USER MOD reduce.3.24.130724 H: found=0, std=0, add=1562, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1555 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 110 SER OG : rot 170:sc= 0.853 USER MOD Set 1.2: A 120 LYS NZ :NH3+ -158:sc= 0.976 (180deg=0) USER MOD Set 2.1: A 107 HIS : no HD1:sc= -0.184 X(o=-0.18,f=-0.59) USER MOD Set 2.2: A 163 ASN : amide:sc= 0 X(o=-0.18,f=-0.18) USER MOD Set 3.1: A 98 GLN : amide:sc= -0.312 X(o=-0.31,f=-0.4) USER MOD Set 3.2: A 101 MET CE :methyl 156:sc=-0.00269 (180deg=-0.295) USER MOD Set 3.3: A 111 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 77 THR OG1 : rot 70:sc= 1.3 USER MOD Set 4.2: A 97 ASN : amide:sc= -0.502 K(o=0.8,f=-5.7!) USER MOD Set 5.1: A 96 LYS NZ :NH3+ -175:sc= 0.0269 (180deg=0.00263) USER MOD Set 5.2: A 104 HIS : no HE2:sc= -1.04 K(o=-1,f=-1.7) USER MOD Set 6.1: A 74 TYR OH : rot 139:sc= 1.27 USER MOD Set 6.2: A 103 GLN : amide:sc= 1.96 K(o=3.2,f=-1.1) USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.0578 (180deg=0) USER MOD Single : A 2 MET CE :methyl -169:sc= -1.58 (180deg=-1.93) USER MOD Single : A 3 ASN : amide:sc= -0.0998 X(o=-0.1,f=-0.18) USER MOD Single : A 4 THR OG1 : rot -51:sc= 0.376 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.669 X(o=-0.67,f=-0.91) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.0936 X(o=-0.094,f=0) USER MOD Single : A 18 SER OG : rot 162:sc= 1.89 USER MOD Single : A 21 MET CE :methyl 180:sc= -0.0318 (180deg=-0.0318) USER MOD Single : A 22 MET CE :methyl -160:sc= -0.281 (180deg=-0.837) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -163:sc= 1.25 (180deg=0.822) USER MOD Single : A 36 SER OG : rot 32:sc= 0.023 USER MOD Single : A 42 SER OG : rot -69:sc= 1.83 USER MOD Single : A 45 ASN : amide:sc= -0.0532 X(o=-0.053,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0625 K(o=-0.063,f=-7.4!) USER MOD Single : A 52 SER OG : rot -48:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= -0.0407 (180deg=-0.0407) USER MOD Single : A 55 SER OG : rot -150:sc= 1.26 USER MOD Single : A 59 HIS : no HE2:sc= 0.894 K(o=0.89,f=-2.7!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0.0318 USER MOD Single : A 82 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000579) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.232 K(o=-0.23,f=-1.2) USER MOD Single : A 91 TYR OH : rot 15:sc= 1.29 USER MOD Single : A 92 GLN : amide:sc= -0.0498 X(o=-0.05,f=-0.01) USER MOD Single : A 100 TYR OH : rot 39:sc= 1.29 USER MOD Single : A 102 HIS :FLIP no HD1:sc= -0.48 F(o=-1.1,f=-0.48) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -42:sc= 1.2 USER MOD Single : A 112 THR OG1 : rot -15:sc= 0.188 USER MOD Single : A 113 SER OG : rot 180:sc=-0.00605 USER MOD Single : A 114 SER OG : rot -106:sc= 0.252 USER MOD Single : A 118 MET CE :methyl -134:sc= -0.859 (180deg=-9.71!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -83:sc= 0.689 USER MOD Single : A 125 CYS SG : rot 179:sc=0.000984 USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.0168 USER MOD Single : A 133 ASN : amide:sc= -0.352 K(o=-0.35,f=-9.2!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 TYR OH : rot -166:sc= 1.25 USER MOD Single : A 151 ASN : amide:sc= 0.474 K(o=0.47,f=-0.057) USER MOD Single : A 153 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 157 THR OG1 : rot -135:sc= 1.3 USER MOD Single : A 159 HIS : no HE2:sc= -2.68! C(o=-2.7!,f=-4.2!) USER MOD Single : A 167 MET CE :methyl -179:sc= -0.212 (180deg=-0.213) USER MOD Single : A 170 TYR OH : rot 175:sc= 0.556 USER MOD Single : A 171 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00773) USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 ASN : amide:sc= -0.236 X(o=-0.24,f=0) USER MOD Single : A 180 GLN : amide:sc= -0.189 X(o=-0.19,f=0) USER MOD Single : A 182 LYS NZ :NH3+ -157:sc= -0.0689 (180deg=-0.398) USER MOD Single : A 184 LYS NZ :NH3+ -162:sc= -0.0315 (180deg=-0.295) USER MOD Single : A 185 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.0016) USER MOD Single : A 191 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.661 -13.919 -1.364 1.00 3.40 N ATOM 2 CA GLY A 1 -12.676 -14.767 -2.063 1.00 10.21 C ATOM 3 C GLY A 1 -13.350 -16.002 -2.573 1.00 50.05 C ATOM 4 O GLY A 1 -14.554 -16.213 -2.557 1.00 1.01 O ATOM 0 H1 GLY A 1 -13.669 -12.971 -1.792 1.00 3.40 H new ATOM 0 H2 GLY A 1 -14.606 -14.344 -1.447 1.00 3.40 H new ATOM 0 H3 GLY A 1 -13.403 -13.843 -0.359 1.00 3.40 H new ATOM 0 HA2 GLY A 1 -12.229 -14.216 -2.891 1.00 10.21 H new ATOM 0 HA3 GLY A 1 -11.866 -15.036 -1.385 1.00 10.21 H new ATOM 8 N MET A 2 -12.511 -16.979 -2.804 1.00 12.22 N ATOM 9 CA MET A 2 -12.472 -18.090 -1.890 1.00 71.22 C ATOM 10 C MET A 2 -10.995 -18.377 -1.639 1.00 52.02 C ATOM 11 O MET A 2 -10.196 -17.453 -1.731 1.00 21.21 O ATOM 12 CB MET A 2 -13.319 -19.241 -2.414 1.00 74.55 C ATOM 13 CG MET A 2 -13.724 -20.250 -1.339 1.00 42.44 C ATOM 14 SD MET A 2 -13.862 -21.941 -1.918 1.00 45.31 S ATOM 15 CE MET A 2 -12.136 -22.280 -2.320 1.00 34.33 C ATOM 0 H MET A 2 -11.865 -17.030 -3.591 1.00 12.22 H new ATOM 0 HA MET A 2 -12.929 -17.885 -0.922 1.00 71.22 H new ATOM 0 HB2 MET A 2 -14.219 -18.836 -2.876 1.00 74.55 H new ATOM 0 HB3 MET A 2 -12.765 -19.760 -3.196 1.00 74.55 H new ATOM 0 HG2 MET A 2 -12.992 -20.215 -0.532 1.00 42.44 H new ATOM 0 HG3 MET A 2 -14.681 -19.945 -0.915 1.00 42.44 H new ATOM 0 HE1 MET A 2 -12.069 -23.216 -2.875 1.00 34.33 H new ATOM 0 HE2 MET A 2 -11.738 -21.468 -2.929 1.00 34.33 H new ATOM 0 HE3 MET A 2 -11.557 -22.361 -1.400 1.00 34.33 H new ATOM 25 N ASN A 3 -10.630 -19.609 -1.292 1.00 33.13 N ATOM 26 CA ASN A 3 -9.235 -20.083 -1.227 1.00 64.25 C ATOM 27 C ASN A 3 -8.642 -20.365 -2.606 1.00 61.55 C ATOM 28 O ASN A 3 -7.451 -20.660 -2.715 1.00 62.01 O ATOM 29 CB ASN A 3 -9.098 -21.395 -0.439 1.00 50.03 C ATOM 30 CG ASN A 3 -9.952 -21.517 0.798 1.00 73.23 C ATOM 31 OD1 ASN A 3 -10.624 -22.519 1.026 1.00 13.10 O ATOM 32 ND2 ASN A 3 -10.006 -20.443 1.540 1.00 73.15 N ATOM 0 H ASN A 3 -11.307 -20.329 -1.041 1.00 33.13 H new ATOM 0 HA ASN A 3 -8.703 -19.269 -0.734 1.00 64.25 H new ATOM 0 HB2 ASN A 3 -9.339 -22.223 -1.106 1.00 50.03 H new ATOM 0 HB3 ASN A 3 -8.054 -21.514 -0.149 1.00 50.03 H new ATOM 0 HD21 ASN A 3 -10.626 -20.413 2.349 1.00 73.15 H new ATOM 0 HD22 ASN A 3 -9.428 -19.635 1.310 1.00 73.15 H new ATOM 39 N THR A 4 -9.465 -20.289 -3.643 1.00 30.22 N ATOM 40 CA THR A 4 -9.189 -20.620 -5.040 1.00 64.33 C ATOM 41 C THR A 4 -8.247 -19.640 -5.753 1.00 73.05 C ATOM 42 O THR A 4 -8.349 -19.371 -6.944 1.00 74.13 O ATOM 43 CB THR A 4 -10.535 -20.784 -5.779 1.00 12.40 C ATOM 44 OG1 THR A 4 -10.367 -21.318 -7.079 1.00 31.31 O ATOM 45 CG2 THR A 4 -11.342 -19.484 -5.881 1.00 13.34 C ATOM 0 H THR A 4 -10.425 -19.967 -3.521 1.00 30.22 H new ATOM 0 HA THR A 4 -8.636 -21.559 -5.055 1.00 64.33 H new ATOM 0 HB THR A 4 -11.099 -21.485 -5.164 1.00 12.40 H new ATOM 0 HG1 THR A 4 -9.689 -20.800 -7.560 1.00 31.31 H new ATOM 0 HG21 THR A 4 -12.275 -19.675 -6.412 1.00 13.34 H new ATOM 0 HG22 THR A 4 -11.564 -19.114 -4.880 1.00 13.34 H new ATOM 0 HG23 THR A 4 -10.762 -18.737 -6.424 1.00 13.34 H new ATOM 53 N VAL A 5 -7.289 -19.113 -5.023 1.00 74.41 N ATOM 54 CA VAL A 5 -6.564 -17.924 -5.385 1.00 5.21 C ATOM 55 C VAL A 5 -5.127 -18.110 -4.940 1.00 64.01 C ATOM 56 O VAL A 5 -4.804 -18.059 -3.753 1.00 52.52 O ATOM 57 CB VAL A 5 -7.301 -16.694 -4.814 1.00 61.02 C ATOM 58 CG1 VAL A 5 -7.732 -16.790 -3.352 1.00 74.42 C ATOM 59 CG2 VAL A 5 -6.475 -15.426 -4.998 1.00 54.32 C ATOM 0 H VAL A 5 -6.987 -19.515 -4.136 1.00 74.41 H new ATOM 0 HA VAL A 5 -6.525 -17.745 -6.460 1.00 5.21 H new ATOM 0 HB VAL A 5 -8.222 -16.659 -5.397 1.00 61.02 H new ATOM 0 HG11 VAL A 5 -8.239 -15.870 -3.061 1.00 74.42 H new ATOM 0 HG12 VAL A 5 -8.411 -17.634 -3.227 1.00 74.42 H new ATOM 0 HG13 VAL A 5 -6.854 -16.935 -2.723 1.00 74.42 H new ATOM 0 HG21 VAL A 5 -7.018 -14.575 -4.587 1.00 54.32 H new ATOM 0 HG22 VAL A 5 -5.523 -15.534 -4.479 1.00 54.32 H new ATOM 0 HG23 VAL A 5 -6.293 -15.261 -6.060 1.00 54.32 H new ATOM 69 N LYS A 6 -4.261 -18.322 -5.926 1.00 1.13 N ATOM 70 CA LYS A 6 -2.805 -18.385 -5.809 1.00 53.41 C ATOM 71 C LYS A 6 -2.171 -17.539 -6.904 1.00 2.51 C ATOM 72 O LYS A 6 -0.971 -17.646 -7.151 1.00 23.23 O ATOM 73 CB LYS A 6 -2.386 -19.854 -5.946 1.00 14.52 C ATOM 74 CG LYS A 6 -2.704 -20.680 -4.680 1.00 74.45 C ATOM 75 CD LYS A 6 -1.495 -21.169 -3.878 1.00 53.43 C ATOM 76 CE LYS A 6 -0.517 -20.042 -3.556 1.00 2.24 C ATOM 77 NZ LYS A 6 0.359 -20.392 -2.417 1.00 64.02 N ATOM 0 H LYS A 6 -4.574 -18.463 -6.886 1.00 1.13 H new ATOM 0 HA LYS A 6 -2.473 -17.996 -4.846 1.00 53.41 H new ATOM 0 HB2 LYS A 6 -2.896 -20.296 -6.802 1.00 14.52 H new ATOM 0 HB3 LYS A 6 -1.317 -19.906 -6.151 1.00 14.52 H new ATOM 0 HG2 LYS A 6 -3.330 -20.076 -4.024 1.00 74.45 H new ATOM 0 HG3 LYS A 6 -3.295 -21.547 -4.975 1.00 74.45 H new ATOM 0 HD2 LYS A 6 -1.839 -21.625 -2.949 1.00 53.43 H new ATOM 0 HD3 LYS A 6 -0.978 -21.945 -4.442 1.00 53.43 H new ATOM 0 HE2 LYS A 6 0.094 -19.827 -4.433 1.00 2.24 H new ATOM 0 HE3 LYS A 6 -1.072 -19.133 -3.324 1.00 2.24 H new ATOM 0 HZ1 LYS A 6 1.011 -19.604 -2.225 1.00 64.02 H new ATOM 0 HZ2 LYS A 6 -0.223 -20.573 -1.574 1.00 64.02 H new ATOM 0 HZ3 LYS A 6 0.906 -21.245 -2.649 1.00 64.02 H new ATOM 91 N ASN A 7 -2.975 -16.740 -7.599 1.00 14.31 N ATOM 92 CA ASN A 7 -2.540 -15.943 -8.732 1.00 51.32 C ATOM 93 C ASN A 7 -3.366 -14.688 -8.812 1.00 3.33 C ATOM 94 O ASN A 7 -4.508 -14.656 -8.359 1.00 54.24 O ATOM 95 CB ASN A 7 -2.679 -16.685 -10.069 1.00 70.45 C ATOM 96 CG ASN A 7 -4.041 -17.342 -10.260 1.00 23.03 C ATOM 97 OD1 ASN A 7 -4.399 -18.270 -9.540 1.00 44.53 O ATOM 98 ND2 ASN A 7 -4.823 -16.900 -11.222 1.00 4.52 N ATOM 0 H ASN A 7 -3.966 -16.629 -7.383 1.00 14.31 H new ATOM 0 HA ASN A 7 -1.485 -15.721 -8.571 1.00 51.32 H new ATOM 0 HB2 ASN A 7 -2.505 -15.983 -10.885 1.00 70.45 H new ATOM 0 HB3 ASN A 7 -1.904 -17.448 -10.134 1.00 70.45 H new ATOM 0 HD21 ASN A 7 -5.736 -17.329 -11.375 1.00 4.52 H new ATOM 0 HD22 ASN A 7 -4.516 -16.129 -11.815 1.00 4.52 H new ATOM 105 N LYS A 8 -2.784 -13.687 -9.468 1.00 4.41 N ATOM 106 CA LYS A 8 -3.343 -12.368 -9.658 1.00 62.15 C ATOM 107 C LYS A 8 -4.801 -12.409 -10.073 1.00 33.31 C ATOM 108 O LYS A 8 -5.616 -11.784 -9.406 1.00 50.25 O ATOM 109 CB LYS A 8 -2.469 -11.691 -10.711 1.00 51.35 C ATOM 110 CG LYS A 8 -2.999 -10.290 -11.036 1.00 3.40 C ATOM 111 CD LYS A 8 -1.959 -9.426 -11.740 1.00 1.24 C ATOM 112 CE LYS A 8 -1.828 -9.757 -13.229 1.00 13.50 C ATOM 113 NZ LYS A 8 -1.240 -8.626 -13.963 1.00 45.31 N ATOM 0 H LYS A 8 -1.865 -13.788 -9.899 1.00 4.41 H new ATOM 0 HA LYS A 8 -3.341 -11.810 -8.722 1.00 62.15 H new ATOM 0 HB2 LYS A 8 -1.443 -11.622 -10.350 1.00 51.35 H new ATOM 0 HB3 LYS A 8 -2.448 -12.296 -11.617 1.00 51.35 H new ATOM 0 HG2 LYS A 8 -3.884 -10.376 -11.667 1.00 3.40 H new ATOM 0 HG3 LYS A 8 -3.312 -9.799 -10.114 1.00 3.40 H new ATOM 0 HD2 LYS A 8 -2.228 -8.376 -11.628 1.00 1.24 H new ATOM 0 HD3 LYS A 8 -0.992 -9.561 -11.255 1.00 1.24 H new ATOM 0 HE2 LYS A 8 -1.206 -10.643 -13.356 1.00 13.50 H new ATOM 0 HE3 LYS A 8 -2.809 -9.994 -13.642 1.00 13.50 H new ATOM 0 HZ1 LYS A 8 -1.160 -8.870 -14.971 1.00 45.31 H new ATOM 0 HZ2 LYS A 8 -1.849 -7.789 -13.857 1.00 45.31 H new ATOM 0 HZ3 LYS A 8 -0.295 -8.418 -13.581 1.00 45.31 H new ATOM 127 N GLN A 9 -5.114 -13.097 -11.169 1.00 42.24 N ATOM 128 CA GLN A 9 -6.441 -13.131 -11.767 1.00 70.44 C ATOM 129 C GLN A 9 -7.499 -13.399 -10.681 1.00 21.44 C ATOM 130 O GLN A 9 -8.421 -12.607 -10.506 1.00 64.22 O ATOM 131 CB GLN A 9 -6.421 -14.182 -12.897 1.00 43.53 C ATOM 132 CG GLN A 9 -7.498 -13.977 -13.979 1.00 72.31 C ATOM 133 CD GLN A 9 -7.021 -13.248 -15.227 1.00 4.42 C ATOM 134 OE1 GLN A 9 -7.245 -13.695 -16.351 1.00 14.10 O ATOM 135 NE2 GLN A 9 -6.391 -12.095 -15.089 1.00 11.44 N ATOM 0 H GLN A 9 -4.432 -13.660 -11.677 1.00 42.24 H new ATOM 0 HA GLN A 9 -6.714 -12.173 -12.209 1.00 70.44 H new ATOM 0 HB2 GLN A 9 -5.440 -14.168 -13.372 1.00 43.53 H new ATOM 0 HB3 GLN A 9 -6.549 -15.171 -12.458 1.00 43.53 H new ATOM 0 HG2 GLN A 9 -7.888 -14.952 -14.272 1.00 72.31 H new ATOM 0 HG3 GLN A 9 -8.327 -13.419 -13.544 1.00 72.31 H new ATOM 0 HE21 GLN A 9 -6.205 -11.724 -14.157 1.00 11.44 H new ATOM 0 HE22 GLN A 9 -6.091 -11.576 -15.914 1.00 11.44 H new ATOM 144 N GLU A 10 -7.281 -14.443 -9.882 1.00 34.31 N ATOM 145 CA GLU A 10 -8.203 -14.956 -8.871 1.00 30.03 C ATOM 146 C GLU A 10 -8.364 -14.028 -7.668 1.00 45.32 C ATOM 147 O GLU A 10 -9.396 -14.013 -6.996 1.00 63.13 O ATOM 148 CB GLU A 10 -7.644 -16.322 -8.435 1.00 52.53 C ATOM 149 CG GLU A 10 -7.768 -17.390 -9.515 1.00 10.34 C ATOM 150 CD GLU A 10 -9.189 -17.877 -9.814 1.00 72.25 C ATOM 151 OE1 GLU A 10 -10.030 -17.031 -10.186 1.00 41.11 O ATOM 152 OE2 GLU A 10 -9.439 -19.104 -9.803 1.00 45.44 O ATOM 0 H GLU A 10 -6.415 -14.979 -9.925 1.00 34.31 H new ATOM 0 HA GLU A 10 -9.203 -15.036 -9.297 1.00 30.03 H new ATOM 0 HB2 GLU A 10 -6.595 -16.209 -8.163 1.00 52.53 H new ATOM 0 HB3 GLU A 10 -8.171 -16.655 -7.541 1.00 52.53 H new ATOM 0 HG2 GLU A 10 -7.337 -16.999 -10.437 1.00 10.34 H new ATOM 0 HG3 GLU A 10 -7.165 -18.249 -9.221 1.00 10.34 H new ATOM 159 N ILE A 11 -7.332 -13.240 -7.392 1.00 31.12 N ATOM 160 CA ILE A 11 -7.431 -12.126 -6.458 1.00 43.21 C ATOM 161 C ILE A 11 -8.307 -11.018 -7.078 1.00 50.34 C ATOM 162 O ILE A 11 -9.235 -10.517 -6.440 1.00 5.12 O ATOM 163 CB ILE A 11 -6.043 -11.543 -6.104 1.00 54.15 C ATOM 164 CG1 ILE A 11 -4.972 -12.568 -5.684 1.00 65.21 C ATOM 165 CG2 ILE A 11 -6.226 -10.517 -4.982 1.00 52.24 C ATOM 166 CD1 ILE A 11 -3.559 -11.977 -5.617 1.00 53.22 C ATOM 0 H ILE A 11 -6.407 -13.354 -7.807 1.00 31.12 H new ATOM 0 HA ILE A 11 -7.880 -12.500 -5.538 1.00 43.21 H new ATOM 0 HB ILE A 11 -5.661 -11.102 -7.025 1.00 54.15 H new ATOM 0 HG12 ILE A 11 -5.234 -12.977 -4.708 1.00 65.21 H new ATOM 0 HG13 ILE A 11 -4.978 -13.399 -6.390 1.00 65.21 H new ATOM 0 HG21 ILE A 11 -5.258 -10.092 -4.716 1.00 52.24 H new ATOM 0 HG22 ILE A 11 -6.890 -9.722 -5.321 1.00 52.24 H new ATOM 0 HG23 ILE A 11 -6.660 -11.005 -4.110 1.00 52.24 H new ATOM 0 HD11 ILE A 11 -2.854 -12.752 -5.315 1.00 53.22 H new ATOM 0 HD12 ILE A 11 -3.278 -11.593 -6.598 1.00 53.22 H new ATOM 0 HD13 ILE A 11 -3.538 -11.165 -4.890 1.00 53.22 H new ATOM 178 N LEU A 12 -7.974 -10.564 -8.293 1.00 13.14 N ATOM 179 CA LEU A 12 -8.574 -9.380 -8.912 1.00 63.35 C ATOM 180 C LEU A 12 -10.064 -9.589 -9.159 1.00 44.22 C ATOM 181 O LEU A 12 -10.853 -8.654 -9.048 1.00 62.44 O ATOM 182 CB LEU A 12 -7.912 -9.067 -10.269 1.00 32.34 C ATOM 183 CG LEU A 12 -6.437 -8.636 -10.230 1.00 63.14 C ATOM 184 CD1 LEU A 12 -5.950 -8.409 -11.665 1.00 74.42 C ATOM 185 CD2 LEU A 12 -6.225 -7.394 -9.365 1.00 51.52 C ATOM 0 H LEU A 12 -7.272 -11.015 -8.879 1.00 13.14 H new ATOM 0 HA LEU A 12 -8.420 -8.551 -8.221 1.00 63.35 H new ATOM 0 HB2 LEU A 12 -7.992 -9.952 -10.900 1.00 32.34 H new ATOM 0 HB3 LEU A 12 -8.485 -8.277 -10.754 1.00 32.34 H new ATOM 0 HG LEU A 12 -5.850 -9.430 -9.768 1.00 63.14 H new ATOM 0 HD11 LEU A 12 -4.904 -8.103 -11.650 1.00 74.42 H new ATOM 0 HD12 LEU A 12 -6.049 -9.334 -12.233 1.00 74.42 H new ATOM 0 HD13 LEU A 12 -6.550 -7.629 -12.134 1.00 74.42 H new ATOM 0 HD21 LEU A 12 -5.169 -7.126 -9.366 1.00 51.52 H new ATOM 0 HD22 LEU A 12 -6.810 -6.567 -9.767 1.00 51.52 H new ATOM 0 HD23 LEU A 12 -6.545 -7.603 -8.344 1.00 51.52 H new ATOM 197 N GLU A 13 -10.462 -10.814 -9.475 1.00 64.22 N ATOM 198 CA GLU A 13 -11.858 -11.158 -9.611 1.00 4.43 C ATOM 199 C GLU A 13 -12.612 -10.940 -8.289 1.00 1.20 C ATOM 200 O GLU A 13 -13.729 -10.421 -8.321 1.00 22.21 O ATOM 201 CB GLU A 13 -11.979 -12.576 -10.194 1.00 64.14 C ATOM 202 CG GLU A 13 -11.675 -12.566 -11.696 1.00 74.42 C ATOM 203 CD GLU A 13 -11.942 -13.862 -12.471 1.00 2.14 C ATOM 204 OE1 GLU A 13 -12.479 -14.846 -11.915 1.00 73.24 O ATOM 205 OE2 GLU A 13 -11.649 -13.872 -13.691 1.00 31.10 O ATOM 0 H GLU A 13 -9.823 -11.591 -9.643 1.00 64.22 H new ATOM 0 HA GLU A 13 -12.348 -10.490 -10.320 1.00 4.43 H new ATOM 0 HB2 GLU A 13 -11.289 -13.246 -9.682 1.00 64.14 H new ATOM 0 HB3 GLU A 13 -12.984 -12.962 -10.023 1.00 64.14 H new ATOM 0 HG2 GLU A 13 -12.262 -11.770 -12.155 1.00 74.42 H new ATOM 0 HG3 GLU A 13 -10.625 -12.304 -11.827 1.00 74.42 H new ATOM 212 N ALA A 14 -12.004 -11.200 -7.123 1.00 12.13 N ATOM 213 CA ALA A 14 -12.691 -11.001 -5.848 1.00 10.53 C ATOM 214 C ALA A 14 -12.732 -9.518 -5.468 1.00 74.12 C ATOM 215 O ALA A 14 -13.603 -9.096 -4.705 1.00 32.11 O ATOM 216 CB ALA A 14 -11.985 -11.825 -4.767 1.00 2.41 C ATOM 0 H ALA A 14 -11.048 -11.545 -7.040 1.00 12.13 H new ATOM 0 HA ALA A 14 -13.724 -11.337 -5.941 1.00 10.53 H new ATOM 0 HB1 ALA A 14 -12.491 -11.682 -3.812 1.00 2.41 H new ATOM 0 HB2 ALA A 14 -12.012 -12.880 -5.038 1.00 2.41 H new ATOM 0 HB3 ALA A 14 -10.948 -11.499 -4.680 1.00 2.41 H new ATOM 222 N PHE A 15 -11.795 -8.732 -6.003 1.00 42.51 N ATOM 223 CA PHE A 15 -11.711 -7.296 -5.817 1.00 22.42 C ATOM 224 C PHE A 15 -12.957 -6.614 -6.377 1.00 50.45 C ATOM 225 O PHE A 15 -13.667 -5.953 -5.628 1.00 14.32 O ATOM 226 CB PHE A 15 -10.428 -6.765 -6.464 1.00 63.11 C ATOM 227 CG PHE A 15 -10.282 -5.274 -6.379 1.00 21.00 C ATOM 228 CD1 PHE A 15 -10.834 -4.474 -7.396 1.00 44.13 C ATOM 229 CD2 PHE A 15 -9.644 -4.688 -5.275 1.00 30.34 C ATOM 230 CE1 PHE A 15 -10.811 -3.082 -7.277 1.00 73.02 C ATOM 231 CE2 PHE A 15 -9.603 -3.294 -5.168 1.00 21.04 C ATOM 232 CZ PHE A 15 -10.216 -2.505 -6.148 1.00 61.44 C ATOM 0 H PHE A 15 -11.051 -9.098 -6.597 1.00 42.51 H new ATOM 0 HA PHE A 15 -11.669 -7.068 -4.752 1.00 22.42 H new ATOM 0 HB2 PHE A 15 -9.569 -7.233 -5.984 1.00 63.11 H new ATOM 0 HB3 PHE A 15 -10.410 -7.064 -7.512 1.00 63.11 H new ATOM 0 HD1 PHE A 15 -11.275 -4.935 -8.267 1.00 44.13 H new ATOM 0 HD2 PHE A 15 -9.189 -5.307 -4.516 1.00 30.34 H new ATOM 0 HE1 PHE A 15 -11.246 -2.460 -8.045 1.00 73.02 H new ATOM 0 HE2 PHE A 15 -9.101 -2.829 -4.333 1.00 21.04 H new ATOM 0 HZ PHE A 15 -10.230 -1.431 -6.032 1.00 61.44 H new ATOM 242 N ARG A 16 -13.214 -6.728 -7.687 1.00 30.23 N ATOM 243 CA ARG A 16 -14.314 -6.004 -8.343 1.00 54.42 C ATOM 244 C ARG A 16 -15.672 -6.589 -7.961 1.00 62.13 C ATOM 245 O ARG A 16 -16.676 -5.884 -8.053 1.00 61.15 O ATOM 246 CB ARG A 16 -14.113 -6.048 -9.879 1.00 52.35 C ATOM 247 CG ARG A 16 -13.989 -4.674 -10.554 1.00 63.25 C ATOM 248 CD ARG A 16 -15.282 -4.217 -11.241 1.00 65.04 C ATOM 249 NE ARG A 16 -15.601 -4.977 -12.462 1.00 5.41 N ATOM 250 CZ ARG A 16 -15.068 -4.864 -13.685 1.00 3.50 C ATOM 251 NH1 ARG A 16 -14.053 -4.042 -13.927 1.00 12.12 N ATOM 252 NH2 ARG A 16 -15.575 -5.597 -14.664 1.00 44.33 N ATOM 0 H ARG A 16 -12.672 -7.318 -8.318 1.00 30.23 H new ATOM 0 HA ARG A 16 -14.300 -4.968 -8.005 1.00 54.42 H new ATOM 0 HB2 ARG A 16 -13.215 -6.626 -10.097 1.00 52.35 H new ATOM 0 HB3 ARG A 16 -14.952 -6.582 -10.326 1.00 52.35 H new ATOM 0 HG2 ARG A 16 -13.702 -3.934 -9.807 1.00 63.25 H new ATOM 0 HG3 ARG A 16 -13.187 -4.710 -11.291 1.00 63.25 H new ATOM 0 HD2 ARG A 16 -16.110 -4.311 -10.538 1.00 65.04 H new ATOM 0 HD3 ARG A 16 -15.196 -3.160 -11.493 1.00 65.04 H new ATOM 0 HE ARG A 16 -16.327 -5.686 -12.362 1.00 5.41 H new ATOM 0 HH11 ARG A 16 -13.662 -3.479 -13.172 1.00 12.12 H new ATOM 0 HH12 ARG A 16 -13.665 -3.974 -14.868 1.00 12.12 H new ATOM 0 HH21 ARG A 16 -16.353 -6.229 -14.477 1.00 44.33 H new ATOM 0 HH22 ARG A 16 -15.187 -5.530 -15.605 1.00 44.33 H new ATOM 266 N GLU A 17 -15.713 -7.841 -7.503 1.00 21.21 N ATOM 267 CA GLU A 17 -16.887 -8.419 -6.861 1.00 44.55 C ATOM 268 C GLU A 17 -17.239 -7.682 -5.562 1.00 2.42 C ATOM 269 O GLU A 17 -18.412 -7.673 -5.188 1.00 70.34 O ATOM 270 CB GLU A 17 -16.628 -9.914 -6.599 1.00 45.54 C ATOM 271 CG GLU A 17 -17.002 -10.794 -7.804 1.00 25.32 C ATOM 272 CD GLU A 17 -18.094 -11.801 -7.449 1.00 70.35 C ATOM 273 OE1 GLU A 17 -19.293 -11.471 -7.609 1.00 73.43 O ATOM 274 OE2 GLU A 17 -17.738 -12.927 -7.030 1.00 73.44 O ATOM 0 H GLU A 17 -14.925 -8.485 -7.569 1.00 21.21 H new ATOM 0 HA GLU A 17 -17.745 -8.311 -7.525 1.00 44.55 H new ATOM 0 HB2 GLU A 17 -15.575 -10.061 -6.358 1.00 45.54 H new ATOM 0 HB3 GLU A 17 -17.201 -10.232 -5.728 1.00 45.54 H new ATOM 0 HG2 GLU A 17 -17.342 -10.162 -8.625 1.00 25.32 H new ATOM 0 HG3 GLU A 17 -16.117 -11.325 -8.156 1.00 25.32 H new ATOM 281 N SER A 18 -16.277 -7.043 -4.888 1.00 3.24 N ATOM 282 CA SER A 18 -16.513 -6.363 -3.627 1.00 12.32 C ATOM 283 C SER A 18 -16.818 -4.884 -3.859 1.00 54.31 C ATOM 284 O SER A 18 -16.030 -4.165 -4.485 1.00 23.34 O ATOM 285 CB SER A 18 -15.303 -6.523 -2.716 1.00 52.22 C ATOM 286 OG SER A 18 -15.621 -6.079 -1.413 1.00 5.42 O ATOM 0 H SER A 18 -15.311 -6.987 -5.210 1.00 3.24 H new ATOM 0 HA SER A 18 -17.380 -6.815 -3.144 1.00 12.32 H new ATOM 0 HB2 SER A 18 -14.993 -7.568 -2.688 1.00 52.22 H new ATOM 0 HB3 SER A 18 -14.462 -5.952 -3.109 1.00 52.22 H new ATOM 0 HG SER A 18 -14.973 -6.445 -0.775 1.00 5.42 H new ATOM 292 N PRO A 19 -17.946 -4.404 -3.317 1.00 73.45 N ATOM 293 CA PRO A 19 -18.422 -3.058 -3.548 1.00 61.41 C ATOM 294 C PRO A 19 -17.500 -2.030 -2.909 1.00 50.15 C ATOM 295 O PRO A 19 -17.131 -1.064 -3.578 1.00 5.32 O ATOM 296 CB PRO A 19 -19.842 -3.030 -2.967 1.00 70.51 C ATOM 297 CG PRO A 19 -19.841 -4.137 -1.916 1.00 14.02 C ATOM 298 CD PRO A 19 -18.865 -5.145 -2.469 1.00 62.33 C ATOM 0 HA PRO A 19 -18.433 -2.797 -4.606 1.00 61.41 H new ATOM 0 HB2 PRO A 19 -20.072 -2.061 -2.524 1.00 70.51 H new ATOM 0 HB3 PRO A 19 -20.591 -3.214 -3.737 1.00 70.51 H new ATOM 0 HG2 PRO A 19 -19.525 -3.765 -0.941 1.00 14.02 H new ATOM 0 HG3 PRO A 19 -20.834 -4.568 -1.786 1.00 14.02 H new ATOM 0 HD2 PRO A 19 -18.330 -5.649 -1.664 1.00 62.33 H new ATOM 0 HD3 PRO A 19 -19.384 -5.916 -3.039 1.00 62.33 H new ATOM 306 N ASP A 20 -17.136 -2.193 -1.634 1.00 34.53 N ATOM 307 CA ASP A 20 -16.335 -1.174 -0.954 1.00 41.43 C ATOM 308 C ASP A 20 -14.911 -1.209 -1.473 1.00 64.42 C ATOM 309 O ASP A 20 -14.324 -0.160 -1.723 1.00 43.34 O ATOM 310 CB ASP A 20 -16.366 -1.307 0.575 1.00 33.31 C ATOM 311 CG ASP A 20 -17.348 -0.282 1.131 1.00 61.13 C ATOM 312 OD1 ASP A 20 -18.566 -0.438 0.913 1.00 74.41 O ATOM 313 OD2 ASP A 20 -16.920 0.776 1.645 1.00 25.33 O ATOM 0 H ASP A 20 -17.377 -3.003 -1.063 1.00 34.53 H new ATOM 0 HA ASP A 20 -16.782 -0.206 -1.181 1.00 41.43 H new ATOM 0 HB2 ASP A 20 -16.668 -2.314 0.861 1.00 33.31 H new ATOM 0 HB3 ASP A 20 -15.371 -1.142 0.990 1.00 33.31 H new ATOM 318 N MET A 21 -14.362 -2.408 -1.698 1.00 42.01 N ATOM 319 CA MET A 21 -12.987 -2.545 -2.143 1.00 73.34 C ATOM 320 C MET A 21 -12.771 -1.797 -3.444 1.00 14.00 C ATOM 321 O MET A 21 -11.765 -1.094 -3.593 1.00 4.44 O ATOM 322 CB MET A 21 -12.689 -4.036 -2.363 1.00 11.22 C ATOM 323 CG MET A 21 -11.210 -4.363 -2.209 1.00 62.35 C ATOM 324 SD MET A 21 -10.665 -4.365 -0.491 1.00 14.12 S ATOM 325 CE MET A 21 -9.433 -3.047 -0.538 1.00 12.02 C ATOM 0 H MET A 21 -14.856 -3.292 -1.577 1.00 42.01 H new ATOM 0 HA MET A 21 -12.322 -2.128 -1.387 1.00 73.34 H new ATOM 0 HB2 MET A 21 -13.265 -4.627 -1.651 1.00 11.22 H new ATOM 0 HB3 MET A 21 -13.020 -4.326 -3.360 1.00 11.22 H new ATOM 0 HG2 MET A 21 -11.012 -5.341 -2.648 1.00 62.35 H new ATOM 0 HG3 MET A 21 -10.622 -3.636 -2.770 1.00 62.35 H new ATOM 0 HE1 MET A 21 -8.998 -2.920 0.453 1.00 12.02 H new ATOM 0 HE2 MET A 21 -8.648 -3.308 -1.248 1.00 12.02 H new ATOM 0 HE3 MET A 21 -9.908 -2.116 -0.847 1.00 12.02 H new ATOM 335 N MET A 22 -13.712 -1.947 -4.382 1.00 45.03 N ATOM 336 CA MET A 22 -13.537 -1.373 -5.696 1.00 30.31 C ATOM 337 C MET A 22 -14.023 0.077 -5.729 1.00 10.20 C ATOM 338 O MET A 22 -13.453 0.871 -6.478 1.00 64.01 O ATOM 339 CB MET A 22 -14.049 -2.357 -6.757 1.00 33.12 C ATOM 340 CG MET A 22 -15.521 -2.300 -7.157 1.00 3.40 C ATOM 341 SD MET A 22 -15.816 -1.998 -8.922 1.00 70.44 S ATOM 342 CE MET A 22 -14.761 -0.564 -9.293 1.00 72.44 C ATOM 0 H MET A 22 -14.586 -2.455 -4.248 1.00 45.03 H new ATOM 0 HA MET A 22 -12.487 -1.250 -5.963 1.00 30.31 H new ATOM 0 HB2 MET A 22 -13.455 -2.210 -7.659 1.00 33.12 H new ATOM 0 HB3 MET A 22 -13.842 -3.366 -6.400 1.00 33.12 H new ATOM 0 HG2 MET A 22 -15.996 -3.241 -6.879 1.00 3.40 H new ATOM 0 HG3 MET A 22 -16.010 -1.514 -6.581 1.00 3.40 H new ATOM 0 HE1 MET A 22 -15.112 -0.080 -10.204 1.00 72.44 H new ATOM 0 HE2 MET A 22 -14.806 0.144 -8.466 1.00 72.44 H new ATOM 0 HE3 MET A 22 -13.732 -0.896 -9.432 1.00 72.44 H new ATOM 352 N ALA A 23 -14.936 0.480 -4.834 1.00 1.44 N ATOM 353 CA ALA A 23 -15.321 1.880 -4.637 1.00 24.24 C ATOM 354 C ALA A 23 -14.108 2.757 -4.360 1.00 42.13 C ATOM 355 O ALA A 23 -13.990 3.806 -4.991 1.00 2.34 O ATOM 356 CB ALA A 23 -16.325 2.055 -3.492 1.00 74.35 C ATOM 0 H ALA A 23 -15.432 -0.166 -4.221 1.00 1.44 H new ATOM 0 HA ALA A 23 -15.795 2.191 -5.568 1.00 24.24 H new ATOM 0 HB1 ALA A 23 -16.578 3.110 -3.388 1.00 74.35 H new ATOM 0 HB2 ALA A 23 -17.228 1.486 -3.710 1.00 74.35 H new ATOM 0 HB3 ALA A 23 -15.884 1.694 -2.563 1.00 74.35 H new ATOM 362 N ILE A 24 -13.201 2.331 -3.470 1.00 24.34 N ATOM 363 CA ILE A 24 -12.048 3.128 -3.022 1.00 52.02 C ATOM 364 C ILE A 24 -11.295 3.730 -4.219 1.00 43.22 C ATOM 365 O ILE A 24 -10.909 4.900 -4.226 1.00 5.34 O ATOM 366 CB ILE A 24 -11.151 2.252 -2.109 1.00 63.11 C ATOM 367 CG1 ILE A 24 -11.891 1.943 -0.790 1.00 53.31 C ATOM 368 CG2 ILE A 24 -9.799 2.922 -1.790 1.00 52.20 C ATOM 369 CD1 ILE A 24 -11.283 0.807 0.036 1.00 33.50 C ATOM 0 H ILE A 24 -13.247 1.410 -3.034 1.00 24.34 H new ATOM 0 HA ILE A 24 -12.387 3.980 -2.433 1.00 52.02 H new ATOM 0 HB ILE A 24 -10.942 1.331 -2.654 1.00 63.11 H new ATOM 0 HG12 ILE A 24 -11.910 2.846 -0.180 1.00 53.31 H new ATOM 0 HG13 ILE A 24 -12.926 1.692 -1.021 1.00 53.31 H new ATOM 0 HG21 ILE A 24 -9.211 2.266 -1.148 1.00 52.20 H new ATOM 0 HG22 ILE A 24 -9.256 3.105 -2.717 1.00 52.20 H new ATOM 0 HG23 ILE A 24 -9.974 3.869 -1.279 1.00 52.20 H new ATOM 0 HD11 ILE A 24 -11.870 0.663 0.943 1.00 33.50 H new ATOM 0 HD12 ILE A 24 -11.289 -0.112 -0.550 1.00 33.50 H new ATOM 0 HD13 ILE A 24 -10.257 1.060 0.304 1.00 33.50 H new ATOM 381 N LEU A 25 -11.128 2.935 -5.273 1.00 41.21 N ATOM 382 CA LEU A 25 -10.364 3.318 -6.452 1.00 54.50 C ATOM 383 C LEU A 25 -11.147 4.307 -7.304 1.00 71.02 C ATOM 384 O LEU A 25 -10.551 5.234 -7.850 1.00 61.34 O ATOM 385 CB LEU A 25 -9.996 2.100 -7.294 1.00 10.44 C ATOM 386 CG LEU A 25 -8.841 1.263 -6.740 1.00 44.52 C ATOM 387 CD1 LEU A 25 -9.141 0.742 -5.329 1.00 74.03 C ATOM 388 CD2 LEU A 25 -8.641 0.112 -7.723 1.00 5.30 C ATOM 0 H LEU A 25 -11.525 1.997 -5.331 1.00 41.21 H new ATOM 0 HA LEU A 25 -9.446 3.792 -6.105 1.00 54.50 H new ATOM 0 HB2 LEU A 25 -10.875 1.463 -7.389 1.00 10.44 H new ATOM 0 HB3 LEU A 25 -9.735 2.435 -8.298 1.00 10.44 H new ATOM 0 HG LEU A 25 -7.938 1.866 -6.645 1.00 44.52 H new ATOM 0 HD11 LEU A 25 -8.297 0.153 -4.972 1.00 74.03 H new ATOM 0 HD12 LEU A 25 -9.306 1.585 -4.657 1.00 74.03 H new ATOM 0 HD13 LEU A 25 -10.034 0.118 -5.354 1.00 74.03 H new ATOM 0 HD21 LEU A 25 -7.825 -0.523 -7.378 1.00 5.30 H new ATOM 0 HD22 LEU A 25 -9.557 -0.476 -7.786 1.00 5.30 H new ATOM 0 HD23 LEU A 25 -8.398 0.512 -8.707 1.00 5.30 H new ATOM 400 N THR A 26 -12.466 4.126 -7.419 1.00 30.14 N ATOM 401 CA THR A 26 -13.342 5.052 -8.121 1.00 24.01 C ATOM 402 C THR A 26 -13.279 6.416 -7.437 1.00 42.23 C ATOM 403 O THR A 26 -13.321 7.450 -8.101 1.00 24.14 O ATOM 404 CB THR A 26 -14.802 4.546 -8.105 1.00 1.24 C ATOM 405 OG1 THR A 26 -14.928 3.163 -8.386 1.00 21.11 O ATOM 406 CG2 THR A 26 -15.646 5.285 -9.133 1.00 11.31 C ATOM 0 H THR A 26 -12.954 3.323 -7.022 1.00 30.14 H new ATOM 0 HA THR A 26 -13.010 5.130 -9.156 1.00 24.01 H new ATOM 0 HB THR A 26 -15.148 4.733 -7.089 1.00 1.24 H new ATOM 0 HG1 THR A 26 -15.874 2.908 -8.358 1.00 21.11 H new ATOM 0 HG21 THR A 26 -16.669 4.910 -9.101 1.00 11.31 H new ATOM 0 HG22 THR A 26 -15.643 6.351 -8.907 1.00 11.31 H new ATOM 0 HG23 THR A 26 -15.231 5.124 -10.128 1.00 11.31 H new ATOM 414 N ILE A 27 -13.170 6.419 -6.111 1.00 25.04 N ATOM 415 CA ILE A 27 -13.076 7.632 -5.335 1.00 52.34 C ATOM 416 C ILE A 27 -11.730 8.285 -5.676 1.00 45.31 C ATOM 417 O ILE A 27 -11.745 9.350 -6.282 1.00 4.34 O ATOM 418 CB ILE A 27 -13.345 7.309 -3.843 1.00 4.11 C ATOM 419 CG1 ILE A 27 -14.799 6.817 -3.637 1.00 24.22 C ATOM 420 CG2 ILE A 27 -13.089 8.507 -2.915 1.00 62.53 C ATOM 421 CD1 ILE A 27 -14.925 5.873 -2.433 1.00 54.31 C ATOM 0 H ILE A 27 -13.145 5.568 -5.549 1.00 25.04 H new ATOM 0 HA ILE A 27 -13.837 8.375 -5.576 1.00 52.34 H new ATOM 0 HB ILE A 27 -12.641 6.521 -3.578 1.00 4.11 H new ATOM 0 HG12 ILE A 27 -15.455 7.676 -3.494 1.00 24.22 H new ATOM 0 HG13 ILE A 27 -15.138 6.303 -4.537 1.00 24.22 H new ATOM 0 HG21 ILE A 27 -13.295 8.219 -1.884 1.00 62.53 H new ATOM 0 HG22 ILE A 27 -12.049 8.820 -3.004 1.00 62.53 H new ATOM 0 HG23 ILE A 27 -13.742 9.333 -3.198 1.00 62.53 H new ATOM 0 HD11 ILE A 27 -15.962 5.554 -2.328 1.00 54.31 H new ATOM 0 HD12 ILE A 27 -14.291 5.000 -2.587 1.00 54.31 H new ATOM 0 HD13 ILE A 27 -14.612 6.394 -1.528 1.00 54.31 H new ATOM 433 N ILE A 28 -10.563 7.689 -5.375 1.00 45.51 N ATOM 434 CA ILE A 28 -9.265 8.371 -5.580 1.00 10.33 C ATOM 435 C ILE A 28 -9.042 8.763 -7.046 1.00 65.33 C ATOM 436 O ILE A 28 -8.451 9.805 -7.320 1.00 32.43 O ATOM 437 CB ILE A 28 -8.099 7.498 -5.062 1.00 44.54 C ATOM 438 CG1 ILE A 28 -6.843 8.320 -4.693 1.00 10.55 C ATOM 439 CG2 ILE A 28 -7.742 6.313 -5.971 1.00 22.11 C ATOM 440 CD1 ILE A 28 -5.807 8.504 -5.801 1.00 34.45 C ATOM 0 H ILE A 28 -10.487 6.746 -4.993 1.00 45.51 H new ATOM 0 HA ILE A 28 -9.292 9.294 -5.001 1.00 10.33 H new ATOM 0 HB ILE A 28 -8.488 7.064 -4.141 1.00 44.54 H new ATOM 0 HG12 ILE A 28 -7.165 9.306 -4.358 1.00 10.55 H new ATOM 0 HG13 ILE A 28 -6.356 7.839 -3.845 1.00 10.55 H new ATOM 0 HG21 ILE A 28 -6.915 5.755 -5.533 1.00 22.11 H new ATOM 0 HG22 ILE A 28 -8.608 5.659 -6.073 1.00 22.11 H new ATOM 0 HG23 ILE A 28 -7.450 6.683 -6.954 1.00 22.11 H new ATOM 0 HD11 ILE A 28 -4.973 9.096 -5.424 1.00 34.45 H new ATOM 0 HD12 ILE A 28 -5.443 7.529 -6.124 1.00 34.45 H new ATOM 0 HD13 ILE A 28 -6.265 9.019 -6.646 1.00 34.45 H new ATOM 452 N ARG A 29 -9.508 7.969 -8.018 1.00 54.11 N ATOM 453 CA ARG A 29 -9.341 8.371 -9.422 1.00 53.33 C ATOM 454 C ARG A 29 -10.016 9.712 -9.699 1.00 71.40 C ATOM 455 O ARG A 29 -9.555 10.471 -10.543 1.00 32.31 O ATOM 456 CB ARG A 29 -9.811 7.298 -10.416 1.00 72.14 C ATOM 457 CG ARG A 29 -11.321 7.127 -10.565 1.00 33.41 C ATOM 458 CD ARG A 29 -11.652 6.215 -11.749 1.00 44.22 C ATOM 459 NE ARG A 29 -12.035 7.006 -12.931 1.00 3.13 N ATOM 460 CZ ARG A 29 -11.361 7.213 -14.073 1.00 5.32 C ATOM 461 NH1 ARG A 29 -10.104 6.805 -14.225 1.00 4.33 N ATOM 462 NH2 ARG A 29 -11.971 7.844 -15.072 1.00 30.14 N ATOM 0 H ARG A 29 -9.985 7.080 -7.870 1.00 54.11 H new ATOM 0 HA ARG A 29 -8.269 8.487 -9.580 1.00 53.33 H new ATOM 0 HB2 ARG A 29 -9.395 7.534 -11.396 1.00 72.14 H new ATOM 0 HB3 ARG A 29 -9.387 6.341 -10.112 1.00 72.14 H new ATOM 0 HG2 ARG A 29 -11.736 6.706 -9.649 1.00 33.41 H new ATOM 0 HG3 ARG A 29 -11.789 8.101 -10.709 1.00 33.41 H new ATOM 0 HD2 ARG A 29 -10.789 5.593 -11.987 1.00 44.22 H new ATOM 0 HD3 ARG A 29 -12.465 5.541 -11.478 1.00 44.22 H new ATOM 0 HE ARG A 29 -12.945 7.463 -12.873 1.00 3.13 H new ATOM 0 HH11 ARG A 29 -9.629 6.322 -13.463 1.00 4.33 H new ATOM 0 HH12 ARG A 29 -9.615 6.975 -15.104 1.00 4.33 H new ATOM 0 HH21 ARG A 29 -12.934 8.161 -14.962 1.00 30.14 H new ATOM 0 HH22 ARG A 29 -11.476 8.011 -15.948 1.00 30.14 H new ATOM 476 N ASP A 30 -11.094 9.989 -8.975 1.00 24.22 N ATOM 477 CA ASP A 30 -11.903 11.198 -9.077 1.00 53.51 C ATOM 478 C ASP A 30 -11.559 12.210 -7.968 1.00 61.24 C ATOM 479 O ASP A 30 -12.120 13.301 -7.902 1.00 32.02 O ATOM 480 CB ASP A 30 -13.381 10.800 -9.031 1.00 73.34 C ATOM 481 CG ASP A 30 -14.261 11.768 -9.828 1.00 31.04 C ATOM 482 OD1 ASP A 30 -14.302 11.691 -11.074 1.00 25.11 O ATOM 483 OD2 ASP A 30 -14.891 12.655 -9.208 1.00 70.10 O ATOM 0 H ASP A 30 -11.445 9.345 -8.266 1.00 24.22 H new ATOM 0 HA ASP A 30 -11.687 11.696 -10.022 1.00 53.51 H new ATOM 0 HB2 ASP A 30 -13.498 9.792 -9.429 1.00 73.34 H new ATOM 0 HB3 ASP A 30 -13.717 10.774 -7.995 1.00 73.34 H new ATOM 488 N LEU A 31 -10.627 11.878 -7.068 1.00 62.34 N ATOM 489 CA LEU A 31 -10.154 12.762 -5.992 1.00 14.15 C ATOM 490 C LEU A 31 -9.612 14.076 -6.534 1.00 54.24 C ATOM 491 O LEU A 31 -9.758 15.109 -5.878 1.00 4.33 O ATOM 492 CB LEU A 31 -9.138 12.061 -5.066 1.00 5.55 C ATOM 493 CG LEU A 31 -9.688 11.699 -3.684 1.00 31.05 C ATOM 494 CD1 LEU A 31 -11.077 11.096 -3.623 1.00 23.22 C ATOM 495 CD2 LEU A 31 -8.776 10.832 -2.813 1.00 53.23 C ATOM 0 H LEU A 31 -10.169 10.967 -7.066 1.00 62.34 H new ATOM 0 HA LEU A 31 -11.023 13.002 -5.380 1.00 14.15 H new ATOM 0 HB2 LEU A 31 -8.787 11.152 -5.554 1.00 5.55 H new ATOM 0 HB3 LEU A 31 -8.271 12.710 -4.940 1.00 5.55 H new ATOM 0 HG LEU A 31 -9.742 12.709 -3.277 1.00 31.05 H new ATOM 0 HD11 LEU A 31 -11.339 10.889 -2.585 1.00 23.22 H new ATOM 0 HD12 LEU A 31 -11.797 11.797 -4.046 1.00 23.22 H new ATOM 0 HD13 LEU A 31 -11.096 10.168 -4.194 1.00 23.22 H new ATOM 0 HD21 LEU A 31 -9.264 10.636 -1.858 1.00 53.23 H new ATOM 0 HD22 LEU A 31 -8.579 9.887 -3.320 1.00 53.23 H new ATOM 0 HD23 LEU A 31 -7.835 11.354 -2.640 1.00 53.23 H new ATOM 507 N GLY A 32 -9.029 14.045 -7.728 1.00 71.43 N ATOM 508 CA GLY A 32 -8.375 15.198 -8.334 1.00 11.11 C ATOM 509 C GLY A 32 -7.080 15.504 -7.589 1.00 23.43 C ATOM 510 O GLY A 32 -6.744 16.661 -7.346 1.00 41.50 O ATOM 0 H GLY A 32 -8.997 13.207 -8.309 1.00 71.43 H new ATOM 0 HA2 GLY A 32 -8.163 14.998 -9.384 1.00 11.11 H new ATOM 0 HA3 GLY A 32 -9.038 16.063 -8.302 1.00 11.11 H new ATOM 514 N LEU A 33 -6.402 14.453 -7.126 1.00 45.10 N ATOM 515 CA LEU A 33 -4.983 14.487 -6.804 1.00 53.12 C ATOM 516 C LEU A 33 -4.228 14.200 -8.097 1.00 1.53 C ATOM 517 O LEU A 33 -4.714 13.435 -8.935 1.00 30.01 O ATOM 518 CB LEU A 33 -4.657 13.368 -5.811 1.00 2.43 C ATOM 519 CG LEU A 33 -5.391 13.478 -4.472 1.00 42.14 C ATOM 520 CD1 LEU A 33 -5.301 12.138 -3.753 1.00 24.21 C ATOM 521 CD2 LEU A 33 -4.870 14.608 -3.594 1.00 45.13 C ATOM 0 H LEU A 33 -6.833 13.543 -6.963 1.00 45.10 H new ATOM 0 HA LEU A 33 -4.710 15.451 -6.374 1.00 53.12 H new ATOM 0 HB2 LEU A 33 -4.903 12.410 -6.269 1.00 2.43 H new ATOM 0 HB3 LEU A 33 -3.583 13.366 -5.624 1.00 2.43 H new ATOM 0 HG LEU A 33 -6.432 13.726 -4.678 1.00 42.14 H new ATOM 0 HD11 LEU A 33 -5.820 12.203 -2.797 1.00 24.21 H new ATOM 0 HD12 LEU A 33 -5.764 11.364 -4.366 1.00 24.21 H new ATOM 0 HD13 LEU A 33 -4.254 11.887 -3.581 1.00 24.21 H new ATOM 0 HD21 LEU A 33 -5.432 14.632 -2.660 1.00 45.13 H new ATOM 0 HD22 LEU A 33 -3.814 14.444 -3.378 1.00 45.13 H new ATOM 0 HD23 LEU A 33 -4.990 15.558 -4.114 1.00 45.13 H new ATOM 533 N LYS A 34 -3.018 14.740 -8.233 1.00 4.23 N ATOM 534 CA LYS A 34 -2.161 14.383 -9.361 1.00 44.54 C ATOM 535 C LYS A 34 -1.299 13.196 -8.963 1.00 1.44 C ATOM 536 O LYS A 34 -0.895 13.071 -7.806 1.00 65.14 O ATOM 537 CB LYS A 34 -1.285 15.561 -9.819 1.00 1.14 C ATOM 538 CG LYS A 34 -2.112 16.824 -10.131 1.00 30.45 C ATOM 539 CD LYS A 34 -1.791 17.940 -9.135 1.00 30.03 C ATOM 540 CE LYS A 34 -2.875 19.015 -9.097 1.00 51.50 C ATOM 541 NZ LYS A 34 -2.415 20.181 -8.322 1.00 22.04 N ATOM 0 H LYS A 34 -2.614 15.417 -7.586 1.00 4.23 H new ATOM 0 HA LYS A 34 -2.794 14.119 -10.208 1.00 44.54 H new ATOM 0 HB2 LYS A 34 -0.555 15.791 -9.042 1.00 1.14 H new ATOM 0 HB3 LYS A 34 -0.724 15.269 -10.707 1.00 1.14 H new ATOM 0 HG2 LYS A 34 -1.900 17.163 -11.145 1.00 30.45 H new ATOM 0 HG3 LYS A 34 -3.175 16.588 -10.090 1.00 30.45 H new ATOM 0 HD2 LYS A 34 -1.672 17.512 -8.140 1.00 30.03 H new ATOM 0 HD3 LYS A 34 -0.838 18.398 -9.401 1.00 30.03 H new ATOM 0 HE2 LYS A 34 -3.128 19.322 -10.112 1.00 51.50 H new ATOM 0 HE3 LYS A 34 -3.783 18.609 -8.651 1.00 51.50 H new ATOM 0 HZ1 LYS A 34 -3.233 20.767 -8.059 1.00 22.04 H new ATOM 0 HZ2 LYS A 34 -1.930 19.856 -7.461 1.00 22.04 H new ATOM 0 HZ3 LYS A 34 -1.757 20.743 -8.898 1.00 22.04 H new ATOM 555 N ASP A 35 -0.926 12.383 -9.948 1.00 54.21 N ATOM 556 CA ASP A 35 0.172 11.416 -9.879 1.00 70.32 C ATOM 557 C ASP A 35 0.006 10.469 -8.686 1.00 33.25 C ATOM 558 O ASP A 35 0.951 10.183 -7.952 1.00 4.13 O ATOM 559 CB ASP A 35 1.532 12.149 -9.885 1.00 70.23 C ATOM 560 CG ASP A 35 1.868 12.844 -11.206 1.00 23.33 C ATOM 561 OD1 ASP A 35 0.968 13.013 -12.064 1.00 51.50 O ATOM 562 OD2 ASP A 35 3.037 13.258 -11.378 1.00 50.51 O ATOM 0 H ASP A 35 -1.397 12.378 -10.853 1.00 54.21 H new ATOM 0 HA ASP A 35 0.145 10.785 -10.768 1.00 70.32 H new ATOM 0 HB2 ASP A 35 1.535 12.891 -9.087 1.00 70.23 H new ATOM 0 HB3 ASP A 35 2.319 11.431 -9.655 1.00 70.23 H new ATOM 567 N SER A 36 -1.205 9.950 -8.473 1.00 53.41 N ATOM 568 CA SER A 36 -1.618 9.311 -7.227 1.00 42.20 C ATOM 569 C SER A 36 -2.290 7.966 -7.497 1.00 54.23 C ATOM 570 O SER A 36 -3.109 7.875 -8.414 1.00 1.34 O ATOM 571 CB SER A 36 -2.575 10.286 -6.542 1.00 11.54 C ATOM 572 OG SER A 36 -3.648 10.614 -7.408 1.00 22.01 O ATOM 0 H SER A 36 -1.941 9.964 -9.180 1.00 53.41 H new ATOM 0 HA SER A 36 -0.760 9.097 -6.589 1.00 42.20 H new ATOM 0 HB2 SER A 36 -2.962 9.842 -5.625 1.00 11.54 H new ATOM 0 HB3 SER A 36 -2.039 11.191 -6.257 1.00 11.54 H new ATOM 0 HG SER A 36 -3.848 9.848 -7.986 1.00 22.01 H new ATOM 578 N TRP A 37 -1.975 6.925 -6.725 1.00 54.23 N ATOM 579 CA TRP A 37 -2.659 5.638 -6.787 1.00 42.30 C ATOM 580 C TRP A 37 -2.394 4.820 -5.519 1.00 5.22 C ATOM 581 O TRP A 37 -1.541 5.200 -4.713 1.00 1.54 O ATOM 582 CB TRP A 37 -2.225 4.877 -8.040 1.00 31.02 C ATOM 583 CG TRP A 37 -0.828 4.351 -8.116 1.00 23.23 C ATOM 584 CD1 TRP A 37 0.309 4.962 -7.714 1.00 63.24 C ATOM 585 CD2 TRP A 37 -0.423 3.056 -8.633 1.00 11.51 C ATOM 586 NE1 TRP A 37 1.384 4.129 -7.956 1.00 65.23 N ATOM 587 CE2 TRP A 37 0.991 2.938 -8.531 1.00 45.42 C ATOM 588 CE3 TRP A 37 -1.128 1.967 -9.177 1.00 45.22 C ATOM 589 CZ2 TRP A 37 1.674 1.785 -8.954 1.00 3.13 C ATOM 590 CZ3 TRP A 37 -0.474 0.800 -9.577 1.00 4.52 C ATOM 591 CH2 TRP A 37 0.915 0.714 -9.462 1.00 42.12 C ATOM 0 H TRP A 37 -1.228 6.955 -6.031 1.00 54.23 H new ATOM 0 HA TRP A 37 -3.734 5.811 -6.846 1.00 42.30 H new ATOM 0 HB2 TRP A 37 -2.903 4.032 -8.164 1.00 31.02 H new ATOM 0 HB3 TRP A 37 -2.376 5.536 -8.895 1.00 31.02 H new ATOM 0 HD1 TRP A 37 0.368 5.946 -7.273 1.00 63.24 H new ATOM 0 HE1 TRP A 37 2.351 4.366 -7.736 1.00 65.23 H new ATOM 0 HE3 TRP A 37 -2.200 2.035 -9.288 1.00 45.22 H new ATOM 0 HZ2 TRP A 37 2.750 1.722 -8.891 1.00 3.13 H new ATOM 0 HZ3 TRP A 37 -1.039 -0.031 -9.973 1.00 4.52 H new ATOM 0 HH2 TRP A 37 1.417 -0.192 -9.769 1.00 42.12 H new ATOM 602 N LEU A 38 -3.123 3.716 -5.304 1.00 63.20 N ATOM 603 CA LEU A 38 -2.998 2.904 -4.091 1.00 5.55 C ATOM 604 C LEU A 38 -1.673 2.151 -4.102 1.00 22.24 C ATOM 605 O LEU A 38 -1.199 1.728 -5.157 1.00 61.13 O ATOM 606 CB LEU A 38 -4.179 1.929 -3.954 1.00 52.44 C ATOM 607 CG LEU A 38 -4.525 1.577 -2.493 1.00 44.41 C ATOM 608 CD1 LEU A 38 -5.202 2.704 -1.720 1.00 52.30 C ATOM 609 CD2 LEU A 38 -5.540 0.447 -2.466 1.00 4.21 C ATOM 0 H LEU A 38 -3.814 3.363 -5.966 1.00 63.20 H new ATOM 0 HA LEU A 38 -3.016 3.569 -3.227 1.00 5.55 H new ATOM 0 HB2 LEU A 38 -5.056 2.366 -4.431 1.00 52.44 H new ATOM 0 HB3 LEU A 38 -3.946 1.011 -4.494 1.00 52.44 H new ATOM 0 HG LEU A 38 -3.565 1.336 -2.036 1.00 44.41 H new ATOM 0 HD11 LEU A 38 -5.411 2.373 -0.703 1.00 52.30 H new ATOM 0 HD12 LEU A 38 -4.544 3.572 -1.691 1.00 52.30 H new ATOM 0 HD13 LEU A 38 -6.136 2.973 -2.213 1.00 52.30 H new ATOM 0 HD21 LEU A 38 -5.783 0.200 -1.432 1.00 4.21 H new ATOM 0 HD22 LEU A 38 -6.445 0.759 -2.987 1.00 4.21 H new ATOM 0 HD23 LEU A 38 -5.121 -0.430 -2.960 1.00 4.21 H new ATOM 621 N ALA A 39 -1.087 1.975 -2.920 1.00 64.01 N ATOM 622 CA ALA A 39 0.174 1.289 -2.705 1.00 24.01 C ATOM 623 C ALA A 39 0.187 0.701 -1.309 1.00 31.44 C ATOM 624 O ALA A 39 -0.755 0.882 -0.535 1.00 22.35 O ATOM 625 CB ALA A 39 1.338 2.264 -2.923 1.00 64.02 C ATOM 0 H ALA A 39 -1.499 2.323 -2.054 1.00 64.01 H new ATOM 0 HA ALA A 39 0.289 0.474 -3.420 1.00 24.01 H new ATOM 0 HB1 ALA A 39 2.283 1.745 -2.761 1.00 64.02 H new ATOM 0 HB2 ALA A 39 1.305 2.647 -3.943 1.00 64.02 H new ATOM 0 HB3 ALA A 39 1.254 3.093 -2.221 1.00 64.02 H new ATOM 631 N ALA A 40 1.282 0.016 -1.008 1.00 23.12 N ATOM 632 CA ALA A 40 1.583 -0.526 0.297 1.00 62.12 C ATOM 633 C ALA A 40 0.497 -1.464 0.811 1.00 52.31 C ATOM 634 O ALA A 40 -0.199 -2.103 0.017 1.00 32.24 O ATOM 635 CB ALA A 40 1.942 0.582 1.286 1.00 5.11 C ATOM 0 H ALA A 40 2.008 -0.181 -1.697 1.00 23.12 H new ATOM 0 HA ALA A 40 2.469 -1.152 0.192 1.00 62.12 H new ATOM 0 HB1 ALA A 40 2.163 0.143 2.259 1.00 5.11 H new ATOM 0 HB2 ALA A 40 2.816 1.123 0.924 1.00 5.11 H new ATOM 0 HB3 ALA A 40 1.103 1.271 1.381 1.00 5.11 H new ATOM 641 N GLY A 41 0.396 -1.602 2.132 1.00 21.40 N ATOM 642 CA GLY A 41 -0.495 -2.515 2.820 1.00 25.33 C ATOM 643 C GLY A 41 -1.935 -2.447 2.320 1.00 71.31 C ATOM 644 O GLY A 41 -2.621 -3.466 2.381 1.00 24.21 O ATOM 0 H GLY A 41 0.963 -1.051 2.776 1.00 21.40 H new ATOM 0 HA2 GLY A 41 -0.124 -3.533 2.700 1.00 25.33 H new ATOM 0 HA3 GLY A 41 -0.478 -2.293 3.887 1.00 25.33 H new ATOM 648 N SER A 42 -2.369 -1.309 1.786 1.00 50.32 N ATOM 649 CA SER A 42 -3.688 -1.062 1.220 1.00 21.53 C ATOM 650 C SER A 42 -3.960 -1.806 -0.093 1.00 34.20 C ATOM 651 O SER A 42 -5.106 -1.865 -0.538 1.00 4.40 O ATOM 652 CB SER A 42 -3.798 0.444 1.015 1.00 22.52 C ATOM 653 OG SER A 42 -3.446 1.120 2.217 1.00 22.31 O ATOM 0 H SER A 42 -1.770 -0.485 1.735 1.00 50.32 H new ATOM 0 HA SER A 42 -4.440 -1.444 1.910 1.00 21.53 H new ATOM 0 HB2 SER A 42 -3.141 0.759 0.204 1.00 22.52 H new ATOM 0 HB3 SER A 42 -4.815 0.707 0.723 1.00 22.52 H new ATOM 0 HG SER A 42 -4.132 0.957 2.897 1.00 22.31 H new ATOM 659 N VAL A 43 -2.944 -2.396 -0.714 1.00 30.51 N ATOM 660 CA VAL A 43 -3.083 -3.300 -1.854 1.00 41.44 C ATOM 661 C VAL A 43 -2.946 -4.744 -1.351 1.00 70.21 C ATOM 662 O VAL A 43 -3.531 -5.647 -1.924 1.00 71.23 O ATOM 663 CB VAL A 43 -2.027 -2.934 -2.907 1.00 30.34 C ATOM 664 CG1 VAL A 43 -2.112 -3.890 -4.110 1.00 33.24 C ATOM 665 CG2 VAL A 43 -2.278 -1.483 -3.348 1.00 74.35 C ATOM 0 H VAL A 43 -1.974 -2.256 -0.432 1.00 30.51 H new ATOM 0 HA VAL A 43 -4.061 -3.206 -2.327 1.00 41.44 H new ATOM 0 HB VAL A 43 -1.027 -3.027 -2.484 1.00 30.34 H new ATOM 0 HG11 VAL A 43 -1.357 -3.616 -4.847 1.00 33.24 H new ATOM 0 HG12 VAL A 43 -1.938 -4.913 -3.775 1.00 33.24 H new ATOM 0 HG13 VAL A 43 -3.101 -3.819 -4.562 1.00 33.24 H new ATOM 0 HG21 VAL A 43 -1.540 -1.198 -4.097 1.00 74.35 H new ATOM 0 HG22 VAL A 43 -3.278 -1.400 -3.774 1.00 74.35 H new ATOM 0 HG23 VAL A 43 -2.195 -0.821 -2.486 1.00 74.35 H new ATOM 675 N ARG A 44 -2.187 -5.006 -0.286 1.00 64.52 N ATOM 676 CA ARG A 44 -1.944 -6.365 0.207 1.00 65.35 C ATOM 677 C ARG A 44 -3.048 -6.860 1.130 1.00 3.11 C ATOM 678 O ARG A 44 -3.249 -8.067 1.229 1.00 74.34 O ATOM 679 CB ARG A 44 -0.580 -6.354 0.900 1.00 3.34 C ATOM 680 CG ARG A 44 -0.218 -7.505 1.842 1.00 24.50 C ATOM 681 CD ARG A 44 0.998 -7.046 2.658 1.00 64.21 C ATOM 682 NE ARG A 44 0.584 -6.180 3.779 1.00 1.21 N ATOM 683 CZ ARG A 44 1.300 -5.910 4.872 1.00 1.02 C ATOM 684 NH1 ARG A 44 2.585 -6.229 4.950 1.00 50.02 N ATOM 685 NH2 ARG A 44 0.692 -5.338 5.901 1.00 23.24 N ATOM 0 H ARG A 44 -1.722 -4.281 0.261 1.00 64.52 H new ATOM 0 HA ARG A 44 -1.944 -7.067 -0.627 1.00 65.35 H new ATOM 0 HB2 ARG A 44 0.184 -6.312 0.123 1.00 3.34 H new ATOM 0 HB3 ARG A 44 -0.507 -5.427 1.469 1.00 3.34 H new ATOM 0 HG2 ARG A 44 -1.055 -7.745 2.498 1.00 24.50 H new ATOM 0 HG3 ARG A 44 0.014 -8.408 1.277 1.00 24.50 H new ATOM 0 HD2 ARG A 44 1.532 -7.915 3.043 1.00 64.21 H new ATOM 0 HD3 ARG A 44 1.691 -6.506 2.013 1.00 64.21 H new ATOM 0 HE ARG A 44 -0.337 -5.747 3.712 1.00 1.21 H new ATOM 0 HH11 ARG A 44 3.045 -6.690 4.165 1.00 50.02 H new ATOM 0 HH12 ARG A 44 3.114 -6.013 5.795 1.00 50.02 H new ATOM 0 HH21 ARG A 44 -0.302 -5.114 5.846 1.00 23.24 H new ATOM 0 HH22 ARG A 44 1.218 -5.122 6.748 1.00 23.24 H new ATOM 699 N ASN A 45 -3.735 -5.976 1.850 1.00 53.44 N ATOM 700 CA ASN A 45 -4.720 -6.366 2.853 1.00 31.42 C ATOM 701 C ASN A 45 -5.833 -7.177 2.188 1.00 21.11 C ATOM 702 O ASN A 45 -6.149 -8.272 2.656 1.00 43.34 O ATOM 703 CB ASN A 45 -5.245 -5.128 3.583 1.00 5.33 C ATOM 704 CG ASN A 45 -6.148 -5.517 4.730 1.00 73.21 C ATOM 705 OD1 ASN A 45 -5.677 -5.625 5.858 1.00 1.43 O ATOM 706 ND2 ASN A 45 -7.428 -5.699 4.465 1.00 70.52 N ATOM 0 H ASN A 45 -3.623 -4.967 1.753 1.00 53.44 H new ATOM 0 HA ASN A 45 -4.258 -7.004 3.607 1.00 31.42 H new ATOM 0 HB2 ASN A 45 -4.407 -4.540 3.958 1.00 5.33 H new ATOM 0 HB3 ASN A 45 -5.791 -4.494 2.884 1.00 5.33 H new ATOM 0 HD21 ASN A 45 -8.075 -5.941 5.216 1.00 70.52 H new ATOM 0 HD22 ASN A 45 -7.770 -5.597 3.510 1.00 70.52 H new ATOM 713 N PHE A 46 -6.353 -6.718 1.046 1.00 70.32 N ATOM 714 CA PHE A 46 -7.362 -7.430 0.269 1.00 21.40 C ATOM 715 C PHE A 46 -6.804 -8.645 -0.462 1.00 32.42 C ATOM 716 O PHE A 46 -7.599 -9.390 -1.013 1.00 70.34 O ATOM 717 CB PHE A 46 -8.099 -6.515 -0.709 1.00 74.31 C ATOM 718 CG PHE A 46 -7.553 -6.496 -2.138 1.00 33.21 C ATOM 719 CD1 PHE A 46 -6.489 -5.646 -2.459 1.00 23.20 C ATOM 720 CD2 PHE A 46 -8.040 -7.385 -3.131 1.00 1.41 C ATOM 721 CE1 PHE A 46 -5.919 -5.675 -3.738 1.00 11.20 C ATOM 722 CE2 PHE A 46 -7.464 -7.425 -4.418 1.00 63.34 C ATOM 723 CZ PHE A 46 -6.391 -6.562 -4.715 1.00 21.20 C ATOM 0 H PHE A 46 -6.078 -5.827 0.632 1.00 70.32 H new ATOM 0 HA PHE A 46 -8.082 -7.792 1.003 1.00 21.40 H new ATOM 0 HB2 PHE A 46 -9.146 -6.818 -0.743 1.00 74.31 H new ATOM 0 HB3 PHE A 46 -8.074 -5.498 -0.316 1.00 74.31 H new ATOM 0 HD1 PHE A 46 -6.105 -4.963 -1.716 1.00 23.20 H new ATOM 0 HD2 PHE A 46 -8.865 -8.042 -2.898 1.00 1.41 H new ATOM 0 HE1 PHE A 46 -5.105 -5.005 -3.974 1.00 11.20 H new ATOM 0 HE2 PHE A 46 -7.840 -8.108 -5.165 1.00 63.34 H new ATOM 0 HZ PHE A 46 -5.933 -6.584 -5.693 1.00 21.20 H new ATOM 733 N ILE A 47 -5.515 -8.974 -0.349 1.00 41.21 N ATOM 734 CA ILE A 47 -4.930 -10.182 -0.932 1.00 50.24 C ATOM 735 C ILE A 47 -4.536 -11.225 0.122 1.00 73.25 C ATOM 736 O ILE A 47 -4.665 -12.408 -0.150 1.00 71.21 O ATOM 737 CB ILE A 47 -3.683 -9.733 -1.729 1.00 25.03 C ATOM 738 CG1 ILE A 47 -4.057 -8.681 -2.794 1.00 42.23 C ATOM 739 CG2 ILE A 47 -2.934 -10.942 -2.306 1.00 11.40 C ATOM 740 CD1 ILE A 47 -2.883 -8.187 -3.632 1.00 25.02 C ATOM 0 H ILE A 47 -4.840 -8.401 0.157 1.00 41.21 H new ATOM 0 HA ILE A 47 -5.670 -10.668 -1.568 1.00 50.24 H new ATOM 0 HB ILE A 47 -2.989 -9.242 -1.047 1.00 25.03 H new ATOM 0 HG12 ILE A 47 -4.809 -9.107 -3.459 1.00 42.23 H new ATOM 0 HG13 ILE A 47 -4.518 -7.827 -2.297 1.00 42.23 H new ATOM 0 HG21 ILE A 47 -2.062 -10.598 -2.862 1.00 11.40 H new ATOM 0 HG22 ILE A 47 -2.613 -11.593 -1.493 1.00 11.40 H new ATOM 0 HG23 ILE A 47 -3.595 -11.495 -2.974 1.00 11.40 H new ATOM 0 HD11 ILE A 47 -3.236 -7.451 -4.354 1.00 25.02 H new ATOM 0 HD12 ILE A 47 -2.139 -7.729 -2.981 1.00 25.02 H new ATOM 0 HD13 ILE A 47 -2.434 -9.028 -4.161 1.00 25.02 H new ATOM 752 N TRP A 48 -4.018 -10.844 1.289 1.00 41.12 N ATOM 753 CA TRP A 48 -3.559 -11.801 2.296 1.00 42.23 C ATOM 754 C TRP A 48 -4.724 -12.464 3.033 1.00 62.23 C ATOM 755 O TRP A 48 -4.792 -13.689 3.138 1.00 45.21 O ATOM 756 CB TRP A 48 -2.608 -11.084 3.267 1.00 73.44 C ATOM 757 CG TRP A 48 -1.137 -11.150 2.970 1.00 73.31 C ATOM 758 CD1 TRP A 48 -0.524 -11.881 2.014 1.00 31.32 C ATOM 759 CD2 TRP A 48 -0.058 -10.511 3.702 1.00 73.25 C ATOM 760 NE1 TRP A 48 0.844 -11.750 2.119 1.00 64.53 N ATOM 761 CE2 TRP A 48 1.195 -10.935 3.173 1.00 62.54 C ATOM 762 CE3 TRP A 48 -0.032 -9.631 4.793 1.00 21.51 C ATOM 763 CZ2 TRP A 48 2.415 -10.521 3.734 1.00 25.50 C ATOM 764 CZ3 TRP A 48 1.179 -9.176 5.332 1.00 32.30 C ATOM 765 CH2 TRP A 48 2.402 -9.595 4.787 1.00 64.31 C ATOM 0 H TRP A 48 -3.905 -9.868 1.563 1.00 41.12 H new ATOM 0 HA TRP A 48 -3.023 -12.608 1.796 1.00 42.23 H new ATOM 0 HB2 TRP A 48 -2.897 -10.034 3.307 1.00 73.44 H new ATOM 0 HB3 TRP A 48 -2.769 -11.497 4.263 1.00 73.44 H new ATOM 0 HD1 TRP A 48 -1.032 -12.481 1.274 1.00 31.32 H new ATOM 0 HE1 TRP A 48 1.513 -12.200 1.494 1.00 64.53 H new ATOM 0 HE3 TRP A 48 -0.963 -9.297 5.226 1.00 21.51 H new ATOM 0 HZ2 TRP A 48 3.350 -10.911 3.359 1.00 25.50 H new ATOM 0 HZ3 TRP A 48 1.171 -8.498 6.173 1.00 32.30 H new ATOM 0 HH2 TRP A 48 3.331 -9.206 5.177 1.00 64.31 H new ATOM 776 N ASN A 49 -5.641 -11.658 3.563 1.00 4.12 N ATOM 777 CA ASN A 49 -6.834 -12.103 4.281 1.00 72.23 C ATOM 778 C ASN A 49 -7.657 -13.149 3.494 1.00 52.31 C ATOM 779 O ASN A 49 -8.174 -14.091 4.098 1.00 22.20 O ATOM 780 CB ASN A 49 -7.722 -10.892 4.654 1.00 33.53 C ATOM 781 CG ASN A 49 -7.140 -10.012 5.748 1.00 31.14 C ATOM 782 OD1 ASN A 49 -6.430 -10.502 6.613 1.00 41.04 O ATOM 783 ND2 ASN A 49 -7.402 -8.721 5.732 1.00 34.41 N ATOM 0 H ASN A 49 -5.572 -10.642 3.503 1.00 4.12 H new ATOM 0 HA ASN A 49 -6.487 -12.595 5.190 1.00 72.23 H new ATOM 0 HB2 ASN A 49 -7.885 -10.286 3.763 1.00 33.53 H new ATOM 0 HB3 ASN A 49 -8.698 -11.256 4.975 1.00 33.53 H new ATOM 0 HD21 ASN A 49 -7.010 -8.112 6.450 1.00 34.41 H new ATOM 0 HD22 ASN A 49 -7.997 -8.330 5.001 1.00 34.41 H new ATOM 790 N LEU A 50 -7.737 -13.032 2.160 1.00 43.23 N ATOM 791 CA LEU A 50 -8.380 -13.905 1.181 1.00 5.14 C ATOM 792 C LEU A 50 -7.957 -15.355 1.385 1.00 22.50 C ATOM 793 O LEU A 50 -8.730 -16.264 1.092 1.00 42.24 O ATOM 794 CB LEU A 50 -7.835 -13.537 -0.216 1.00 71.21 C ATOM 795 CG LEU A 50 -8.446 -12.398 -1.016 1.00 52.44 C ATOM 796 CD1 LEU A 50 -7.752 -12.320 -2.385 1.00 71.12 C ATOM 797 CD2 LEU A 50 -9.939 -12.485 -1.277 1.00 64.53 C ATOM 0 H LEU A 50 -7.303 -12.234 1.696 1.00 43.23 H new ATOM 0 HA LEU A 50 -9.459 -13.789 1.283 1.00 5.14 H new ATOM 0 HB2 LEU A 50 -6.775 -13.312 -0.097 1.00 71.21 H new ATOM 0 HB3 LEU A 50 -7.903 -14.433 -0.832 1.00 71.21 H new ATOM 0 HG LEU A 50 -8.295 -11.518 -0.391 1.00 52.44 H new ATOM 0 HD11 LEU A 50 -8.184 -11.505 -2.966 1.00 71.12 H new ATOM 0 HD12 LEU A 50 -6.687 -12.139 -2.243 1.00 71.12 H new ATOM 0 HD13 LEU A 50 -7.892 -13.260 -2.918 1.00 71.12 H new ATOM 0 HD21 LEU A 50 -10.258 -11.618 -1.855 1.00 64.53 H new ATOM 0 HD22 LEU A 50 -10.158 -13.395 -1.836 1.00 64.53 H new ATOM 0 HD23 LEU A 50 -10.474 -12.505 -0.327 1.00 64.53 H new ATOM 809 N LEU A 51 -6.707 -15.561 1.814 1.00 32.53 N ATOM 810 CA LEU A 51 -6.017 -16.844 1.882 1.00 3.42 C ATOM 811 C LEU A 51 -6.026 -17.399 3.315 1.00 14.24 C ATOM 812 O LEU A 51 -5.502 -18.485 3.554 1.00 11.42 O ATOM 813 CB LEU A 51 -4.541 -16.659 1.460 1.00 63.33 C ATOM 814 CG LEU A 51 -4.189 -15.672 0.329 1.00 52.44 C ATOM 815 CD1 LEU A 51 -2.674 -15.590 0.134 1.00 42.44 C ATOM 816 CD2 LEU A 51 -4.867 -15.970 -1.004 1.00 65.21 C ATOM 0 H LEU A 51 -6.122 -14.792 2.140 1.00 32.53 H new ATOM 0 HA LEU A 51 -6.533 -17.537 1.217 1.00 3.42 H new ATOM 0 HB2 LEU A 51 -3.985 -16.351 2.346 1.00 63.33 H new ATOM 0 HB3 LEU A 51 -4.160 -17.638 1.169 1.00 63.33 H new ATOM 0 HG LEU A 51 -4.580 -14.709 0.659 1.00 52.44 H new ATOM 0 HD11 LEU A 51 -2.448 -14.888 -0.669 1.00 42.44 H new ATOM 0 HD12 LEU A 51 -2.206 -15.248 1.057 1.00 42.44 H new ATOM 0 HD13 LEU A 51 -2.287 -16.575 -0.126 1.00 42.44 H new ATOM 0 HD21 LEU A 51 -4.563 -15.227 -1.741 1.00 65.21 H new ATOM 0 HD22 LEU A 51 -4.574 -16.962 -1.347 1.00 65.21 H new ATOM 0 HD23 LEU A 51 -5.949 -15.934 -0.878 1.00 65.21 H new ATOM 828 N SER A 52 -6.515 -16.626 4.292 1.00 61.14 N ATOM 829 CA SER A 52 -6.363 -16.868 5.727 1.00 72.35 C ATOM 830 C SER A 52 -7.721 -16.948 6.432 1.00 25.43 C ATOM 831 O SER A 52 -7.783 -17.060 7.652 1.00 1.33 O ATOM 832 CB SER A 52 -5.478 -15.758 6.305 1.00 64.24 C ATOM 833 OG SER A 52 -4.699 -16.204 7.391 1.00 23.53 O ATOM 0 H SER A 52 -7.049 -15.780 4.093 1.00 61.14 H new ATOM 0 HA SER A 52 -5.887 -17.834 5.893 1.00 72.35 H new ATOM 0 HB2 SER A 52 -4.822 -15.376 5.523 1.00 64.24 H new ATOM 0 HB3 SER A 52 -6.106 -14.928 6.628 1.00 64.24 H new ATOM 0 HG SER A 52 -5.267 -16.694 8.021 1.00 23.53 H new ATOM 839 N ASP A 53 -8.804 -16.861 5.666 1.00 72.24 N ATOM 840 CA ASP A 53 -10.204 -16.860 6.078 1.00 34.12 C ATOM 841 C ASP A 53 -10.538 -15.723 7.052 1.00 41.35 C ATOM 842 O ASP A 53 -11.452 -15.793 7.868 1.00 53.04 O ATOM 843 CB ASP A 53 -10.641 -18.253 6.535 1.00 62.25 C ATOM 844 CG ASP A 53 -12.154 -18.381 6.425 1.00 22.23 C ATOM 845 OD1 ASP A 53 -12.689 -18.154 5.313 1.00 4.43 O ATOM 846 OD2 ASP A 53 -12.811 -18.753 7.424 1.00 41.34 O ATOM 0 H ASP A 53 -8.717 -16.783 4.653 1.00 72.24 H new ATOM 0 HA ASP A 53 -10.815 -16.632 5.205 1.00 34.12 H new ATOM 0 HB2 ASP A 53 -10.157 -19.015 5.924 1.00 62.25 H new ATOM 0 HB3 ASP A 53 -10.326 -18.423 7.565 1.00 62.25 H new ATOM 851 N LYS A 54 -9.752 -14.661 6.932 1.00 2.24 N ATOM 852 CA LYS A 54 -9.841 -13.335 7.528 1.00 42.04 C ATOM 853 C LYS A 54 -10.919 -12.523 6.803 1.00 53.44 C ATOM 854 O LYS A 54 -11.686 -13.064 5.995 1.00 43.02 O ATOM 855 CB LYS A 54 -8.475 -12.710 7.349 1.00 23.30 C ATOM 856 CG LYS A 54 -7.424 -13.387 8.226 1.00 43.41 C ATOM 857 CD LYS A 54 -7.420 -12.814 9.633 1.00 31.14 C ATOM 858 CE LYS A 54 -6.880 -11.403 9.618 1.00 21.14 C ATOM 859 NZ LYS A 54 -7.327 -10.683 10.831 1.00 43.14 N ATOM 0 H LYS A 54 -8.928 -14.719 6.334 1.00 2.24 H new ATOM 0 HA LYS A 54 -10.115 -13.370 8.582 1.00 42.04 H new ATOM 0 HB2 LYS A 54 -8.177 -12.781 6.303 1.00 23.30 H new ATOM 0 HB3 LYS A 54 -8.525 -11.649 7.595 1.00 23.30 H new ATOM 0 HG2 LYS A 54 -7.620 -14.458 8.269 1.00 43.41 H new ATOM 0 HG3 LYS A 54 -6.438 -13.261 7.778 1.00 43.41 H new ATOM 0 HD2 LYS A 54 -8.431 -12.820 10.039 1.00 31.14 H new ATOM 0 HD3 LYS A 54 -6.810 -13.438 10.286 1.00 31.14 H new ATOM 0 HE2 LYS A 54 -5.791 -11.421 9.575 1.00 21.14 H new ATOM 0 HE3 LYS A 54 -7.226 -10.881 8.726 1.00 21.14 H new ATOM 0 HZ1 LYS A 54 -6.953 -9.713 10.816 1.00 43.14 H new ATOM 0 HZ2 LYS A 54 -8.366 -10.653 10.854 1.00 43.14 H new ATOM 0 HZ3 LYS A 54 -6.976 -11.176 11.677 1.00 43.14 H new ATOM 873 N SER A 55 -10.898 -11.213 7.008 1.00 72.13 N ATOM 874 CA SER A 55 -11.755 -10.203 6.405 1.00 72.23 C ATOM 875 C SER A 55 -11.011 -9.414 5.323 1.00 45.42 C ATOM 876 O SER A 55 -10.315 -8.445 5.615 1.00 45.24 O ATOM 877 CB SER A 55 -12.297 -9.304 7.506 1.00 34.13 C ATOM 878 OG SER A 55 -13.253 -8.398 7.014 1.00 50.21 O ATOM 0 H SER A 55 -10.226 -10.796 7.653 1.00 72.13 H new ATOM 0 HA SER A 55 -12.593 -10.684 5.901 1.00 72.23 H new ATOM 0 HB2 SER A 55 -12.745 -9.917 8.288 1.00 34.13 H new ATOM 0 HB3 SER A 55 -11.475 -8.753 7.964 1.00 34.13 H new ATOM 0 HG SER A 55 -13.236 -7.580 7.553 1.00 50.21 H new ATOM 884 N PRO A 56 -11.005 -9.896 4.072 1.00 51.15 N ATOM 885 CA PRO A 56 -10.386 -9.192 2.962 1.00 32.53 C ATOM 886 C PRO A 56 -10.996 -7.824 2.670 1.00 53.04 C ATOM 887 O PRO A 56 -10.282 -6.986 2.116 1.00 52.13 O ATOM 888 CB PRO A 56 -10.503 -10.135 1.769 1.00 34.20 C ATOM 889 CG PRO A 56 -11.584 -11.141 2.129 1.00 50.45 C ATOM 890 CD PRO A 56 -11.629 -11.129 3.637 1.00 53.04 C ATOM 0 HA PRO A 56 -9.350 -8.955 3.203 1.00 32.53 H new ATOM 0 HB2 PRO A 56 -10.767 -9.587 0.864 1.00 34.20 H new ATOM 0 HB3 PRO A 56 -9.555 -10.636 1.574 1.00 34.20 H new ATOM 0 HG2 PRO A 56 -12.546 -10.859 1.702 1.00 50.45 H new ATOM 0 HG3 PRO A 56 -11.345 -12.134 1.748 1.00 50.45 H new ATOM 0 HD2 PRO A 56 -12.658 -11.186 3.992 1.00 53.04 H new ATOM 0 HD3 PRO A 56 -11.103 -11.992 4.045 1.00 53.04 H new ATOM 898 N PHE A 57 -12.241 -7.563 3.072 1.00 31.50 N ATOM 899 CA PHE A 57 -12.989 -6.393 2.597 1.00 32.24 C ATOM 900 C PHE A 57 -13.214 -5.351 3.674 1.00 21.22 C ATOM 901 O PHE A 57 -14.122 -4.525 3.604 1.00 63.44 O ATOM 902 CB PHE A 57 -14.237 -6.844 1.831 1.00 22.40 C ATOM 903 CG PHE A 57 -13.885 -7.746 0.668 1.00 25.10 C ATOM 904 CD1 PHE A 57 -13.039 -7.242 -0.332 1.00 42.21 C ATOM 905 CD2 PHE A 57 -14.368 -9.062 0.574 1.00 70.44 C ATOM 906 CE1 PHE A 57 -12.663 -8.036 -1.422 1.00 53.25 C ATOM 907 CE2 PHE A 57 -13.986 -9.867 -0.515 1.00 34.24 C ATOM 908 CZ PHE A 57 -13.127 -9.360 -1.506 1.00 5.22 C ATOM 0 H PHE A 57 -12.757 -8.148 3.729 1.00 31.50 H new ATOM 0 HA PHE A 57 -12.378 -5.849 1.877 1.00 32.24 H new ATOM 0 HB2 PHE A 57 -14.910 -7.370 2.509 1.00 22.40 H new ATOM 0 HB3 PHE A 57 -14.774 -5.970 1.464 1.00 22.40 H new ATOM 0 HD1 PHE A 57 -12.673 -6.228 -0.260 1.00 42.21 H new ATOM 0 HD2 PHE A 57 -15.029 -9.454 1.333 1.00 70.44 H new ATOM 0 HE1 PHE A 57 -12.021 -7.634 -2.192 1.00 53.25 H new ATOM 0 HE2 PHE A 57 -14.354 -10.879 -0.590 1.00 34.24 H new ATOM 0 HZ PHE A 57 -12.824 -9.988 -2.331 1.00 5.22 H new ATOM 918 N ASP A 58 -12.317 -5.355 4.651 1.00 41.43 N ATOM 919 CA ASP A 58 -12.592 -4.800 5.955 1.00 71.14 C ATOM 920 C ASP A 58 -12.688 -3.273 5.987 1.00 13.34 C ATOM 921 O ASP A 58 -13.397 -2.762 6.844 1.00 54.04 O ATOM 922 CB ASP A 58 -11.487 -5.270 6.904 1.00 62.34 C ATOM 923 CG ASP A 58 -11.930 -5.624 8.317 1.00 4.44 C ATOM 924 OD1 ASP A 58 -13.028 -6.193 8.517 1.00 61.42 O ATOM 925 OD2 ASP A 58 -11.062 -5.534 9.214 1.00 14.31 O ATOM 0 H ASP A 58 -11.380 -5.745 4.554 1.00 41.43 H new ATOM 0 HA ASP A 58 -13.577 -5.155 6.259 1.00 71.14 H new ATOM 0 HB2 ASP A 58 -11.005 -6.144 6.465 1.00 62.34 H new ATOM 0 HB3 ASP A 58 -10.731 -4.487 6.966 1.00 62.34 H new ATOM 930 N HIS A 59 -11.975 -2.573 5.088 1.00 50.22 N ATOM 931 CA HIS A 59 -11.747 -1.124 4.887 1.00 41.31 C ATOM 932 C HIS A 59 -11.425 -0.239 6.100 1.00 42.15 C ATOM 933 O HIS A 59 -10.873 0.840 5.917 1.00 5.22 O ATOM 934 CB HIS A 59 -12.821 -0.494 3.996 1.00 32.13 C ATOM 935 CG HIS A 59 -14.182 -0.380 4.623 1.00 44.15 C ATOM 936 ND1 HIS A 59 -14.658 0.682 5.358 1.00 51.42 N ATOM 937 CD2 HIS A 59 -15.181 -1.304 4.519 1.00 12.10 C ATOM 938 CE1 HIS A 59 -15.933 0.402 5.675 1.00 24.34 C ATOM 939 NE2 HIS A 59 -16.298 -0.805 5.198 1.00 2.22 N ATOM 0 H HIS A 59 -11.465 -3.091 4.373 1.00 50.22 H new ATOM 0 HA HIS A 59 -10.785 -1.138 4.375 1.00 41.31 H new ATOM 0 HB2 HIS A 59 -12.489 0.502 3.702 1.00 32.13 H new ATOM 0 HB3 HIS A 59 -12.906 -1.084 3.084 1.00 32.13 H new ATOM 0 HD1 HIS A 59 -14.140 1.523 5.614 1.00 51.42 H new ATOM 0 HD2 HIS A 59 -15.120 -2.252 4.004 1.00 12.10 H new ATOM 0 HE1 HIS A 59 -16.581 1.058 6.238 1.00 24.34 H new ATOM 947 N GLU A 60 -11.624 -0.720 7.319 1.00 25.34 N ATOM 948 CA GLU A 60 -11.344 -0.104 8.616 1.00 44.02 C ATOM 949 C GLU A 60 -9.838 -0.133 8.941 1.00 3.12 C ATOM 950 O GLU A 60 -9.415 -0.149 10.101 1.00 41.13 O ATOM 951 CB GLU A 60 -12.141 -0.895 9.658 1.00 62.25 C ATOM 952 CG GLU A 60 -13.663 -0.781 9.474 1.00 44.23 C ATOM 953 CD GLU A 60 -14.254 0.511 10.027 1.00 24.32 C ATOM 954 OE1 GLU A 60 -14.182 1.567 9.360 1.00 41.22 O ATOM 955 OE2 GLU A 60 -14.873 0.472 11.114 1.00 61.43 O ATOM 0 H GLU A 60 -12.028 -1.649 7.440 1.00 25.34 H new ATOM 0 HA GLU A 60 -11.636 0.946 8.611 1.00 44.02 H new ATOM 0 HB2 GLU A 60 -11.853 -1.945 9.605 1.00 62.25 H new ATOM 0 HB3 GLU A 60 -11.875 -0.541 10.654 1.00 62.25 H new ATOM 0 HG2 GLU A 60 -13.898 -0.852 8.412 1.00 44.23 H new ATOM 0 HG3 GLU A 60 -14.143 -1.628 9.964 1.00 44.23 H new ATOM 962 N THR A 61 -9.024 -0.206 7.898 1.00 54.14 N ATOM 963 CA THR A 61 -7.581 -0.343 7.893 1.00 11.34 C ATOM 964 C THR A 61 -6.980 0.896 7.202 1.00 1.22 C ATOM 965 O THR A 61 -7.706 1.760 6.712 1.00 50.11 O ATOM 966 CB THR A 61 -7.236 -1.722 7.288 1.00 74.54 C ATOM 967 OG1 THR A 61 -5.853 -2.015 7.383 1.00 74.45 O ATOM 968 CG2 THR A 61 -7.675 -1.900 5.832 1.00 23.33 C ATOM 0 H THR A 61 -9.395 -0.167 6.948 1.00 54.14 H new ATOM 0 HA THR A 61 -7.128 -0.350 8.884 1.00 11.34 H new ATOM 0 HB THR A 61 -7.810 -2.423 7.894 1.00 74.54 H new ATOM 0 HG1 THR A 61 -5.678 -2.896 6.991 1.00 74.45 H new ATOM 0 HG21 THR A 61 -7.394 -2.895 5.486 1.00 23.33 H new ATOM 0 HG22 THR A 61 -8.756 -1.783 5.761 1.00 23.33 H new ATOM 0 HG23 THR A 61 -7.187 -1.149 5.211 1.00 23.33 H new ATOM 976 N ASP A 62 -5.657 1.043 7.235 1.00 45.23 N ATOM 977 CA ASP A 62 -4.957 2.227 6.740 1.00 42.01 C ATOM 978 C ASP A 62 -4.994 2.251 5.210 1.00 71.11 C ATOM 979 O ASP A 62 -4.824 1.208 4.562 1.00 12.02 O ATOM 980 CB ASP A 62 -3.509 2.274 7.259 1.00 14.05 C ATOM 981 CG ASP A 62 -2.669 1.046 6.899 1.00 10.31 C ATOM 982 OD1 ASP A 62 -2.931 -0.047 7.448 1.00 54.42 O ATOM 983 OD2 ASP A 62 -1.657 1.169 6.165 1.00 74.33 O ATOM 0 H ASP A 62 -5.031 0.331 7.612 1.00 45.23 H new ATOM 0 HA ASP A 62 -5.466 3.115 7.116 1.00 42.01 H new ATOM 0 HB2 ASP A 62 -3.021 3.163 6.859 1.00 14.05 H new ATOM 0 HB3 ASP A 62 -3.528 2.381 8.344 1.00 14.05 H new ATOM 988 N ILE A 63 -5.206 3.436 4.628 1.00 64.10 N ATOM 989 CA ILE A 63 -5.422 3.644 3.201 1.00 21.21 C ATOM 990 C ILE A 63 -4.305 4.565 2.713 1.00 64.51 C ATOM 991 O ILE A 63 -4.416 5.783 2.781 1.00 1.03 O ATOM 992 CB ILE A 63 -6.839 4.204 2.910 1.00 3.03 C ATOM 993 CG1 ILE A 63 -7.973 3.477 3.662 1.00 74.30 C ATOM 994 CG2 ILE A 63 -7.096 4.232 1.395 1.00 63.31 C ATOM 995 CD1 ILE A 63 -8.163 1.993 3.317 1.00 71.52 C ATOM 0 H ILE A 63 -5.232 4.305 5.161 1.00 64.10 H new ATOM 0 HA ILE A 63 -5.383 2.699 2.659 1.00 21.21 H new ATOM 0 HB ILE A 63 -6.853 5.222 3.299 1.00 3.03 H new ATOM 0 HG12 ILE A 63 -7.784 3.560 4.732 1.00 74.30 H new ATOM 0 HG13 ILE A 63 -8.909 3.999 3.462 1.00 74.30 H new ATOM 0 HG21 ILE A 63 -8.094 4.627 1.202 1.00 63.31 H new ATOM 0 HG22 ILE A 63 -6.354 4.868 0.912 1.00 63.31 H new ATOM 0 HG23 ILE A 63 -7.023 3.221 0.995 1.00 63.31 H new ATOM 0 HD11 ILE A 63 -8.986 1.585 3.904 1.00 71.52 H new ATOM 0 HD12 ILE A 63 -8.390 1.892 2.256 1.00 71.52 H new ATOM 0 HD13 ILE A 63 -7.248 1.446 3.546 1.00 71.52 H new ATOM 1007 N ASP A 64 -3.204 3.983 2.243 1.00 70.12 N ATOM 1008 CA ASP A 64 -2.071 4.677 1.632 1.00 4.24 C ATOM 1009 C ASP A 64 -2.602 5.573 0.509 1.00 5.11 C ATOM 1010 O ASP A 64 -3.306 5.091 -0.377 1.00 73.23 O ATOM 1011 CB ASP A 64 -1.072 3.637 1.072 1.00 63.10 C ATOM 1012 CG ASP A 64 0.388 3.864 1.469 1.00 63.14 C ATOM 1013 OD1 ASP A 64 0.706 3.721 2.669 1.00 14.04 O ATOM 1014 OD2 ASP A 64 1.241 4.131 0.590 1.00 50.13 O ATOM 0 H ASP A 64 -3.071 2.972 2.279 1.00 70.12 H new ATOM 0 HA ASP A 64 -1.553 5.289 2.370 1.00 4.24 H new ATOM 0 HB2 ASP A 64 -1.375 2.646 1.410 1.00 63.10 H new ATOM 0 HB3 ASP A 64 -1.141 3.638 -0.016 1.00 63.10 H new ATOM 1019 N VAL A 65 -2.273 6.863 0.515 1.00 62.40 N ATOM 1020 CA VAL A 65 -2.489 7.796 -0.580 1.00 2.01 C ATOM 1021 C VAL A 65 -1.183 8.535 -0.846 1.00 70.12 C ATOM 1022 O VAL A 65 -0.981 9.679 -0.439 1.00 32.21 O ATOM 1023 CB VAL A 65 -3.705 8.709 -0.295 1.00 31.53 C ATOM 1024 CG1 VAL A 65 -4.024 9.588 -1.502 1.00 31.34 C ATOM 1025 CG2 VAL A 65 -5.024 7.996 0.022 1.00 14.14 C ATOM 0 H VAL A 65 -1.829 7.303 1.321 1.00 62.40 H new ATOM 0 HA VAL A 65 -2.754 7.273 -1.499 1.00 2.01 H new ATOM 0 HB VAL A 65 -3.379 9.260 0.587 1.00 31.53 H new ATOM 0 HG11 VAL A 65 -4.883 10.220 -1.275 1.00 31.34 H new ATOM 0 HG12 VAL A 65 -3.163 10.215 -1.733 1.00 31.34 H new ATOM 0 HG13 VAL A 65 -4.254 8.957 -2.361 1.00 31.34 H new ATOM 0 HG21 VAL A 65 -5.803 8.736 0.204 1.00 14.14 H new ATOM 0 HG22 VAL A 65 -5.310 7.368 -0.822 1.00 14.14 H new ATOM 0 HG23 VAL A 65 -4.898 7.376 0.910 1.00 14.14 H new ATOM 1035 N ILE A 66 -0.274 7.873 -1.556 1.00 1.33 N ATOM 1036 CA ILE A 66 0.862 8.566 -2.134 1.00 23.43 C ATOM 1037 C ILE A 66 0.348 9.361 -3.325 1.00 21.23 C ATOM 1038 O ILE A 66 -0.617 8.961 -3.988 1.00 3.31 O ATOM 1039 CB ILE A 66 2.011 7.610 -2.511 1.00 34.24 C ATOM 1040 CG1 ILE A 66 1.747 6.783 -3.790 1.00 72.01 C ATOM 1041 CG2 ILE A 66 2.341 6.737 -1.293 1.00 44.44 C ATOM 1042 CD1 ILE A 66 2.869 5.775 -4.087 1.00 42.34 C ATOM 0 H ILE A 66 -0.304 6.870 -1.741 1.00 1.33 H new ATOM 0 HA ILE A 66 1.301 9.239 -1.398 1.00 23.43 H new ATOM 0 HB ILE A 66 2.882 8.211 -2.773 1.00 34.24 H new ATOM 0 HG12 ILE A 66 0.803 6.249 -3.684 1.00 72.01 H new ATOM 0 HG13 ILE A 66 1.637 7.459 -4.638 1.00 72.01 H new ATOM 0 HG21 ILE A 66 3.153 6.054 -1.544 1.00 44.44 H new ATOM 0 HG22 ILE A 66 2.645 7.373 -0.461 1.00 44.44 H new ATOM 0 HG23 ILE A 66 1.460 6.163 -1.007 1.00 44.44 H new ATOM 0 HD11 ILE A 66 2.631 5.222 -4.996 1.00 42.34 H new ATOM 0 HD12 ILE A 66 3.810 6.308 -4.223 1.00 42.34 H new ATOM 0 HD13 ILE A 66 2.963 5.079 -3.253 1.00 42.34 H new ATOM 1054 N PHE A 67 1.024 10.460 -3.614 1.00 4.31 N ATOM 1055 CA PHE A 67 0.775 11.289 -4.774 1.00 31.24 C ATOM 1056 C PHE A 67 2.119 11.905 -5.205 1.00 62.02 C ATOM 1057 O PHE A 67 3.173 11.424 -4.763 1.00 12.34 O ATOM 1058 CB PHE A 67 -0.437 12.220 -4.512 1.00 50.24 C ATOM 1059 CG PHE A 67 -0.415 13.331 -3.475 1.00 11.43 C ATOM 1060 CD1 PHE A 67 -0.133 13.080 -2.114 1.00 14.51 C ATOM 1061 CD2 PHE A 67 -0.712 14.649 -3.884 1.00 13.31 C ATOM 1062 CE1 PHE A 67 -0.077 14.147 -1.195 1.00 43.43 C ATOM 1063 CE2 PHE A 67 -0.682 15.706 -2.960 1.00 5.11 C ATOM 1064 CZ PHE A 67 -0.349 15.460 -1.620 1.00 21.35 C ATOM 0 H PHE A 67 1.783 10.808 -3.028 1.00 4.31 H new ATOM 0 HA PHE A 67 0.439 10.743 -5.656 1.00 31.24 H new ATOM 0 HB2 PHE A 67 -0.678 12.690 -5.465 1.00 50.24 H new ATOM 0 HB3 PHE A 67 -1.275 11.573 -4.255 1.00 50.24 H new ATOM 0 HD1 PHE A 67 0.040 12.069 -1.777 1.00 14.51 H new ATOM 0 HD2 PHE A 67 -0.964 14.846 -4.915 1.00 13.31 H new ATOM 0 HE1 PHE A 67 0.175 13.956 -0.162 1.00 43.43 H new ATOM 0 HE2 PHE A 67 -0.916 16.710 -3.282 1.00 5.11 H new ATOM 0 HZ PHE A 67 -0.301 16.277 -0.916 1.00 21.35 H new ATOM 1074 N PHE A 68 2.158 12.862 -6.133 1.00 13.14 N ATOM 1075 CA PHE A 68 3.324 13.732 -6.326 1.00 65.10 C ATOM 1076 C PHE A 68 2.782 15.112 -6.633 1.00 5.21 C ATOM 1077 O PHE A 68 2.274 15.339 -7.735 1.00 34.44 O ATOM 1078 CB PHE A 68 4.266 13.182 -7.413 1.00 71.12 C ATOM 1079 CG PHE A 68 5.370 14.121 -7.874 1.00 61.42 C ATOM 1080 CD1 PHE A 68 6.509 14.359 -7.080 1.00 33.31 C ATOM 1081 CD2 PHE A 68 5.276 14.735 -9.136 1.00 41.11 C ATOM 1082 CE1 PHE A 68 7.540 15.190 -7.545 1.00 71.13 C ATOM 1083 CE2 PHE A 68 6.310 15.562 -9.606 1.00 24.35 C ATOM 1084 CZ PHE A 68 7.445 15.789 -8.811 1.00 74.01 C ATOM 0 H PHE A 68 1.386 13.057 -6.771 1.00 13.14 H new ATOM 0 HA PHE A 68 3.946 13.776 -5.432 1.00 65.10 H new ATOM 0 HB2 PHE A 68 4.726 12.268 -7.039 1.00 71.12 H new ATOM 0 HB3 PHE A 68 3.666 12.905 -8.280 1.00 71.12 H new ATOM 0 HD1 PHE A 68 6.589 13.899 -6.106 1.00 33.31 H new ATOM 0 HD2 PHE A 68 4.402 14.569 -9.749 1.00 41.11 H new ATOM 0 HE1 PHE A 68 8.408 15.369 -6.928 1.00 71.13 H new ATOM 0 HE2 PHE A 68 6.232 16.023 -10.579 1.00 24.35 H new ATOM 0 HZ PHE A 68 8.242 16.422 -9.172 1.00 74.01 H new ATOM 1094 N ASP A 69 2.827 16.030 -5.658 1.00 42.53 N ATOM 1095 CA ASP A 69 2.468 17.409 -5.952 1.00 45.34 C ATOM 1096 C ASP A 69 3.361 18.374 -5.171 1.00 51.52 C ATOM 1097 O ASP A 69 2.987 18.843 -4.097 1.00 24.05 O ATOM 1098 CB ASP A 69 0.954 17.624 -5.763 1.00 52.42 C ATOM 1099 CG ASP A 69 0.438 18.838 -6.537 1.00 4.21 C ATOM 1100 OD1 ASP A 69 1.142 19.328 -7.437 1.00 13.22 O ATOM 1101 OD2 ASP A 69 -0.754 19.199 -6.337 1.00 53.10 O ATOM 0 H ASP A 69 3.100 15.845 -4.693 1.00 42.53 H new ATOM 0 HA ASP A 69 2.659 17.632 -7.002 1.00 45.34 H new ATOM 0 HB2 ASP A 69 0.419 16.733 -6.091 1.00 52.42 H new ATOM 0 HB3 ASP A 69 0.737 17.753 -4.703 1.00 52.42 H new ATOM 1106 N PRO A 70 4.577 18.643 -5.685 1.00 33.43 N ATOM 1107 CA PRO A 70 5.549 19.574 -5.112 1.00 65.33 C ATOM 1108 C PRO A 70 5.002 20.973 -4.872 1.00 31.33 C ATOM 1109 O PRO A 70 5.484 21.676 -3.982 1.00 53.22 O ATOM 1110 CB PRO A 70 6.684 19.665 -6.138 1.00 33.02 C ATOM 1111 CG PRO A 70 6.593 18.348 -6.889 1.00 51.50 C ATOM 1112 CD PRO A 70 5.115 18.035 -6.889 1.00 14.51 C ATOM 0 HA PRO A 70 5.856 19.203 -4.134 1.00 65.33 H new ATOM 0 HB2 PRO A 70 6.554 20.517 -6.805 1.00 33.02 H new ATOM 0 HB3 PRO A 70 7.653 19.784 -5.654 1.00 33.02 H new ATOM 0 HG2 PRO A 70 6.983 18.438 -7.903 1.00 51.50 H new ATOM 0 HG3 PRO A 70 7.168 17.565 -6.395 1.00 51.50 H new ATOM 0 HD2 PRO A 70 4.631 18.437 -7.779 1.00 14.51 H new ATOM 0 HD3 PRO A 70 4.944 16.958 -6.892 1.00 14.51 H new ATOM 1120 N ASP A 71 4.047 21.406 -5.688 1.00 53.20 N ATOM 1121 CA ASP A 71 3.425 22.715 -5.548 1.00 42.14 C ATOM 1122 C ASP A 71 2.511 22.773 -4.325 1.00 5.51 C ATOM 1123 O ASP A 71 2.370 23.828 -3.708 1.00 22.04 O ATOM 1124 CB ASP A 71 2.652 23.031 -6.830 1.00 2.24 C ATOM 1125 CG ASP A 71 2.224 24.490 -6.858 1.00 3.13 C ATOM 1126 OD1 ASP A 71 3.094 25.345 -7.163 1.00 43.43 O ATOM 1127 OD2 ASP A 71 1.031 24.766 -6.614 1.00 45.20 O ATOM 0 H ASP A 71 3.683 20.857 -6.466 1.00 53.20 H new ATOM 0 HA ASP A 71 4.200 23.466 -5.395 1.00 42.14 H new ATOM 0 HB2 ASP A 71 3.274 22.813 -7.698 1.00 2.24 H new ATOM 0 HB3 ASP A 71 1.774 22.389 -6.898 1.00 2.24 H new ATOM 1132 N PHE A 72 1.941 21.626 -3.946 1.00 3.55 N ATOM 1133 CA PHE A 72 0.929 21.513 -2.911 1.00 61.44 C ATOM 1134 C PHE A 72 1.577 21.784 -1.563 1.00 13.34 C ATOM 1135 O PHE A 72 2.477 21.044 -1.153 1.00 1.41 O ATOM 1136 CB PHE A 72 0.292 20.117 -2.965 1.00 61.32 C ATOM 1137 CG PHE A 72 -1.155 20.086 -2.542 1.00 22.24 C ATOM 1138 CD1 PHE A 72 -2.099 20.700 -3.375 1.00 73.02 C ATOM 1139 CD2 PHE A 72 -1.571 19.450 -1.358 1.00 4.23 C ATOM 1140 CE1 PHE A 72 -3.441 20.775 -2.980 1.00 43.42 C ATOM 1141 CE2 PHE A 72 -2.932 19.464 -1.001 1.00 5.45 C ATOM 1142 CZ PHE A 72 -3.860 20.165 -1.789 1.00 73.34 C ATOM 0 H PHE A 72 2.183 20.729 -4.367 1.00 3.55 H new ATOM 0 HA PHE A 72 0.136 22.244 -3.066 1.00 61.44 H new ATOM 0 HB2 PHE A 72 0.371 19.732 -3.982 1.00 61.32 H new ATOM 0 HB3 PHE A 72 0.862 19.444 -2.324 1.00 61.32 H new ATOM 0 HD1 PHE A 72 -1.792 21.116 -4.323 1.00 73.02 H new ATOM 0 HD2 PHE A 72 -0.849 18.954 -0.726 1.00 4.23 H new ATOM 0 HE1 PHE A 72 -4.155 21.304 -3.594 1.00 43.42 H new ATOM 0 HE2 PHE A 72 -3.264 18.935 -0.120 1.00 5.45 H new ATOM 0 HZ PHE A 72 -4.892 20.234 -1.479 1.00 73.34 H new ATOM 1152 N SER A 73 1.159 22.855 -0.888 1.00 63.43 N ATOM 1153 CA SER A 73 1.743 23.318 0.365 1.00 54.20 C ATOM 1154 C SER A 73 1.779 22.222 1.425 1.00 62.52 C ATOM 1155 O SER A 73 1.007 21.256 1.404 1.00 71.22 O ATOM 1156 CB SER A 73 0.974 24.532 0.890 1.00 10.02 C ATOM 1157 OG SER A 73 0.641 25.418 -0.157 1.00 73.33 O ATOM 0 H SER A 73 0.385 23.437 -1.208 1.00 63.43 H new ATOM 0 HA SER A 73 2.774 23.603 0.156 1.00 54.20 H new ATOM 0 HB2 SER A 73 0.065 24.201 1.392 1.00 10.02 H new ATOM 0 HB3 SER A 73 1.577 25.054 1.633 1.00 10.02 H new ATOM 0 HG SER A 73 0.149 26.184 0.206 1.00 73.33 H new ATOM 1163 N TYR A 74 2.673 22.411 2.392 1.00 63.30 N ATOM 1164 CA TYR A 74 2.809 21.522 3.526 1.00 52.44 C ATOM 1165 C TYR A 74 1.469 21.428 4.249 1.00 63.40 C ATOM 1166 O TYR A 74 0.990 20.323 4.489 1.00 64.42 O ATOM 1167 CB TYR A 74 3.927 22.035 4.436 1.00 65.24 C ATOM 1168 CG TYR A 74 4.294 21.098 5.569 1.00 14.31 C ATOM 1169 CD1 TYR A 74 3.449 20.957 6.688 1.00 73.24 C ATOM 1170 CD2 TYR A 74 5.489 20.361 5.499 1.00 54.42 C ATOM 1171 CE1 TYR A 74 3.795 20.073 7.728 1.00 53.34 C ATOM 1172 CE2 TYR A 74 5.831 19.467 6.525 1.00 4.24 C ATOM 1173 CZ TYR A 74 4.974 19.302 7.636 1.00 32.22 C ATOM 1174 OH TYR A 74 5.255 18.357 8.578 1.00 54.22 O ATOM 0 H TYR A 74 3.326 23.195 2.404 1.00 63.30 H new ATOM 0 HA TYR A 74 3.082 20.517 3.203 1.00 52.44 H new ATOM 0 HB2 TYR A 74 4.815 22.219 3.831 1.00 65.24 H new ATOM 0 HB3 TYR A 74 3.624 22.994 4.858 1.00 65.24 H new ATOM 0 HD1 TYR A 74 2.534 21.528 6.748 1.00 73.24 H new ATOM 0 HD2 TYR A 74 6.147 20.483 4.651 1.00 54.42 H new ATOM 0 HE1 TYR A 74 3.158 19.985 8.596 1.00 53.34 H new ATOM 0 HE2 TYR A 74 6.751 18.904 6.465 1.00 4.24 H new ATOM 0 HH TYR A 74 5.616 17.557 8.142 1.00 54.22 H new ATOM 1184 N GLU A 75 0.852 22.564 4.588 1.00 23.11 N ATOM 1185 CA GLU A 75 -0.381 22.530 5.360 1.00 51.30 C ATOM 1186 C GLU A 75 -1.557 22.104 4.491 1.00 51.00 C ATOM 1187 O GLU A 75 -2.391 21.335 4.961 1.00 34.13 O ATOM 1188 CB GLU A 75 -0.659 23.865 6.060 1.00 51.02 C ATOM 1189 CG GLU A 75 -1.002 23.581 7.525 1.00 54.00 C ATOM 1190 CD GLU A 75 -1.336 24.836 8.328 1.00 11.01 C ATOM 1191 OE1 GLU A 75 -1.666 25.882 7.729 1.00 11.25 O ATOM 1192 OE2 GLU A 75 -1.268 24.754 9.577 1.00 12.14 O ATOM 0 H GLU A 75 1.182 23.498 4.343 1.00 23.11 H new ATOM 0 HA GLU A 75 -0.252 21.783 6.143 1.00 51.30 H new ATOM 0 HB2 GLU A 75 0.212 24.516 5.994 1.00 51.02 H new ATOM 0 HB3 GLU A 75 -1.483 24.385 5.572 1.00 51.02 H new ATOM 0 HG2 GLU A 75 -1.850 22.897 7.565 1.00 54.00 H new ATOM 0 HG3 GLU A 75 -0.160 23.072 7.995 1.00 54.00 H new ATOM 1199 N GLU A 76 -1.596 22.518 3.220 1.00 41.03 N ATOM 1200 CA GLU A 76 -2.607 22.055 2.270 1.00 21.21 C ATOM 1201 C GLU A 76 -2.650 20.533 2.231 1.00 71.34 C ATOM 1202 O GLU A 76 -3.740 19.964 2.154 1.00 4.23 O ATOM 1203 CB GLU A 76 -2.309 22.540 0.848 1.00 4.34 C ATOM 1204 CG GLU A 76 -2.674 24.001 0.600 1.00 51.13 C ATOM 1205 CD GLU A 76 -3.769 24.116 -0.459 1.00 34.15 C ATOM 1206 OE1 GLU A 76 -4.934 23.772 -0.140 1.00 73.51 O ATOM 1207 OE2 GLU A 76 -3.454 24.497 -1.608 1.00 65.20 O ATOM 0 H GLU A 76 -0.929 23.181 2.824 1.00 41.03 H new ATOM 0 HA GLU A 76 -3.560 22.462 2.608 1.00 21.21 H new ATOM 0 HB2 GLU A 76 -1.247 22.402 0.643 1.00 4.34 H new ATOM 0 HB3 GLU A 76 -2.854 21.915 0.141 1.00 4.34 H new ATOM 0 HG2 GLU A 76 -3.012 24.459 1.530 1.00 51.13 H new ATOM 0 HG3 GLU A 76 -1.790 24.551 0.277 1.00 51.13 H new ATOM 1214 N THR A 77 -1.484 19.885 2.296 1.00 24.25 N ATOM 1215 CA THR A 77 -1.389 18.429 2.338 1.00 70.53 C ATOM 1216 C THR A 77 -2.194 17.908 3.541 1.00 42.01 C ATOM 1217 O THR A 77 -3.081 17.066 3.375 1.00 70.33 O ATOM 1218 CB THR A 77 0.093 17.995 2.349 1.00 11.04 C ATOM 1219 OG1 THR A 77 0.803 18.551 1.244 1.00 21.34 O ATOM 1220 CG2 THR A 77 0.271 16.475 2.280 1.00 30.22 C ATOM 0 H THR A 77 -0.581 20.358 2.321 1.00 24.25 H new ATOM 0 HA THR A 77 -1.826 17.985 1.444 1.00 70.53 H new ATOM 0 HB THR A 77 0.489 18.363 3.296 1.00 11.04 H new ATOM 0 HG1 THR A 77 0.906 19.517 1.374 1.00 21.34 H new ATOM 0 HG21 THR A 77 1.334 16.232 2.291 1.00 30.22 H new ATOM 0 HG22 THR A 77 -0.216 16.012 3.138 1.00 30.22 H new ATOM 0 HG23 THR A 77 -0.178 16.097 1.361 1.00 30.22 H new ATOM 1228 N LEU A 78 -1.940 18.441 4.742 1.00 51.12 N ATOM 1229 CA LEU A 78 -2.590 17.988 5.966 1.00 43.14 C ATOM 1230 C LEU A 78 -4.088 18.265 5.954 1.00 61.32 C ATOM 1231 O LEU A 78 -4.869 17.453 6.448 1.00 32.41 O ATOM 1232 CB LEU A 78 -2.012 18.697 7.193 1.00 1.35 C ATOM 1233 CG LEU A 78 -0.481 18.746 7.280 1.00 10.04 C ATOM 1234 CD1 LEU A 78 -0.095 19.391 8.607 1.00 1.23 C ATOM 1235 CD2 LEU A 78 0.178 17.376 7.111 1.00 10.15 C ATOM 0 H LEU A 78 -1.275 19.201 4.887 1.00 51.12 H new ATOM 0 HA LEU A 78 -2.410 16.914 6.017 1.00 43.14 H new ATOM 0 HB2 LEU A 78 -2.390 19.719 7.210 1.00 1.35 H new ATOM 0 HB3 LEU A 78 -2.392 18.202 8.087 1.00 1.35 H new ATOM 0 HG LEU A 78 -0.109 19.344 6.448 1.00 10.04 H new ATOM 0 HD11 LEU A 78 0.991 19.435 8.688 1.00 1.23 H new ATOM 0 HD12 LEU A 78 -0.504 20.400 8.653 1.00 1.23 H new ATOM 0 HD13 LEU A 78 -0.496 18.799 9.430 1.00 1.23 H new ATOM 0 HD21 LEU A 78 1.260 17.482 7.183 1.00 10.15 H new ATOM 0 HD22 LEU A 78 -0.174 16.704 7.894 1.00 10.15 H new ATOM 0 HD23 LEU A 78 -0.082 16.965 6.136 1.00 10.15 H new ATOM 1247 N LEU A 79 -4.482 19.429 5.446 1.00 61.14 N ATOM 1248 CA LEU A 79 -5.865 19.890 5.409 1.00 71.23 C ATOM 1249 C LEU A 79 -6.673 19.071 4.415 1.00 41.21 C ATOM 1250 O LEU A 79 -7.826 18.729 4.672 1.00 4.43 O ATOM 1251 CB LEU A 79 -5.893 21.383 5.031 1.00 63.51 C ATOM 1252 CG LEU A 79 -5.924 22.337 6.241 1.00 33.15 C ATOM 1253 CD1 LEU A 79 -4.861 22.016 7.301 1.00 63.14 C ATOM 1254 CD2 LEU A 79 -5.688 23.764 5.740 1.00 65.23 C ATOM 0 H LEU A 79 -3.828 20.097 5.037 1.00 61.14 H new ATOM 0 HA LEU A 79 -6.314 19.761 6.394 1.00 71.23 H new ATOM 0 HB2 LEU A 79 -5.016 21.610 4.425 1.00 63.51 H new ATOM 0 HB3 LEU A 79 -6.768 21.573 4.409 1.00 63.51 H new ATOM 0 HG LEU A 79 -6.898 22.220 6.715 1.00 33.15 H new ATOM 0 HD11 LEU A 79 -4.941 22.727 8.123 1.00 63.14 H new ATOM 0 HD12 LEU A 79 -5.017 21.005 7.678 1.00 63.14 H new ATOM 0 HD13 LEU A 79 -3.869 22.087 6.855 1.00 63.14 H new ATOM 0 HD21 LEU A 79 -5.707 24.454 6.584 1.00 65.23 H new ATOM 0 HD22 LEU A 79 -4.718 23.821 5.247 1.00 65.23 H new ATOM 0 HD23 LEU A 79 -6.471 24.035 5.032 1.00 65.23 H new ATOM 1266 N LEU A 80 -6.088 18.732 3.272 1.00 65.44 N ATOM 1267 CA LEU A 80 -6.766 17.879 2.308 1.00 74.13 C ATOM 1268 C LEU A 80 -6.953 16.478 2.891 1.00 14.04 C ATOM 1269 O LEU A 80 -8.015 15.878 2.720 1.00 64.54 O ATOM 1270 CB LEU A 80 -5.999 17.863 0.982 1.00 25.54 C ATOM 1271 CG LEU A 80 -6.713 17.064 -0.123 1.00 73.21 C ATOM 1272 CD1 LEU A 80 -8.157 17.528 -0.353 1.00 5.01 C ATOM 1273 CD2 LEU A 80 -5.918 17.224 -1.419 1.00 22.53 C ATOM 0 H LEU A 80 -5.154 19.032 2.993 1.00 65.44 H new ATOM 0 HA LEU A 80 -7.758 18.279 2.098 1.00 74.13 H new ATOM 0 HB2 LEU A 80 -5.852 18.888 0.643 1.00 25.54 H new ATOM 0 HB3 LEU A 80 -5.009 17.437 1.147 1.00 25.54 H new ATOM 0 HG LEU A 80 -6.761 16.022 0.192 1.00 73.21 H new ATOM 0 HD11 LEU A 80 -8.610 16.929 -1.143 1.00 5.01 H new ATOM 0 HD12 LEU A 80 -8.729 17.408 0.567 1.00 5.01 H new ATOM 0 HD13 LEU A 80 -8.159 18.578 -0.647 1.00 5.01 H new ATOM 0 HD21 LEU A 80 -6.407 16.665 -2.217 1.00 22.53 H new ATOM 0 HD22 LEU A 80 -5.872 18.279 -1.690 1.00 22.53 H new ATOM 0 HD23 LEU A 80 -4.907 16.842 -1.275 1.00 22.53 H new ATOM 1285 N GLU A 81 -5.954 15.983 3.628 1.00 1.22 N ATOM 1286 CA GLU A 81 -6.007 14.698 4.314 1.00 23.14 C ATOM 1287 C GLU A 81 -7.146 14.703 5.329 1.00 24.51 C ATOM 1288 O GLU A 81 -8.052 13.872 5.253 1.00 65.41 O ATOM 1289 CB GLU A 81 -4.647 14.453 4.983 1.00 12.04 C ATOM 1290 CG GLU A 81 -4.479 13.053 5.582 1.00 63.44 C ATOM 1291 CD GLU A 81 -3.396 13.039 6.661 1.00 72.14 C ATOM 1292 OE1 GLU A 81 -2.421 13.824 6.561 1.00 73.32 O ATOM 1293 OE2 GLU A 81 -3.588 12.346 7.683 1.00 34.15 O ATOM 0 H GLU A 81 -5.072 16.477 3.764 1.00 1.22 H new ATOM 0 HA GLU A 81 -6.203 13.889 3.611 1.00 23.14 H new ATOM 0 HB2 GLU A 81 -3.859 14.617 4.248 1.00 12.04 H new ATOM 0 HB3 GLU A 81 -4.506 15.192 5.772 1.00 12.04 H new ATOM 0 HG2 GLU A 81 -5.426 12.721 6.009 1.00 63.44 H new ATOM 0 HG3 GLU A 81 -4.220 12.346 4.794 1.00 63.44 H new ATOM 1300 N LYS A 82 -7.114 15.647 6.275 1.00 30.12 N ATOM 1301 CA LYS A 82 -8.080 15.688 7.361 1.00 14.14 C ATOM 1302 C LYS A 82 -9.496 15.789 6.789 1.00 24.53 C ATOM 1303 O LYS A 82 -10.355 15.010 7.193 1.00 42.22 O ATOM 1304 CB LYS A 82 -7.693 16.763 8.402 1.00 24.13 C ATOM 1305 CG LYS A 82 -8.173 18.184 8.096 1.00 64.54 C ATOM 1306 CD LYS A 82 -7.449 19.291 8.886 1.00 11.12 C ATOM 1307 CE LYS A 82 -8.208 19.767 10.126 1.00 41.33 C ATOM 1308 NZ LYS A 82 -8.234 18.768 11.208 1.00 65.10 N ATOM 0 H LYS A 82 -6.421 16.395 6.304 1.00 30.12 H new ATOM 0 HA LYS A 82 -8.067 14.757 7.928 1.00 14.14 H new ATOM 0 HB2 LYS A 82 -8.093 16.465 9.371 1.00 24.13 H new ATOM 0 HB3 LYS A 82 -6.607 16.778 8.496 1.00 24.13 H new ATOM 0 HG2 LYS A 82 -8.046 18.374 7.030 1.00 64.54 H new ATOM 0 HG3 LYS A 82 -9.241 18.246 8.306 1.00 64.54 H new ATOM 0 HD2 LYS A 82 -6.469 18.924 9.191 1.00 11.12 H new ATOM 0 HD3 LYS A 82 -7.280 20.142 8.227 1.00 11.12 H new ATOM 0 HE2 LYS A 82 -7.748 20.683 10.497 1.00 41.33 H new ATOM 0 HE3 LYS A 82 -9.231 20.016 9.845 1.00 41.33 H new ATOM 0 HZ1 LYS A 82 -8.747 19.155 12.026 1.00 65.10 H new ATOM 0 HZ2 LYS A 82 -8.713 17.907 10.874 1.00 65.10 H new ATOM 0 HZ3 LYS A 82 -7.260 18.535 11.489 1.00 65.10 H new ATOM 1322 N LYS A 83 -9.727 16.646 5.789 1.00 72.51 N ATOM 1323 CA LYS A 83 -11.028 16.821 5.155 1.00 61.44 C ATOM 1324 C LYS A 83 -11.510 15.525 4.504 1.00 32.14 C ATOM 1325 O LYS A 83 -12.670 15.160 4.674 1.00 53.11 O ATOM 1326 CB LYS A 83 -10.911 17.990 4.170 1.00 45.44 C ATOM 1327 CG LYS A 83 -12.209 18.314 3.417 1.00 64.54 C ATOM 1328 CD LYS A 83 -12.047 18.300 1.892 1.00 3.31 C ATOM 1329 CE LYS A 83 -11.626 16.930 1.343 1.00 25.14 C ATOM 1330 NZ LYS A 83 -11.853 16.854 -0.115 1.00 5.32 N ATOM 0 H LYS A 83 -9.001 17.244 5.395 1.00 72.51 H new ATOM 0 HA LYS A 83 -11.791 17.061 5.895 1.00 61.44 H new ATOM 0 HB2 LYS A 83 -10.589 18.878 4.714 1.00 45.44 H new ATOM 0 HB3 LYS A 83 -10.131 17.761 3.444 1.00 45.44 H new ATOM 0 HG2 LYS A 83 -12.975 17.592 3.700 1.00 64.54 H new ATOM 0 HG3 LYS A 83 -12.566 19.296 3.728 1.00 64.54 H new ATOM 0 HD2 LYS A 83 -12.989 18.596 1.430 1.00 3.31 H new ATOM 0 HD3 LYS A 83 -11.304 19.044 1.605 1.00 3.31 H new ATOM 0 HE2 LYS A 83 -10.572 16.755 1.561 1.00 25.14 H new ATOM 0 HE3 LYS A 83 -12.190 16.144 1.844 1.00 25.14 H new ATOM 0 HZ1 LYS A 83 -11.561 15.919 -0.464 1.00 5.32 H new ATOM 0 HZ2 LYS A 83 -12.863 16.999 -0.317 1.00 5.32 H new ATOM 0 HZ3 LYS A 83 -11.295 17.591 -0.592 1.00 5.32 H new ATOM 1344 N LEU A 84 -10.646 14.806 3.781 1.00 13.41 N ATOM 1345 CA LEU A 84 -11.014 13.530 3.161 1.00 4.43 C ATOM 1346 C LEU A 84 -11.576 12.550 4.194 1.00 30.45 C ATOM 1347 O LEU A 84 -12.520 11.811 3.911 1.00 34.54 O ATOM 1348 CB LEU A 84 -9.781 12.915 2.470 1.00 23.23 C ATOM 1349 CG LEU A 84 -9.743 13.138 0.955 1.00 53.24 C ATOM 1350 CD1 LEU A 84 -8.341 12.828 0.420 1.00 44.04 C ATOM 1351 CD2 LEU A 84 -10.768 12.245 0.241 1.00 70.22 C ATOM 0 H LEU A 84 -9.681 15.089 3.610 1.00 13.41 H new ATOM 0 HA LEU A 84 -11.792 13.722 2.422 1.00 4.43 H new ATOM 0 HB2 LEU A 84 -8.880 13.339 2.912 1.00 23.23 H new ATOM 0 HB3 LEU A 84 -9.761 11.844 2.670 1.00 23.23 H new ATOM 0 HG LEU A 84 -9.993 14.181 0.759 1.00 53.24 H new ATOM 0 HD11 LEU A 84 -8.319 12.988 -0.658 1.00 44.04 H new ATOM 0 HD12 LEU A 84 -7.615 13.485 0.899 1.00 44.04 H new ATOM 0 HD13 LEU A 84 -8.090 11.790 0.638 1.00 44.04 H new ATOM 0 HD21 LEU A 84 -10.720 12.423 -0.833 1.00 70.22 H new ATOM 0 HD22 LEU A 84 -10.543 11.198 0.446 1.00 70.22 H new ATOM 0 HD23 LEU A 84 -11.769 12.479 0.603 1.00 70.22 H new ATOM 1363 N ARG A 85 -10.982 12.529 5.387 1.00 14.33 N ATOM 1364 CA ARG A 85 -11.364 11.631 6.470 1.00 73.42 C ATOM 1365 C ARG A 85 -12.635 12.104 7.190 1.00 22.24 C ATOM 1366 O ARG A 85 -13.246 11.308 7.893 1.00 10.41 O ATOM 1367 CB ARG A 85 -10.175 11.518 7.439 1.00 72.51 C ATOM 1368 CG ARG A 85 -8.919 10.868 6.806 1.00 41.23 C ATOM 1369 CD ARG A 85 -7.612 11.378 7.433 1.00 63.11 C ATOM 1370 NE ARG A 85 -7.660 11.282 8.891 1.00 5.11 N ATOM 1371 CZ ARG A 85 -6.986 12.030 9.765 1.00 34.53 C ATOM 1372 NH1 ARG A 85 -5.869 12.677 9.423 1.00 61.41 N ATOM 1373 NH2 ARG A 85 -7.479 12.127 10.996 1.00 52.32 N ATOM 0 H ARG A 85 -10.208 13.148 5.629 1.00 14.33 H new ATOM 0 HA ARG A 85 -11.603 10.650 6.059 1.00 73.42 H new ATOM 0 HB2 ARG A 85 -9.916 12.513 7.801 1.00 72.51 H new ATOM 0 HB3 ARG A 85 -10.479 10.933 8.307 1.00 72.51 H new ATOM 0 HG2 ARG A 85 -8.976 9.786 6.923 1.00 41.23 H new ATOM 0 HG3 ARG A 85 -8.909 11.073 5.735 1.00 41.23 H new ATOM 0 HD2 ARG A 85 -6.771 10.797 7.054 1.00 63.11 H new ATOM 0 HD3 ARG A 85 -7.443 12.414 7.138 1.00 63.11 H new ATOM 0 HE ARG A 85 -8.274 10.567 9.281 1.00 5.11 H new ATOM 0 HH11 ARG A 85 -5.510 12.606 8.471 1.00 61.41 H new ATOM 0 HH12 ARG A 85 -5.375 13.242 10.114 1.00 61.41 H new ATOM 0 HH21 ARG A 85 -8.341 11.639 11.240 1.00 52.32 H new ATOM 0 HH22 ARG A 85 -6.995 12.689 11.696 1.00 52.32 H new ATOM 1387 N GLU A 86 -13.073 13.356 7.035 1.00 3.04 N ATOM 1388 CA GLU A 86 -14.300 13.847 7.639 1.00 21.23 C ATOM 1389 C GLU A 86 -15.517 13.474 6.799 1.00 65.34 C ATOM 1390 O GLU A 86 -16.572 13.150 7.350 1.00 14.25 O ATOM 1391 CB GLU A 86 -14.215 15.367 7.742 1.00 61.21 C ATOM 1392 CG GLU A 86 -13.262 15.801 8.848 1.00 63.40 C ATOM 1393 CD GLU A 86 -13.279 17.309 9.034 1.00 24.51 C ATOM 1394 OE1 GLU A 86 -12.930 18.064 8.096 1.00 13.22 O ATOM 1395 OE2 GLU A 86 -13.551 17.758 10.169 1.00 1.02 O ATOM 0 H GLU A 86 -12.579 14.056 6.482 1.00 3.04 H new ATOM 0 HA GLU A 86 -14.412 13.394 8.624 1.00 21.23 H new ATOM 0 HB2 GLU A 86 -13.880 15.779 6.790 1.00 61.21 H new ATOM 0 HB3 GLU A 86 -15.207 15.775 7.935 1.00 61.21 H new ATOM 0 HG2 GLU A 86 -13.541 15.314 9.783 1.00 63.40 H new ATOM 0 HG3 GLU A 86 -12.250 15.474 8.608 1.00 63.40 H new ATOM 1402 N ASP A 87 -15.386 13.543 5.471 1.00 24.53 N ATOM 1403 CA ASP A 87 -16.483 13.235 4.552 1.00 25.22 C ATOM 1404 C ASP A 87 -16.693 11.724 4.506 1.00 73.13 C ATOM 1405 O ASP A 87 -17.823 11.228 4.465 1.00 44.42 O ATOM 1406 CB ASP A 87 -16.169 13.773 3.147 1.00 62.32 C ATOM 1407 CG ASP A 87 -17.296 14.669 2.646 1.00 33.43 C ATOM 1408 OD1 ASP A 87 -17.268 15.882 2.976 1.00 65.24 O ATOM 1409 OD2 ASP A 87 -18.170 14.201 1.892 1.00 5.24 O ATOM 0 H ASP A 87 -14.520 13.813 5.005 1.00 24.53 H new ATOM 0 HA ASP A 87 -17.395 13.715 4.906 1.00 25.22 H new ATOM 0 HB2 ASP A 87 -15.235 14.334 3.168 1.00 62.32 H new ATOM 0 HB3 ASP A 87 -16.026 12.941 2.458 1.00 62.32 H new ATOM 1414 N PHE A 88 -15.588 10.972 4.560 1.00 65.23 N ATOM 1415 CA PHE A 88 -15.595 9.523 4.454 1.00 51.03 C ATOM 1416 C PHE A 88 -14.786 8.924 5.610 1.00 13.22 C ATOM 1417 O PHE A 88 -13.702 8.381 5.387 1.00 22.34 O ATOM 1418 CB PHE A 88 -15.110 9.087 3.060 1.00 13.43 C ATOM 1419 CG PHE A 88 -15.501 10.009 1.921 1.00 1.11 C ATOM 1420 CD1 PHE A 88 -16.851 10.132 1.541 1.00 22.41 C ATOM 1421 CD2 PHE A 88 -14.512 10.744 1.237 1.00 63.23 C ATOM 1422 CE1 PHE A 88 -17.202 10.950 0.454 1.00 23.15 C ATOM 1423 CE2 PHE A 88 -14.862 11.541 0.133 1.00 41.20 C ATOM 1424 CZ PHE A 88 -16.208 11.648 -0.253 1.00 33.41 C ATOM 0 H PHE A 88 -14.655 11.366 4.680 1.00 65.23 H new ATOM 0 HA PHE A 88 -16.610 9.136 4.548 1.00 51.03 H new ATOM 0 HB2 PHE A 88 -14.023 9.003 3.081 1.00 13.43 H new ATOM 0 HB3 PHE A 88 -15.503 8.092 2.851 1.00 13.43 H new ATOM 0 HD1 PHE A 88 -17.616 9.598 2.085 1.00 22.41 H new ATOM 0 HD2 PHE A 88 -13.483 10.695 1.562 1.00 63.23 H new ATOM 0 HE1 PHE A 88 -18.237 11.043 0.161 1.00 23.15 H new ATOM 0 HE2 PHE A 88 -14.098 12.070 -0.417 1.00 41.20 H new ATOM 0 HZ PHE A 88 -16.480 12.268 -1.095 1.00 33.41 H new ATOM 1434 N PRO A 89 -15.301 8.976 6.852 1.00 50.32 N ATOM 1435 CA PRO A 89 -14.594 8.462 8.022 1.00 5.15 C ATOM 1436 C PRO A 89 -14.451 6.938 7.995 1.00 61.21 C ATOM 1437 O PRO A 89 -13.687 6.379 8.779 1.00 2.45 O ATOM 1438 CB PRO A 89 -15.409 8.942 9.226 1.00 45.32 C ATOM 1439 CG PRO A 89 -16.831 9.020 8.673 1.00 44.22 C ATOM 1440 CD PRO A 89 -16.611 9.485 7.235 1.00 21.42 C ATOM 0 HA PRO A 89 -13.568 8.829 8.058 1.00 5.15 H new ATOM 0 HB2 PRO A 89 -15.339 8.247 10.063 1.00 45.32 H new ATOM 0 HB3 PRO A 89 -15.063 9.911 9.587 1.00 45.32 H new ATOM 0 HG2 PRO A 89 -17.334 8.054 8.713 1.00 44.22 H new ATOM 0 HG3 PRO A 89 -17.446 9.723 9.236 1.00 44.22 H new ATOM 0 HD2 PRO A 89 -17.389 9.100 6.576 1.00 21.42 H new ATOM 0 HD3 PRO A 89 -16.644 10.572 7.166 1.00 21.42 H new ATOM 1448 N GLN A 90 -15.143 6.267 7.074 1.00 53.04 N ATOM 1449 CA GLN A 90 -15.044 4.844 6.808 1.00 64.52 C ATOM 1450 C GLN A 90 -13.681 4.424 6.235 1.00 70.53 C ATOM 1451 O GLN A 90 -13.466 3.231 6.022 1.00 53.31 O ATOM 1452 CB GLN A 90 -16.182 4.489 5.835 1.00 3.42 C ATOM 1453 CG GLN A 90 -15.978 5.091 4.431 1.00 42.34 C ATOM 1454 CD GLN A 90 -17.173 5.871 3.900 1.00 73.42 C ATOM 1455 OE1 GLN A 90 -17.538 6.918 4.433 1.00 21.55 O ATOM 1456 NE2 GLN A 90 -17.744 5.419 2.799 1.00 70.40 N ATOM 0 H GLN A 90 -15.819 6.730 6.467 1.00 53.04 H new ATOM 0 HA GLN A 90 -15.134 4.299 7.748 1.00 64.52 H new ATOM 0 HB2 GLN A 90 -16.258 3.405 5.753 1.00 3.42 H new ATOM 0 HB3 GLN A 90 -17.128 4.845 6.244 1.00 3.42 H new ATOM 0 HG2 GLN A 90 -15.111 5.751 4.455 1.00 42.34 H new ATOM 0 HG3 GLN A 90 -15.747 4.286 3.734 1.00 42.34 H new ATOM 0 HE21 GLN A 90 -17.421 4.548 2.378 1.00 70.40 H new ATOM 0 HE22 GLN A 90 -18.508 5.941 2.369 1.00 70.40 H new ATOM 1465 N TYR A 91 -12.805 5.380 5.903 1.00 3.12 N ATOM 1466 CA TYR A 91 -11.616 5.193 5.088 1.00 10.31 C ATOM 1467 C TYR A 91 -10.493 6.076 5.640 1.00 61.21 C ATOM 1468 O TYR A 91 -10.602 7.302 5.690 1.00 34.11 O ATOM 1469 CB TYR A 91 -11.932 5.608 3.643 1.00 65.53 C ATOM 1470 CG TYR A 91 -12.942 4.789 2.848 1.00 24.32 C ATOM 1471 CD1 TYR A 91 -13.055 3.392 3.007 1.00 54.14 C ATOM 1472 CD2 TYR A 91 -13.757 5.443 1.903 1.00 11.31 C ATOM 1473 CE1 TYR A 91 -13.971 2.662 2.225 1.00 14.03 C ATOM 1474 CE2 TYR A 91 -14.632 4.714 1.080 1.00 24.55 C ATOM 1475 CZ TYR A 91 -14.736 3.319 1.236 1.00 30.54 C ATOM 1476 OH TYR A 91 -15.597 2.632 0.445 1.00 34.44 O ATOM 0 H TYR A 91 -12.918 6.345 6.213 1.00 3.12 H new ATOM 0 HA TYR A 91 -11.305 4.149 5.109 1.00 10.31 H new ATOM 0 HB2 TYR A 91 -12.287 6.638 3.666 1.00 65.53 H new ATOM 0 HB3 TYR A 91 -10.995 5.606 3.087 1.00 65.53 H new ATOM 0 HD1 TYR A 91 -12.437 2.881 3.730 1.00 54.14 H new ATOM 0 HD2 TYR A 91 -13.709 6.518 1.810 1.00 11.31 H new ATOM 0 HE1 TYR A 91 -14.088 1.600 2.382 1.00 14.03 H new ATOM 0 HE2 TYR A 91 -15.222 5.222 0.331 1.00 24.55 H new ATOM 0 HH TYR A 91 -15.756 1.744 0.828 1.00 34.44 H new ATOM 1486 N GLN A 92 -9.399 5.449 6.059 1.00 63.22 N ATOM 1487 CA GLN A 92 -8.262 6.116 6.683 1.00 61.32 C ATOM 1488 C GLN A 92 -7.302 6.690 5.624 1.00 61.52 C ATOM 1489 O GLN A 92 -6.197 6.172 5.474 1.00 62.23 O ATOM 1490 CB GLN A 92 -7.545 5.090 7.584 1.00 53.21 C ATOM 1491 CG GLN A 92 -8.391 4.523 8.720 1.00 51.02 C ATOM 1492 CD GLN A 92 -7.505 3.824 9.751 1.00 61.22 C ATOM 1493 OE1 GLN A 92 -6.663 4.429 10.419 1.00 70.51 O ATOM 1494 NE2 GLN A 92 -7.664 2.525 9.875 1.00 11.05 N ATOM 0 H GLN A 92 -9.275 4.440 5.972 1.00 63.22 H new ATOM 0 HA GLN A 92 -8.609 6.959 7.280 1.00 61.32 H new ATOM 0 HB2 GLN A 92 -7.198 4.264 6.963 1.00 53.21 H new ATOM 0 HB3 GLN A 92 -6.660 5.561 8.011 1.00 53.21 H new ATOM 0 HG2 GLN A 92 -8.952 5.326 9.199 1.00 51.02 H new ATOM 0 HG3 GLN A 92 -9.120 3.818 8.321 1.00 51.02 H new ATOM 0 HE21 GLN A 92 -8.365 2.041 9.314 1.00 11.05 H new ATOM 0 HE22 GLN A 92 -7.086 2.001 10.532 1.00 11.05 H new ATOM 1503 N TRP A 93 -7.696 7.737 4.890 1.00 70.52 N ATOM 1504 CA TRP A 93 -6.924 8.338 3.792 1.00 5.01 C ATOM 1505 C TRP A 93 -5.582 8.960 4.247 1.00 30.42 C ATOM 1506 O TRP A 93 -5.524 10.126 4.639 1.00 65.54 O ATOM 1507 CB TRP A 93 -7.777 9.396 3.074 1.00 12.25 C ATOM 1508 CG TRP A 93 -9.125 8.969 2.574 1.00 44.40 C ATOM 1509 CD1 TRP A 93 -10.292 9.151 3.229 1.00 31.15 C ATOM 1510 CD2 TRP A 93 -9.475 8.283 1.333 1.00 61.31 C ATOM 1511 NE1 TRP A 93 -11.337 8.710 2.446 1.00 45.22 N ATOM 1512 CE2 TRP A 93 -10.891 8.137 1.273 1.00 54.00 C ATOM 1513 CE3 TRP A 93 -8.737 7.744 0.260 1.00 41.24 C ATOM 1514 CZ2 TRP A 93 -11.531 7.489 0.202 1.00 13.15 C ATOM 1515 CZ3 TRP A 93 -9.364 7.084 -0.812 1.00 5.31 C ATOM 1516 CH2 TRP A 93 -10.758 6.932 -0.829 1.00 51.11 C ATOM 0 H TRP A 93 -8.588 8.205 5.047 1.00 70.52 H new ATOM 0 HA TRP A 93 -6.671 7.527 3.109 1.00 5.01 H new ATOM 0 HB2 TRP A 93 -7.920 10.234 3.756 1.00 12.25 H new ATOM 0 HB3 TRP A 93 -7.205 9.771 2.225 1.00 12.25 H new ATOM 0 HD1 TRP A 93 -10.391 9.577 4.216 1.00 31.15 H new ATOM 0 HE1 TRP A 93 -12.320 8.797 2.703 1.00 45.22 H new ATOM 0 HE3 TRP A 93 -7.661 7.840 0.261 1.00 41.24 H new ATOM 0 HZ2 TRP A 93 -12.608 7.420 0.173 1.00 13.15 H new ATOM 0 HZ3 TRP A 93 -8.770 6.693 -1.625 1.00 5.31 H new ATOM 0 HH2 TRP A 93 -11.235 6.389 -1.632 1.00 51.11 H new ATOM 1527 N GLU A 94 -4.485 8.214 4.146 1.00 42.02 N ATOM 1528 CA GLU A 94 -3.123 8.589 4.527 1.00 73.24 C ATOM 1529 C GLU A 94 -2.434 9.337 3.369 1.00 65.30 C ATOM 1530 O GLU A 94 -1.603 8.760 2.658 1.00 4.01 O ATOM 1531 CB GLU A 94 -2.342 7.307 4.883 1.00 21.22 C ATOM 1532 CG GLU A 94 -2.874 6.566 6.117 1.00 10.01 C ATOM 1533 CD GLU A 94 -2.233 7.058 7.416 1.00 3.45 C ATOM 1534 OE1 GLU A 94 -1.014 6.868 7.636 1.00 42.11 O ATOM 1535 OE2 GLU A 94 -2.927 7.709 8.230 1.00 34.52 O ATOM 0 H GLU A 94 -4.525 7.267 3.770 1.00 42.02 H new ATOM 0 HA GLU A 94 -3.148 9.254 5.390 1.00 73.24 H new ATOM 0 HB2 GLU A 94 -2.368 6.631 4.028 1.00 21.22 H new ATOM 0 HB3 GLU A 94 -1.297 7.567 5.052 1.00 21.22 H new ATOM 0 HG2 GLU A 94 -3.955 6.695 6.177 1.00 10.01 H new ATOM 0 HG3 GLU A 94 -2.687 5.498 6.005 1.00 10.01 H new ATOM 1542 N LEU A 95 -2.754 10.618 3.144 1.00 65.21 N ATOM 1543 CA LEU A 95 -2.089 11.420 2.102 1.00 51.12 C ATOM 1544 C LEU A 95 -0.593 11.571 2.392 1.00 33.35 C ATOM 1545 O LEU A 95 -0.200 11.809 3.535 1.00 25.25 O ATOM 1546 CB LEU A 95 -2.757 12.797 1.913 1.00 24.45 C ATOM 1547 CG LEU A 95 -3.800 12.801 0.781 1.00 63.43 C ATOM 1548 CD1 LEU A 95 -4.641 14.078 0.812 1.00 5.33 C ATOM 1549 CD2 LEU A 95 -3.147 12.747 -0.603 1.00 30.11 C ATOM 0 H LEU A 95 -3.469 11.123 3.668 1.00 65.21 H new ATOM 0 HA LEU A 95 -2.201 10.878 1.163 1.00 51.12 H new ATOM 0 HB2 LEU A 95 -3.237 13.094 2.845 1.00 24.45 H new ATOM 0 HB3 LEU A 95 -1.991 13.542 1.698 1.00 24.45 H new ATOM 0 HG LEU A 95 -4.415 11.916 0.945 1.00 63.43 H new ATOM 0 HD11 LEU A 95 -5.369 14.054 0.001 1.00 5.33 H new ATOM 0 HD12 LEU A 95 -5.163 14.147 1.767 1.00 5.33 H new ATOM 0 HD13 LEU A 95 -3.991 14.945 0.690 1.00 5.33 H new ATOM 0 HD21 LEU A 95 -3.921 12.752 -1.371 1.00 30.11 H new ATOM 0 HD22 LEU A 95 -2.500 13.615 -0.734 1.00 30.11 H new ATOM 0 HD23 LEU A 95 -2.555 11.836 -0.691 1.00 30.11 H new ATOM 1561 N LYS A 96 0.275 11.438 1.381 1.00 52.22 N ATOM 1562 CA LYS A 96 1.717 11.518 1.596 1.00 44.11 C ATOM 1563 C LYS A 96 2.462 12.088 0.391 1.00 32.45 C ATOM 1564 O LYS A 96 2.570 11.432 -0.649 1.00 13.21 O ATOM 1565 CB LYS A 96 2.230 10.131 2.003 1.00 45.33 C ATOM 1566 CG LYS A 96 3.656 10.142 2.568 1.00 54.32 C ATOM 1567 CD LYS A 96 3.729 10.640 4.019 1.00 4.05 C ATOM 1568 CE LYS A 96 3.777 12.167 4.081 1.00 72.24 C ATOM 1569 NZ LYS A 96 2.668 12.725 4.909 1.00 13.32 N ATOM 0 H LYS A 96 0.001 11.275 0.412 1.00 52.22 H new ATOM 0 HA LYS A 96 1.916 12.223 2.403 1.00 44.11 H new ATOM 0 HB2 LYS A 96 1.556 9.709 2.749 1.00 45.33 H new ATOM 0 HB3 LYS A 96 2.198 9.472 1.135 1.00 45.33 H new ATOM 0 HG2 LYS A 96 4.068 9.134 2.516 1.00 54.32 H new ATOM 0 HG3 LYS A 96 4.283 10.776 1.941 1.00 54.32 H new ATOM 0 HD2 LYS A 96 2.863 10.279 4.574 1.00 4.05 H new ATOM 0 HD3 LYS A 96 4.613 10.226 4.504 1.00 4.05 H new ATOM 0 HE2 LYS A 96 4.734 12.484 4.495 1.00 72.24 H new ATOM 0 HE3 LYS A 96 3.716 12.574 3.071 1.00 72.24 H new ATOM 0 HZ1 LYS A 96 2.685 13.764 4.857 1.00 13.32 H new ATOM 0 HZ2 LYS A 96 1.757 12.375 4.550 1.00 13.32 H new ATOM 0 HZ3 LYS A 96 2.788 12.426 5.898 1.00 13.32 H new ATOM 1583 N ASN A 97 2.983 13.309 0.552 1.00 22.34 N ATOM 1584 CA ASN A 97 3.666 14.058 -0.495 1.00 43.31 C ATOM 1585 C ASN A 97 5.149 13.629 -0.554 1.00 53.54 C ATOM 1586 O ASN A 97 5.981 14.237 0.109 1.00 43.42 O ATOM 1587 CB ASN A 97 3.445 15.589 -0.283 1.00 5.34 C ATOM 1588 CG ASN A 97 3.291 16.394 -1.574 1.00 2.14 C ATOM 1589 OD1 ASN A 97 3.658 15.964 -2.649 1.00 50.30 O ATOM 1590 ND2 ASN A 97 2.687 17.559 -1.558 1.00 3.33 N ATOM 0 H ASN A 97 2.937 13.812 1.438 1.00 22.34 H new ATOM 0 HA ASN A 97 3.246 13.831 -1.475 1.00 43.31 H new ATOM 0 HB2 ASN A 97 2.554 15.733 0.328 1.00 5.34 H new ATOM 0 HB3 ASN A 97 4.287 15.990 0.281 1.00 5.34 H new ATOM 0 HD21 ASN A 97 2.541 18.070 -2.429 1.00 3.33 H new ATOM 0 HD22 ASN A 97 2.364 17.954 -0.675 1.00 3.33 H new ATOM 1597 N GLN A 98 5.487 12.562 -1.295 1.00 44.40 N ATOM 1598 CA GLN A 98 6.820 11.887 -1.302 1.00 4.24 C ATOM 1599 C GLN A 98 8.013 12.815 -1.629 1.00 5.14 C ATOM 1600 O GLN A 98 9.161 12.563 -1.258 1.00 4.31 O ATOM 1601 CB GLN A 98 6.917 10.673 -2.253 1.00 62.02 C ATOM 1602 CG GLN A 98 5.704 9.743 -2.316 1.00 51.12 C ATOM 1603 CD GLN A 98 5.490 9.010 -1.003 1.00 61.00 C ATOM 1604 OE1 GLN A 98 6.368 8.309 -0.515 1.00 45.23 O ATOM 1605 NE2 GLN A 98 4.333 9.166 -0.394 1.00 42.30 N ATOM 0 H GLN A 98 4.825 12.120 -1.933 1.00 44.40 H new ATOM 0 HA GLN A 98 6.893 11.552 -0.267 1.00 4.24 H new ATOM 0 HB2 GLN A 98 7.111 11.045 -3.259 1.00 62.02 H new ATOM 0 HB3 GLN A 98 7.783 10.081 -1.959 1.00 62.02 H new ATOM 0 HG2 GLN A 98 4.813 10.322 -2.559 1.00 51.12 H new ATOM 0 HG3 GLN A 98 5.842 9.019 -3.119 1.00 51.12 H new ATOM 0 HE21 GLN A 98 3.611 9.753 -0.813 1.00 42.30 H new ATOM 0 HE22 GLN A 98 4.158 8.700 0.496 1.00 42.30 H new ATOM 1614 N VAL A 99 7.744 13.898 -2.333 1.00 45.41 N ATOM 1615 CA VAL A 99 8.584 15.087 -2.477 1.00 21.44 C ATOM 1616 C VAL A 99 9.100 15.674 -1.164 1.00 31.44 C ATOM 1617 O VAL A 99 10.298 15.906 -1.011 1.00 14.42 O ATOM 1618 CB VAL A 99 7.830 16.072 -3.388 1.00 4.22 C ATOM 1619 CG1 VAL A 99 6.345 16.166 -3.099 1.00 12.11 C ATOM 1620 CG2 VAL A 99 8.325 17.518 -3.351 1.00 71.34 C ATOM 0 H VAL A 99 6.874 13.983 -2.858 1.00 45.41 H new ATOM 0 HA VAL A 99 9.526 14.813 -2.951 1.00 21.44 H new ATOM 0 HB VAL A 99 8.031 15.628 -4.363 1.00 4.22 H new ATOM 0 HG11 VAL A 99 5.886 16.880 -3.783 1.00 12.11 H new ATOM 0 HG12 VAL A 99 5.885 15.187 -3.234 1.00 12.11 H new ATOM 0 HG13 VAL A 99 6.195 16.499 -2.072 1.00 12.11 H new ATOM 0 HG21 VAL A 99 7.725 18.125 -4.029 1.00 71.34 H new ATOM 0 HG22 VAL A 99 8.234 17.908 -2.337 1.00 71.34 H new ATOM 0 HG23 VAL A 99 9.369 17.553 -3.661 1.00 71.34 H new ATOM 1630 N TYR A 100 8.198 15.952 -0.236 1.00 2.35 N ATOM 1631 CA TYR A 100 8.489 16.553 1.069 1.00 21.04 C ATOM 1632 C TYR A 100 9.367 15.626 1.911 1.00 43.23 C ATOM 1633 O TYR A 100 10.590 15.755 1.872 1.00 71.43 O ATOM 1634 CB TYR A 100 7.200 16.966 1.784 1.00 53.14 C ATOM 1635 CG TYR A 100 6.596 18.240 1.242 1.00 41.44 C ATOM 1636 CD1 TYR A 100 5.861 18.216 0.045 1.00 23.35 C ATOM 1637 CD2 TYR A 100 6.769 19.453 1.933 1.00 21.42 C ATOM 1638 CE1 TYR A 100 5.202 19.365 -0.405 1.00 33.25 C ATOM 1639 CE2 TYR A 100 6.169 20.628 1.453 1.00 24.33 C ATOM 1640 CZ TYR A 100 5.361 20.581 0.299 1.00 33.04 C ATOM 1641 OH TYR A 100 4.787 21.723 -0.155 1.00 11.24 O ATOM 0 H TYR A 100 7.205 15.761 -0.370 1.00 2.35 H new ATOM 0 HA TYR A 100 9.061 17.468 0.913 1.00 21.04 H new ATOM 0 HB2 TYR A 100 6.471 16.161 1.696 1.00 53.14 H new ATOM 0 HB3 TYR A 100 7.407 17.094 2.846 1.00 53.14 H new ATOM 0 HD1 TYR A 100 5.804 17.305 -0.532 1.00 23.35 H new ATOM 0 HD2 TYR A 100 7.364 19.480 2.834 1.00 21.42 H new ATOM 0 HE1 TYR A 100 4.576 19.324 -1.284 1.00 33.25 H new ATOM 0 HE2 TYR A 100 6.326 21.565 1.966 1.00 24.33 H new ATOM 0 HH TYR A 100 3.898 21.522 -0.514 1.00 11.24 H new ATOM 1651 N MET A 101 8.772 14.672 2.630 1.00 74.30 N ATOM 1652 CA MET A 101 9.471 13.583 3.308 1.00 25.45 C ATOM 1653 C MET A 101 10.595 14.091 4.216 1.00 21.22 C ATOM 1654 O MET A 101 10.426 15.161 4.808 1.00 74.52 O ATOM 1655 CB MET A 101 9.817 12.484 2.292 1.00 72.30 C ATOM 1656 CG MET A 101 8.512 12.030 1.630 1.00 51.24 C ATOM 1657 SD MET A 101 7.084 11.697 2.702 1.00 14.12 S ATOM 1658 CE MET A 101 7.080 9.912 2.625 1.00 13.31 C ATOM 0 H MET A 101 7.761 14.637 2.759 1.00 74.30 H new ATOM 0 HA MET A 101 8.819 13.092 4.031 1.00 25.45 H new ATOM 0 HB2 MET A 101 10.514 12.861 1.544 1.00 72.30 H new ATOM 0 HB3 MET A 101 10.306 11.645 2.788 1.00 72.30 H new ATOM 0 HG2 MET A 101 8.219 12.795 0.911 1.00 51.24 H new ATOM 0 HG3 MET A 101 8.723 11.123 1.063 1.00 51.24 H new ATOM 0 HE1 MET A 101 6.585 9.511 3.509 1.00 13.31 H new ATOM 0 HE2 MET A 101 6.546 9.588 1.732 1.00 13.31 H new ATOM 0 HE3 MET A 101 8.106 9.547 2.587 1.00 13.31 H new ATOM 1668 N HIS A 102 11.618 13.263 4.471 1.00 5.42 N ATOM 1669 CA HIS A 102 12.570 13.254 5.593 1.00 21.22 C ATOM 1670 C HIS A 102 11.882 13.101 6.956 1.00 30.24 C ATOM 1671 O HIS A 102 12.282 12.286 7.774 1.00 25.54 O ATOM 1672 CB HIS A 102 13.579 14.423 5.545 1.00 32.12 C ATOM 1673 CG HIS A 102 13.096 15.743 6.103 1.00 3.43 C ATOM 1674 ND1 HIS A 102 12.882 16.041 7.423 1.00 32.22 N flip ATOM 1675 CD2 HIS A 102 12.780 16.865 5.376 1.00 70.23 C flip ATOM 1676 CE1 HIS A 102 12.379 17.347 7.491 1.00 21.34 C flip ATOM 1677 NE2 HIS A 102 12.359 17.811 6.228 1.00 11.05 N flip ATOM 0 H HIS A 102 11.821 12.500 3.826 1.00 5.42 H new ATOM 0 HA HIS A 102 13.171 12.354 5.464 1.00 21.22 H new ATOM 0 HB2 HIS A 102 14.474 14.126 6.092 1.00 32.12 H new ATOM 0 HB3 HIS A 102 13.876 14.577 4.508 1.00 32.12 H new ATOM 0 HD2 HIS A 102 12.857 16.967 4.304 1.00 70.23 H new ATOM 0 HE1 HIS A 102 12.069 17.876 8.380 1.00 21.34 H new ATOM 0 HE2 HIS A 102 12.065 18.749 5.957 1.00 11.05 H new ATOM 1685 N GLN A 103 10.810 13.848 7.200 1.00 25.15 N ATOM 1686 CA GLN A 103 10.118 13.965 8.474 1.00 34.11 C ATOM 1687 C GLN A 103 9.518 12.648 8.981 1.00 74.41 C ATOM 1688 O GLN A 103 9.140 12.559 10.150 1.00 21.45 O ATOM 1689 CB GLN A 103 9.073 15.079 8.340 1.00 25.21 C ATOM 1690 CG GLN A 103 7.903 14.697 7.437 1.00 65.53 C ATOM 1691 CD GLN A 103 7.306 15.897 6.722 1.00 74.32 C ATOM 1692 OE1 GLN A 103 6.270 16.417 7.118 1.00 21.32 O ATOM 1693 NE2 GLN A 103 7.925 16.357 5.642 1.00 5.11 N ATOM 0 H GLN A 103 10.379 14.418 6.472 1.00 25.15 H new ATOM 0 HA GLN A 103 10.845 14.224 9.244 1.00 34.11 H new ATOM 0 HB2 GLN A 103 8.693 15.333 9.329 1.00 25.21 H new ATOM 0 HB3 GLN A 103 9.553 15.974 7.944 1.00 25.21 H new ATOM 0 HG2 GLN A 103 8.240 13.969 6.699 1.00 65.53 H new ATOM 0 HG3 GLN A 103 7.131 14.212 8.034 1.00 65.53 H new ATOM 0 HE21 GLN A 103 8.787 15.916 5.322 1.00 5.11 H new ATOM 0 HE22 GLN A 103 7.539 17.152 5.132 1.00 5.11 H new ATOM 1702 N HIS A 104 9.437 11.626 8.124 1.00 64.52 N ATOM 1703 CA HIS A 104 8.941 10.305 8.467 1.00 14.24 C ATOM 1704 C HIS A 104 9.976 9.205 8.185 1.00 62.44 C ATOM 1705 O HIS A 104 9.651 8.033 8.386 1.00 23.43 O ATOM 1706 CB HIS A 104 7.635 10.024 7.708 1.00 71.30 C ATOM 1707 CG HIS A 104 6.610 11.132 7.697 1.00 72.41 C ATOM 1708 ND1 HIS A 104 5.850 11.580 8.754 1.00 34.51 N ATOM 1709 CD2 HIS A 104 6.230 11.836 6.590 1.00 21.31 C ATOM 1710 CE1 HIS A 104 5.015 12.524 8.282 1.00 70.54 C ATOM 1711 NE2 HIS A 104 5.214 12.720 6.963 1.00 32.44 N ATOM 0 H HIS A 104 9.724 11.705 7.148 1.00 64.52 H new ATOM 0 HA HIS A 104 8.747 10.292 9.540 1.00 14.24 H new ATOM 0 HB2 HIS A 104 7.886 9.781 6.675 1.00 71.30 H new ATOM 0 HB3 HIS A 104 7.173 9.137 8.141 1.00 71.30 H new ATOM 0 HD1 HIS A 104 5.909 11.255 9.719 1.00 34.51 H new ATOM 0 HD2 HIS A 104 6.643 11.728 5.598 1.00 21.31 H new ATOM 0 HE1 HIS A 104 4.286 13.052 8.878 1.00 70.54 H new ATOM 1719 N SER A 105 11.173 9.510 7.658 1.00 51.03 N ATOM 1720 CA SER A 105 12.112 8.489 7.235 1.00 73.21 C ATOM 1721 C SER A 105 13.561 8.990 7.341 1.00 74.42 C ATOM 1722 O SER A 105 13.835 10.127 6.948 1.00 12.03 O ATOM 1723 CB SER A 105 11.799 8.186 5.766 1.00 30.42 C ATOM 1724 OG SER A 105 11.770 6.802 5.493 1.00 12.02 O ATOM 0 H SER A 105 11.503 10.465 7.519 1.00 51.03 H new ATOM 0 HA SER A 105 12.016 7.607 7.869 1.00 73.21 H new ATOM 0 HB2 SER A 105 10.836 8.624 5.505 1.00 30.42 H new ATOM 0 HB3 SER A 105 12.548 8.662 5.133 1.00 30.42 H new ATOM 0 HG SER A 105 11.565 6.660 4.545 1.00 12.02 H new ATOM 1730 N PRO A 106 14.515 8.117 7.701 1.00 23.15 N ATOM 1731 CA PRO A 106 15.936 8.385 7.541 1.00 52.20 C ATOM 1732 C PRO A 106 16.323 8.574 6.082 1.00 23.45 C ATOM 1733 O PRO A 106 15.550 8.213 5.192 1.00 11.22 O ATOM 1734 CB PRO A 106 16.657 7.179 8.136 1.00 72.32 C ATOM 1735 CG PRO A 106 15.618 6.070 8.181 1.00 4.33 C ATOM 1736 CD PRO A 106 14.300 6.812 8.298 1.00 45.22 C ATOM 0 HA PRO A 106 16.209 9.314 8.042 1.00 52.20 H new ATOM 0 HB2 PRO A 106 17.512 6.892 7.525 1.00 72.32 H new ATOM 0 HB3 PRO A 106 17.038 7.401 9.133 1.00 72.32 H new ATOM 0 HG2 PRO A 106 15.652 5.454 7.282 1.00 4.33 H new ATOM 0 HG3 PRO A 106 15.779 5.405 9.030 1.00 4.33 H new ATOM 0 HD2 PRO A 106 13.504 6.275 7.783 1.00 45.22 H new ATOM 0 HD3 PRO A 106 13.998 6.906 9.341 1.00 45.22 H new ATOM 1744 N HIS A 107 17.534 9.105 5.888 1.00 70.33 N ATOM 1745 CA HIS A 107 18.109 9.741 4.710 1.00 44.31 C ATOM 1746 C HIS A 107 17.920 8.978 3.395 1.00 41.54 C ATOM 1747 O HIS A 107 18.866 8.455 2.811 1.00 1.54 O ATOM 1748 CB HIS A 107 19.576 10.127 5.006 1.00 53.50 C ATOM 1749 CG HIS A 107 20.485 9.095 5.643 1.00 3.34 C ATOM 1750 ND1 HIS A 107 21.505 9.386 6.525 1.00 74.32 N ATOM 1751 CD2 HIS A 107 20.467 7.733 5.484 1.00 3.34 C ATOM 1752 CE1 HIS A 107 22.086 8.233 6.887 1.00 10.52 C ATOM 1753 NE2 HIS A 107 21.504 7.198 6.258 1.00 11.44 N ATOM 0 H HIS A 107 18.213 9.095 6.649 1.00 70.33 H new ATOM 0 HA HIS A 107 17.537 10.650 4.522 1.00 44.31 H new ATOM 0 HB2 HIS A 107 20.033 10.435 4.066 1.00 53.50 H new ATOM 0 HB3 HIS A 107 19.563 11.002 5.656 1.00 53.50 H new ATOM 0 HD2 HIS A 107 19.776 7.173 4.871 1.00 3.34 H new ATOM 0 HE1 HIS A 107 22.906 8.148 7.585 1.00 10.52 H new ATOM 0 HE2 HIS A 107 21.766 6.215 6.330 1.00 11.44 H new ATOM 1761 N THR A 108 16.691 8.973 2.889 1.00 2.11 N ATOM 1762 CA THR A 108 16.253 8.143 1.766 1.00 11.45 C ATOM 1763 C THR A 108 15.980 8.921 0.478 1.00 61.12 C ATOM 1764 O THR A 108 15.295 8.412 -0.420 1.00 2.41 O ATOM 1765 CB THR A 108 15.068 7.271 2.214 1.00 64.44 C ATOM 1766 OG1 THR A 108 14.826 6.264 1.247 1.00 41.41 O ATOM 1767 CG2 THR A 108 13.778 8.063 2.450 1.00 31.35 C ATOM 0 H THR A 108 15.947 9.564 3.259 1.00 2.11 H new ATOM 0 HA THR A 108 17.083 7.493 1.490 1.00 11.45 H new ATOM 0 HB THR A 108 15.351 6.835 3.172 1.00 64.44 H new ATOM 0 HG1 THR A 108 14.901 6.648 0.349 1.00 41.41 H new ATOM 0 HG21 THR A 108 12.986 7.383 2.763 1.00 31.35 H new ATOM 0 HG22 THR A 108 13.946 8.808 3.228 1.00 31.35 H new ATOM 0 HG23 THR A 108 13.483 8.562 1.527 1.00 31.35 H new ATOM 1775 N ALA A 109 16.511 10.134 0.387 1.00 53.43 N ATOM 1776 CA ALA A 109 16.337 11.034 -0.742 1.00 65.42 C ATOM 1777 C ALA A 109 16.738 10.299 -2.017 1.00 30.25 C ATOM 1778 O ALA A 109 17.905 9.923 -2.167 1.00 51.54 O ATOM 1779 CB ALA A 109 17.176 12.293 -0.545 1.00 21.15 C ATOM 0 H ALA A 109 17.095 10.530 1.124 1.00 53.43 H new ATOM 0 HA ALA A 109 15.294 11.342 -0.820 1.00 65.42 H new ATOM 0 HB1 ALA A 109 17.038 12.959 -1.396 1.00 21.15 H new ATOM 0 HB2 ALA A 109 16.862 12.800 0.367 1.00 21.15 H new ATOM 0 HB3 ALA A 109 18.228 12.020 -0.465 1.00 21.15 H new ATOM 1785 N SER A 110 15.762 10.029 -2.878 1.00 71.14 N ATOM 1786 CA SER A 110 15.889 9.209 -4.069 1.00 42.13 C ATOM 1787 C SER A 110 14.557 9.245 -4.813 1.00 1.54 C ATOM 1788 O SER A 110 14.450 9.757 -5.929 1.00 12.24 O ATOM 1789 CB SER A 110 16.345 7.792 -3.663 1.00 71.24 C ATOM 1790 OG SER A 110 16.297 6.874 -4.730 1.00 24.44 O ATOM 0 H SER A 110 14.818 10.395 -2.755 1.00 71.14 H new ATOM 0 HA SER A 110 16.650 9.587 -4.752 1.00 42.13 H new ATOM 0 HB2 SER A 110 17.363 7.840 -3.277 1.00 71.24 H new ATOM 0 HB3 SER A 110 15.713 7.431 -2.851 1.00 71.24 H new ATOM 0 HG SER A 110 16.743 6.042 -4.466 1.00 24.44 H new ATOM 1796 N TYR A 111 13.520 8.719 -4.168 1.00 53.51 N ATOM 1797 CA TYR A 111 12.179 8.673 -4.739 1.00 71.21 C ATOM 1798 C TYR A 111 11.568 10.043 -4.970 1.00 30.11 C ATOM 1799 O TYR A 111 11.997 11.050 -4.413 1.00 41.41 O ATOM 1800 CB TYR A 111 11.254 7.690 -4.051 1.00 13.51 C ATOM 1801 CG TYR A 111 11.150 7.887 -2.571 1.00 5.52 C ATOM 1802 CD1 TYR A 111 10.593 9.084 -2.139 1.00 21.31 C ATOM 1803 CD2 TYR A 111 11.614 6.938 -1.658 1.00 23.43 C ATOM 1804 CE1 TYR A 111 10.441 9.342 -0.771 1.00 61.30 C ATOM 1805 CE2 TYR A 111 11.450 7.165 -0.275 1.00 10.15 C ATOM 1806 CZ TYR A 111 10.837 8.369 0.173 1.00 64.41 C ATOM 1807 OH TYR A 111 10.618 8.618 1.494 1.00 43.31 O ATOM 0 H TYR A 111 13.586 8.313 -3.235 1.00 53.51 H new ATOM 0 HA TYR A 111 12.314 8.261 -5.739 1.00 71.21 H new ATOM 0 HB2 TYR A 111 10.260 7.774 -4.489 1.00 13.51 H new ATOM 0 HB3 TYR A 111 11.605 6.677 -4.249 1.00 13.51 H new ATOM 0 HD1 TYR A 111 10.275 9.820 -2.863 1.00 21.31 H new ATOM 0 HD2 TYR A 111 12.095 6.037 -2.008 1.00 23.43 H new ATOM 0 HE1 TYR A 111 10.023 10.281 -0.439 1.00 61.30 H new ATOM 0 HE2 TYR A 111 11.788 6.429 0.440 1.00 10.15 H new ATOM 0 HH TYR A 111 10.940 7.861 2.027 1.00 43.31 H new ATOM 1817 N THR A 112 10.493 10.042 -5.748 1.00 33.33 N ATOM 1818 CA THR A 112 9.763 11.223 -6.155 1.00 21.35 C ATOM 1819 C THR A 112 8.452 10.746 -6.795 1.00 34.41 C ATOM 1820 O THR A 112 7.373 11.212 -6.418 1.00 50.30 O ATOM 1821 CB THR A 112 10.701 12.057 -7.058 1.00 63.44 C ATOM 1822 OG1 THR A 112 10.164 13.310 -7.402 1.00 63.30 O ATOM 1823 CG2 THR A 112 11.166 11.339 -8.326 1.00 53.21 C ATOM 0 H THR A 112 10.095 9.182 -6.124 1.00 33.33 H new ATOM 0 HA THR A 112 9.472 11.887 -5.341 1.00 21.35 H new ATOM 0 HB THR A 112 11.579 12.208 -6.430 1.00 63.44 H new ATOM 0 HG1 THR A 112 9.203 13.318 -7.209 1.00 63.30 H new ATOM 0 HG21 THR A 112 11.819 11.998 -8.898 1.00 53.21 H new ATOM 0 HG22 THR A 112 11.711 10.435 -8.053 1.00 53.21 H new ATOM 0 HG23 THR A 112 10.300 11.072 -8.931 1.00 53.21 H new ATOM 1831 N SER A 113 8.537 9.745 -7.685 1.00 12.14 N ATOM 1832 CA SER A 113 7.403 9.255 -8.464 1.00 74.01 C ATOM 1833 C SER A 113 6.682 8.154 -7.682 1.00 63.34 C ATOM 1834 O SER A 113 7.242 7.577 -6.745 1.00 53.44 O ATOM 1835 CB SER A 113 7.859 8.731 -9.843 1.00 73.23 C ATOM 1836 OG SER A 113 9.008 9.396 -10.341 1.00 24.31 O ATOM 0 H SER A 113 9.408 9.251 -7.882 1.00 12.14 H new ATOM 0 HA SER A 113 6.715 10.083 -8.637 1.00 74.01 H new ATOM 0 HB2 SER A 113 8.069 7.664 -9.768 1.00 73.23 H new ATOM 0 HB3 SER A 113 7.043 8.846 -10.556 1.00 73.23 H new ATOM 0 HG SER A 113 9.250 9.022 -11.214 1.00 24.31 H new ATOM 1842 N SER A 114 5.472 7.797 -8.110 1.00 54.43 N ATOM 1843 CA SER A 114 4.593 6.896 -7.373 1.00 64.44 C ATOM 1844 C SER A 114 5.207 5.504 -7.240 1.00 63.20 C ATOM 1845 O SER A 114 5.351 4.976 -6.144 1.00 72.01 O ATOM 1846 CB SER A 114 3.223 6.820 -8.063 1.00 3.35 C ATOM 1847 OG SER A 114 2.941 7.971 -8.832 1.00 13.45 O ATOM 0 H SER A 114 5.072 8.130 -8.987 1.00 54.43 H new ATOM 0 HA SER A 114 4.462 7.294 -6.367 1.00 64.44 H new ATOM 0 HB2 SER A 114 3.192 5.940 -8.706 1.00 3.35 H new ATOM 0 HB3 SER A 114 2.446 6.691 -7.309 1.00 3.35 H new ATOM 0 HG SER A 114 2.274 8.519 -8.368 1.00 13.45 H new ATOM 1853 N ARG A 115 5.572 4.897 -8.372 1.00 42.32 N ATOM 1854 CA ARG A 115 6.254 3.606 -8.409 1.00 25.23 C ATOM 1855 C ARG A 115 7.616 3.701 -7.708 1.00 33.44 C ATOM 1856 O ARG A 115 8.062 2.730 -7.109 1.00 5.43 O ATOM 1857 CB ARG A 115 6.444 3.188 -9.876 1.00 74.40 C ATOM 1858 CG ARG A 115 5.265 2.536 -10.610 1.00 33.03 C ATOM 1859 CD ARG A 115 4.035 3.420 -10.834 1.00 64.11 C ATOM 1860 NE ARG A 115 4.334 4.721 -11.450 1.00 10.41 N ATOM 1861 CZ ARG A 115 3.455 5.711 -11.638 1.00 31.43 C ATOM 1862 NH1 ARG A 115 2.154 5.523 -11.440 1.00 24.33 N ATOM 1863 NH2 ARG A 115 3.915 6.900 -11.992 1.00 10.41 N ATOM 0 H ARG A 115 5.400 5.294 -9.296 1.00 42.32 H new ATOM 0 HA ARG A 115 5.653 2.861 -7.887 1.00 25.23 H new ATOM 0 HB2 ARG A 115 6.735 4.075 -10.438 1.00 74.40 H new ATOM 0 HB3 ARG A 115 7.284 2.495 -9.917 1.00 74.40 H new ATOM 0 HG2 ARG A 115 5.617 2.187 -11.581 1.00 33.03 H new ATOM 0 HG3 ARG A 115 4.956 1.655 -10.047 1.00 33.03 H new ATOM 0 HD2 ARG A 115 3.327 2.885 -11.467 1.00 64.11 H new ATOM 0 HD3 ARG A 115 3.543 3.588 -9.876 1.00 64.11 H new ATOM 0 HE ARG A 115 5.292 4.882 -11.760 1.00 10.41 H new ATOM 0 HH11 ARG A 115 1.810 4.611 -11.139 1.00 24.33 H new ATOM 0 HH12 ARG A 115 1.499 6.291 -11.589 1.00 24.33 H new ATOM 0 HH21 ARG A 115 4.917 7.043 -12.115 1.00 10.41 H new ATOM 0 HH22 ARG A 115 3.267 7.673 -12.142 1.00 10.41 H new ATOM 1877 N ASP A 116 8.265 4.861 -7.775 1.00 53.30 N ATOM 1878 CA ASP A 116 9.623 5.076 -7.285 1.00 5.31 C ATOM 1879 C ASP A 116 9.680 4.946 -5.774 1.00 41.51 C ATOM 1880 O ASP A 116 10.575 4.309 -5.228 1.00 73.21 O ATOM 1881 CB ASP A 116 10.104 6.475 -7.705 1.00 53.43 C ATOM 1882 CG ASP A 116 11.423 6.473 -8.456 1.00 62.14 C ATOM 1883 OD1 ASP A 116 11.674 5.531 -9.254 1.00 64.01 O ATOM 1884 OD2 ASP A 116 12.171 7.449 -8.324 1.00 43.43 O ATOM 0 H ASP A 116 7.850 5.699 -8.182 1.00 53.30 H new ATOM 0 HA ASP A 116 10.274 4.317 -7.719 1.00 5.31 H new ATOM 0 HB2 ASP A 116 9.341 6.938 -8.331 1.00 53.43 H new ATOM 0 HB3 ASP A 116 10.205 7.096 -6.815 1.00 53.43 H new ATOM 1889 N ALA A 117 8.730 5.575 -5.081 1.00 51.50 N ATOM 1890 CA ALA A 117 8.651 5.479 -3.633 1.00 11.34 C ATOM 1891 C ALA A 117 8.315 4.046 -3.200 1.00 50.44 C ATOM 1892 O ALA A 117 8.819 3.576 -2.178 1.00 10.42 O ATOM 1893 CB ALA A 117 7.648 6.517 -3.127 1.00 50.13 C ATOM 0 H ALA A 117 8.006 6.156 -5.505 1.00 51.50 H new ATOM 0 HA ALA A 117 9.618 5.702 -3.181 1.00 11.34 H new ATOM 0 HB1 ALA A 117 7.578 6.456 -2.041 1.00 50.13 H new ATOM 0 HB2 ALA A 117 7.981 7.515 -3.414 1.00 50.13 H new ATOM 0 HB3 ALA A 117 6.669 6.321 -3.565 1.00 50.13 H new ATOM 1899 N MET A 118 7.540 3.338 -4.018 1.00 43.34 N ATOM 1900 CA MET A 118 7.016 2.011 -3.767 1.00 52.41 C ATOM 1901 C MET A 118 8.122 0.968 -3.736 1.00 24.04 C ATOM 1902 O MET A 118 8.227 0.195 -2.782 1.00 32.35 O ATOM 1903 CB MET A 118 6.039 1.705 -4.897 1.00 53.10 C ATOM 1904 CG MET A 118 4.908 0.793 -4.468 1.00 12.55 C ATOM 1905 SD MET A 118 3.699 0.644 -5.792 1.00 32.45 S ATOM 1906 CE MET A 118 3.143 2.351 -5.928 1.00 1.21 C ATOM 0 H MET A 118 7.248 3.702 -4.925 1.00 43.34 H new ATOM 0 HA MET A 118 6.528 1.979 -2.793 1.00 52.41 H new ATOM 0 HB2 MET A 118 5.623 2.639 -5.273 1.00 53.10 H new ATOM 0 HB3 MET A 118 6.580 1.242 -5.722 1.00 53.10 H new ATOM 0 HG2 MET A 118 5.301 -0.191 -4.211 1.00 12.55 H new ATOM 0 HG3 MET A 118 4.431 1.189 -3.572 1.00 12.55 H new ATOM 0 HE1 MET A 118 2.055 2.376 -5.981 1.00 1.21 H new ATOM 0 HE2 MET A 118 3.477 2.913 -5.056 1.00 1.21 H new ATOM 0 HE3 MET A 118 3.561 2.799 -6.830 1.00 1.21 H new ATOM 1916 N SER A 119 8.990 0.957 -4.751 1.00 41.54 N ATOM 1917 CA SER A 119 10.067 -0.016 -4.860 1.00 73.00 C ATOM 1918 C SER A 119 11.115 0.151 -3.751 1.00 44.51 C ATOM 1919 O SER A 119 12.012 -0.691 -3.614 1.00 70.30 O ATOM 1920 CB SER A 119 10.671 0.074 -6.263 1.00 33.33 C ATOM 1921 OG SER A 119 11.134 1.377 -6.541 1.00 33.11 O ATOM 0 H SER A 119 8.961 1.627 -5.520 1.00 41.54 H new ATOM 0 HA SER A 119 9.662 -1.018 -4.717 1.00 73.00 H new ATOM 0 HB2 SER A 119 11.495 -0.633 -6.352 1.00 33.33 H new ATOM 0 HB3 SER A 119 9.923 -0.213 -7.002 1.00 33.33 H new ATOM 0 HG SER A 119 11.516 1.403 -7.443 1.00 33.11 H new ATOM 1927 N LYS A 120 11.003 1.220 -2.959 1.00 3.51 N ATOM 1928 CA LYS A 120 11.866 1.605 -1.856 1.00 21.13 C ATOM 1929 C LYS A 120 11.124 1.453 -0.521 1.00 34.11 C ATOM 1930 O LYS A 120 11.574 2.029 0.468 1.00 73.24 O ATOM 1931 CB LYS A 120 12.396 3.033 -2.139 1.00 11.41 C ATOM 1932 CG LYS A 120 13.461 3.003 -3.253 1.00 33.01 C ATOM 1933 CD LYS A 120 13.731 4.344 -3.958 1.00 30.23 C ATOM 1934 CE LYS A 120 14.730 4.094 -5.098 1.00 42.42 C ATOM 1935 NZ LYS A 120 14.704 5.081 -6.197 1.00 3.15 N ATOM 0 H LYS A 120 10.243 1.888 -3.089 1.00 3.51 H new ATOM 0 HA LYS A 120 12.732 0.948 -1.771 1.00 21.13 H new ATOM 0 HB2 LYS A 120 11.571 3.682 -2.434 1.00 11.41 H new ATOM 0 HB3 LYS A 120 12.824 3.455 -1.230 1.00 11.41 H new ATOM 0 HG2 LYS A 120 14.397 2.644 -2.825 1.00 33.01 H new ATOM 0 HG3 LYS A 120 13.154 2.275 -4.004 1.00 33.01 H new ATOM 0 HD2 LYS A 120 12.803 4.761 -4.350 1.00 30.23 H new ATOM 0 HD3 LYS A 120 14.134 5.070 -3.252 1.00 30.23 H new ATOM 0 HE2 LYS A 120 15.735 4.071 -4.678 1.00 42.42 H new ATOM 0 HE3 LYS A 120 14.537 3.106 -5.516 1.00 42.42 H new ATOM 0 HZ1 LYS A 120 15.110 4.656 -7.055 1.00 3.15 H new ATOM 0 HZ2 LYS A 120 13.722 5.367 -6.383 1.00 3.15 H new ATOM 0 HZ3 LYS A 120 15.262 5.916 -5.927 1.00 3.15 H new ATOM 1949 N TYR A 121 9.996 0.726 -0.449 1.00 3.32 N ATOM 1950 CA TYR A 121 9.329 0.443 0.824 1.00 64.33 C ATOM 1951 C TYR A 121 10.176 -0.400 1.774 1.00 62.21 C ATOM 1952 O TYR A 121 11.132 -1.047 1.344 1.00 62.10 O ATOM 1953 CB TYR A 121 7.966 -0.258 0.636 1.00 30.13 C ATOM 1954 CG TYR A 121 6.780 0.655 0.426 1.00 25.03 C ATOM 1955 CD1 TYR A 121 6.709 1.912 1.056 1.00 53.51 C ATOM 1956 CD2 TYR A 121 5.686 0.201 -0.327 1.00 43.32 C ATOM 1957 CE1 TYR A 121 5.635 2.768 0.815 1.00 11.24 C ATOM 1958 CE2 TYR A 121 4.661 1.100 -0.667 1.00 70.42 C ATOM 1959 CZ TYR A 121 4.635 2.404 -0.114 1.00 73.22 C ATOM 1960 OH TYR A 121 3.670 3.293 -0.499 1.00 23.05 O ATOM 0 H TYR A 121 9.529 0.325 -1.262 1.00 3.32 H new ATOM 0 HA TYR A 121 9.175 1.426 1.270 1.00 64.33 H new ATOM 0 HB2 TYR A 121 8.039 -0.930 -0.219 1.00 30.13 H new ATOM 0 HB3 TYR A 121 7.773 -0.877 1.512 1.00 30.13 H new ATOM 0 HD1 TYR A 121 7.494 2.216 1.733 1.00 53.51 H new ATOM 0 HD2 TYR A 121 5.632 -0.831 -0.642 1.00 43.32 H new ATOM 0 HE1 TYR A 121 5.568 3.710 1.339 1.00 11.24 H new ATOM 0 HE2 TYR A 121 3.887 0.794 -1.355 1.00 70.42 H new ATOM 0 HH TYR A 121 2.952 3.305 0.168 1.00 23.05 H new ATOM 1970 N PRO A 122 9.792 -0.465 3.062 1.00 42.42 N ATOM 1971 CA PRO A 122 10.481 -1.321 4.018 1.00 41.34 C ATOM 1972 C PRO A 122 10.352 -2.826 3.754 1.00 64.54 C ATOM 1973 O PRO A 122 11.101 -3.593 4.347 1.00 31.31 O ATOM 1974 CB PRO A 122 9.945 -0.919 5.395 1.00 33.12 C ATOM 1975 CG PRO A 122 8.603 -0.239 5.124 1.00 13.44 C ATOM 1976 CD PRO A 122 8.745 0.331 3.713 1.00 65.32 C ATOM 0 HA PRO A 122 11.557 -1.165 3.934 1.00 41.34 H new ATOM 0 HB2 PRO A 122 9.821 -1.790 6.038 1.00 33.12 H new ATOM 0 HB3 PRO A 122 10.633 -0.243 5.903 1.00 33.12 H new ATOM 0 HG2 PRO A 122 7.778 -0.949 5.185 1.00 13.44 H new ATOM 0 HG3 PRO A 122 8.401 0.547 5.852 1.00 13.44 H new ATOM 0 HD2 PRO A 122 7.804 0.261 3.167 1.00 65.32 H new ATOM 0 HD3 PRO A 122 9.018 1.386 3.743 1.00 65.32 H new ATOM 1984 N GLU A 123 9.440 -3.286 2.891 1.00 23.05 N ATOM 1985 CA GLU A 123 9.132 -4.710 2.713 1.00 71.15 C ATOM 1986 C GLU A 123 8.958 -4.995 1.211 1.00 50.44 C ATOM 1987 O GLU A 123 8.380 -4.163 0.505 1.00 23.00 O ATOM 1988 CB GLU A 123 7.827 -5.031 3.466 1.00 45.24 C ATOM 1989 CG GLU A 123 7.817 -4.752 4.989 1.00 33.22 C ATOM 1990 CD GLU A 123 6.470 -4.221 5.505 1.00 1.30 C ATOM 1991 OE1 GLU A 123 5.407 -4.573 4.941 1.00 42.01 O ATOM 1992 OE2 GLU A 123 6.460 -3.366 6.420 1.00 61.23 O ATOM 0 H GLU A 123 8.889 -2.674 2.290 1.00 23.05 H new ATOM 0 HA GLU A 123 9.938 -5.329 3.106 1.00 71.15 H new ATOM 0 HB2 GLU A 123 7.021 -4.457 3.010 1.00 45.24 H new ATOM 0 HB3 GLU A 123 7.595 -6.085 3.311 1.00 45.24 H new ATOM 0 HG2 GLU A 123 8.064 -5.671 5.521 1.00 33.22 H new ATOM 0 HG3 GLU A 123 8.598 -4.028 5.223 1.00 33.22 H new ATOM 1999 N ARG A 124 9.431 -6.142 0.699 1.00 61.13 N ATOM 2000 CA ARG A 124 9.306 -6.502 -0.726 1.00 34.44 C ATOM 2001 C ARG A 124 7.839 -6.704 -1.066 1.00 62.02 C ATOM 2002 O ARG A 124 7.366 -6.165 -2.063 1.00 10.24 O ATOM 2003 CB ARG A 124 10.089 -7.781 -1.104 1.00 53.41 C ATOM 2004 CG ARG A 124 11.576 -7.763 -0.730 1.00 25.21 C ATOM 2005 CD ARG A 124 12.570 -7.644 -1.889 1.00 53.13 C ATOM 2006 NE ARG A 124 12.606 -8.805 -2.789 1.00 65.44 N ATOM 2007 CZ ARG A 124 13.568 -9.070 -3.684 1.00 11.24 C ATOM 2008 NH1 ARG A 124 14.749 -8.465 -3.616 1.00 11.21 N ATOM 2009 NH2 ARG A 124 13.323 -9.946 -4.648 1.00 33.12 N ATOM 0 H ARG A 124 9.911 -6.847 1.259 1.00 61.13 H new ATOM 0 HA ARG A 124 9.736 -5.680 -1.298 1.00 34.44 H new ATOM 0 HB2 ARG A 124 9.617 -8.635 -0.618 1.00 53.41 H new ATOM 0 HB3 ARG A 124 10.002 -7.938 -2.179 1.00 53.41 H new ATOM 0 HG2 ARG A 124 11.746 -6.930 -0.048 1.00 25.21 H new ATOM 0 HG3 ARG A 124 11.801 -8.677 -0.180 1.00 25.21 H new ATOM 0 HD2 ARG A 124 12.323 -6.757 -2.472 1.00 53.13 H new ATOM 0 HD3 ARG A 124 13.568 -7.488 -1.479 1.00 53.13 H new ATOM 0 HE ARG A 124 11.832 -9.466 -2.727 1.00 65.44 H new ATOM 0 HH11 ARG A 124 14.934 -7.788 -2.875 1.00 11.21 H new ATOM 0 HH12 ARG A 124 15.471 -8.677 -4.304 1.00 11.21 H new ATOM 0 HH21 ARG A 124 12.414 -10.406 -4.700 1.00 33.12 H new ATOM 0 HH22 ARG A 124 14.043 -10.160 -5.338 1.00 33.12 H new ATOM 2023 N CYS A 125 7.112 -7.448 -0.230 1.00 25.42 N ATOM 2024 CA CYS A 125 5.684 -7.674 -0.382 1.00 73.02 C ATOM 2025 C CYS A 125 4.958 -6.338 -0.550 1.00 10.23 C ATOM 2026 O CYS A 125 4.191 -6.201 -1.502 1.00 64.04 O ATOM 2027 CB CYS A 125 5.179 -8.518 0.798 1.00 13.44 C ATOM 2028 SG CYS A 125 3.375 -8.599 0.903 1.00 11.14 S ATOM 0 H CYS A 125 7.511 -7.916 0.584 1.00 25.42 H new ATOM 0 HA CYS A 125 5.472 -8.243 -1.287 1.00 73.02 H new ATOM 0 HB2 CYS A 125 5.576 -9.529 0.708 1.00 13.44 H new ATOM 0 HB3 CYS A 125 5.571 -8.103 1.726 1.00 13.44 H new ATOM 0 HG CYS A 125 3.032 -9.343 1.912 1.00 11.14 H new ATOM 2034 N THR A 126 5.228 -5.333 0.301 1.00 70.25 N ATOM 2035 CA THR A 126 4.371 -4.146 0.311 1.00 21.02 C ATOM 2036 C THR A 126 4.657 -3.291 -0.934 1.00 5.11 C ATOM 2037 O THR A 126 3.855 -2.425 -1.279 1.00 30.04 O ATOM 2038 CB THR A 126 4.568 -3.349 1.616 1.00 13.54 C ATOM 2039 OG1 THR A 126 3.414 -2.636 1.998 1.00 22.40 O ATOM 2040 CG2 THR A 126 5.682 -2.331 1.694 1.00 43.34 C ATOM 0 H THR A 126 6.002 -5.320 0.965 1.00 70.25 H new ATOM 0 HA THR A 126 3.325 -4.451 0.276 1.00 21.02 H new ATOM 0 HB THR A 126 4.830 -4.179 2.272 1.00 13.54 H new ATOM 0 HG1 THR A 126 3.590 -2.150 2.830 1.00 22.40 H new ATOM 0 HG21 THR A 126 5.679 -1.863 2.678 1.00 43.34 H new ATOM 0 HG22 THR A 126 6.639 -2.826 1.530 1.00 43.34 H new ATOM 0 HG23 THR A 126 5.532 -1.569 0.930 1.00 43.34 H new ATOM 2048 N ALA A 127 5.809 -3.492 -1.597 1.00 74.23 N ATOM 2049 CA ALA A 127 6.281 -2.748 -2.755 1.00 50.50 C ATOM 2050 C ALA A 127 5.472 -3.110 -4.002 1.00 12.20 C ATOM 2051 O ALA A 127 5.999 -3.670 -4.972 1.00 44.55 O ATOM 2052 CB ALA A 127 7.790 -2.975 -2.928 1.00 31.44 C ATOM 0 H ALA A 127 6.465 -4.221 -1.316 1.00 74.23 H new ATOM 0 HA ALA A 127 6.127 -1.680 -2.598 1.00 50.50 H new ATOM 0 HB1 ALA A 127 8.145 -2.418 -3.795 1.00 31.44 H new ATOM 0 HB2 ALA A 127 8.314 -2.631 -2.037 1.00 31.44 H new ATOM 0 HB3 ALA A 127 7.984 -4.038 -3.075 1.00 31.44 H new ATOM 2058 N VAL A 128 4.196 -2.740 -3.976 1.00 72.42 N ATOM 2059 CA VAL A 128 3.191 -3.020 -4.977 1.00 1.10 C ATOM 2060 C VAL A 128 2.147 -1.921 -4.925 1.00 1.20 C ATOM 2061 O VAL A 128 1.889 -1.342 -3.862 1.00 33.11 O ATOM 2062 CB VAL A 128 2.591 -4.415 -4.713 1.00 10.51 C ATOM 2063 CG1 VAL A 128 2.007 -4.536 -3.299 1.00 31.22 C ATOM 2064 CG2 VAL A 128 1.486 -4.848 -5.687 1.00 44.31 C ATOM 0 H VAL A 128 3.818 -2.199 -3.198 1.00 72.42 H new ATOM 0 HA VAL A 128 3.618 -3.035 -5.980 1.00 1.10 H new ATOM 0 HB VAL A 128 3.449 -5.072 -4.853 1.00 10.51 H new ATOM 0 HG11 VAL A 128 1.596 -5.536 -3.159 1.00 31.22 H new ATOM 0 HG12 VAL A 128 2.793 -4.361 -2.564 1.00 31.22 H new ATOM 0 HG13 VAL A 128 1.217 -3.797 -3.167 1.00 31.22 H new ATOM 0 HG21 VAL A 128 1.131 -5.842 -5.416 1.00 44.31 H new ATOM 0 HG22 VAL A 128 0.658 -4.141 -5.636 1.00 44.31 H new ATOM 0 HG23 VAL A 128 1.883 -4.869 -6.702 1.00 44.31 H new ATOM 2074 N GLY A 129 1.543 -1.648 -6.077 1.00 72.05 N ATOM 2075 CA GLY A 129 0.467 -0.683 -6.191 1.00 45.14 C ATOM 2076 C GLY A 129 -0.645 -1.250 -7.055 1.00 70.05 C ATOM 2077 O GLY A 129 -0.414 -2.205 -7.808 1.00 24.03 O ATOM 0 H GLY A 129 1.791 -2.095 -6.960 1.00 72.05 H new ATOM 0 HA2 GLY A 129 0.081 -0.437 -5.202 1.00 45.14 H new ATOM 0 HA3 GLY A 129 0.842 0.243 -6.627 1.00 45.14 H new ATOM 2081 N LEU A 130 -1.845 -0.682 -6.914 1.00 71.33 N ATOM 2082 CA LEU A 130 -3.056 -1.107 -7.603 1.00 64.45 C ATOM 2083 C LEU A 130 -3.932 0.125 -7.863 1.00 70.02 C ATOM 2084 O LEU A 130 -4.037 0.994 -6.995 1.00 52.24 O ATOM 2085 CB LEU A 130 -3.745 -2.224 -6.787 1.00 31.04 C ATOM 2086 CG LEU A 130 -5.092 -2.711 -7.364 1.00 33.40 C ATOM 2087 CD1 LEU A 130 -4.973 -3.387 -8.733 1.00 43.53 C ATOM 2088 CD2 LEU A 130 -5.677 -3.710 -6.365 1.00 41.54 C ATOM 0 H LEU A 130 -2.001 0.113 -6.295 1.00 71.33 H new ATOM 0 HA LEU A 130 -2.838 -1.543 -8.578 1.00 64.45 H new ATOM 0 HB2 LEU A 130 -3.067 -3.075 -6.717 1.00 31.04 H new ATOM 0 HB3 LEU A 130 -3.910 -1.864 -5.772 1.00 31.04 H new ATOM 0 HG LEU A 130 -5.728 -1.838 -7.513 1.00 33.40 H new ATOM 0 HD11 LEU A 130 -5.961 -3.701 -9.071 1.00 43.53 H new ATOM 0 HD12 LEU A 130 -4.551 -2.684 -9.451 1.00 43.53 H new ATOM 0 HD13 LEU A 130 -4.323 -4.258 -8.653 1.00 43.53 H new ATOM 0 HD21 LEU A 130 -6.633 -4.079 -6.737 1.00 41.54 H new ATOM 0 HD22 LEU A 130 -4.989 -4.546 -6.241 1.00 41.54 H new ATOM 0 HD23 LEU A 130 -5.827 -3.218 -5.404 1.00 41.54 H new ATOM 2100 N ARG A 131 -4.529 0.256 -9.055 1.00 70.35 N ATOM 2101 CA ARG A 131 -5.615 1.213 -9.324 1.00 3.32 C ATOM 2102 C ARG A 131 -6.405 0.767 -10.552 1.00 13.41 C ATOM 2103 O ARG A 131 -6.032 -0.197 -11.214 1.00 41.12 O ATOM 2104 CB ARG A 131 -5.098 2.657 -9.542 1.00 74.41 C ATOM 2105 CG ARG A 131 -5.936 3.735 -8.819 1.00 65.40 C ATOM 2106 CD ARG A 131 -6.292 4.965 -9.668 1.00 72.24 C ATOM 2107 NE ARG A 131 -5.138 5.737 -10.176 1.00 13.51 N ATOM 2108 CZ ARG A 131 -5.232 6.939 -10.775 1.00 2.12 C ATOM 2109 NH1 ARG A 131 -6.423 7.483 -10.992 1.00 3.55 N ATOM 2110 NH2 ARG A 131 -4.144 7.585 -11.165 1.00 53.23 N ATOM 0 H ARG A 131 -4.271 -0.303 -9.868 1.00 70.35 H new ATOM 0 HA ARG A 131 -6.256 1.225 -8.442 1.00 3.32 H new ATOM 0 HB2 ARG A 131 -4.066 2.720 -9.196 1.00 74.41 H new ATOM 0 HB3 ARG A 131 -5.090 2.873 -10.610 1.00 74.41 H new ATOM 0 HG2 ARG A 131 -6.860 3.278 -8.466 1.00 65.40 H new ATOM 0 HG3 ARG A 131 -5.388 4.068 -7.938 1.00 65.40 H new ATOM 0 HD2 ARG A 131 -6.892 4.638 -10.517 1.00 72.24 H new ATOM 0 HD3 ARG A 131 -6.918 5.629 -9.072 1.00 72.24 H new ATOM 0 HE ARG A 131 -4.208 5.332 -10.065 1.00 13.51 H new ATOM 0 HH11 ARG A 131 -7.269 6.990 -10.705 1.00 3.55 H new ATOM 0 HH12 ARG A 131 -6.493 8.394 -11.446 1.00 3.55 H new ATOM 0 HH21 ARG A 131 -3.224 7.172 -11.013 1.00 53.23 H new ATOM 0 HH22 ARG A 131 -4.226 8.495 -11.618 1.00 53.23 H new ATOM 2124 N LEU A 132 -7.466 1.508 -10.874 1.00 72.43 N ATOM 2125 CA LEU A 132 -8.095 1.504 -12.189 1.00 30.31 C ATOM 2126 C LEU A 132 -7.255 2.376 -13.100 1.00 31.32 C ATOM 2127 O LEU A 132 -6.697 3.384 -12.657 1.00 43.44 O ATOM 2128 CB LEU A 132 -9.535 2.050 -12.089 1.00 44.50 C ATOM 2129 CG LEU A 132 -10.522 1.247 -11.224 1.00 43.32 C ATOM 2130 CD1 LEU A 132 -11.941 1.549 -11.701 1.00 43.31 C ATOM 2131 CD2 LEU A 132 -10.335 -0.263 -11.211 1.00 71.43 C ATOM 0 H LEU A 132 -7.919 2.139 -10.213 1.00 72.43 H new ATOM 0 HA LEU A 132 -8.152 0.491 -12.587 1.00 30.31 H new ATOM 0 HB2 LEU A 132 -9.487 3.066 -11.696 1.00 44.50 H new ATOM 0 HB3 LEU A 132 -9.944 2.117 -13.097 1.00 44.50 H new ATOM 0 HG LEU A 132 -10.327 1.569 -10.201 1.00 43.32 H new ATOM 0 HD11 LEU A 132 -12.655 0.987 -11.098 1.00 43.31 H new ATOM 0 HD12 LEU A 132 -12.140 2.616 -11.599 1.00 43.31 H new ATOM 0 HD13 LEU A 132 -12.043 1.260 -12.747 1.00 43.31 H new ATOM 0 HD21 LEU A 132 -11.088 -0.717 -10.568 1.00 71.43 H new ATOM 0 HD22 LEU A 132 -10.441 -0.651 -12.224 1.00 71.43 H new ATOM 0 HD23 LEU A 132 -9.342 -0.503 -10.832 1.00 71.43 H new ATOM 2143 N ASN A 133 -7.214 2.026 -14.376 1.00 44.22 N ATOM 2144 CA ASN A 133 -6.869 2.945 -15.451 1.00 11.11 C ATOM 2145 C ASN A 133 -8.148 3.622 -15.930 1.00 45.24 C ATOM 2146 O ASN A 133 -9.224 3.442 -15.359 1.00 11.44 O ATOM 2147 CB ASN A 133 -6.163 2.224 -16.614 1.00 42.43 C ATOM 2148 CG ASN A 133 -7.022 1.176 -17.302 1.00 51.13 C ATOM 2149 OD1 ASN A 133 -7.995 0.700 -16.742 1.00 10.24 O ATOM 2150 ND2 ASN A 133 -6.729 0.806 -18.530 1.00 61.15 N ATOM 0 H ASN A 133 -7.423 1.081 -14.699 1.00 44.22 H new ATOM 0 HA ASN A 133 -6.167 3.690 -15.075 1.00 11.11 H new ATOM 0 HB2 ASN A 133 -5.850 2.964 -17.351 1.00 42.43 H new ATOM 0 HB3 ASN A 133 -5.258 1.747 -16.237 1.00 42.43 H new ATOM 0 HD21 ASN A 133 -7.315 0.123 -19.010 1.00 61.15 H new ATOM 0 HD22 ASN A 133 -5.916 1.202 -19.002 1.00 61.15 H new ATOM 2157 N GLU A 134 -8.008 4.382 -17.008 1.00 41.52 N ATOM 2158 CA GLU A 134 -9.101 5.015 -17.745 1.00 34.24 C ATOM 2159 C GLU A 134 -10.172 3.989 -18.136 1.00 41.42 C ATOM 2160 O GLU A 134 -11.358 4.300 -18.113 1.00 61.13 O ATOM 2161 CB GLU A 134 -8.523 5.680 -19.004 1.00 1.21 C ATOM 2162 CG GLU A 134 -7.613 6.873 -18.678 1.00 25.45 C ATOM 2163 CD GLU A 134 -6.616 7.137 -19.806 1.00 42.22 C ATOM 2164 OE1 GLU A 134 -7.000 7.740 -20.835 1.00 61.24 O ATOM 2165 OE2 GLU A 134 -5.430 6.767 -19.653 1.00 21.43 O ATOM 0 H GLU A 134 -7.093 4.584 -17.412 1.00 41.52 H new ATOM 0 HA GLU A 134 -9.576 5.762 -17.109 1.00 34.24 H new ATOM 0 HB2 GLU A 134 -7.958 4.942 -19.573 1.00 1.21 H new ATOM 0 HB3 GLU A 134 -9.341 6.016 -19.641 1.00 1.21 H new ATOM 0 HG2 GLU A 134 -8.221 7.762 -18.512 1.00 25.45 H new ATOM 0 HG3 GLU A 134 -7.073 6.679 -17.751 1.00 25.45 H new ATOM 2172 N GLU A 135 -9.752 2.767 -18.469 1.00 51.21 N ATOM 2173 CA GLU A 135 -10.611 1.710 -18.999 1.00 4.13 C ATOM 2174 C GLU A 135 -11.177 0.818 -17.889 1.00 31.32 C ATOM 2175 O GLU A 135 -11.910 -0.132 -18.168 1.00 53.33 O ATOM 2176 CB GLU A 135 -9.840 0.867 -20.021 1.00 44.53 C ATOM 2177 CG GLU A 135 -9.172 1.721 -21.109 1.00 52.43 C ATOM 2178 CD GLU A 135 -8.351 0.873 -22.073 1.00 63.15 C ATOM 2179 OE1 GLU A 135 -7.325 0.300 -21.636 1.00 32.34 O ATOM 2180 OE2 GLU A 135 -8.706 0.856 -23.275 1.00 25.11 O ATOM 0 H GLU A 135 -8.778 2.479 -18.374 1.00 51.21 H new ATOM 0 HA GLU A 135 -11.457 2.189 -19.492 1.00 4.13 H new ATOM 0 HB2 GLU A 135 -9.078 0.283 -19.504 1.00 44.53 H new ATOM 0 HB3 GLU A 135 -10.522 0.157 -20.489 1.00 44.53 H new ATOM 0 HG2 GLU A 135 -9.936 2.264 -21.664 1.00 52.43 H new ATOM 0 HG3 GLU A 135 -8.528 2.466 -20.641 1.00 52.43 H new ATOM 2187 N LEU A 136 -10.877 1.132 -16.626 1.00 72.23 N ATOM 2188 CA LEU A 136 -11.412 0.513 -15.422 1.00 21.13 C ATOM 2189 C LEU A 136 -10.906 -0.911 -15.191 1.00 73.21 C ATOM 2190 O LEU A 136 -11.591 -1.744 -14.591 1.00 72.25 O ATOM 2191 CB LEU A 136 -12.941 0.625 -15.368 1.00 52.22 C ATOM 2192 CG LEU A 136 -13.494 2.031 -15.691 1.00 2.33 C ATOM 2193 CD1 LEU A 136 -15.016 2.028 -15.588 1.00 63.45 C ATOM 2194 CD2 LEU A 136 -12.937 3.161 -14.810 1.00 65.14 C ATOM 0 H LEU A 136 -10.211 1.873 -16.409 1.00 72.23 H new ATOM 0 HA LEU A 136 -11.020 1.083 -14.579 1.00 21.13 H new ATOM 0 HB2 LEU A 136 -13.370 -0.090 -16.070 1.00 52.22 H new ATOM 0 HB3 LEU A 136 -13.279 0.336 -14.373 1.00 52.22 H new ATOM 0 HG LEU A 136 -13.162 2.243 -16.707 1.00 2.33 H new ATOM 0 HD11 LEU A 136 -15.398 3.023 -15.817 1.00 63.45 H new ATOM 0 HD12 LEU A 136 -15.427 1.309 -16.297 1.00 63.45 H new ATOM 0 HD13 LEU A 136 -15.312 1.750 -14.576 1.00 63.45 H new ATOM 0 HD21 LEU A 136 -13.382 4.110 -15.110 1.00 65.14 H new ATOM 0 HD22 LEU A 136 -13.178 2.961 -13.766 1.00 65.14 H new ATOM 0 HD23 LEU A 136 -11.855 3.215 -14.928 1.00 65.14 H new ATOM 2206 N ASP A 137 -9.716 -1.199 -15.690 1.00 51.22 N ATOM 2207 CA ASP A 137 -8.929 -2.408 -15.494 1.00 41.14 C ATOM 2208 C ASP A 137 -8.189 -2.382 -14.157 1.00 5.24 C ATOM 2209 O ASP A 137 -8.505 -1.583 -13.286 1.00 41.13 O ATOM 2210 CB ASP A 137 -7.948 -2.495 -16.665 1.00 33.43 C ATOM 2211 CG ASP A 137 -7.333 -3.887 -16.826 1.00 33.20 C ATOM 2212 OD1 ASP A 137 -8.043 -4.840 -17.218 1.00 30.22 O ATOM 2213 OD2 ASP A 137 -6.153 -4.049 -16.440 1.00 33.43 O ATOM 0 H ASP A 137 -9.233 -0.536 -16.296 1.00 51.22 H new ATOM 0 HA ASP A 137 -9.577 -3.284 -15.466 1.00 41.14 H new ATOM 0 HB2 ASP A 137 -8.464 -2.223 -17.586 1.00 33.43 H new ATOM 0 HB3 ASP A 137 -7.151 -1.766 -16.519 1.00 33.43 H new ATOM 2218 N PHE A 138 -7.208 -3.256 -13.977 1.00 65.23 N ATOM 2219 CA PHE A 138 -6.432 -3.457 -12.770 1.00 45.53 C ATOM 2220 C PHE A 138 -4.967 -3.153 -13.083 1.00 70.21 C ATOM 2221 O PHE A 138 -4.188 -4.028 -13.467 1.00 42.54 O ATOM 2222 CB PHE A 138 -6.656 -4.887 -12.283 1.00 11.21 C ATOM 2223 CG PHE A 138 -8.114 -5.311 -12.296 1.00 51.41 C ATOM 2224 CD1 PHE A 138 -8.985 -4.832 -11.305 1.00 64.14 C ATOM 2225 CD2 PHE A 138 -8.616 -6.114 -13.340 1.00 32.01 C ATOM 2226 CE1 PHE A 138 -10.338 -5.209 -11.315 1.00 71.31 C ATOM 2227 CE2 PHE A 138 -9.975 -6.477 -13.360 1.00 31.33 C ATOM 2228 CZ PHE A 138 -10.831 -6.043 -12.335 1.00 12.30 C ATOM 0 H PHE A 138 -6.917 -3.885 -14.725 1.00 65.23 H new ATOM 0 HA PHE A 138 -6.741 -2.788 -11.967 1.00 45.53 H new ATOM 0 HB2 PHE A 138 -6.082 -5.570 -12.910 1.00 11.21 H new ATOM 0 HB3 PHE A 138 -6.267 -4.982 -11.269 1.00 11.21 H new ATOM 0 HD1 PHE A 138 -8.614 -4.173 -10.534 1.00 64.14 H new ATOM 0 HD2 PHE A 138 -7.956 -6.451 -14.126 1.00 32.01 H new ATOM 0 HE1 PHE A 138 -11.001 -4.858 -10.538 1.00 71.31 H new ATOM 0 HE2 PHE A 138 -10.359 -7.089 -14.163 1.00 31.33 H new ATOM 0 HZ PHE A 138 -11.867 -6.349 -12.330 1.00 12.30 H new ATOM 2238 N GLU A 139 -4.598 -1.882 -12.974 1.00 45.52 N ATOM 2239 CA GLU A 139 -3.201 -1.456 -13.029 1.00 1.30 C ATOM 2240 C GLU A 139 -2.471 -2.128 -11.869 1.00 72.32 C ATOM 2241 O GLU A 139 -2.931 -2.005 -10.739 1.00 54.42 O ATOM 2242 CB GLU A 139 -3.105 0.076 -12.912 1.00 63.14 C ATOM 2243 CG GLU A 139 -1.658 0.590 -12.957 1.00 44.23 C ATOM 2244 CD GLU A 139 -1.036 0.508 -14.353 1.00 11.12 C ATOM 2245 OE1 GLU A 139 -0.841 -0.621 -14.857 1.00 65.32 O ATOM 2246 OE2 GLU A 139 -0.754 1.585 -14.922 1.00 3.25 O ATOM 0 H GLU A 139 -5.258 -1.115 -12.845 1.00 45.52 H new ATOM 0 HA GLU A 139 -2.749 -1.742 -13.979 1.00 1.30 H new ATOM 0 HB2 GLU A 139 -3.673 0.533 -13.722 1.00 63.14 H new ATOM 0 HB3 GLU A 139 -3.569 0.394 -11.978 1.00 63.14 H new ATOM 0 HG2 GLU A 139 -1.635 1.625 -12.616 1.00 44.23 H new ATOM 0 HG3 GLU A 139 -1.051 0.011 -12.261 1.00 44.23 H new ATOM 2253 N LEU A 140 -1.355 -2.812 -12.122 1.00 1.10 N ATOM 2254 CA LEU A 140 -0.572 -3.531 -11.117 1.00 25.41 C ATOM 2255 C LEU A 140 0.892 -3.113 -11.318 1.00 63.42 C ATOM 2256 O LEU A 140 1.296 -2.833 -12.451 1.00 72.15 O ATOM 2257 CB LEU A 140 -0.762 -5.051 -11.321 1.00 13.22 C ATOM 2258 CG LEU A 140 -0.693 -5.959 -10.073 1.00 11.52 C ATOM 2259 CD1 LEU A 140 0.540 -5.759 -9.195 1.00 21.14 C ATOM 2260 CD2 LEU A 140 -1.937 -5.797 -9.194 1.00 63.04 C ATOM 0 H LEU A 140 -0.959 -2.883 -13.059 1.00 1.10 H new ATOM 0 HA LEU A 140 -0.888 -3.296 -10.101 1.00 25.41 H new ATOM 0 HB2 LEU A 140 -1.731 -5.207 -11.795 1.00 13.22 H new ATOM 0 HB3 LEU A 140 -0.003 -5.392 -12.026 1.00 13.22 H new ATOM 0 HG LEU A 140 -0.633 -6.965 -10.489 1.00 11.52 H new ATOM 0 HD11 LEU A 140 0.496 -6.441 -8.346 1.00 21.14 H new ATOM 0 HD12 LEU A 140 1.438 -5.962 -9.778 1.00 21.14 H new ATOM 0 HD13 LEU A 140 0.567 -4.731 -8.834 1.00 21.14 H new ATOM 0 HD21 LEU A 140 -1.856 -6.450 -8.325 1.00 63.04 H new ATOM 0 HD22 LEU A 140 -2.017 -4.761 -8.864 1.00 63.04 H new ATOM 0 HD23 LEU A 140 -2.825 -6.064 -9.767 1.00 63.04 H new ATOM 2272 N TYR A 141 1.706 -3.096 -10.262 1.00 63.25 N ATOM 2273 CA TYR A 141 3.158 -2.927 -10.326 1.00 34.10 C ATOM 2274 C TYR A 141 3.786 -3.884 -9.336 1.00 22.01 C ATOM 2275 O TYR A 141 3.501 -3.768 -8.148 1.00 10.30 O ATOM 2276 CB TYR A 141 3.542 -1.498 -9.940 1.00 71.43 C ATOM 2277 CG TYR A 141 5.018 -1.161 -9.932 1.00 24.12 C ATOM 2278 CD1 TYR A 141 5.804 -1.381 -11.076 1.00 61.04 C ATOM 2279 CD2 TYR A 141 5.576 -0.509 -8.815 1.00 72.42 C ATOM 2280 CE1 TYR A 141 7.131 -0.927 -11.116 1.00 61.13 C ATOM 2281 CE2 TYR A 141 6.887 -0.006 -8.860 1.00 72.32 C ATOM 2282 CZ TYR A 141 7.669 -0.207 -10.026 1.00 14.12 C ATOM 2283 OH TYR A 141 8.894 0.370 -10.159 1.00 4.43 O ATOM 0 H TYR A 141 1.362 -3.203 -9.308 1.00 63.25 H new ATOM 0 HA TYR A 141 3.506 -3.126 -11.340 1.00 34.10 H new ATOM 0 HB2 TYR A 141 3.043 -0.816 -10.628 1.00 71.43 H new ATOM 0 HB3 TYR A 141 3.143 -1.297 -8.946 1.00 71.43 H new ATOM 0 HD1 TYR A 141 5.386 -1.900 -11.926 1.00 61.04 H new ATOM 0 HD2 TYR A 141 4.990 -0.395 -7.915 1.00 72.42 H new ATOM 0 HE1 TYR A 141 7.743 -1.129 -11.983 1.00 61.13 H new ATOM 0 HE2 TYR A 141 7.295 0.528 -8.015 1.00 72.32 H new ATOM 0 HH TYR A 141 9.130 0.831 -9.327 1.00 4.43 H new ATOM 2293 N VAL A 142 4.641 -4.789 -9.800 1.00 53.45 N ATOM 2294 CA VAL A 142 5.434 -5.655 -8.939 1.00 51.51 C ATOM 2295 C VAL A 142 6.854 -5.714 -9.514 1.00 52.54 C ATOM 2296 O VAL A 142 7.162 -6.635 -10.273 1.00 51.35 O ATOM 2297 CB VAL A 142 4.788 -7.049 -8.751 1.00 44.32 C ATOM 2298 CG1 VAL A 142 3.779 -7.054 -7.599 1.00 41.21 C ATOM 2299 CG2 VAL A 142 4.117 -7.616 -10.014 1.00 71.35 C ATOM 0 H VAL A 142 4.804 -4.943 -10.795 1.00 53.45 H new ATOM 0 HA VAL A 142 5.477 -5.244 -7.930 1.00 51.51 H new ATOM 0 HB VAL A 142 5.627 -7.704 -8.516 1.00 44.32 H new ATOM 0 HG11 VAL A 142 3.347 -8.050 -7.498 1.00 41.21 H new ATOM 0 HG12 VAL A 142 4.284 -6.782 -6.672 1.00 41.21 H new ATOM 0 HG13 VAL A 142 2.987 -6.334 -7.806 1.00 41.21 H new ATOM 0 HG21 VAL A 142 3.691 -8.594 -9.792 1.00 71.35 H new ATOM 0 HG22 VAL A 142 3.325 -6.941 -10.340 1.00 71.35 H new ATOM 0 HG23 VAL A 142 4.858 -7.715 -10.807 1.00 71.35 H new ATOM 2309 N PRO A 143 7.738 -4.750 -9.201 1.00 42.44 N ATOM 2310 CA PRO A 143 9.110 -4.743 -9.697 1.00 41.12 C ATOM 2311 C PRO A 143 9.970 -5.856 -9.085 1.00 44.13 C ATOM 2312 O PRO A 143 11.113 -6.012 -9.519 1.00 22.43 O ATOM 2313 CB PRO A 143 9.664 -3.357 -9.358 1.00 32.03 C ATOM 2314 CG PRO A 143 8.892 -2.990 -8.097 1.00 1.42 C ATOM 2315 CD PRO A 143 7.511 -3.587 -8.360 1.00 62.31 C ATOM 0 HA PRO A 143 9.130 -4.938 -10.769 1.00 41.12 H new ATOM 0 HB2 PRO A 143 10.739 -3.382 -9.182 1.00 32.03 H new ATOM 0 HB3 PRO A 143 9.489 -2.643 -10.163 1.00 32.03 H new ATOM 0 HG2 PRO A 143 9.352 -3.413 -7.204 1.00 1.42 H new ATOM 0 HG3 PRO A 143 8.845 -1.911 -7.951 1.00 1.42 H new ATOM 0 HD2 PRO A 143 7.022 -3.868 -7.427 1.00 62.31 H new ATOM 0 HD3 PRO A 143 6.861 -2.866 -8.856 1.00 62.31 H new ATOM 2323 N TYR A 144 9.453 -6.619 -8.113 1.00 25.03 N ATOM 2324 CA TYR A 144 10.115 -7.797 -7.561 1.00 22.41 C ATOM 2325 C TYR A 144 9.315 -9.078 -7.833 1.00 70.23 C ATOM 2326 O TYR A 144 9.839 -10.174 -7.624 1.00 1.33 O ATOM 2327 CB TYR A 144 10.372 -7.589 -6.058 1.00 54.25 C ATOM 2328 CG TYR A 144 11.108 -6.301 -5.725 1.00 11.34 C ATOM 2329 CD1 TYR A 144 12.368 -6.047 -6.302 1.00 42.34 C ATOM 2330 CD2 TYR A 144 10.518 -5.338 -4.878 1.00 72.02 C ATOM 2331 CE1 TYR A 144 13.021 -4.826 -6.066 1.00 74.21 C ATOM 2332 CE2 TYR A 144 11.175 -4.118 -4.625 1.00 74.44 C ATOM 2333 CZ TYR A 144 12.419 -3.859 -5.239 1.00 1.32 C ATOM 2334 OH TYR A 144 13.062 -2.681 -5.038 1.00 12.55 O ATOM 0 H TYR A 144 8.547 -6.427 -7.684 1.00 25.03 H new ATOM 0 HA TYR A 144 11.075 -7.925 -8.061 1.00 22.41 H new ATOM 0 HB2 TYR A 144 9.417 -7.595 -5.533 1.00 54.25 H new ATOM 0 HB3 TYR A 144 10.949 -8.433 -5.679 1.00 54.25 H new ATOM 0 HD1 TYR A 144 12.833 -6.794 -6.928 1.00 42.34 H new ATOM 0 HD2 TYR A 144 9.559 -5.537 -4.422 1.00 72.02 H new ATOM 0 HE1 TYR A 144 13.982 -4.630 -6.518 1.00 74.21 H new ATOM 0 HE2 TYR A 144 10.730 -3.387 -3.966 1.00 74.44 H new ATOM 0 HH TYR A 144 12.655 -2.211 -4.280 1.00 12.55 H new ATOM 2344 N GLY A 145 8.074 -8.976 -8.318 1.00 24.01 N ATOM 2345 CA GLY A 145 7.172 -10.097 -8.571 1.00 42.21 C ATOM 2346 C GLY A 145 6.165 -10.298 -7.435 1.00 25.40 C ATOM 2347 O GLY A 145 6.346 -9.783 -6.330 1.00 41.43 O ATOM 0 H GLY A 145 7.657 -8.075 -8.553 1.00 24.01 H new ATOM 0 HA2 GLY A 145 6.635 -9.925 -9.504 1.00 42.21 H new ATOM 0 HA3 GLY A 145 7.756 -11.008 -8.702 1.00 42.21 H new ATOM 2351 N LEU A 146 5.088 -11.033 -7.717 1.00 42.31 N ATOM 2352 CA LEU A 146 3.936 -11.210 -6.836 1.00 5.44 C ATOM 2353 C LEU A 146 4.193 -12.200 -5.722 1.00 11.10 C ATOM 2354 O LEU A 146 3.509 -12.141 -4.700 1.00 44.25 O ATOM 2355 CB LEU A 146 2.753 -11.757 -7.650 1.00 1.51 C ATOM 2356 CG LEU A 146 1.989 -10.669 -8.406 1.00 3.44 C ATOM 2357 CD1 LEU A 146 1.152 -11.302 -9.512 1.00 44.42 C ATOM 2358 CD2 LEU A 146 1.079 -9.870 -7.464 1.00 43.11 C ATOM 0 H LEU A 146 4.992 -11.539 -8.597 1.00 42.31 H new ATOM 0 HA LEU A 146 3.729 -10.232 -6.401 1.00 5.44 H new ATOM 0 HB2 LEU A 146 3.121 -12.496 -8.362 1.00 1.51 H new ATOM 0 HB3 LEU A 146 2.067 -12.275 -6.979 1.00 1.51 H new ATOM 0 HG LEU A 146 2.717 -9.983 -8.840 1.00 3.44 H new ATOM 0 HD11 LEU A 146 0.609 -10.524 -10.048 1.00 44.42 H new ATOM 0 HD12 LEU A 146 1.806 -11.832 -10.205 1.00 44.42 H new ATOM 0 HD13 LEU A 146 0.442 -12.004 -9.075 1.00 44.42 H new ATOM 0 HD21 LEU A 146 0.550 -9.105 -8.032 1.00 43.11 H new ATOM 0 HD22 LEU A 146 0.357 -10.541 -7.000 1.00 43.11 H new ATOM 0 HD23 LEU A 146 1.683 -9.396 -6.691 1.00 43.11 H new ATOM 2370 N GLU A 147 5.095 -13.162 -5.918 1.00 3.52 N ATOM 2371 CA GLU A 147 5.043 -14.369 -5.125 1.00 1.12 C ATOM 2372 C GLU A 147 5.403 -14.155 -3.663 1.00 21.30 C ATOM 2373 O GLU A 147 5.008 -14.976 -2.840 1.00 53.52 O ATOM 2374 CB GLU A 147 5.878 -15.477 -5.765 1.00 24.02 C ATOM 2375 CG GLU A 147 4.956 -16.459 -6.494 1.00 10.50 C ATOM 2376 CD GLU A 147 5.577 -17.847 -6.616 1.00 25.00 C ATOM 2377 OE1 GLU A 147 6.524 -18.024 -7.398 1.00 11.34 O ATOM 2378 OE2 GLU A 147 5.055 -18.799 -5.971 1.00 65.05 O ATOM 0 H GLU A 147 5.849 -13.124 -6.604 1.00 3.52 H new ATOM 0 HA GLU A 147 4.001 -14.688 -5.117 1.00 1.12 H new ATOM 0 HB2 GLU A 147 6.595 -15.048 -6.465 1.00 24.02 H new ATOM 0 HB3 GLU A 147 6.453 -16.001 -5.001 1.00 24.02 H new ATOM 0 HG2 GLU A 147 4.009 -16.532 -5.959 1.00 10.50 H new ATOM 0 HG3 GLU A 147 4.731 -16.074 -7.489 1.00 10.50 H new ATOM 2385 N ASP A 148 6.046 -13.042 -3.316 1.00 1.53 N ATOM 2386 CA ASP A 148 6.244 -12.644 -1.923 1.00 70.23 C ATOM 2387 C ASP A 148 4.910 -12.485 -1.201 1.00 12.30 C ATOM 2388 O ASP A 148 4.802 -12.819 -0.024 1.00 34.00 O ATOM 2389 CB ASP A 148 7.045 -11.340 -1.824 1.00 12.23 C ATOM 2390 CG ASP A 148 8.499 -11.658 -1.519 1.00 1.32 C ATOM 2391 OD1 ASP A 148 9.153 -12.293 -2.377 1.00 23.30 O ATOM 2392 OD2 ASP A 148 8.986 -11.304 -0.423 1.00 74.21 O ATOM 0 H ASP A 148 6.445 -12.390 -3.992 1.00 1.53 H new ATOM 0 HA ASP A 148 6.812 -13.439 -1.440 1.00 70.23 H new ATOM 0 HB2 ASP A 148 6.972 -10.784 -2.759 1.00 12.23 H new ATOM 0 HB3 ASP A 148 6.629 -10.704 -1.042 1.00 12.23 H new ATOM 2397 N ILE A 149 3.868 -12.012 -1.887 1.00 70.05 N ATOM 2398 CA ILE A 149 2.566 -11.808 -1.286 1.00 52.11 C ATOM 2399 C ILE A 149 1.934 -13.190 -1.132 1.00 3.51 C ATOM 2400 O ILE A 149 1.537 -13.553 -0.023 1.00 44.42 O ATOM 2401 CB ILE A 149 1.705 -10.810 -2.102 1.00 45.33 C ATOM 2402 CG1 ILE A 149 2.558 -9.612 -2.599 1.00 13.11 C ATOM 2403 CG2 ILE A 149 0.539 -10.333 -1.215 1.00 53.21 C ATOM 2404 CD1 ILE A 149 1.773 -8.459 -3.220 1.00 42.11 C ATOM 0 H ILE A 149 3.912 -11.762 -2.875 1.00 70.05 H new ATOM 0 HA ILE A 149 2.648 -11.339 -0.305 1.00 52.11 H new ATOM 0 HB ILE A 149 1.310 -11.306 -2.989 1.00 45.33 H new ATOM 0 HG12 ILE A 149 3.134 -9.225 -1.758 1.00 13.11 H new ATOM 0 HG13 ILE A 149 3.274 -9.979 -3.334 1.00 13.11 H new ATOM 0 HG21 ILE A 149 -0.078 -9.629 -1.773 1.00 53.21 H new ATOM 0 HG22 ILE A 149 -0.066 -11.190 -0.917 1.00 53.21 H new ATOM 0 HG23 ILE A 149 0.935 -9.842 -0.326 1.00 53.21 H new ATOM 0 HD11 ILE A 149 2.463 -7.676 -3.533 1.00 42.11 H new ATOM 0 HD12 ILE A 149 1.218 -8.821 -4.086 1.00 42.11 H new ATOM 0 HD13 ILE A 149 1.076 -8.056 -2.485 1.00 42.11 H new ATOM 2416 N LEU A 150 1.874 -13.987 -2.208 1.00 24.11 N ATOM 2417 CA LEU A 150 1.254 -15.321 -2.172 1.00 72.45 C ATOM 2418 C LEU A 150 1.909 -16.226 -1.125 1.00 63.12 C ATOM 2419 O LEU A 150 1.226 -17.005 -0.456 1.00 50.55 O ATOM 2420 CB LEU A 150 1.299 -16.015 -3.550 1.00 10.12 C ATOM 2421 CG LEU A 150 0.401 -15.445 -4.670 1.00 12.10 C ATOM 2422 CD1 LEU A 150 -0.895 -14.791 -4.184 1.00 24.23 C ATOM 2423 CD2 LEU A 150 1.132 -14.427 -5.546 1.00 25.33 C ATOM 0 H LEU A 150 2.250 -13.729 -3.121 1.00 24.11 H new ATOM 0 HA LEU A 150 0.212 -15.162 -1.895 1.00 72.45 H new ATOM 0 HB2 LEU A 150 2.330 -15.993 -3.903 1.00 10.12 H new ATOM 0 HB3 LEU A 150 1.033 -17.062 -3.407 1.00 10.12 H new ATOM 0 HG LEU A 150 0.140 -16.333 -5.246 1.00 12.10 H new ATOM 0 HD11 LEU A 150 -1.459 -14.421 -5.040 1.00 24.23 H new ATOM 0 HD12 LEU A 150 -1.494 -15.526 -3.645 1.00 24.23 H new ATOM 0 HD13 LEU A 150 -0.657 -13.960 -3.520 1.00 24.23 H new ATOM 0 HD21 LEU A 150 0.455 -14.058 -6.317 1.00 25.33 H new ATOM 0 HD22 LEU A 150 1.470 -13.593 -4.930 1.00 25.33 H new ATOM 0 HD23 LEU A 150 1.993 -14.903 -6.016 1.00 25.33 H new ATOM 2435 N ASN A 151 3.227 -16.120 -0.959 1.00 24.00 N ATOM 2436 CA ASN A 151 3.995 -16.922 -0.018 1.00 44.14 C ATOM 2437 C ASN A 151 4.017 -16.326 1.389 1.00 32.21 C ATOM 2438 O ASN A 151 4.722 -16.879 2.233 1.00 12.43 O ATOM 2439 CB ASN A 151 5.406 -17.185 -0.574 1.00 53.13 C ATOM 2440 CG ASN A 151 5.325 -18.215 -1.682 1.00 31.13 C ATOM 2441 OD1 ASN A 151 5.034 -19.371 -1.394 1.00 45.54 O ATOM 2442 ND2 ASN A 151 5.490 -17.822 -2.934 1.00 44.13 N ATOM 0 H ASN A 151 3.798 -15.460 -1.487 1.00 24.00 H new ATOM 0 HA ASN A 151 3.492 -17.883 0.091 1.00 44.14 H new ATOM 0 HB2 ASN A 151 5.838 -16.259 -0.954 1.00 53.13 H new ATOM 0 HB3 ASN A 151 6.062 -17.540 0.221 1.00 53.13 H new ATOM 0 HD21 ASN A 151 5.375 -18.489 -3.697 1.00 44.13 H new ATOM 0 HD22 ASN A 151 5.732 -16.852 -3.136 1.00 44.13 H new ATOM 2449 N PHE A 152 3.252 -15.256 1.647 1.00 10.14 N ATOM 2450 CA PHE A 152 3.144 -14.539 2.917 1.00 71.21 C ATOM 2451 C PHE A 152 4.511 -14.129 3.467 1.00 42.13 C ATOM 2452 O PHE A 152 4.862 -14.460 4.596 1.00 10.42 O ATOM 2453 CB PHE A 152 2.330 -15.351 3.936 1.00 30.14 C ATOM 2454 CG PHE A 152 0.833 -15.329 3.777 1.00 53.22 C ATOM 2455 CD1 PHE A 152 0.101 -14.303 4.404 1.00 53.11 C ATOM 2456 CD2 PHE A 152 0.163 -16.379 3.126 1.00 50.44 C ATOM 2457 CE1 PHE A 152 -1.299 -14.342 4.421 1.00 31.31 C ATOM 2458 CE2 PHE A 152 -1.241 -16.414 3.142 1.00 43.24 C ATOM 2459 CZ PHE A 152 -1.966 -15.408 3.806 1.00 54.02 C ATOM 0 H PHE A 152 2.657 -14.846 0.927 1.00 10.14 H new ATOM 0 HA PHE A 152 2.603 -13.612 2.726 1.00 71.21 H new ATOM 0 HB2 PHE A 152 2.662 -16.388 3.888 1.00 30.14 H new ATOM 0 HB3 PHE A 152 2.572 -14.985 4.934 1.00 30.14 H new ATOM 0 HD1 PHE A 152 0.621 -13.482 4.874 1.00 53.11 H new ATOM 0 HD2 PHE A 152 0.722 -17.151 2.619 1.00 50.44 H new ATOM 0 HE1 PHE A 152 -1.860 -13.556 4.905 1.00 31.31 H new ATOM 0 HE2 PHE A 152 -1.765 -17.216 2.643 1.00 43.24 H new ATOM 0 HZ PHE A 152 -3.044 -15.458 3.842 1.00 54.02 H new ATOM 2469 N GLN A 153 5.308 -13.402 2.690 1.00 21.14 N ATOM 2470 CA GLN A 153 6.699 -13.156 3.036 1.00 31.34 C ATOM 2471 C GLN A 153 6.924 -11.701 3.366 1.00 44.43 C ATOM 2472 O GLN A 153 6.339 -10.812 2.743 1.00 72.32 O ATOM 2473 CB GLN A 153 7.602 -13.540 1.869 1.00 34.02 C ATOM 2474 CG GLN A 153 7.264 -14.943 1.391 1.00 71.22 C ATOM 2475 CD GLN A 153 8.426 -15.548 0.648 1.00 41.23 C ATOM 2476 OE1 GLN A 153 8.568 -15.401 -0.557 1.00 22.42 O ATOM 2477 NE2 GLN A 153 9.272 -16.254 1.370 1.00 63.13 N ATOM 0 H GLN A 153 5.010 -12.973 1.814 1.00 21.14 H new ATOM 0 HA GLN A 153 6.939 -13.761 3.910 1.00 31.34 H new ATOM 0 HB2 GLN A 153 7.477 -12.829 1.053 1.00 34.02 H new ATOM 0 HB3 GLN A 153 8.647 -13.493 2.176 1.00 34.02 H new ATOM 0 HG2 GLN A 153 7.005 -15.570 2.244 1.00 71.22 H new ATOM 0 HG3 GLN A 153 6.389 -14.910 0.742 1.00 71.22 H new ATOM 0 HE21 GLN A 153 9.124 -16.357 2.374 1.00 63.13 H new ATOM 0 HE22 GLN A 153 10.075 -16.698 0.925 1.00 63.13 H new ATOM 2486 N VAL A 154 7.857 -11.462 4.278 1.00 34.23 N ATOM 2487 CA VAL A 154 8.254 -10.140 4.712 1.00 31.43 C ATOM 2488 C VAL A 154 9.780 -10.148 4.747 1.00 30.34 C ATOM 2489 O VAL A 154 10.376 -10.411 5.790 1.00 4.30 O ATOM 2490 CB VAL A 154 7.570 -9.820 6.059 1.00 52.32 C ATOM 2491 CG1 VAL A 154 7.797 -8.356 6.450 1.00 33.54 C ATOM 2492 CG2 VAL A 154 6.053 -10.081 5.978 1.00 64.43 C ATOM 0 H VAL A 154 8.370 -12.208 4.747 1.00 34.23 H new ATOM 0 HA VAL A 154 7.937 -9.340 4.043 1.00 31.43 H new ATOM 0 HB VAL A 154 8.012 -10.472 6.813 1.00 52.32 H new ATOM 0 HG11 VAL A 154 7.306 -8.153 7.402 1.00 33.54 H new ATOM 0 HG12 VAL A 154 8.866 -8.166 6.545 1.00 33.54 H new ATOM 0 HG13 VAL A 154 7.380 -7.705 5.681 1.00 33.54 H new ATOM 0 HG21 VAL A 154 5.592 -9.849 6.938 1.00 64.43 H new ATOM 0 HG22 VAL A 154 5.616 -9.450 5.204 1.00 64.43 H new ATOM 0 HG23 VAL A 154 5.877 -11.129 5.735 1.00 64.43 H new ATOM 2502 N ARG A 155 10.411 -9.912 3.592 1.00 3.32 N ATOM 2503 CA ARG A 155 11.829 -9.559 3.506 1.00 23.30 C ATOM 2504 C ARG A 155 11.929 -8.064 3.199 1.00 23.10 C ATOM 2505 O ARG A 155 11.045 -7.539 2.518 1.00 10.23 O ATOM 2506 CB ARG A 155 12.627 -10.415 2.484 1.00 2.42 C ATOM 2507 CG ARG A 155 11.924 -10.973 1.245 1.00 21.00 C ATOM 2508 CD ARG A 155 11.892 -12.500 1.234 1.00 22.02 C ATOM 2509 NE ARG A 155 11.302 -12.939 -0.028 1.00 53.41 N ATOM 2510 CZ ARG A 155 11.688 -13.941 -0.831 1.00 10.32 C ATOM 2511 NH1 ARG A 155 12.741 -14.696 -0.553 1.00 72.31 N ATOM 2512 NH2 ARG A 155 11.019 -14.204 -1.939 1.00 1.42 N ATOM 0 H ARG A 155 9.947 -9.961 2.685 1.00 3.32 H new ATOM 0 HA ARG A 155 12.296 -9.781 4.465 1.00 23.30 H new ATOM 0 HB2 ARG A 155 13.465 -9.810 2.137 1.00 2.42 H new ATOM 0 HB3 ARG A 155 13.048 -11.261 3.027 1.00 2.42 H new ATOM 0 HG2 ARG A 155 10.904 -10.590 1.206 1.00 21.00 H new ATOM 0 HG3 ARG A 155 12.433 -10.616 0.350 1.00 21.00 H new ATOM 0 HD2 ARG A 155 12.900 -12.901 1.342 1.00 22.02 H new ATOM 0 HD3 ARG A 155 11.309 -12.873 2.076 1.00 22.02 H new ATOM 0 HE ARG A 155 10.486 -12.412 -0.341 1.00 53.41 H new ATOM 0 HH11 ARG A 155 13.284 -14.522 0.293 1.00 72.31 H new ATOM 0 HH12 ARG A 155 13.008 -15.451 -1.185 1.00 72.31 H new ATOM 0 HH21 ARG A 155 10.204 -13.644 -2.188 1.00 1.42 H new ATOM 0 HH22 ARG A 155 11.317 -14.968 -2.546 1.00 1.42 H new ATOM 2526 N PRO A 156 12.981 -7.373 3.666 1.00 44.25 N ATOM 2527 CA PRO A 156 13.246 -5.988 3.296 1.00 34.10 C ATOM 2528 C PRO A 156 13.516 -5.863 1.795 1.00 70.41 C ATOM 2529 O PRO A 156 13.935 -6.829 1.152 1.00 63.14 O ATOM 2530 CB PRO A 156 14.439 -5.547 4.150 1.00 41.52 C ATOM 2531 CG PRO A 156 15.117 -6.856 4.556 1.00 21.40 C ATOM 2532 CD PRO A 156 13.972 -7.856 4.610 1.00 14.42 C ATOM 0 HA PRO A 156 12.387 -5.344 3.484 1.00 34.10 H new ATOM 0 HB2 PRO A 156 15.117 -4.906 3.586 1.00 41.52 H new ATOM 0 HB3 PRO A 156 14.116 -4.979 5.022 1.00 41.52 H new ATOM 0 HG2 PRO A 156 15.875 -7.155 3.832 1.00 21.40 H new ATOM 0 HG3 PRO A 156 15.615 -6.766 5.521 1.00 21.40 H new ATOM 0 HD2 PRO A 156 14.313 -8.856 4.342 1.00 14.42 H new ATOM 0 HD3 PRO A 156 13.556 -7.920 5.615 1.00 14.42 H new ATOM 2540 N THR A 157 13.265 -4.684 1.216 1.00 74.41 N ATOM 2541 CA THR A 157 13.567 -4.433 -0.191 1.00 65.20 C ATOM 2542 C THR A 157 15.083 -4.485 -0.426 1.00 24.22 C ATOM 2543 O THR A 157 15.862 -4.215 0.493 1.00 41.13 O ATOM 2544 CB THR A 157 12.981 -3.082 -0.639 1.00 43.24 C ATOM 2545 OG1 THR A 157 13.318 -2.063 0.275 1.00 1.11 O ATOM 2546 CG2 THR A 157 11.464 -3.168 -0.818 1.00 43.30 C ATOM 0 H THR A 157 12.853 -3.889 1.704 1.00 74.41 H new ATOM 0 HA THR A 157 13.102 -5.213 -0.794 1.00 65.20 H new ATOM 0 HB THR A 157 13.418 -2.834 -1.606 1.00 43.24 H new ATOM 0 HG1 THR A 157 12.527 -1.514 0.460 1.00 1.11 H new ATOM 0 HG21 THR A 157 11.079 -2.198 -1.135 1.00 43.30 H new ATOM 0 HG22 THR A 157 11.229 -3.916 -1.575 1.00 43.30 H new ATOM 0 HG23 THR A 157 11.001 -3.450 0.128 1.00 43.30 H new ATOM 2554 N PRO A 158 15.529 -4.729 -1.669 1.00 43.24 N ATOM 2555 CA PRO A 158 16.945 -4.788 -1.990 1.00 22.04 C ATOM 2556 C PRO A 158 17.610 -3.415 -2.034 1.00 52.11 C ATOM 2557 O PRO A 158 18.819 -3.366 -2.274 1.00 62.40 O ATOM 2558 CB PRO A 158 17.005 -5.431 -3.374 1.00 43.21 C ATOM 2559 CG PRO A 158 15.726 -4.936 -4.033 1.00 5.13 C ATOM 2560 CD PRO A 158 14.742 -4.968 -2.871 1.00 44.14 C ATOM 0 HA PRO A 158 17.482 -5.346 -1.223 1.00 22.04 H new ATOM 0 HB2 PRO A 158 17.891 -5.119 -3.927 1.00 43.21 H new ATOM 0 HB3 PRO A 158 17.034 -6.519 -3.313 1.00 43.21 H new ATOM 0 HG2 PRO A 158 15.840 -3.933 -4.444 1.00 5.13 H new ATOM 0 HG3 PRO A 158 15.412 -5.583 -4.852 1.00 5.13 H new ATOM 0 HD2 PRO A 158 13.972 -4.206 -2.991 1.00 44.14 H new ATOM 0 HD3 PRO A 158 14.232 -5.930 -2.818 1.00 44.14 H new ATOM 2568 N HIS A 159 16.863 -2.338 -1.774 1.00 64.22 N ATOM 2569 CA HIS A 159 17.400 -1.003 -1.587 1.00 61.44 C ATOM 2570 C HIS A 159 17.649 -0.700 -0.099 1.00 52.23 C ATOM 2571 O HIS A 159 18.390 0.233 0.198 1.00 33.21 O ATOM 2572 CB HIS A 159 16.429 0.015 -2.209 1.00 2.52 C ATOM 2573 CG HIS A 159 17.111 1.259 -2.746 1.00 33.15 C ATOM 2574 ND1 HIS A 159 18.249 1.856 -2.254 1.00 12.21 N ATOM 2575 CD2 HIS A 159 16.764 1.951 -3.872 1.00 33.02 C ATOM 2576 CE1 HIS A 159 18.568 2.882 -3.060 1.00 4.44 C ATOM 2577 NE2 HIS A 159 17.666 3.003 -4.046 1.00 61.31 N ATOM 0 H HIS A 159 15.848 -2.379 -1.687 1.00 64.22 H new ATOM 0 HA HIS A 159 18.366 -0.932 -2.086 1.00 61.44 H new ATOM 0 HB2 HIS A 159 15.881 -0.467 -3.019 1.00 2.52 H new ATOM 0 HB3 HIS A 159 15.695 0.309 -1.459 1.00 2.52 H new ATOM 0 HD1 HIS A 159 18.762 1.569 -1.421 1.00 12.21 H new ATOM 0 HD2 HIS A 159 15.931 1.722 -4.520 1.00 33.02 H new ATOM 0 HE1 HIS A 159 19.430 3.520 -2.932 1.00 4.44 H new ATOM 2585 N PHE A 160 17.021 -1.431 0.835 1.00 62.11 N ATOM 2586 CA PHE A 160 16.993 -1.101 2.263 1.00 54.33 C ATOM 2587 C PHE A 160 18.330 -1.351 2.951 1.00 74.03 C ATOM 2588 O PHE A 160 18.843 -0.423 3.567 1.00 42.41 O ATOM 2589 CB PHE A 160 15.827 -1.829 2.958 1.00 52.34 C ATOM 2590 CG PHE A 160 14.792 -0.879 3.526 1.00 32.15 C ATOM 2591 CD1 PHE A 160 14.150 0.047 2.681 1.00 53.23 C ATOM 2592 CD2 PHE A 160 14.486 -0.895 4.900 1.00 1.43 C ATOM 2593 CE1 PHE A 160 13.221 0.960 3.205 1.00 11.35 C ATOM 2594 CE2 PHE A 160 13.542 0.009 5.416 1.00 61.40 C ATOM 2595 CZ PHE A 160 12.909 0.933 4.571 1.00 22.13 C ATOM 0 H PHE A 160 16.509 -2.284 0.611 1.00 62.11 H new ATOM 0 HA PHE A 160 16.820 -0.029 2.352 1.00 54.33 H new ATOM 0 HB2 PHE A 160 15.346 -2.498 2.244 1.00 52.34 H new ATOM 0 HB3 PHE A 160 16.221 -2.451 3.762 1.00 52.34 H new ATOM 0 HD1 PHE A 160 14.374 0.055 1.624 1.00 53.23 H new ATOM 0 HD2 PHE A 160 14.975 -1.600 5.556 1.00 1.43 H new ATOM 0 HE1 PHE A 160 12.747 1.682 2.556 1.00 11.35 H new ATOM 0 HE2 PHE A 160 13.302 -0.008 6.469 1.00 61.40 H new ATOM 0 HZ PHE A 160 12.182 1.623 4.973 1.00 22.13 H new ATOM 2605 N LEU A 161 18.908 -2.550 2.816 1.00 44.54 N ATOM 2606 CA LEU A 161 20.172 -2.942 3.457 1.00 42.53 C ATOM 2607 C LEU A 161 21.321 -2.036 3.014 1.00 42.50 C ATOM 2608 O LEU A 161 22.357 -1.967 3.669 1.00 21.25 O ATOM 2609 CB LEU A 161 20.592 -4.377 3.122 1.00 70.03 C ATOM 2610 CG LEU A 161 19.649 -5.519 3.506 1.00 32.32 C ATOM 2611 CD1 LEU A 161 19.597 -5.725 5.020 1.00 30.21 C ATOM 2612 CD2 LEU A 161 18.233 -5.503 2.902 1.00 51.51 C ATOM 0 H LEU A 161 18.502 -3.292 2.246 1.00 44.54 H new ATOM 0 HA LEU A 161 19.984 -2.854 4.527 1.00 42.53 H new ATOM 0 HB2 LEU A 161 20.759 -4.432 2.046 1.00 70.03 H new ATOM 0 HB3 LEU A 161 21.552 -4.563 3.603 1.00 70.03 H new ATOM 0 HG LEU A 161 20.116 -6.379 3.026 1.00 32.32 H new ATOM 0 HD11 LEU A 161 18.917 -6.544 5.253 1.00 30.21 H new ATOM 0 HD12 LEU A 161 20.594 -5.965 5.389 1.00 30.21 H new ATOM 0 HD13 LEU A 161 19.243 -4.812 5.499 1.00 30.21 H new ATOM 0 HD21 LEU A 161 17.675 -6.369 3.259 1.00 51.51 H new ATOM 0 HD22 LEU A 161 17.719 -4.591 3.204 1.00 51.51 H new ATOM 0 HD23 LEU A 161 18.301 -5.538 1.815 1.00 51.51 H new ATOM 2624 N GLU A 162 21.165 -1.377 1.866 1.00 63.12 N ATOM 2625 CA GLU A 162 22.130 -0.426 1.320 1.00 41.51 C ATOM 2626 C GLU A 162 22.359 0.778 2.252 1.00 31.45 C ATOM 2627 O GLU A 162 23.351 1.492 2.080 1.00 13.43 O ATOM 2628 CB GLU A 162 21.687 0.051 -0.073 1.00 12.33 C ATOM 2629 CG GLU A 162 21.269 -1.099 -0.991 1.00 73.03 C ATOM 2630 CD GLU A 162 21.324 -0.707 -2.471 1.00 61.13 C ATOM 2631 OE1 GLU A 162 20.451 0.057 -2.935 1.00 21.15 O ATOM 2632 OE2 GLU A 162 22.246 -1.154 -3.197 1.00 71.32 O ATOM 0 H GLU A 162 20.342 -1.494 1.275 1.00 63.12 H new ATOM 0 HA GLU A 162 23.081 -0.951 1.233 1.00 41.51 H new ATOM 0 HB2 GLU A 162 20.853 0.745 0.034 1.00 12.33 H new ATOM 0 HB3 GLU A 162 22.503 0.603 -0.539 1.00 12.33 H new ATOM 0 HG2 GLU A 162 21.922 -1.955 -0.819 1.00 73.03 H new ATOM 0 HG3 GLU A 162 20.257 -1.414 -0.738 1.00 73.03 H new ATOM 2639 N ASN A 163 21.469 0.995 3.230 1.00 63.14 N ATOM 2640 CA ASN A 163 21.558 2.000 4.285 1.00 10.34 C ATOM 2641 C ASN A 163 21.044 1.426 5.608 1.00 54.14 C ATOM 2642 O ASN A 163 19.834 1.293 5.795 1.00 23.02 O ATOM 2643 CB ASN A 163 20.731 3.242 3.924 1.00 14.54 C ATOM 2644 CG ASN A 163 21.557 4.381 3.362 1.00 63.02 C ATOM 2645 OD1 ASN A 163 21.405 4.762 2.207 1.00 25.03 O ATOM 2646 ND2 ASN A 163 22.407 4.973 4.179 1.00 64.41 N ATOM 0 H ASN A 163 20.618 0.437 3.306 1.00 63.14 H new ATOM 0 HA ASN A 163 22.605 2.285 4.390 1.00 10.34 H new ATOM 0 HB2 ASN A 163 19.971 2.962 3.195 1.00 14.54 H new ATOM 0 HB3 ASN A 163 20.207 3.590 4.814 1.00 14.54 H new ATOM 0 HD21 ASN A 163 22.957 5.768 3.854 1.00 64.41 H new ATOM 0 HD22 ASN A 163 22.514 4.636 5.136 1.00 64.41 H new ATOM 2653 N GLU A 164 21.950 1.187 6.556 1.00 74.02 N ATOM 2654 CA GLU A 164 21.668 0.760 7.930 1.00 5.15 C ATOM 2655 C GLU A 164 20.605 1.624 8.611 1.00 64.43 C ATOM 2656 O GLU A 164 19.798 1.101 9.379 1.00 5.01 O ATOM 2657 CB GLU A 164 22.978 0.831 8.740 1.00 51.34 C ATOM 2658 CG GLU A 164 24.075 -0.148 8.283 1.00 44.20 C ATOM 2659 CD GLU A 164 23.734 -1.613 8.572 1.00 31.51 C ATOM 2660 OE1 GLU A 164 23.220 -1.892 9.682 1.00 2.25 O ATOM 2661 OE2 GLU A 164 23.992 -2.477 7.711 1.00 14.52 O ATOM 0 H GLU A 164 22.949 1.290 6.380 1.00 74.02 H new ATOM 0 HA GLU A 164 21.277 -0.257 7.892 1.00 5.15 H new ATOM 0 HB2 GLU A 164 23.370 1.846 8.682 1.00 51.34 H new ATOM 0 HB3 GLU A 164 22.751 0.637 9.788 1.00 51.34 H new ATOM 0 HG2 GLU A 164 24.241 -0.024 7.213 1.00 44.20 H new ATOM 0 HG3 GLU A 164 25.010 0.106 8.782 1.00 44.20 H new ATOM 2668 N ASP A 165 20.547 2.925 8.322 1.00 21.25 N ATOM 2669 CA ASP A 165 19.563 3.809 8.938 1.00 50.31 C ATOM 2670 C ASP A 165 18.160 3.392 8.522 1.00 54.04 C ATOM 2671 O ASP A 165 17.239 3.494 9.322 1.00 12.11 O ATOM 2672 CB ASP A 165 19.780 5.264 8.499 1.00 2.24 C ATOM 2673 CG ASP A 165 20.774 6.048 9.346 1.00 45.24 C ATOM 2674 OD1 ASP A 165 21.933 5.593 9.461 1.00 62.24 O ATOM 2675 OD2 ASP A 165 20.425 7.150 9.843 1.00 43.42 O ATOM 0 H ASP A 165 21.173 3.388 7.663 1.00 21.25 H new ATOM 0 HA ASP A 165 19.680 3.734 10.019 1.00 50.31 H new ATOM 0 HB2 ASP A 165 20.123 5.269 7.464 1.00 2.24 H new ATOM 0 HB3 ASP A 165 18.821 5.781 8.519 1.00 2.24 H new ATOM 2680 N ARG A 166 17.945 2.898 7.296 1.00 70.20 N ATOM 2681 CA ARG A 166 16.589 2.486 6.939 1.00 2.22 C ATOM 2682 C ARG A 166 16.170 1.249 7.711 1.00 51.11 C ATOM 2683 O ARG A 166 14.989 1.093 8.008 1.00 62.34 O ATOM 2684 CB ARG A 166 16.430 2.217 5.447 1.00 21.32 C ATOM 2685 CG ARG A 166 16.688 3.449 4.581 1.00 42.50 C ATOM 2686 CD ARG A 166 15.864 3.331 3.292 1.00 62.30 C ATOM 2687 NE ARG A 166 16.486 4.043 2.165 1.00 62.21 N ATOM 2688 CZ ARG A 166 17.515 3.578 1.441 1.00 70.04 C ATOM 2689 NH1 ARG A 166 18.060 2.409 1.752 1.00 3.52 N ATOM 2690 NH2 ARG A 166 17.989 4.263 0.407 1.00 45.30 N ATOM 0 H ARG A 166 18.653 2.779 6.571 1.00 70.20 H new ATOM 0 HA ARG A 166 15.944 3.323 7.205 1.00 2.22 H new ATOM 0 HB2 ARG A 166 17.117 1.424 5.152 1.00 21.32 H new ATOM 0 HB3 ARG A 166 15.421 1.852 5.256 1.00 21.32 H new ATOM 0 HG2 ARG A 166 16.414 4.355 5.122 1.00 42.50 H new ATOM 0 HG3 ARG A 166 17.749 3.528 4.344 1.00 42.50 H new ATOM 0 HD2 ARG A 166 15.746 2.279 3.034 1.00 62.30 H new ATOM 0 HD3 ARG A 166 14.865 3.731 3.464 1.00 62.30 H new ATOM 0 HE ARG A 166 16.107 4.957 1.916 1.00 62.21 H new ATOM 0 HH11 ARG A 166 17.696 1.870 2.538 1.00 3.52 H new ATOM 0 HH12 ARG A 166 18.843 2.050 1.205 1.00 3.52 H new ATOM 0 HH21 ARG A 166 17.570 5.157 0.153 1.00 45.30 H new ATOM 0 HH22 ARG A 166 18.772 3.895 -0.133 1.00 45.30 H new ATOM 2704 N MET A 167 17.116 0.372 8.027 1.00 13.33 N ATOM 2705 CA MET A 167 16.809 -0.881 8.696 1.00 11.22 C ATOM 2706 C MET A 167 16.163 -0.627 10.057 1.00 25.43 C ATOM 2707 O MET A 167 15.220 -1.338 10.405 1.00 63.44 O ATOM 2708 CB MET A 167 18.055 -1.771 8.809 1.00 21.12 C ATOM 2709 CG MET A 167 18.595 -2.183 7.431 1.00 33.43 C ATOM 2710 SD MET A 167 17.394 -2.987 6.326 1.00 32.22 S ATOM 2711 CE MET A 167 16.973 -4.451 7.309 1.00 11.01 C ATOM 0 H MET A 167 18.107 0.510 7.828 1.00 13.33 H new ATOM 0 HA MET A 167 16.085 -1.423 8.088 1.00 11.22 H new ATOM 0 HB2 MET A 167 18.832 -1.239 9.359 1.00 21.12 H new ATOM 0 HB3 MET A 167 17.812 -2.664 9.385 1.00 21.12 H new ATOM 0 HG2 MET A 167 18.983 -1.295 6.932 1.00 33.43 H new ATOM 0 HG3 MET A 167 19.437 -2.860 7.578 1.00 33.43 H new ATOM 0 HE1 MET A 167 16.256 -5.063 6.762 1.00 11.01 H new ATOM 0 HE2 MET A 167 17.875 -5.032 7.501 1.00 11.01 H new ATOM 0 HE3 MET A 167 16.534 -4.139 8.257 1.00 11.01 H new ATOM 2721 N GLU A 168 16.594 0.408 10.787 1.00 54.32 N ATOM 2722 CA GLU A 168 15.978 0.761 12.067 1.00 3.12 C ATOM 2723 C GLU A 168 14.475 1.052 11.884 1.00 32.33 C ATOM 2724 O GLU A 168 13.632 0.601 12.666 1.00 50.02 O ATOM 2725 CB GLU A 168 16.804 1.856 12.787 1.00 65.34 C ATOM 2726 CG GLU A 168 16.328 3.291 12.568 1.00 24.44 C ATOM 2727 CD GLU A 168 16.710 4.282 13.677 1.00 34.31 C ATOM 2728 OE1 GLU A 168 16.465 3.968 14.870 1.00 73.43 O ATOM 2729 OE2 GLU A 168 17.034 5.452 13.379 1.00 23.55 O ATOM 0 H GLU A 168 17.367 1.014 10.512 1.00 54.32 H new ATOM 0 HA GLU A 168 16.005 -0.087 12.752 1.00 3.12 H new ATOM 0 HB2 GLU A 168 16.795 1.648 13.857 1.00 65.34 H new ATOM 0 HB3 GLU A 168 17.840 1.781 12.456 1.00 65.34 H new ATOM 0 HG2 GLU A 168 16.736 3.652 11.624 1.00 24.44 H new ATOM 0 HG3 GLU A 168 15.243 3.285 12.465 1.00 24.44 H new ATOM 2736 N LEU A 169 14.125 1.774 10.815 1.00 11.41 N ATOM 2737 CA LEU A 169 12.745 2.131 10.502 1.00 43.40 C ATOM 2738 C LEU A 169 11.922 0.896 10.161 1.00 30.15 C ATOM 2739 O LEU A 169 10.728 0.883 10.454 1.00 71.31 O ATOM 2740 CB LEU A 169 12.664 3.214 9.401 1.00 14.43 C ATOM 2741 CG LEU A 169 12.235 2.793 7.972 1.00 73.20 C ATOM 2742 CD1 LEU A 169 10.710 2.772 7.750 1.00 52.11 C ATOM 2743 CD2 LEU A 169 12.788 3.799 6.964 1.00 42.01 C ATOM 0 H LEU A 169 14.801 2.129 10.138 1.00 11.41 H new ATOM 0 HA LEU A 169 12.307 2.572 11.397 1.00 43.40 H new ATOM 0 HB2 LEU A 169 11.969 3.981 9.742 1.00 14.43 H new ATOM 0 HB3 LEU A 169 13.645 3.684 9.327 1.00 14.43 H new ATOM 0 HG LEU A 169 12.622 1.782 7.842 1.00 73.20 H new ATOM 0 HD11 LEU A 169 10.496 2.467 6.726 1.00 52.11 H new ATOM 0 HD12 LEU A 169 10.251 2.066 8.442 1.00 52.11 H new ATOM 0 HD13 LEU A 169 10.303 3.768 7.925 1.00 52.11 H new ATOM 0 HD21 LEU A 169 12.489 3.507 5.957 1.00 42.01 H new ATOM 0 HD22 LEU A 169 12.394 4.791 7.186 1.00 42.01 H new ATOM 0 HD23 LEU A 169 13.876 3.818 7.028 1.00 42.01 H new ATOM 2755 N TYR A 170 12.519 -0.128 9.541 1.00 2.24 N ATOM 2756 CA TYR A 170 11.777 -1.335 9.221 1.00 62.54 C ATOM 2757 C TYR A 170 11.381 -1.964 10.546 1.00 12.04 C ATOM 2758 O TYR A 170 10.192 -2.132 10.819 1.00 42.32 O ATOM 2759 CB TYR A 170 12.606 -2.275 8.319 1.00 21.21 C ATOM 2760 CG TYR A 170 12.175 -3.733 8.190 1.00 14.31 C ATOM 2761 CD1 TYR A 170 10.835 -4.085 7.927 1.00 1.04 C ATOM 2762 CD2 TYR A 170 13.153 -4.747 8.242 1.00 43.30 C ATOM 2763 CE1 TYR A 170 10.486 -5.432 7.702 1.00 10.32 C ATOM 2764 CE2 TYR A 170 12.813 -6.091 8.011 1.00 23.50 C ATOM 2765 CZ TYR A 170 11.476 -6.443 7.733 1.00 13.04 C ATOM 2766 OH TYR A 170 11.128 -7.744 7.516 1.00 25.24 O ATOM 0 H TYR A 170 13.499 -0.139 9.258 1.00 2.24 H new ATOM 0 HA TYR A 170 10.880 -1.116 8.642 1.00 62.54 H new ATOM 0 HB2 TYR A 170 12.621 -1.845 7.318 1.00 21.21 H new ATOM 0 HB3 TYR A 170 13.633 -2.265 8.685 1.00 21.21 H new ATOM 0 HD1 TYR A 170 10.073 -3.320 7.898 1.00 1.04 H new ATOM 0 HD2 TYR A 170 14.178 -4.487 8.462 1.00 43.30 H new ATOM 0 HE1 TYR A 170 9.457 -5.694 7.505 1.00 10.32 H new ATOM 0 HE2 TYR A 170 13.576 -6.855 8.046 1.00 23.50 H new ATOM 0 HH TYR A 170 11.935 -8.299 7.492 1.00 25.24 H new ATOM 2776 N GLN A 171 12.377 -2.222 11.391 1.00 53.02 N ATOM 2777 CA GLN A 171 12.242 -2.896 12.668 1.00 45.31 C ATOM 2778 C GLN A 171 11.193 -2.237 13.542 1.00 1.23 C ATOM 2779 O GLN A 171 10.287 -2.921 14.024 1.00 52.30 O ATOM 2780 CB GLN A 171 13.589 -2.895 13.376 1.00 72.34 C ATOM 2781 CG GLN A 171 14.590 -3.749 12.607 1.00 50.12 C ATOM 2782 CD GLN A 171 14.465 -5.252 12.872 1.00 31.53 C ATOM 2783 OE1 GLN A 171 13.476 -5.747 13.419 1.00 51.01 O ATOM 2784 NE2 GLN A 171 15.434 -6.033 12.434 1.00 14.32 N ATOM 0 H GLN A 171 13.340 -1.953 11.190 1.00 53.02 H new ATOM 0 HA GLN A 171 11.916 -3.920 12.485 1.00 45.31 H new ATOM 0 HB2 GLN A 171 13.962 -1.874 13.462 1.00 72.34 H new ATOM 0 HB3 GLN A 171 13.475 -3.279 14.390 1.00 72.34 H new ATOM 0 HG2 GLN A 171 14.462 -3.567 11.540 1.00 50.12 H new ATOM 0 HG3 GLN A 171 15.599 -3.428 12.866 1.00 50.12 H new ATOM 0 HE21 GLN A 171 16.252 -5.626 11.982 1.00 14.32 H new ATOM 0 HE22 GLN A 171 15.365 -7.044 12.548 1.00 14.32 H new ATOM 2793 N THR A 172 11.312 -0.925 13.743 1.00 2.15 N ATOM 2794 CA THR A 172 10.396 -0.163 14.602 1.00 25.13 C ATOM 2795 C THR A 172 8.908 -0.391 14.251 1.00 30.33 C ATOM 2796 O THR A 172 8.063 -0.422 15.152 1.00 13.21 O ATOM 2797 CB THR A 172 10.853 1.291 14.778 1.00 25.54 C ATOM 2798 OG1 THR A 172 10.358 1.837 15.992 1.00 13.25 O ATOM 2799 CG2 THR A 172 10.258 2.105 13.673 1.00 13.43 C ATOM 0 H THR A 172 12.045 -0.357 13.317 1.00 2.15 H new ATOM 0 HA THR A 172 10.456 -0.570 15.611 1.00 25.13 H new ATOM 0 HB THR A 172 11.943 1.311 14.777 1.00 25.54 H new ATOM 0 HG1 THR A 172 10.664 2.764 16.083 1.00 13.25 H new ATOM 0 HG21 THR A 172 10.570 3.144 13.778 1.00 13.43 H new ATOM 0 HG22 THR A 172 10.599 1.719 12.712 1.00 13.43 H new ATOM 0 HG23 THR A 172 9.171 2.046 13.722 1.00 13.43 H new ATOM 2807 N ARG A 173 8.578 -0.618 12.972 1.00 61.44 N ATOM 2808 CA ARG A 173 7.216 -0.874 12.496 1.00 51.01 C ATOM 2809 C ARG A 173 7.095 -2.279 11.904 1.00 24.24 C ATOM 2810 O ARG A 173 6.340 -2.492 10.952 1.00 72.11 O ATOM 2811 CB ARG A 173 6.762 0.244 11.542 1.00 11.34 C ATOM 2812 CG ARG A 173 7.614 0.373 10.268 1.00 41.42 C ATOM 2813 CD ARG A 173 6.764 0.539 9.008 1.00 23.52 C ATOM 2814 NE ARG A 173 6.057 -0.697 8.630 1.00 32.33 N ATOM 2815 CZ ARG A 173 4.943 -0.762 7.892 1.00 44.31 C ATOM 2816 NH1 ARG A 173 4.315 0.337 7.492 1.00 32.32 N ATOM 2817 NH2 ARG A 173 4.452 -1.943 7.549 1.00 22.31 N ATOM 0 H ARG A 173 9.270 -0.628 12.223 1.00 61.44 H new ATOM 0 HA ARG A 173 6.528 -0.853 13.341 1.00 51.01 H new ATOM 0 HB2 ARG A 173 5.726 0.063 11.256 1.00 11.34 H new ATOM 0 HB3 ARG A 173 6.783 1.193 12.077 1.00 11.34 H new ATOM 0 HG2 ARG A 173 8.282 1.229 10.367 1.00 41.42 H new ATOM 0 HG3 ARG A 173 8.242 -0.512 10.164 1.00 41.42 H new ATOM 0 HD2 ARG A 173 6.036 1.334 9.168 1.00 23.52 H new ATOM 0 HD3 ARG A 173 7.403 0.854 8.183 1.00 23.52 H new ATOM 0 HE ARG A 173 6.450 -1.579 8.959 1.00 32.33 H new ATOM 0 HH11 ARG A 173 4.680 1.255 7.747 1.00 32.32 H new ATOM 0 HH12 ARG A 173 3.467 0.264 6.930 1.00 32.32 H new ATOM 0 HH21 ARG A 173 4.923 -2.797 7.847 1.00 22.31 H new ATOM 0 HH22 ARG A 173 3.603 -1.998 6.986 1.00 22.31 H new ATOM 2831 N LEU A 174 7.831 -3.244 12.455 1.00 14.05 N ATOM 2832 CA LEU A 174 7.830 -4.634 12.022 1.00 70.43 C ATOM 2833 C LEU A 174 7.336 -5.506 13.163 1.00 30.50 C ATOM 2834 O LEU A 174 6.256 -6.078 13.029 1.00 4.00 O ATOM 2835 CB LEU A 174 9.214 -4.994 11.444 1.00 51.15 C ATOM 2836 CG LEU A 174 9.523 -6.442 11.031 1.00 43.21 C ATOM 2837 CD1 LEU A 174 10.196 -7.236 12.154 1.00 11.04 C ATOM 2838 CD2 LEU A 174 8.308 -7.154 10.427 1.00 65.21 C ATOM 0 H LEU A 174 8.462 -3.071 13.238 1.00 14.05 H new ATOM 0 HA LEU A 174 7.134 -4.813 11.203 1.00 70.43 H new ATOM 0 HB2 LEU A 174 9.372 -4.366 10.567 1.00 51.15 H new ATOM 0 HB3 LEU A 174 9.960 -4.702 12.183 1.00 51.15 H new ATOM 0 HG LEU A 174 10.257 -6.387 10.227 1.00 43.21 H new ATOM 0 HD11 LEU A 174 10.394 -8.252 11.813 1.00 11.04 H new ATOM 0 HD12 LEU A 174 11.136 -6.755 12.427 1.00 11.04 H new ATOM 0 HD13 LEU A 174 9.538 -7.266 13.023 1.00 11.04 H new ATOM 0 HD21 LEU A 174 8.582 -8.173 10.153 1.00 65.21 H new ATOM 0 HD22 LEU A 174 7.501 -7.180 11.159 1.00 65.21 H new ATOM 0 HD23 LEU A 174 7.976 -6.617 9.539 1.00 65.21 H new ATOM 2850 N SER A 175 8.063 -5.603 14.275 1.00 4.23 N ATOM 2851 CA SER A 175 7.668 -6.516 15.342 1.00 24.22 C ATOM 2852 C SER A 175 6.393 -6.045 16.058 1.00 23.32 C ATOM 2853 O SER A 175 5.596 -6.867 16.499 1.00 10.02 O ATOM 2854 CB SER A 175 8.811 -6.683 16.345 1.00 34.22 C ATOM 2855 OG SER A 175 10.029 -7.093 15.737 1.00 24.14 O ATOM 0 H SER A 175 8.913 -5.070 14.458 1.00 4.23 H new ATOM 0 HA SER A 175 7.448 -7.481 14.885 1.00 24.22 H new ATOM 0 HB2 SER A 175 8.971 -5.739 16.865 1.00 34.22 H new ATOM 0 HB3 SER A 175 8.522 -7.417 17.098 1.00 34.22 H new ATOM 0 HG SER A 175 10.723 -7.182 16.423 1.00 24.14 H new ATOM 2861 N LYS A 176 6.153 -4.733 16.140 1.00 33.13 N ATOM 2862 CA LYS A 176 5.092 -4.074 16.904 1.00 50.21 C ATOM 2863 C LYS A 176 3.791 -4.020 16.094 1.00 22.20 C ATOM 2864 O LYS A 176 3.060 -3.025 16.137 1.00 4.32 O ATOM 2865 CB LYS A 176 5.636 -2.690 17.309 1.00 51.33 C ATOM 2866 CG LYS A 176 4.807 -1.918 18.346 1.00 14.34 C ATOM 2867 CD LYS A 176 4.335 -0.559 17.825 1.00 13.22 C ATOM 2868 CE LYS A 176 5.499 0.402 17.546 1.00 41.03 C ATOM 2869 NZ LYS A 176 6.207 0.836 18.768 1.00 43.02 N ATOM 0 H LYS A 176 6.734 -4.059 15.641 1.00 33.13 H new ATOM 0 HA LYS A 176 4.829 -4.627 17.806 1.00 50.21 H new ATOM 0 HB2 LYS A 176 6.644 -2.819 17.702 1.00 51.33 H new ATOM 0 HB3 LYS A 176 5.720 -2.078 16.411 1.00 51.33 H new ATOM 0 HG2 LYS A 176 3.941 -2.515 18.631 1.00 14.34 H new ATOM 0 HG3 LYS A 176 5.403 -1.771 19.247 1.00 14.34 H new ATOM 0 HD2 LYS A 176 3.761 -0.704 16.910 1.00 13.22 H new ATOM 0 HD3 LYS A 176 3.663 -0.108 18.555 1.00 13.22 H new ATOM 0 HE2 LYS A 176 6.209 -0.084 16.877 1.00 41.03 H new ATOM 0 HE3 LYS A 176 5.118 1.280 17.024 1.00 41.03 H new ATOM 0 HZ1 LYS A 176 6.947 1.521 18.515 1.00 43.02 H new ATOM 0 HZ2 LYS A 176 5.531 1.281 19.421 1.00 43.02 H new ATOM 0 HZ3 LYS A 176 6.642 0.011 19.229 1.00 43.02 H new ATOM 2883 N LYS A 177 3.529 -5.031 15.267 1.00 64.43 N ATOM 2884 CA LYS A 177 2.405 -5.046 14.334 1.00 63.35 C ATOM 2885 C LYS A 177 1.567 -6.331 14.442 1.00 2.21 C ATOM 2886 O LYS A 177 0.646 -6.526 13.643 1.00 3.02 O ATOM 2887 CB LYS A 177 2.955 -4.907 12.915 1.00 14.13 C ATOM 2888 CG LYS A 177 3.659 -3.595 12.524 1.00 34.20 C ATOM 2889 CD LYS A 177 2.695 -2.454 12.167 1.00 4.33 C ATOM 2890 CE LYS A 177 3.221 -1.612 10.993 1.00 30.55 C ATOM 2891 NZ LYS A 177 2.663 -0.243 11.008 1.00 21.14 N ATOM 0 H LYS A 177 4.101 -5.875 15.226 1.00 64.43 H new ATOM 0 HA LYS A 177 1.744 -4.216 14.582 1.00 63.35 H new ATOM 0 HB2 LYS A 177 3.660 -5.722 12.752 1.00 14.13 H new ATOM 0 HB3 LYS A 177 2.127 -5.058 12.223 1.00 14.13 H new ATOM 0 HG2 LYS A 177 4.295 -3.275 13.350 1.00 34.20 H new ATOM 0 HG3 LYS A 177 4.313 -3.785 11.673 1.00 34.20 H new ATOM 0 HD2 LYS A 177 1.720 -2.868 11.910 1.00 4.33 H new ATOM 0 HD3 LYS A 177 2.550 -1.814 13.038 1.00 4.33 H new ATOM 0 HE2 LYS A 177 4.309 -1.562 11.040 1.00 30.55 H new ATOM 0 HE3 LYS A 177 2.965 -2.099 10.052 1.00 30.55 H new ATOM 0 HZ1 LYS A 177 3.040 0.295 10.202 1.00 21.14 H new ATOM 0 HZ2 LYS A 177 1.626 -0.290 10.938 1.00 21.14 H new ATOM 0 HZ3 LYS A 177 2.929 0.231 11.895 1.00 21.14 H new ATOM 2905 N ASN A 178 1.894 -7.234 15.375 1.00 3.00 N ATOM 2906 CA ASN A 178 1.312 -8.568 15.572 1.00 22.43 C ATOM 2907 C ASN A 178 1.161 -9.398 14.286 1.00 52.12 C ATOM 2908 O ASN A 178 0.300 -10.267 14.204 1.00 63.45 O ATOM 2909 CB ASN A 178 0.039 -8.493 16.438 1.00 50.31 C ATOM 2910 CG ASN A 178 -1.211 -7.985 15.729 1.00 61.45 C ATOM 2911 OD1 ASN A 178 -1.461 -6.782 15.701 1.00 2.40 O ATOM 2912 ND2 ASN A 178 -2.022 -8.865 15.173 1.00 72.33 N ATOM 0 H ASN A 178 2.624 -7.038 16.060 1.00 3.00 H new ATOM 0 HA ASN A 178 2.043 -9.146 16.138 1.00 22.43 H new ATOM 0 HB2 ASN A 178 -0.168 -9.487 16.834 1.00 50.31 H new ATOM 0 HB3 ASN A 178 0.239 -7.845 17.291 1.00 50.31 H new ATOM 0 HD21 ASN A 178 -2.874 -8.551 14.709 1.00 72.33 H new ATOM 0 HD22 ASN A 178 -1.796 -9.859 15.207 1.00 72.33 H new ATOM 2919 N TRP A 179 2.010 -9.167 13.281 1.00 50.12 N ATOM 2920 CA TRP A 179 1.925 -9.740 11.939 1.00 30.11 C ATOM 2921 C TRP A 179 1.849 -11.258 11.917 1.00 1.33 C ATOM 2922 O TRP A 179 1.000 -11.843 11.247 1.00 51.22 O ATOM 2923 CB TRP A 179 3.147 -9.285 11.146 1.00 4.10 C ATOM 2924 CG TRP A 179 3.176 -7.866 10.681 1.00 32.32 C ATOM 2925 CD1 TRP A 179 4.244 -7.042 10.746 1.00 32.40 C ATOM 2926 CD2 TRP A 179 2.108 -7.079 10.078 1.00 45.45 C ATOM 2927 NE1 TRP A 179 3.962 -5.865 10.091 1.00 64.42 N ATOM 2928 CE2 TRP A 179 2.636 -5.798 9.731 1.00 51.21 C ATOM 2929 CE3 TRP A 179 0.744 -7.302 9.809 1.00 45.44 C ATOM 2930 CZ2 TRP A 179 1.846 -4.772 9.190 1.00 34.42 C ATOM 2931 CZ3 TRP A 179 -0.058 -6.277 9.272 1.00 12.33 C ATOM 2932 CH2 TRP A 179 0.482 -5.017 8.970 1.00 5.13 C ATOM 0 H TRP A 179 2.812 -8.546 13.388 1.00 50.12 H new ATOM 0 HA TRP A 179 0.994 -9.385 11.497 1.00 30.11 H new ATOM 0 HB2 TRP A 179 4.030 -9.456 11.761 1.00 4.10 H new ATOM 0 HB3 TRP A 179 3.239 -9.928 10.271 1.00 4.10 H new ATOM 0 HD1 TRP A 179 5.178 -7.272 11.237 1.00 32.40 H new ATOM 0 HE1 TRP A 179 4.648 -5.136 9.897 1.00 64.42 H new ATOM 0 HE3 TRP A 179 0.309 -8.268 10.017 1.00 45.44 H new ATOM 0 HZ2 TRP A 179 2.279 -3.813 8.948 1.00 34.42 H new ATOM 0 HZ3 TRP A 179 -1.106 -6.463 9.089 1.00 12.33 H new ATOM 0 HH2 TRP A 179 -0.150 -4.239 8.570 1.00 5.13 H new ATOM 2943 N GLN A 180 2.783 -11.891 12.610 1.00 12.32 N ATOM 2944 CA GLN A 180 2.857 -13.337 12.721 1.00 21.41 C ATOM 2945 C GLN A 180 1.640 -13.908 13.455 1.00 62.13 C ATOM 2946 O GLN A 180 1.153 -14.970 13.081 1.00 50.42 O ATOM 2947 CB GLN A 180 4.225 -13.751 13.295 1.00 1.22 C ATOM 2948 CG GLN A 180 4.860 -12.827 14.365 1.00 33.22 C ATOM 2949 CD GLN A 180 5.112 -13.479 15.726 1.00 13.03 C ATOM 2950 OE1 GLN A 180 5.798 -14.490 15.836 1.00 42.25 O ATOM 2951 NE2 GLN A 180 4.640 -12.867 16.801 1.00 51.12 N ATOM 0 H GLN A 180 3.522 -11.405 13.119 1.00 12.32 H new ATOM 0 HA GLN A 180 2.803 -13.789 11.731 1.00 21.41 H new ATOM 0 HB2 GLN A 180 4.121 -14.746 13.728 1.00 1.22 H new ATOM 0 HB3 GLN A 180 4.926 -13.836 12.465 1.00 1.22 H new ATOM 0 HG2 GLN A 180 5.808 -12.451 13.980 1.00 33.22 H new ATOM 0 HG3 GLN A 180 4.209 -11.964 14.509 1.00 33.22 H new ATOM 0 HE21 GLN A 180 4.070 -12.027 16.701 1.00 51.12 H new ATOM 0 HE22 GLN A 180 4.846 -13.236 17.729 1.00 51.12 H new ATOM 2960 N GLU A 181 1.076 -13.146 14.392 1.00 10.22 N ATOM 2961 CA GLU A 181 -0.084 -13.498 15.210 1.00 24.32 C ATOM 2962 C GLU A 181 -1.402 -13.268 14.456 1.00 34.32 C ATOM 2963 O GLU A 181 -2.490 -13.371 15.042 1.00 70.23 O ATOM 2964 CB GLU A 181 -0.082 -12.624 16.477 1.00 45.35 C ATOM 2965 CG GLU A 181 1.259 -12.582 17.230 1.00 65.34 C ATOM 2966 CD GLU A 181 1.291 -11.497 18.304 1.00 11.13 C ATOM 2967 OE1 GLU A 181 0.257 -11.205 18.939 1.00 24.30 O ATOM 2968 OE2 GLU A 181 2.359 -10.874 18.511 1.00 13.41 O ATOM 0 H GLU A 181 1.435 -12.217 14.612 1.00 10.22 H new ATOM 0 HA GLU A 181 -0.014 -14.556 15.461 1.00 24.32 H new ATOM 0 HB2 GLU A 181 -0.359 -11.607 16.200 1.00 45.35 H new ATOM 0 HB3 GLU A 181 -0.852 -12.991 17.155 1.00 45.35 H new ATOM 0 HG2 GLU A 181 1.443 -13.552 17.692 1.00 65.34 H new ATOM 0 HG3 GLU A 181 2.067 -12.409 16.519 1.00 65.34 H new ATOM 2975 N LYS A 182 -1.320 -12.831 13.194 1.00 5.04 N ATOM 2976 CA LYS A 182 -2.415 -12.359 12.372 1.00 52.12 C ATOM 2977 C LYS A 182 -2.779 -13.308 11.241 1.00 12.30 C ATOM 2978 O LYS A 182 -3.936 -13.376 10.830 1.00 14.01 O ATOM 2979 CB LYS A 182 -1.938 -11.052 11.749 1.00 51.41 C ATOM 2980 CG LYS A 182 -2.830 -9.940 12.118 1.00 71.31 C ATOM 2981 CD LYS A 182 -3.971 -10.072 11.191 1.00 54.43 C ATOM 2982 CE LYS A 182 -4.098 -8.907 10.279 1.00 61.55 C ATOM 2983 NZ LYS A 182 -4.216 -7.579 10.934 1.00 22.14 N ATOM 0 H LYS A 182 -0.429 -12.800 12.699 1.00 5.04 H new ATOM 0 HA LYS A 182 -3.302 -12.260 12.997 1.00 52.12 H new ATOM 0 HB2 LYS A 182 -0.923 -10.835 12.081 1.00 51.41 H new ATOM 0 HB3 LYS A 182 -1.904 -11.152 10.664 1.00 51.41 H new ATOM 0 HG2 LYS A 182 -3.150 -10.014 13.157 1.00 71.31 H new ATOM 0 HG3 LYS A 182 -2.334 -8.976 12.005 1.00 71.31 H new ATOM 0 HD2 LYS A 182 -3.853 -10.981 10.601 1.00 54.43 H new ATOM 0 HD3 LYS A 182 -4.891 -10.182 11.765 1.00 54.43 H new ATOM 0 HE2 LYS A 182 -3.230 -8.890 9.620 1.00 61.55 H new ATOM 0 HE3 LYS A 182 -4.974 -9.058 9.648 1.00 61.55 H new ATOM 0 HZ1 LYS A 182 -4.676 -6.911 10.283 1.00 22.14 H new ATOM 0 HZ2 LYS A 182 -4.786 -7.668 11.799 1.00 22.14 H new ATOM 0 HZ3 LYS A 182 -3.268 -7.227 11.179 1.00 22.14 H new ATOM 2997 N TRP A 183 -1.770 -13.940 10.667 1.00 41.34 N ATOM 2998 CA TRP A 183 -1.818 -14.739 9.468 1.00 52.35 C ATOM 2999 C TRP A 183 -0.889 -15.896 9.802 1.00 5.13 C ATOM 3000 O TRP A 183 0.321 -15.698 9.928 1.00 32.42 O ATOM 3001 CB TRP A 183 -1.367 -13.895 8.257 1.00 21.44 C ATOM 3002 CG TRP A 183 -2.285 -12.786 7.809 1.00 51.05 C ATOM 3003 CD1 TRP A 183 -3.478 -12.966 7.207 1.00 72.43 C ATOM 3004 CD2 TRP A 183 -2.081 -11.336 7.778 1.00 64.32 C ATOM 3005 NE1 TRP A 183 -4.044 -11.755 6.898 1.00 61.52 N ATOM 3006 CE2 TRP A 183 -3.217 -10.717 7.189 1.00 73.54 C ATOM 3007 CE3 TRP A 183 -1.039 -10.465 8.142 1.00 50.35 C ATOM 3008 CZ2 TRP A 183 -3.347 -9.339 7.002 1.00 22.32 C ATOM 3009 CZ3 TRP A 183 -1.103 -9.095 7.838 1.00 14.22 C ATOM 3010 CH2 TRP A 183 -2.267 -8.516 7.321 1.00 50.42 C ATOM 0 H TRP A 183 -0.830 -13.901 11.060 1.00 41.34 H new ATOM 0 HA TRP A 183 -2.808 -15.099 9.186 1.00 52.35 H new ATOM 0 HB2 TRP A 183 -0.398 -13.456 8.493 1.00 21.44 H new ATOM 0 HB3 TRP A 183 -1.215 -14.569 7.414 1.00 21.44 H new ATOM 0 HD1 TRP A 183 -3.925 -13.927 6.998 1.00 72.43 H new ATOM 0 HE1 TRP A 183 -4.976 -11.647 6.497 1.00 61.52 H new ATOM 0 HE3 TRP A 183 -0.177 -10.855 8.663 1.00 50.35 H new ATOM 0 HZ2 TRP A 183 -4.265 -8.919 6.618 1.00 22.32 H new ATOM 0 HZ3 TRP A 183 -0.235 -8.475 8.007 1.00 14.22 H new ATOM 0 HH2 TRP A 183 -2.328 -7.448 7.171 1.00 50.42 H new ATOM 3021 N LYS A 184 -1.449 -17.085 10.026 1.00 14.00 N ATOM 3022 CA LYS A 184 -0.728 -18.290 10.446 1.00 1.31 C ATOM 3023 C LYS A 184 0.365 -18.731 9.472 1.00 33.24 C ATOM 3024 O LYS A 184 1.143 -19.627 9.810 1.00 51.21 O ATOM 3025 CB LYS A 184 -1.743 -19.429 10.674 1.00 44.44 C ATOM 3026 CG LYS A 184 -2.295 -19.393 12.105 1.00 24.32 C ATOM 3027 CD LYS A 184 -1.319 -20.039 13.110 1.00 22.33 C ATOM 3028 CE LYS A 184 -1.355 -21.572 13.062 1.00 22.23 C ATOM 3029 NZ LYS A 184 -2.668 -22.118 13.466 1.00 62.11 N ATOM 0 H LYS A 184 -2.451 -17.243 9.917 1.00 14.00 H new ATOM 0 HA LYS A 184 -0.208 -18.046 11.372 1.00 1.31 H new ATOM 0 HB2 LYS A 184 -2.563 -19.339 9.961 1.00 44.44 H new ATOM 0 HB3 LYS A 184 -1.264 -20.391 10.489 1.00 44.44 H new ATOM 0 HG2 LYS A 184 -2.485 -18.360 12.396 1.00 24.32 H new ATOM 0 HG3 LYS A 184 -3.251 -19.915 12.139 1.00 24.32 H new ATOM 0 HD2 LYS A 184 -0.306 -19.696 12.899 1.00 22.33 H new ATOM 0 HD3 LYS A 184 -1.566 -19.704 14.118 1.00 22.33 H new ATOM 0 HE2 LYS A 184 -1.121 -21.907 12.051 1.00 22.23 H new ATOM 0 HE3 LYS A 184 -0.581 -21.972 13.717 1.00 22.23 H new ATOM 0 HZ1 LYS A 184 -2.565 -23.123 13.712 1.00 62.11 H new ATOM 0 HZ2 LYS A 184 -3.023 -21.594 14.291 1.00 62.11 H new ATOM 0 HZ3 LYS A 184 -3.341 -22.022 12.679 1.00 62.11 H new ATOM 3043 N ASN A 185 0.425 -18.146 8.277 1.00 34.51 N ATOM 3044 CA ASN A 185 1.449 -18.471 7.287 1.00 71.14 C ATOM 3045 C ASN A 185 2.606 -17.455 7.289 1.00 65.14 C ATOM 3046 O ASN A 185 3.597 -17.681 6.597 1.00 50.03 O ATOM 3047 CB ASN A 185 0.797 -18.622 5.902 1.00 73.42 C ATOM 3048 CG ASN A 185 0.013 -19.932 5.774 1.00 30.44 C ATOM 3049 OD1 ASN A 185 -0.904 -20.220 6.538 1.00 1.34 O ATOM 3050 ND2 ASN A 185 0.311 -20.753 4.780 1.00 10.21 N ATOM 0 H ASN A 185 -0.236 -17.433 7.968 1.00 34.51 H new ATOM 0 HA ASN A 185 1.903 -19.425 7.556 1.00 71.14 H new ATOM 0 HB2 ASN A 185 0.128 -17.780 5.723 1.00 73.42 H new ATOM 0 HB3 ASN A 185 1.568 -18.585 5.133 1.00 73.42 H new ATOM 0 HD21 ASN A 185 -0.219 -21.615 4.654 1.00 10.21 H new ATOM 0 HD22 ASN A 185 1.071 -20.524 4.139 1.00 10.21 H new ATOM 3057 N LEU A 186 2.508 -16.342 8.033 1.00 1.13 N ATOM 3058 CA LEU A 186 3.332 -15.146 7.836 1.00 41.05 C ATOM 3059 C LEU A 186 4.812 -15.388 8.152 1.00 73.53 C ATOM 3060 O LEU A 186 5.170 -15.637 9.305 1.00 13.42 O ATOM 3061 CB LEU A 186 2.723 -13.944 8.604 1.00 24.30 C ATOM 3062 CG LEU A 186 3.097 -12.531 8.102 1.00 30.51 C ATOM 3063 CD1 LEU A 186 4.563 -12.242 8.384 1.00 32.33 C ATOM 3064 CD2 LEU A 186 2.824 -12.305 6.618 1.00 14.13 C ATOM 0 H LEU A 186 1.842 -16.250 8.800 1.00 1.13 H new ATOM 0 HA LEU A 186 3.318 -14.894 6.776 1.00 41.05 H new ATOM 0 HB2 LEU A 186 1.637 -14.038 8.575 1.00 24.30 H new ATOM 0 HB3 LEU A 186 3.022 -14.023 9.649 1.00 24.30 H new ATOM 0 HG LEU A 186 2.451 -11.846 8.652 1.00 30.51 H new ATOM 0 HD11 LEU A 186 4.813 -11.243 8.025 1.00 32.33 H new ATOM 0 HD12 LEU A 186 4.745 -12.298 9.457 1.00 32.33 H new ATOM 0 HD13 LEU A 186 5.184 -12.977 7.872 1.00 32.33 H new ATOM 0 HD21 LEU A 186 3.113 -11.290 6.345 1.00 14.13 H new ATOM 0 HD22 LEU A 186 3.401 -13.018 6.029 1.00 14.13 H new ATOM 0 HD23 LEU A 186 1.762 -12.446 6.418 1.00 14.13 H new ATOM 3076 N ILE A 187 5.671 -15.282 7.134 1.00 11.30 N ATOM 3077 CA ILE A 187 7.116 -15.480 7.205 1.00 1.01 C ATOM 3078 C ILE A 187 7.827 -14.143 7.351 1.00 1.20 C ATOM 3079 O ILE A 187 7.571 -13.199 6.606 1.00 53.23 O ATOM 3080 CB ILE A 187 7.666 -16.233 5.951 1.00 54.31 C ATOM 3081 CG1 ILE A 187 6.701 -17.304 5.403 1.00 70.51 C ATOM 3082 CG2 ILE A 187 9.032 -16.846 6.285 1.00 63.25 C ATOM 3083 CD1 ILE A 187 7.228 -18.175 4.254 1.00 42.03 C ATOM 0 H ILE A 187 5.359 -15.044 6.193 1.00 11.30 H new ATOM 0 HA ILE A 187 7.314 -16.098 8.081 1.00 1.01 H new ATOM 0 HB ILE A 187 7.771 -15.498 5.153 1.00 54.31 H new ATOM 0 HG12 ILE A 187 6.416 -17.960 6.226 1.00 70.51 H new ATOM 0 HG13 ILE A 187 5.793 -16.805 5.064 1.00 70.51 H new ATOM 0 HG21 ILE A 187 9.418 -17.372 5.412 1.00 63.25 H new ATOM 0 HG22 ILE A 187 9.726 -16.055 6.568 1.00 63.25 H new ATOM 0 HG23 ILE A 187 8.924 -17.547 7.112 1.00 63.25 H new ATOM 0 HD11 ILE A 187 6.460 -18.888 3.956 1.00 42.03 H new ATOM 0 HD12 ILE A 187 7.483 -17.541 3.405 1.00 42.03 H new ATOM 0 HD13 ILE A 187 8.116 -18.715 4.584 1.00 42.03 H new ATOM 3095 N PHE A 188 8.784 -14.115 8.274 1.00 14.21 N ATOM 3096 CA PHE A 188 9.668 -12.996 8.563 1.00 21.40 C ATOM 3097 C PHE A 188 11.054 -13.318 8.027 1.00 3.40 C ATOM 3098 O PHE A 188 11.526 -14.453 8.165 1.00 64.23 O ATOM 3099 CB PHE A 188 9.761 -12.792 10.081 1.00 31.33 C ATOM 3100 CG PHE A 188 8.737 -11.865 10.699 1.00 10.21 C ATOM 3101 CD1 PHE A 188 7.412 -11.822 10.226 1.00 2.44 C ATOM 3102 CD2 PHE A 188 9.130 -11.035 11.766 1.00 65.44 C ATOM 3103 CE1 PHE A 188 6.503 -10.910 10.802 1.00 53.04 C ATOM 3104 CE2 PHE A 188 8.210 -10.160 12.361 1.00 11.30 C ATOM 3105 CZ PHE A 188 6.898 -10.088 11.872 1.00 62.21 C ATOM 0 H PHE A 188 8.972 -14.919 8.873 1.00 14.21 H new ATOM 0 HA PHE A 188 9.279 -12.091 8.096 1.00 21.40 H new ATOM 0 HB2 PHE A 188 9.675 -13.766 10.563 1.00 31.33 H new ATOM 0 HB3 PHE A 188 10.754 -12.408 10.314 1.00 31.33 H new ATOM 0 HD1 PHE A 188 7.095 -12.480 9.431 1.00 2.44 H new ATOM 0 HD2 PHE A 188 10.147 -11.072 12.129 1.00 65.44 H new ATOM 0 HE1 PHE A 188 5.496 -10.843 10.418 1.00 53.04 H new ATOM 0 HE2 PHE A 188 8.511 -9.543 13.194 1.00 11.30 H new ATOM 0 HZ PHE A 188 6.192 -9.402 12.317 1.00 62.21 H new ATOM 3115 N LYS A 189 11.704 -12.302 7.460 1.00 34.54 N ATOM 3116 CA LYS A 189 13.064 -12.328 6.954 1.00 53.35 C ATOM 3117 C LYS A 189 13.693 -10.958 7.179 1.00 23.41 C ATOM 3118 O LYS A 189 13.004 -9.952 7.365 1.00 73.21 O ATOM 3119 CB LYS A 189 13.053 -12.640 5.446 1.00 43.22 C ATOM 3120 CG LYS A 189 12.513 -14.014 5.040 1.00 4.20 C ATOM 3121 CD LYS A 189 13.389 -15.170 5.533 1.00 10.14 C ATOM 3122 CE LYS A 189 12.595 -16.470 5.639 1.00 30.40 C ATOM 3123 NZ LYS A 189 13.470 -17.642 5.833 1.00 25.10 N ATOM 0 H LYS A 189 11.265 -11.390 7.338 1.00 34.54 H new ATOM 0 HA LYS A 189 13.636 -13.097 7.474 1.00 53.35 H new ATOM 0 HB2 LYS A 189 12.459 -11.877 4.943 1.00 43.22 H new ATOM 0 HB3 LYS A 189 14.072 -12.549 5.071 1.00 43.22 H new ATOM 0 HG2 LYS A 189 11.505 -14.134 5.437 1.00 4.20 H new ATOM 0 HG3 LYS A 189 12.435 -14.062 3.954 1.00 4.20 H new ATOM 0 HD2 LYS A 189 14.227 -15.309 4.850 1.00 10.14 H new ATOM 0 HD3 LYS A 189 13.810 -14.919 6.507 1.00 10.14 H new ATOM 0 HE2 LYS A 189 11.895 -16.399 6.471 1.00 30.40 H new ATOM 0 HE3 LYS A 189 12.002 -16.607 4.735 1.00 30.40 H new ATOM 0 HZ1 LYS A 189 12.889 -18.502 5.900 1.00 25.10 H new ATOM 0 HZ2 LYS A 189 14.122 -17.726 5.027 1.00 25.10 H new ATOM 0 HZ3 LYS A 189 14.017 -17.525 6.710 1.00 25.10 H new ATOM 3137 N ASN A 190 15.017 -10.918 7.084 1.00 44.33 N ATOM 3138 CA ASN A 190 15.844 -9.736 7.245 1.00 63.24 C ATOM 3139 C ASN A 190 16.687 -9.434 6.004 1.00 62.31 C ATOM 3140 O ASN A 190 17.514 -8.524 6.039 1.00 43.44 O ATOM 3141 CB ASN A 190 16.755 -9.919 8.460 1.00 51.31 C ATOM 3142 CG ASN A 190 17.661 -11.137 8.428 1.00 25.13 C ATOM 3143 OD1 ASN A 190 17.354 -12.190 8.994 1.00 41.14 O ATOM 3144 ND2 ASN A 190 18.808 -11.025 7.786 1.00 4.41 N ATOM 0 H ASN A 190 15.567 -11.753 6.882 1.00 44.33 H new ATOM 0 HA ASN A 190 15.178 -8.886 7.392 1.00 63.24 H new ATOM 0 HB2 ASN A 190 17.377 -9.030 8.562 1.00 51.31 H new ATOM 0 HB3 ASN A 190 16.132 -9.976 9.353 1.00 51.31 H new ATOM 0 HD21 ASN A 190 19.453 -11.814 7.753 1.00 4.41 H new ATOM 0 HD22 ASN A 190 19.050 -10.149 7.322 1.00 4.41 H new ATOM 3151 N THR A 191 16.539 -10.201 4.923 1.00 45.51 N ATOM 3152 CA THR A 191 17.336 -10.056 3.700 1.00 34.30 C ATOM 3153 C THR A 191 16.723 -10.918 2.594 1.00 54.53 C ATOM 3154 O THR A 191 15.780 -11.697 2.875 1.00 22.13 O ATOM 3155 CB THR A 191 18.812 -10.393 4.027 1.00 2.11 C ATOM 3156 OG1 THR A 191 19.715 -10.139 2.975 1.00 74.21 O ATOM 3157 CG2 THR A 191 18.967 -11.836 4.491 1.00 23.21 C ATOM 0 H THR A 191 15.852 -10.953 4.870 1.00 45.51 H new ATOM 0 HA THR A 191 17.325 -9.033 3.325 1.00 34.30 H new ATOM 0 HB THR A 191 19.073 -9.712 4.837 1.00 2.11 H new ATOM 0 HG1 THR A 191 20.623 -10.375 3.259 1.00 74.21 H new ATOM 0 HG21 THR A 191 20.015 -12.037 4.711 1.00 23.21 H new ATOM 0 HG22 THR A 191 18.370 -11.995 5.389 1.00 23.21 H new ATOM 0 HG23 THR A 191 18.626 -12.510 3.705 1.00 23.21 H new TER 3165 THR A 191