15.12 H new ATOM 0 HB3 TRP A 117 7.601 -9.904 5.640 1.00 15.12 H new ATOM 0 HD1 TRP A 117 6.339 -6.434 4.777 1.00 4.14 H new ATOM 0 HE1 TRP A 117 8.204 -4.686 5.098 1.00 22.30 H new ATOM 0 HE3 TRP A 117 10.228 -9.644 5.569 1.00 62.14 H new ATOM 0 HZ2 TRP A 117 10.973 -4.720 5.635 1.00 11.44 H new ATOM 0 HZ3 TRP A 117 12.458 -8.700 5.999 1.00 22.50 H new ATOM 0 HH2 TRP A 117 12.819 -6.275 6.025 1.00 72.11 H new ATOM 1664 N ASP A 118 5.310 -8.933 2.382 1.00 43.52 N ATOM 1665 CA ASP A 118 4.590 -8.108 1.469 1.00 4.52 C ATOM 1666 C ASP A 118 3.958 -7.019 2.281 1.00 43.55 C ATOM 1667 O ASP A 118 3.504 -7.275 3.401 1.00 11.23 O ATOM 1668 CB ASP A 118 3.497 -8.928 0.779 1.00 3.54 C ATOM 1669 CG ASP A 118 3.991 -10.287 0.312 1.00 60.34 C ATOM 1670 OD1 ASP A 118 4.454 -10.396 -0.826 1.00 65.54 O ATOM 1671 OD2 ASP A 118 3.964 -11.268 1.116 1.00 4.22 O ATOM 0 H ASP A 118 4.724 -9.572 2.919 1.00 43.52 H new ATOM 0 HA ASP A 118 5.251 -7.702 0.703 1.00 4.52 H new ATOM 0 HB2 ASP A 118 2.663 -9.066 1.467 1.00 3.54 H new ATOM 0 HB3 ASP A 118 3.116 -8.371 -0.077 1.00 3.54 H new ATOM 1676 N GLU A 119 3.934 -5.827 1.767 1.00 31.13 N ATOM 1677 CA GLU A 119 3.369 -4.725 2.503 1.00 4.14 C ATOM 1678 C GLU A 119 2.140 -4.208 1.796 1.00 65.13 C ATOM 1679 O GLU A 119 2.077 -4.187 0.567 1.00 62.10 O ATOM 1680 CB GLU A 119 4.403 -3.611 2.740 1.00 32.51 C ATOM 1681 CG GLU A 119 5.593 -4.060 3.571 1.00 60.11 C ATOM 1682 CD GLU A 119 6.582 -2.955 3.882 1.00 1.33 C ATOM 1683 OE1 GLU A 119 6.590 -1.916 3.202 1.00 23.10 O ATOM 1684 OE2 GLU A 119 7.422 -3.118 4.800 1.00 62.04 O ATOM 0 H GLU A 119 4.297 -5.588 0.844 1.00 31.13 H new ATOM 0 HA GLU A 119 3.071 -5.085 3.488 1.00 4.14 H new ATOM 0 HB2 GLU A 119 4.759 -3.245 1.777 1.00 32.51 H new ATOM 0 HB3 GLU A 119 3.916 -2.773 3.239 1.00 32.51 H new ATOM 0 HG2 GLU A 119 5.230 -4.482 4.508 1.00 60.11 H new ATOM 0 HG3 GLU A 119 6.112 -4.859 3.041 1.00 60.11 H new ATOM 1691 N ALA A 120 1.163 -3.853 2.556 1.00 52.41 N ATOM 1692 CA ALA A 120 -0.088 -3.384 2.048 1.00 43.01 C ATOM 1693 C ALA A 120 -0.428 -2.077 2.685 1.00 71.51 C ATOM 1694 O ALA A 120 -0.531 -1.995 3.893 1.00 62.44 O ATOM 1695 CB ALA A 120 -1.154 -4.387 2.376 1.00 34.45 C ATOM 0 H ALA A 120 1.209 -3.880 3.575 1.00 52.41 H new ATOM 0 HA ALA A 120 -0.020 -3.253 0.968 1.00 43.01 H new ATOM 0 HB1 ALA A 120 -2.113 -4.038 1.992 1.00 34.45 H new ATOM 0 HB2 ALA A 120 -0.906 -5.344 1.917 1.00 34.45 H new ATOM 0 HB3 ALA A 120 -1.219 -4.509 3.457 1.00 34.45 H new ATOM 1701 N GLU A 121 -0.607 -1.071 1.902 1.00 13.24 N ATOM 1702 CA GLU A 121 -0.904 0.213 2.434 1.00 51.55 C ATOM 1703 C GLU A 121 -2.192 0.770 1.870 1.00 13.51 C ATOM 1704 O GLU A 121 -2.321 1.005 0.676 1.00 54.25 O ATOM 1705 CB GLU A 121 0.290 1.164 2.309 1.00 11.44 C ATOM 1706 CG GLU A 121 0.808 1.401 0.913 1.00 5.21 C ATOM 1707 CD GLU A 121 2.052 2.255 0.912 1.00 11.44 C ATOM 1708 OE1 GLU A 121 3.132 1.747 0.578 1.00 63.13 O ATOM 1709 OE2 GLU A 121 1.965 3.469 1.197 1.00 2.52 O ATOM 0 H GLU A 121 -0.552 -1.113 0.884 1.00 13.24 H new ATOM 0 HA GLU A 121 -1.081 0.102 3.504 1.00 51.55 H new ATOM 0 HB2 GLU A 121 0.009 2.126 2.738 1.00 11.44 H new ATOM 0 HB3 GLU A 121 1.106 0.771 2.915 1.00 11.44 H new ATOM 0 HG2 GLU A 121 1.024 0.444 0.439 1.00 5.21 H new ATOM 0 HG3 GLU A 121 0.035 1.885 0.316 1.00 5.21 H new ATOM 1716 N ALA A 122 -3.140 0.932 2.735 1.00 51.32 N ATOM 1717 CA ALA A 122 -4.435 1.424 2.388 1.00 41.31 C ATOM 1718 C ALA A 122 -4.491 2.926 2.601 1.00 10.50 C ATOM 1719 O ALA A 122 -3.989 3.449 3.616 1.00 2.52 O ATOM 1720 CB ALA A 122 -5.496 0.740 3.239 1.00 65.12 C ATOM 0 H ALA A 122 -3.033 0.721 3.727 1.00 51.32 H new ATOM 0 HA ALA A 122 -4.628 1.206 1.338 1.00 41.31 H new ATOM 0 HB1 ALA A 122 -6.481 1.121 2.968 1.00 65.12 H new ATOM 0 HB2 ALA A 122 -5.463 -0.336 3.067 1.00 65.12 H new ATOM 0 HB3 ALA A 122 -5.305 0.945 4.292 1.00 65.12 H new ATOM 1726 N TYR A 123 -5.063 3.603 1.640 1.00 44.11 N ATOM 1727 CA TYR A 123 -5.239 5.030 1.668 1.00 54.52 C ATOM 1728 C TYR A 123 -6.725 5.330 1.656 1.00 31.25 C ATOM 1729 O TYR A 123 -7.443 4.973 0.699 1.00 64.41 O ATOM 1730 CB TYR A 123 -4.636 5.683 0.420 1.00 13.12 C ATOM 1731 CG TYR A 123 -3.211 5.308 0.106 1.00 0.23 C ATOM 1732 CD1 TYR A 123 -2.156 6.096 0.522 1.00 31.30 C ATOM 1733 CD2 TYR A 123 -2.931 4.174 -0.643 1.00 12.44 C ATOM 1734 CE1 TYR A 123 -0.860 5.767 0.196 1.00 72.43 C ATOM 1735 CE2 TYR A 123 -1.648 3.833 -0.959 1.00 12.41 C ATOM 1736 CZ TYR A 123 -0.616 4.632 -0.541 1.00 71.30 C ATOM 1737 OH TYR A 123 0.664 4.315 -0.894 1.00 74.50 O ATOM 0 H TYR A 123 -5.429 3.165 0.795 1.00 44.11 H new ATOM 0 HA TYR A 123 -4.747 5.420 2.559 1.00 54.52 H new ATOM 0 HB2 TYR A 123 -5.257 5.425 -0.438 1.00 13.12 H new ATOM 0 HB3 TYR A 123 -4.689 6.765 0.538 1.00 13.12 H new ATOM 0 HD1 TYR A 123 -2.350 6.981 1.110 1.00 31.30 H new ATOM 0 HD2 TYR A 123 -3.744 3.549 -0.982 1.00 12.44 H new ATOM 0 HE1 TYR A 123 -0.042 6.395 0.516 1.00 72.43 H new ATOM 0 HE2 TYR A 123 -1.448 2.941 -1.534 1.00 12.41 H new ATOM 0 HH TYR A 123 1.244 4.371 -0.106 1.00 74.50 H new ATOM 1747 N ILE A 124 -7.195 5.941 2.682 1.00 75.22 N ATOM 1748 CA ILE A 124 -8.585 6.350 2.759 1.00 75.14 C ATOM 1749 C ILE A 124 -8.557 7.835 2.910 1.00 34.50 C ATOM 1750 O ILE A 124 -7.850 8.323 3.771 1.00 10.20 O ATOM 1751 CB ILE A 124 -9.287 5.756 4.010 1.00 24.45 C ATOM 1752 CG1 ILE A 124 -9.172 4.246 4.055 1.00 40.33 C ATOM 1753 CG2 ILE A 124 -10.751 6.162 4.068 1.00 73.25 C ATOM 1754 CD1 ILE A 124 -9.838 3.647 5.282 1.00 44.40 C ATOM 0 H ILE A 124 -6.640 6.181 3.504 1.00 75.22 H new ATOM 0 HA ILE A 124 -9.127 6.009 1.877 1.00 75.14 H new ATOM 0 HB ILE A 124 -8.774 6.165 4.880 1.00 24.45 H new ATOM 0 HG12 ILE A 124 -9.624 3.824 3.158 1.00 40.33 H new ATOM 0 HG13 ILE A 124 -8.119 3.965 4.044 1.00 40.33 H new ATOM 0 HG21 ILE A 124 -11.214 5.730 4.955 1.00 73.25 H new ATOM 0 HG22 ILE A 124 -10.826 7.249 4.112 1.00 73.25 H new ATOM 0 HG23 ILE A 124 -11.265 5.799 3.178 1.00 73.25 H new ATOM 0 HD11 ILE A 124 -9.726 2.563 5.264 1.00 44.40 H new ATOM 0 HD12 ILE A 124 -9.369 4.045 6.182 1.00 44.40 H new ATOM 0 HD13 ILE A 124 -10.898 3.902 5.282 1.00 44.40 H new ATOM 1766 N TRP A 125 -9.280 8.569 2.114 1.00 41.31 N ATOM 1767 CA TRP A 125 -9.177 9.983 2.253 1.00 23.34 C ATOM 1768 C TRP A 125 -10.451 10.552 2.810 1.00 13.24 C ATOM 1769 O TRP A 125 -11.559 9.999 2.585 1.00 21.33 O ATOM 1770 CB TRP A 125 -8.691 10.692 0.961 1.00 31.23 C ATOM 1771 CG TRP A 125 -9.738 11.175 -0.009 1.00 74.42 C ATOM 1772 CD1 TRP A 125 -9.996 12.480 -0.306 1.00 34.32 C ATOM 1773 CD2 TRP A 125 -10.650 10.402 -0.803 1.00 31.02 C ATOM 1774 NE1 TRP A 125 -10.983 12.568 -1.239 1.00 14.11 N ATOM 1775 CE2 TRP A 125 -11.407 11.314 -1.561 1.00 54.15 C ATOM 1776 CE3 TRP A 125 -10.899 9.042 -0.956 1.00 63.45 C ATOM 1777 CZ2 TRP A 125 -12.386 10.911 -2.451 1.00 63.31 C ATOM 1778 CZ3 TRP A 125 -11.877 8.640 -1.842 1.00 44.22 C ATOM 1779 CH2 TRP A 125 -12.607 9.575 -2.580 1.00 14.35 C ATOM 0 H TRP A 125 -9.918 8.228 1.395 1.00 41.31 H new ATOM 0 HA TRP A 125 -8.390 10.187 2.979 1.00 23.34 H new ATOM 0 HB2 TRP A 125 -8.086 11.549 1.256 1.00 31.23 H new ATOM 0 HB3 TRP A 125 -8.032 10.005 0.429 1.00 31.23 H new ATOM 0 HD1 TRP A 125 -9.489 13.325 0.136 1.00 34.32 H new ATOM 0 HE1 TRP A 125 -11.347 13.435 -1.634 1.00 14.11 H new ATOM 0 HE3 TRP A 125 -10.336 8.314 -0.391 1.00 63.45 H new ATOM 0 HZ2 TRP A 125 -12.954 11.630 -3.022 1.00 63.31 H new ATOM 0 HZ3 TRP A 125 -12.081 7.587 -1.967 1.00 44.22 H new ATOM 0 HH2 TRP A 125 -13.364 9.229 -3.268 1.00 14.35 H new ATOM 1790 N ARG A 126 -10.309 11.575 3.610 1.00 10.31 N ATOM 1791 CA ARG A 126 -11.437 12.216 4.185 1.00 23.34 C ATOM 1792 C ARG A 126 -11.659 13.502 3.443 1.00 53.01 C ATOM 1793 O ARG A 126 -10.784 14.383 3.397 1.00 73.31 O ATOM 1794 CB ARG A 126 -11.246 12.422 5.687 1.00 1.30 C ATOM 1795 CG ARG A 126 -12.522 12.767 6.445 1.00 73.14 C ATOM 1796 CD ARG A 126 -12.297 12.630 7.936 1.00 11.11 C ATOM 1797 NE ARG A 126 -13.523 12.795 8.731 1.00 13.00 N ATOM 1798 CZ ARG A 126 -13.711 12.246 9.952 1.00 63.33 C ATOM 1799 NH1 ARG A 126 -12.858 11.318 10.420 1.00 62.51 N ATOM 1800 NH2 ARG A 126 -14.773 12.575 10.677 1.00 11.41 N ATOM 0 H ARG A 126 -9.410 11.977 3.874 1.00 10.31 H new ATOM 0 HA ARG A 126 -12.327 11.594 4.089 1.00 23.34 H new ATOM 0 HB2 ARG A 126 -10.819 11.515 6.114 1.00 1.30 H new ATOM 0 HB3 ARG A 126 -10.519 13.220 5.842 1.00 1.30 H new ATOM 0 HG2 ARG A 126 -12.830 13.785 6.208 1.00 73.14 H new ATOM 0 HG3 ARG A 126 -13.331 12.108 6.130 1.00 73.14 H new ATOM 0 HD2 ARG A 126 -11.869 11.649 8.142 1.00 11.11 H new ATOM 0 HD3 ARG A 126 -11.564 13.371 8.255 1.00 11.11 H new ATOM 0 HE ARG A 126 -14.277 13.358 8.337 1.00 13.00 H new ATOM 0 HH11 ARG A 126 -12.063 11.024 9.853 1.00 62.51 H new ATOM 0 HH12 ARG A 126 -13.006 10.908 11.342 1.00 62.51 H new ATOM 0 HH21 ARG A 126 -15.451 13.244 10.313 1.00 11.41 H new ATOM 0 HH22 ARG A 126 -14.911 12.158 11.598 1.00 11.41 H new ATOM 1814 N ARG A 127 -12.793 13.574 2.840 1.00 40.22 N ATOM 1815 CA ARG A 127 -13.179 14.642 1.978 1.00 14.55 C ATOM 1816 C ARG A 127 -13.544 15.867 2.818 1.00 14.44 C ATOM 1817 O ARG A 127 -13.920 15.717 3.982 1.00 11.30 O ATOM 1818 CB ARG A 127 -14.368 14.146 1.145 1.00 10.52 C ATOM 1819 CG ARG A 127 -14.807 15.078 0.046 1.00 32.21 C ATOM 1820 CD ARG A 127 -15.895 14.457 -0.801 1.00 55.24 C ATOM 1821 NE ARG A 127 -16.291 15.330 -1.905 1.00 22.14 N ATOM 1822 CZ ARG A 127 -16.745 14.908 -3.097 1.00 13.32 C ATOM 1823 NH1 ARG A 127 -16.897 13.604 -3.342 1.00 60.42 N ATOM 1824 NH2 ARG A 127 -17.046 15.790 -4.037 1.00 30.34 N ATOM 0 H ARG A 127 -13.513 12.858 2.937 1.00 40.22 H new ATOM 0 HA ARG A 127 -12.369 14.938 1.312 1.00 14.55 H new ATOM 0 HB2 ARG A 127 -14.107 13.184 0.703 1.00 10.52 H new ATOM 0 HB3 ARG A 127 -15.212 13.972 1.812 1.00 10.52 H new ATOM 0 HG2 ARG A 127 -15.169 16.010 0.480 1.00 32.21 H new ATOM 0 HG3 ARG A 127 -13.953 15.330 -0.583 1.00 32.21 H new ATOM 0 HD2 ARG A 127 -15.546 13.504 -1.199 1.00 55.24 H new ATOM 0 HD3 ARG A 127 -16.763 14.243 -0.178 1.00 55.24 H new ATOM 0 HE ARG A 127 -16.217 16.337 -1.759 1.00 22.14 H new ATOM 0 HH11 ARG A 127 -16.668 12.920 -2.621 1.00 60.42 H new ATOM 0 HH12 ARG A 127 -17.242 13.293 -4.250 1.00 60.42 H new ATOM 0 HH21 ARG A 127 -16.933 16.787 -3.856 1.00 30.34 H new ATOM 0 HH22 ARG A 127 -17.391 15.472 -4.943 1.00 30.34 H new ATOM 1838 N LYS A 128 -13.447 17.072 2.235 1.00 30.14 N ATOM 1839 CA LYS A 128 -13.771 18.329 2.943 1.00 51.13 C ATOM 1840 C LYS A 128 -15.241 18.313 3.405 1.00 32.13 C ATOM 1841 O LYS A 128 -15.640 19.014 4.331 1.00 72.22 O ATOM 1842 CB LYS A 128 -13.525 19.537 2.023 1.00 23.53 C ATOM 1843 CG LYS A 128 -13.719 20.879 2.693 1.00 23.31 C ATOM 1844 CD LYS A 128 -13.658 22.024 1.706 1.00 25.31 C ATOM 1845 CE LYS A 128 -13.920 23.353 2.400 1.00 44.33 C ATOM 1846 NZ LYS A 128 -15.210 23.348 3.130 1.00 62.15 N ATOM 0 H LYS A 128 -13.145 17.207 1.270 1.00 30.14 H new ATOM 0 HA LYS A 128 -13.125 18.414 3.817 1.00 51.13 H new ATOM 0 HB2 LYS A 128 -12.508 19.482 1.634 1.00 23.53 H new ATOM 0 HB3 LYS A 128 -14.197 19.470 1.168 1.00 23.53 H new ATOM 0 HG2 LYS A 128 -14.682 20.893 3.204 1.00 23.31 H new ATOM 0 HG3 LYS A 128 -12.952 21.017 3.455 1.00 23.31 H new ATOM 0 HD2 LYS A 128 -12.679 22.046 1.228 1.00 25.31 H new ATOM 0 HD3 LYS A 128 -14.394 21.869 0.917 1.00 25.31 H new ATOM 0 HE2 LYS A 128 -13.109 23.565 3.097 1.00 44.33 H new ATOM 0 HE3 LYS A 128 -13.924 24.154 1.661 1.00 44.33 H new ATOM 0 HZ1 LYS A 128 -15.510 24.327 3.312 1.00 62.15 H new ATOM 0 HZ2 LYS A 128 -15.931 22.866 2.557 1.00 62.15 H new ATOM 0 HZ3 LYS A 128 -15.095 22.847 4.034 1.00 62.15 H new ATOM 1860 N ASP A 129 -16.024 17.494 2.731 1.00 71.01 N ATOM 1861 CA ASP A 129 -17.437 17.254 3.033 1.00 44.00 C ATOM 1862 C ASP A 129 -17.611 16.581 4.417 1.00 72.10 C ATOM 1863 O ASP A 129 -18.715 16.502 4.963 1.00 54.35 O ATOM 1864 CB ASP A 129 -18.029 16.373 1.920 1.00 32.32 C ATOM 1865 CG ASP A 129 -19.463 15.983 2.142 1.00 21.45 C ATOM 1866 OD1 ASP A 129 -20.328 16.870 2.169 1.00 50.45 O ATOM 1867 OD2 ASP A 129 -19.750 14.770 2.259 1.00 45.03 O ATOM 0 H ASP A 129 -15.692 16.956 1.931 1.00 71.01 H new ATOM 0 HA ASP A 129 -17.965 18.207 3.074 1.00 44.00 H new ATOM 0 HB2 ASP A 129 -17.951 16.904 0.971 1.00 32.32 H new ATOM 0 HB3 ASP A 129 -17.428 15.468 1.829 1.00 32.32 H new ATOM 1872 N GLY A 130 -16.518 16.090 4.964 1.00 54.25 N ATOM 1873 CA GLY A 130 -16.532 15.472 6.266 1.00 32.23 C ATOM 1874 C GLY A 130 -16.537 13.978 6.157 1.00 35.42 C ATOM 1875 O GLY A 130 -16.082 13.273 7.065 1.00 32.21 O ATOM 0 H GLY A 130 -15.601 16.110 4.518 1.00 54.25 H new ATOM 0 HA2 GLY A 130 -15.659 15.795 6.834 1.00 32.23 H new ATOM 0 HA3 GLY A 130 -17.412 15.802 6.818 1.00 32.23 H new ATOM 1879 N SER A 131 -17.007 13.509 5.027 1.00 41.03 N ATOM 1880 CA SER A 131 -17.145 12.138 4.739 1.00 61.54 C ATOM 1881 C SER A 131 -15.802 11.539 4.361 1.00 5.20 C ATOM 1882 O SER A 131 -14.867 12.251 3.978 1.00 54.12 O ATOM 1883 CB SER A 131 -18.182 11.997 3.626 1.00 45.01 C ATOM 1884 OG SER A 131 -17.904 12.914 2.559 1.00 74.43 O ATOM 0 H SER A 131 -17.311 14.113 4.264 1.00 41.03 H new ATOM 0 HA SER A 131 -17.489 11.587 5.614 1.00 61.54 H new ATOM 0 HB2 SER A 131 -18.178 10.976 3.245 1.00 45.01 H new ATOM 0 HB3 SER A 131 -19.179 12.185 4.024 1.00 45.01 H new ATOM 0 HG SER A 131 -18.447 13.722 2.673 1.00 74.43 H new ATOM 1890 N CYS A 132 -15.702 10.274 4.470 1.00 75.21 N ATOM 1891 CA CYS A 132 -14.467 9.595 4.216 1.00 32.21 C ATOM 1892 C CYS A 132 -14.748 8.361 3.374 1.00 61.43 C ATOM 1893 O CYS A 132 -15.795 7.719 3.533 1.00 1.45 O ATOM 1894 CB CYS A 132 -13.812 9.230 5.548 1.00 42.40 C ATOM 1895 SG CYS A 132 -12.060 8.857 5.448 1.00 34.33 S ATOM 0 H CYS A 132 -16.472 9.662 4.739 1.00 75.21 H new ATOM 0 HA CYS A 132 -13.779 10.236 3.665 1.00 32.21 H new ATOM 0 HB2 CYS A 132 -13.954 10.056 6.245 1.00 42.40 H new ATOM 0 HB3 CYS A 132 -14.330 8.367 5.967 1.00 42.40 H new ATOM 0 HG CYS A 132 -11.821 7.732 6.053 1.00 34.33 H new ATOM 1901 N TRP A 133 -13.853 8.043 2.472 1.00 33.54 N ATOM 1902 CA TRP A 133 -14.032 6.950 1.558 1.00 51.41 C ATOM 1903 C TRP A 133 -12.661 6.458 1.144 1.00 13.31 C ATOM 1904 O TRP A 133 -11.675 7.196 1.267 1.00 31.21 O ATOM 1905 CB TRP A 133 -14.853 7.408 0.344 1.00 64.25 C ATOM 1906 CG TRP A 133 -15.368 6.295 -0.523 1.00 71.04 C ATOM 1907 CD1 TRP A 133 -15.832 5.084 -0.117 1.00 35.02 C ATOM 1908 CD2 TRP A 133 -15.519 6.321 -1.934 1.00 32.13 C ATOM 1909 NE1 TRP A 133 -16.244 4.355 -1.191 1.00 63.31 N ATOM 1910 CE2 TRP A 133 -16.066 5.093 -2.322 1.00 15.51 C ATOM 1911 CE3 TRP A 133 -15.240 7.262 -2.900 1.00 64.22 C ATOM 1912 CZ2 TRP A 133 -16.340 4.785 -3.649 1.00 2.34 C ATOM 1913 CZ3 TRP A 133 -15.509 6.970 -4.220 1.00 72.21 C ATOM 1914 CH2 TRP A 133 -16.056 5.736 -4.583 1.00 34.15 C ATOM 0 H TRP A 133 -12.972 8.543 2.353 1.00 33.54 H new ATOM 0 HA TRP A 133 -14.581 6.136 2.032 1.00 51.41 H new ATOM 0 HB2 TRP A 133 -15.700 7.997 0.697 1.00 64.25 H new ATOM 0 HB3 TRP A 133 -14.237 8.069 -0.265 1.00 64.25 H new ATOM 0 HD1 TRP A 133 -15.869 4.748 0.909 1.00 35.02 H new ATOM 0 HE1 TRP A 133 -16.624 3.409 -1.154 1.00 63.31 H new ATOM 0 HE3 TRP A 133 -14.816 8.217 -2.627 1.00 64.22 H new ATOM 0 HZ2 TRP A 133 -16.761 3.831 -3.929 1.00 2.34 H new ATOM 0 HZ3 TRP A 133 -15.295 7.704 -4.983 1.00 72.21 H new ATOM 0 HH2 TRP A 133 -16.258 5.532 -5.624 1.00 34.15 H new ATOM 1925 N LEU A 134 -12.579 5.220 0.724 1.00 52.44 N ATOM 1926 CA LEU A 134 -11.318 4.620 0.349 1.00 72.41 C ATOM 1927 C LEU A 134 -10.809 5.252 -0.908 1.00 11.14 C ATOM 1928 O LEU A 134 -11.526 5.339 -1.902 1.00 51.51 O ATOM 1929 CB LEU A 134 -11.410 3.095 0.163 1.00 51.01 C ATOM 1930 CG LEU A 134 -11.543 2.222 1.423 1.00 31.53 C ATOM 1931 CD1 LEU A 134 -12.885 2.400 2.120 1.00 15.03 C ATOM 1932 CD2 LEU A 134 -11.291 0.768 1.070 1.00 3.02 C ATOM 0 H LEU A 134 -13.382 4.598 0.632 1.00 52.44 H new ATOM 0 HA LEU A 134 -10.625 4.800 1.171 1.00 72.41 H new ATOM 0 HB2 LEU A 134 -12.266 2.888 -0.479 1.00 51.01 H new ATOM 0 HB3 LEU A 134 -10.521 2.770 -0.377 1.00 51.01 H new ATOM 0 HG LEU A 134 -10.787 2.551 2.136 1.00 31.53 H new ATOM 0 HD11 LEU A 134 -12.924 1.761 3.002 1.00 15.03 H new ATOM 0 HD12 LEU A 134 -13.004 3.441 2.421 1.00 15.03 H new ATOM 0 HD13 LEU A 134 -13.689 2.126 1.437 1.00 15.03 H new ATOM 0 HD21 LEU A 134 -11.386 0.154 1.966 1.00 3.02 H new ATOM 0 HD22 LEU A 134 -12.020 0.442 0.328 1.00 3.02 H new ATOM 0 HD23 LEU A 134 -10.286 0.661 0.663 1.00 3.02 H new ATOM 1944 N HIS A 135 -9.589 5.697 -0.864 1.00 54.35 N ATOM 1945 CA HIS A 135 -8.997 6.350 -1.989 1.00 60.55 C ATOM 1946 C HIS A 135 -8.385 5.309 -2.886 1.00 43.40 C ATOM 1947 O HIS A 135 -8.670 5.233 -4.096 1.00 14.43 O ATOM 1948 CB HIS A 135 -7.904 7.341 -1.530 1.00 71.22 C ATOM 1949 CG HIS A 135 -7.270 8.118 -2.649 1.00 11.31 C ATOM 1950 ND1 HIS A 135 -6.225 7.650 -3.416 1.00 71.01 N ATOM 1951 CD2 HIS A 135 -7.563 9.344 -3.130 1.00 72.14 C ATOM 1952 CE1 HIS A 135 -5.922 8.586 -4.316 1.00 15.53 C ATOM 1953 NE2 HIS A 135 -6.705 9.637 -4.187 1.00 2.24 N ATOM 0 H HIS A 135 -8.979 5.617 -0.050 1.00 54.35 H new ATOM 0 HA HIS A 135 -9.766 6.907 -2.525 1.00 60.55 H new ATOM 0 HB2 HIS A 135 -8.340 8.041 -0.817 1.00 71.22 H new ATOM 0 HB3 HIS A 135 -7.128 6.789 -1.000 1.00 71.22 H new ATOM 0 HD1 HIS A 135 -5.764 6.746 -3.313 1.00 71.01 H new ATOM 0 HD2 HIS A 135 -8.339 9.995 -2.755 1.00 72.14 H new ATOM 0 HE1 HIS A 135 -5.138 8.494 -5.053 1.00 15.53 H new ATOM 1961 N SER A 136 -7.573 4.488 -2.280 1.00 1.20 N ATOM 1962 CA SER A 136 -6.823 3.499 -2.972 1.00 10.11 C ATOM 1963 C SER A 136 -6.108 2.672 -1.965 1.00 15.25 C ATOM 1964 O SER A 136 -6.013 3.059 -0.821 1.00 4.23 O ATOM 1965 CB SER A 136 -5.809 4.173 -3.930 1.00 13.52 C ATOM 1966 OG SER A 136 -5.005 5.157 -3.265 1.00 43.54 O ATOM 0 H SER A 136 -7.417 4.495 -1.272 1.00 1.20 H new ATOM 0 HA SER A 136 -7.486 2.872 -3.568 1.00 10.11 H new ATOM 0 HB2 SER A 136 -5.162 3.411 -4.365 1.00 13.52 H new ATOM 0 HB3 SER A 136 -6.347 4.642 -4.754 1.00 13.52 H new ATOM 0 HG SER A 136 -4.471 4.725 -2.566 1.00 43.54 H new ATOM 1972 N VAL A 137 -5.669 1.532 -2.344 1.00 52.14 N ATOM 1973 CA VAL A 137 -4.832 0.743 -1.479 1.00 72.32 C ATOM 1974 C VAL A 137 -3.727 0.190 -2.346 1.00 54.44 C ATOM 1975 O VAL A 137 -3.948 -0.062 -3.522 1.00 64.42 O ATOM 1976 CB VAL A 137 -5.591 -0.413 -0.708 1.00 51.52 C ATOM 1977 CG1 VAL A 137 -6.857 0.074 -0.008 1.00 63.32 C ATOM 1978 CG2 VAL A 137 -5.896 -1.590 -1.579 1.00 14.43 C ATOM 0 H VAL A 137 -5.868 1.109 -3.251 1.00 52.14 H new ATOM 0 HA VAL A 137 -4.450 1.379 -0.680 1.00 72.32 H new ATOM 0 HB VAL A 137 -4.893 -0.743 0.061 1.00 51.52 H new ATOM 0 HG11 VAL A 137 -7.334 -0.762 0.503 1.00 63.32 H new ATOM 0 HG12 VAL A 137 -6.598 0.844 0.719 1.00 63.32 H new ATOM 0 HG13 VAL A 137 -7.544 0.488 -0.746 1.00 63.32 H new ATOM 0 HG21 VAL A 137 -6.416 -2.349 -0.995 1.00 14.43 H new ATOM 0 HG22 VAL A 137 -6.528 -1.274 -2.409 1.00 14.43 H new ATOM 0 HG23 VAL A 137 -4.966 -2.005 -1.968 1.00 14.43 H new ATOM 1988 N LYS A 138 -2.557 0.074 -1.827 1.00 52.25 N ATOM 1989 CA LYS A 138 -1.455 -0.421 -2.606 1.00 41.34 C ATOM 1990 C LYS A 138 -0.813 -1.611 -1.931 1.00 34.43 C ATOM 1991 O LYS A 138 -0.501 -1.567 -0.755 1.00 12.42 O ATOM 1992 CB LYS A 138 -0.430 0.704 -2.840 1.00 54.30 C ATOM 1993 CG LYS A 138 0.794 0.300 -3.662 1.00 41.30 C ATOM 1994 CD LYS A 138 1.685 1.504 -3.990 1.00 53.35 C ATOM 1995 CE LYS A 138 2.264 2.175 -2.739 1.00 70.33 C ATOM 1996 NZ LYS A 138 3.234 1.318 -2.019 1.00 11.23 N ATOM 0 H LYS A 138 -2.327 0.314 -0.863 1.00 52.25 H new ATOM 0 HA LYS A 138 -1.830 -0.754 -3.574 1.00 41.34 H new ATOM 0 HB2 LYS A 138 -0.930 1.532 -3.343 1.00 54.30 H new ATOM 0 HB3 LYS A 138 -0.093 1.075 -1.872 1.00 54.30 H new ATOM 0 HG2 LYS A 138 1.373 -0.441 -3.111 1.00 41.30 H new ATOM 0 HG3 LYS A 138 0.469 -0.174 -4.588 1.00 41.30 H new ATOM 0 HD2 LYS A 138 2.503 1.180 -4.634 1.00 53.35 H new ATOM 0 HD3 LYS A 138 1.106 2.235 -4.554 1.00 53.35 H new ATOM 0 HE2 LYS A 138 2.753 3.106 -3.026 1.00 70.33 H new ATOM 0 HE3 LYS A 138 1.449 2.438 -2.064 1.00 70.33 H new ATOM 0 HZ1 LYS A 138 3.514 1.781 -1.131 1.00 11.23 H new ATOM 0 HZ2 LYS A 138 2.795 0.399 -1.807 1.00 11.23 H new ATOM 0 HZ3 LYS A 138 4.075 1.171 -2.613 1.00 11.23 H new ATOM 2010 N PHE A 139 -0.622 -2.656 -2.684 1.00 43.45 N ATOM 2011 CA PHE A 139 0.006 -3.843 -2.215 1.00 41.01 C ATOM 2012 C PHE A 139 1.340 -3.937 -2.874 1.00 11.12 C ATOM 2013 O PHE A 139 1.445 -3.799 -4.095 1.00 42.13 O ATOM 2014 CB PHE A 139 -0.831 -5.069 -2.571 1.00 24.34 C ATOM 2015 CG PHE A 139 -2.196 -5.042 -1.970 1.00 44.54 C ATOM 2016 CD1 PHE A 139 -3.321 -4.885 -2.752 1.00 25.01 C ATOM 2017 CD2 PHE A 139 -2.346 -5.155 -0.619 1.00 42.22 C ATOM 2018 CE1 PHE A 139 -4.572 -4.849 -2.175 1.00 64.03 C ATOM 2019 CE2 PHE A 139 -3.582 -5.117 -0.034 1.00 1.23 C ATOM 2020 CZ PHE A 139 -4.702 -4.963 -0.809 1.00 61.32 C ATOM 0 H PHE A 139 -0.908 -2.701 -3.662 1.00 43.45 H new ATOM 0 HA PHE A 139 0.109 -3.809 -1.130 1.00 41.01 H new ATOM 0 HB2 PHE A 139 -0.919 -5.138 -3.655 1.00 24.34 H new ATOM 0 HB3 PHE A 139 -0.311 -5.966 -2.236 1.00 24.34 H new ATOM 0 HD1 PHE A 139 -3.221 -4.790 -3.823 1.00 25.01 H new ATOM 0 HD2 PHE A 139 -1.471 -5.277 0.002 1.00 42.22 H new ATOM 0 HE1 PHE A 139 -5.449 -4.731 -2.794 1.00 64.03 H new ATOM 0 HE2 PHE A 139 -3.675 -5.208 1.038 1.00 1.23 H new ATOM 0 HZ PHE A 139 -5.680 -4.931 -0.351 1.00 61.32 H new ATOM 2030 N ILE A 140 2.350 -4.107 -2.110 1.00 2.34 N ATOM 2031 CA ILE A 140 3.674 -4.194 -2.647 1.00 4.42 C ATOM 2032 C ILE A 140 4.382 -5.430 -2.184 1.00 30.13 C ATOM 2033 O ILE A 140 4.882 -5.515 -1.050 1.00 51.43 O ATOM 2034 CB ILE A 140 4.539 -2.926 -2.383 1.00 62.34 C ATOM 2035 CG1 ILE A 140 4.444 -2.482 -0.908 1.00 73.24 C ATOM 2036 CG2 ILE A 140 4.157 -1.801 -3.337 1.00 2.22 C ATOM 2037 CD1 ILE A 140 5.290 -1.283 -0.552 1.00 62.12 C ATOM 0 H ILE A 140 2.295 -4.191 -1.095 1.00 2.34 H new ATOM 0 HA ILE A 140 3.544 -4.257 -3.727 1.00 4.42 H new ATOM 0 HB ILE A 140 5.581 -3.181 -2.575 1.00 62.34 H new ATOM 0 HG12 ILE A 140 3.403 -2.256 -0.678 1.00 73.24 H new ATOM 0 HG13 ILE A 140 4.737 -3.317 -0.272 1.00 73.24 H new ATOM 0 HG21 ILE A 140 4.774 -0.926 -3.134 1.00 2.22 H new ATOM 0 HG22 ILE A 140 4.316 -2.126 -4.365 1.00 2.22 H new ATOM 0 HG23 ILE A 140 3.107 -1.545 -3.196 1.00 2.22 H new ATOM 0 HD11 ILE A 140 5.158 -1.045 0.504 1.00 62.12 H new ATOM 0 HD12 ILE A 140 6.339 -1.508 -0.745 1.00 62.12 H new ATOM 0 HD13 ILE A 140 4.984 -0.429 -1.157 1.00 62.12 H new ATOM 2049 N MET A 141 4.383 -6.419 -3.027 1.00 33.13 N ATOM 2050 CA MET A 141 5.129 -7.597 -2.754 1.00 54.31 C ATOM 2051 C MET A 141 6.522 -7.316 -3.262 1.00 65.03 C ATOM 2052 O MET A 141 6.816 -7.522 -4.446 1.00 13.44 O ATOM 2053 CB MET A 141 4.552 -8.810 -3.520 1.00 22.55 C ATOM 2054 CG MET A 141 3.057 -9.098 -3.320 1.00 15.24 C ATOM 2055 SD MET A 141 1.962 -7.860 -4.081 1.00 41.33 S ATOM 2056 CE MET A 141 0.364 -8.537 -3.638 1.00 75.11 C ATOM 0 H MET A 141 3.872 -6.427 -3.910 1.00 33.13 H new ATOM 0 HA MET A 141 5.103 -7.837 -1.691 1.00 54.31 H new ATOM 0 HB2 MET A 141 4.731 -8.658 -4.584 1.00 22.55 H new ATOM 0 HB3 MET A 141 5.113 -9.697 -3.226 1.00 22.55 H new ATOM 0 HG2 MET A 141 2.827 -10.078 -3.737 1.00 15.24 H new ATOM 0 HG3 MET A 141 2.846 -9.148 -2.252 1.00 15.24 H new ATOM 0 HE1 MET A 141 -0.425 -7.895 -4.030 1.00 75.11 H new ATOM 0 HE2 MET A 141 0.262 -9.536 -4.061 1.00 75.11 H new ATOM 0 HE3 MET A 141 0.281 -8.593 -2.553 1.00 75.11 H new ATOM 2066 N SER A 142 7.365 -6.820 -2.395 1.00 35.21 N ATOM 2067 CA SER A 142 8.741 -6.421 -2.769 1.00 12.40 C ATOM 2068 C SER A 142 9.631 -6.207 -1.540 1.00 41.34 C ATOM 2069 O SER A 142 10.783 -5.816 -1.672 1.00 12.13 O ATOM 2070 CB SER A 142 8.734 -5.093 -3.587 1.00 62.33 C ATOM 2071 OG SER A 142 7.992 -5.197 -4.802 1.00 3.12 O ATOM 0 H SER A 142 7.142 -6.673 -1.411 1.00 35.21 H new ATOM 0 HA SER A 142 9.141 -7.238 -3.369 1.00 12.40 H new ATOM 0 HB2 SER A 142 8.311 -4.297 -2.975 1.00 62.33 H new ATOM 0 HB3 SER A 142 9.761 -4.807 -3.817 1.00 62.33 H new ATOM 0 HG SER A 142 7.812 -6.141 -4.996 1.00 3.12 H new ATOM 2077 N LYS A 143 9.119 -6.457 -0.360 1.00 43.14 N ATOM 2078 CA LYS A 143 9.892 -6.193 0.816 1.00 13.24 C ATOM 2079 C LYS A 143 10.589 -7.413 1.309 1.00 45.00 C ATOM 2080 O LYS A 143 9.993 -8.478 1.457 1.00 12.43 O ATOM 2081 CB LYS A 143 9.071 -5.524 1.901 1.00 21.31 C ATOM 2082 CG LYS A 143 8.886 -4.038 1.707 1.00 4.13 C ATOM 2083 CD LYS A 143 10.190 -3.284 1.907 1.00 73.41 C ATOM 2084 CE LYS A 143 9.989 -1.774 1.870 1.00 0.24 C ATOM 2085 NZ LYS A 143 9.168 -1.283 3.003 1.00 72.00 N ATOM 0 H LYS A 143 8.187 -6.836 -0.195 1.00 43.14 H new ATOM 0 HA LYS A 143 10.667 -5.482 0.531 1.00 13.24 H new ATOM 0 HB2 LYS A 143 8.091 -5.999 1.944 1.00 21.31 H new ATOM 0 HB3 LYS A 143 9.552 -5.697 2.864 1.00 21.31 H new ATOM 0 HG2 LYS A 143 8.503 -3.846 0.705 1.00 4.13 H new ATOM 0 HG3 LYS A 143 8.139 -3.668 2.410 1.00 4.13 H new ATOM 0 HD2 LYS A 143 10.630 -3.568 2.863 1.00 73.41 H new ATOM 0 HD3 LYS A 143 10.899 -3.574 1.132 1.00 73.41 H new ATOM 0 HE2 LYS A 143 10.961 -1.281 1.889 1.00 0.24 H new ATOM 0 HE3 LYS A 143 9.509 -1.497 0.931 1.00 0.24 H new ATOM 0 HZ1 LYS A 143 9.396 -0.286 3.190 1.00 72.00 H new ATOM 0 HZ2 LYS A 143 8.160 -1.369 2.764 1.00 72.00 H new ATOM 0 HZ3 LYS A 143 9.372 -1.850 3.851 1.00 72.00 H new ATOM 2099 N ALA A 144 11.855 -7.256 1.525 1.00 71.51 N ATOM 2100 CA ALA A 144 12.706 -8.313 1.990 1.00 3.43 C ATOM 2101 C ALA A 144 14.053 -7.753 2.341 1.00 34.42 C ATOM 2102 O ALA A 144 14.813 -7.312 1.455 1.00 15.24 O ATOM 2103 CB ALA A 144 12.861 -9.391 0.931 1.00 12.42 C ATOM 0 H ALA A 144 12.341 -6.371 1.381 1.00 71.51 H new ATOM 0 HA ALA A 144 12.250 -8.762 2.873 1.00 3.43 H new ATOM 0 HB1 ALA A 144 13.511 -10.181 1.308 1.00 12.42 H new ATOM 0 HB2 ALA A 144 11.883 -9.809 0.691 1.00 12.42 H new ATOM 0 HB3 ALA A 144 13.300 -8.958 0.032 1.00 12.42 H new ATOM 2109 N ALA A 145 14.335 -7.712 3.608 1.00 61.21 N ATOM 2110 CA ALA A 145 15.613 -7.255 4.080 1.00 21.05 C ATOM 2111 C ALA A 145 16.664 -8.309 3.766 1.00 32.53 C ATOM 2112 O ALA A 145 16.377 -9.510 3.865 1.00 74.35 O ATOM 2113 CB ALA A 145 15.567 -6.987 5.581 1.00 65.34 C ATOM 0 H ALA A 145 13.689 -7.993 4.345 1.00 61.21 H new ATOM 0 HA ALA A 145 15.868 -6.322 3.578 1.00 21.05 H new ATOM 0 HB1 ALA A 145 16.544 -6.642 5.919 1.00 65.34 H new ATOM 0 HB2 ALA A 145 14.819 -6.222 5.791 1.00 65.34 H new ATOM 0 HB3 ALA A 145 15.305 -7.905 6.107 1.00 65.34 H new ATOM 2119 N PRO A 146 17.857 -7.885 3.312 1.00 60.14 N ATOM 2120 CA PRO A 146 18.971 -8.796 3.056 1.00 2.14 C ATOM 2121 C PRO A 146 19.271 -9.634 4.296 1.00 45.31 C ATOM 2122 O PRO A 146 19.223 -9.123 5.427 1.00 62.54 O ATOM 2123 CB PRO A 146 20.143 -7.855 2.758 1.00 43.21 C ATOM 2124 CG PRO A 146 19.515 -6.600 2.276 1.00 41.21 C ATOM 2125 CD PRO A 146 18.200 -6.487 2.983 1.00 50.22 C ATOM 0 HA PRO A 146 18.768 -9.498 2.247 1.00 2.14 H new ATOM 0 HB2 PRO A 146 20.744 -7.678 3.650 1.00 43.21 H new ATOM 0 HB3 PRO A 146 20.807 -8.278 2.005 1.00 43.21 H new ATOM 0 HG2 PRO A 146 20.148 -5.740 2.494 1.00 41.21 H new ATOM 0 HG3 PRO A 146 19.374 -6.626 1.195 1.00 41.21 H new ATOM 0 HD2 PRO A 146 18.279 -5.873 3.880 1.00 50.22 H new ATOM 0 HD3 PRO A 146 17.442 -6.028 2.348 1.00 50.22 H new ATOM 2133 N TYR A 147 19.577 -10.890 4.096 1.00 44.54 N ATOM 2134 CA TYR A 147 19.813 -11.792 5.181 1.00 21.20 C ATOM 2135 C TYR A 147 21.113 -11.480 5.891 1.00 33.34 C ATOM 2136 O TYR A 147 22.003 -10.776 5.354 1.00 62.42 O ATOM 2137 CB TYR A 147 19.838 -13.245 4.685 1.00 74.12 C ATOM 2138 CG TYR A 147 20.933 -13.564 3.683 1.00 54.35 C ATOM 2139 CD1 TYR A 147 20.732 -13.384 2.324 1.00 62.15 C ATOM 2140 CD2 TYR A 147 22.169 -14.037 4.105 1.00 51.55 C ATOM 2141 CE1 TYR A 147 21.728 -13.660 1.411 1.00 54.30 C ATOM 2142 CE2 TYR A 147 23.170 -14.319 3.201 1.00 63.20 C ATOM 2143 CZ TYR A 147 22.946 -14.128 1.853 1.00 64.30 C ATOM 2144 OH TYR A 147 23.950 -14.392 0.943 1.00 32.33 O ATOM 0 H TYR A 147 19.668 -11.312 3.172 1.00 44.54 H new ATOM 0 HA TYR A 147 18.993 -11.665 5.888 1.00 21.20 H new ATOM 0 HB2 TYR A 147 19.951 -13.905 5.545 1.00 74.12 H new ATOM 0 HB3 TYR A 147 18.874 -13.475 4.232 1.00 74.12 H new ATOM 0 HD1 TYR A 147 19.777 -13.021 1.973 1.00 62.15 H new ATOM 0 HD2 TYR A 147 22.348 -14.186 5.159 1.00 51.55 H new ATOM 0 HE1 TYR A 147 21.554 -13.510 0.356 1.00 54.30 H new ATOM 0 HE2 TYR A 147 24.125 -14.688 3.546 1.00 63.20 H new ATOM 0 HH TYR A 147 24.745 -14.714 1.417 1.00 32.33 H new ATOM 2154 N VAL A 148 21.210 -11.981 7.075 1.00 32.35 N ATOM 2155 CA VAL A 148 22.406 -11.911 7.845 1.00 75.05 C ATOM 2156 C VAL A 148 22.915 -13.329 8.032 1.00 13.14 C ATOM 2157 O VAL A 148 22.128 -14.290 7.932 1.00 63.05 O ATOM 2158 CB VAL A 148 22.173 -11.232 9.223 1.00 31.40 C ATOM 2159 CG1 VAL A 148 21.752 -9.780 9.038 1.00 4.33 C ATOM 2160 CG2 VAL A 148 21.124 -11.984 10.034 1.00 20.24 C ATOM 0 H VAL A 148 20.443 -12.462 7.546 1.00 32.35 H new ATOM 0 HA VAL A 148 23.139 -11.299 7.319 1.00 75.05 H new ATOM 0 HB VAL A 148 23.114 -11.259 9.773 1.00 31.40 H new ATOM 0 HG11 VAL A 148 21.593 -9.320 10.013 1.00 4.33 H new ATOM 0 HG12 VAL A 148 22.534 -9.239 8.505 1.00 4.33 H new ATOM 0 HG13 VAL A 148 20.827 -9.740 8.463 1.00 4.33 H new ATOM 0 HG21 VAL A 148 20.981 -11.487 10.994 1.00 20.24 H new ATOM 0 HG22 VAL A 148 20.181 -11.996 9.487 1.00 20.24 H new ATOM 0 HG23 VAL A 148 21.459 -13.008 10.202 1.00 20.24 H new ATOM 2170 N ALA A 149 24.181 -13.474 8.266 1.00 32.40 N ATOM 2171 CA ALA A 149 24.769 -14.769 8.455 1.00 65.30 C ATOM 2172 C ALA A 149 25.068 -14.953 9.923 1.00 75.20 C ATOM 2173 O ALA A 149 26.136 -14.522 10.381 1.00 61.41 O ATOM 2174 CB ALA A 149 26.025 -14.921 7.603 1.00 22.12 C ATOM 0 H ALA A 149 24.840 -12.698 8.332 1.00 32.40 H new ATOM 0 HA ALA A 149 24.073 -15.544 8.134 1.00 65.30 H new ATOM 0 HB1 ALA A 149 26.455 -15.910 7.762 1.00 22.12 H new ATOM 0 HB2 ALA A 149 25.767 -14.802 6.551 1.00 22.12 H new ATOM 0 HB3 ALA A 149 26.752 -14.160 7.887 1.00 22.12 H new TER 2180 ALA A 149