USER MOD reduce.3.24.130724 H: found=0, std=0, add=1150, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1152 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 LYS NZ :NH3+ -119:sc= -1.04 (180deg=-4.29!) USER MOD Set 1.2: A 148 SER OG : rot 180:sc= -0.426 USER MOD Set 2.1: A 115 THR OG1 : rot -148:sc= -0.054 USER MOD Set 2.2: A 120 ASN : amide:sc= -0.335 K(o=-0.39,f=-5.9!) USER MOD Set 3.1: A 80 TYR OH : rot 13:sc= 1.13 USER MOD Set 3.2: A 82 THR OG1 : rot 180:sc= -3.36! USER MOD Set 3.3: A 108 ASN : amide:sc= 0.126 K(o=-2.1,f=-5.3) USER MOD Set 4.1: A 30 GLN : amide:sc= -3.04! C(o=-2.9!,f=-3!) USER MOD Set 4.2: A 136 GLN : amide:sc= 0.149 K(o=-2.9,f=-3.7) USER MOD Set 5.1: A 25 ASN : amide:sc= -5.03! C(o=-5.8!,f=-12!) USER MOD Set 5.2: A 153 GLN : amide:sc= -0.798 K(o=-5.8,f=-8.2!) USER MOD Single : A 13 ASN : amide:sc= -8.87! C(o=-8.9!,f=-9.5!) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -161:sc= -0.0841 (180deg=-0.439) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0.933 K(o=0.93,f=-0.05) USER MOD Single : A 31 SER OG : rot 12:sc= 0.593 USER MOD Single : A 36 ASN : amide:sc= 0.401 K(o=0.4,f=-4.7!) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.0055) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 53 LYS NZ :NH3+ 149:sc= 1.29 (180deg=1.12) USER MOD Single : A 56 MET CE :methyl 171:sc= -1.22 (180deg=-1.25) USER MOD Single : A 59 TYR OH : rot 156:sc= -0.824 USER MOD Single : A 60 LYS NZ :NH3+ -174:sc= 0.372 (180deg=0.338) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -161:sc= -0.0434 (180deg=-0.355) USER MOD Single : A 67 LYS NZ :NH3+ -131:sc= 1.26 (180deg=-0.534) USER MOD Single : A 69 THR OG1 : rot -110:sc= -2.31! USER MOD Single : A 75 SER OG : rot -82:sc= 0.797 USER MOD Single : A 76 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0768) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.784 K(o=-0.78,f=-9.5!) USER MOD Single : A 84 GLN : amide:sc= -2.07! K(o=-2.1!,f=-0.24) USER MOD Single : A 88 GLN : amide:sc= -1.71! C(o=-1.7!,f=-7.5!) USER MOD Single : A 93 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0172) USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot 180:sc= -0.609 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 36:sc= 1.33 USER MOD Single : A 107 THR OG1 : rot -37:sc= 0.169 USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot 180:sc=-0.00385 USER MOD Single : A 119 LYS NZ :NH3+ -161:sc= 1.18 (180deg=0.748) USER MOD Single : A 121 TYR OH : rot 180:sc= -0.18 USER MOD Single : A 123 THR OG1 : rot -55:sc= 0.914 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.0756 X(o=-0.076,f=-0.01) USER MOD Single : A 129 ASN : amide:sc= 0.595 K(o=0.6,f=-0.32) USER MOD Single : A 134 THR OG1 : rot 19:sc= -3.14! USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 CYS SG : rot 180:sc= 0.196! USER MOD Single : A 150 THR OG1 : rot 158:sc= 0.0584 USER MOD Single : A 157 ASN : amide:sc= -0.649 K(o=-0.65,f=-3.7!) USER MOD Single : A 158 GLN : amide:sc= -1.24 K(o=-1.2,f=-0.025) USER MOD ----------------------------------------------------------------- ATOM 76 N ASN A 13 16.439 -5.324 0.033 1.00 1.23 N ATOM 77 CA ASN A 13 15.592 -5.492 1.196 1.00 1.00 C ATOM 78 C ASN A 13 14.996 -6.900 1.324 1.00 0.86 C ATOM 79 O ASN A 13 13.993 -7.219 0.727 1.00 1.29 O ATOM 80 CB ASN A 13 14.471 -4.427 1.211 1.00 1.76 C ATOM 81 CG ASN A 13 13.611 -4.311 -0.059 1.00 2.67 C ATOM 82 OD1 ASN A 13 12.982 -3.281 -0.278 1.00 3.27 O ATOM 83 ND2 ASN A 13 13.558 -5.335 -0.892 1.00 3.42 N ATOM 0 HA ASN A 13 16.238 -5.354 2.063 1.00 1.00 H new ATOM 0 HB2 ASN A 13 13.810 -4.641 2.051 1.00 1.76 H new ATOM 0 HB3 ASN A 13 14.927 -3.456 1.403 1.00 1.76 H new ATOM 0 HD21 ASN A 13 12.987 -5.278 -1.735 1.00 3.42 H new ATOM 0 HD22 ASN A 13 14.088 -6.183 -0.692 1.00 3.42 H new ATOM 90 N PHE A 14 15.599 -7.731 2.154 1.00 0.97 N ATOM 91 CA PHE A 14 14.923 -8.878 2.771 1.00 1.06 C ATOM 92 C PHE A 14 14.353 -8.522 4.147 1.00 0.93 C ATOM 93 O PHE A 14 15.118 -8.078 5.003 1.00 1.27 O ATOM 94 CB PHE A 14 15.892 -10.058 2.887 1.00 1.64 C ATOM 95 CG PHE A 14 15.252 -11.312 3.411 1.00 2.26 C ATOM 96 CD1 PHE A 14 14.383 -12.045 2.621 1.00 3.13 C ATOM 97 CD2 PHE A 14 15.521 -11.757 4.696 1.00 2.47 C ATOM 98 CE1 PHE A 14 13.794 -13.199 3.099 1.00 4.16 C ATOM 99 CE2 PHE A 14 14.934 -12.911 5.181 1.00 3.36 C ATOM 100 CZ PHE A 14 14.068 -13.631 4.379 1.00 4.21 C ATOM 0 H PHE A 14 16.577 -7.636 2.426 1.00 0.97 H new ATOM 0 HA PHE A 14 14.088 -9.160 2.130 1.00 1.06 H new ATOM 0 HB2 PHE A 14 16.322 -10.262 1.906 1.00 1.64 H new ATOM 0 HB3 PHE A 14 16.715 -9.778 3.544 1.00 1.64 H new ATOM 0 HD1 PHE A 14 14.163 -11.710 1.618 1.00 3.13 H new ATOM 0 HD2 PHE A 14 16.196 -11.196 5.325 1.00 2.47 H new ATOM 0 HE1 PHE A 14 13.120 -13.762 2.471 1.00 4.16 H new ATOM 0 HE2 PHE A 14 15.151 -13.249 6.183 1.00 3.36 H new ATOM 0 HZ PHE A 14 13.606 -14.532 4.755 1.00 4.21 H new ATOM 110 N MET A 15 13.057 -8.669 4.407 1.00 0.73 N ATOM 111 CA MET A 15 12.634 -8.785 5.787 1.00 0.74 C ATOM 112 C MET A 15 12.018 -10.150 6.004 1.00 0.70 C ATOM 113 O MET A 15 12.614 -11.039 6.607 1.00 0.79 O ATOM 114 CB MET A 15 11.671 -7.680 6.198 1.00 0.84 C ATOM 115 CG MET A 15 11.411 -7.622 7.695 1.00 1.48 C ATOM 116 SD MET A 15 12.915 -7.346 8.652 1.00 2.32 S ATOM 117 CE MET A 15 12.255 -7.333 10.319 1.00 2.91 C ATOM 0 H MET A 15 12.314 -8.709 3.709 1.00 0.73 H new ATOM 0 HA MET A 15 13.513 -8.672 6.422 1.00 0.74 H new ATOM 0 HB2 MET A 15 12.071 -6.721 5.870 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.723 -7.824 5.679 1.00 0.84 H new ATOM 0 HG2 MET A 15 10.700 -6.823 7.905 1.00 1.48 H new ATOM 0 HG3 MET A 15 10.947 -8.555 8.016 1.00 1.48 H new ATOM 0 HE1 MET A 15 13.065 -7.172 11.030 1.00 2.91 H new ATOM 0 HE2 MET A 15 11.523 -6.531 10.414 1.00 2.91 H new ATOM 0 HE3 MET A 15 11.774 -8.289 10.527 1.00 2.91 H new ATOM 127 N ARG A 16 10.810 -10.297 5.464 1.00 0.61 N ATOM 128 CA ARG A 16 10.032 -11.511 5.594 1.00 0.61 C ATOM 129 C ARG A 16 8.766 -11.445 4.731 1.00 0.56 C ATOM 130 O ARG A 16 8.268 -10.361 4.424 1.00 0.52 O ATOM 131 CB ARG A 16 9.670 -11.730 7.060 1.00 0.63 C ATOM 132 CG ARG A 16 8.940 -10.566 7.721 1.00 0.72 C ATOM 133 CD ARG A 16 7.463 -10.546 7.375 1.00 1.06 C ATOM 134 NE ARG A 16 6.636 -10.230 8.538 1.00 1.64 N ATOM 135 CZ ARG A 16 5.516 -10.884 8.864 1.00 2.09 C ATOM 136 NH1 ARG A 16 5.088 -11.899 8.121 1.00 2.43 N ATOM 137 NH2 ARG A 16 4.836 -10.534 9.950 1.00 2.73 N ATOM 0 H ARG A 16 10.347 -9.568 4.922 1.00 0.61 H new ATOM 0 HA ARG A 16 10.630 -12.352 5.243 1.00 0.61 H new ATOM 0 HB2 ARG A 16 9.047 -12.621 7.136 1.00 0.63 H new ATOM 0 HB3 ARG A 16 10.584 -11.931 7.619 1.00 0.63 H new ATOM 0 HG2 ARG A 16 9.057 -10.633 8.803 1.00 0.72 H new ATOM 0 HG3 ARG A 16 9.398 -9.627 7.408 1.00 0.72 H new ATOM 0 HD2 ARG A 16 7.284 -9.810 6.591 1.00 1.06 H new ATOM 0 HD3 ARG A 16 7.171 -11.517 6.974 1.00 1.06 H new ATOM 0 HE ARG A 16 6.932 -9.461 9.140 1.00 1.64 H new ATOM 0 HH11 ARG A 16 5.615 -12.184 7.295 1.00 2.43 H new ATOM 0 HH12 ARG A 16 4.233 -12.393 8.376 1.00 2.43 H new ATOM 0 HH21 ARG A 16 5.168 -9.767 10.535 1.00 2.73 H new ATOM 0 HH22 ARG A 16 3.982 -11.032 10.199 1.00 2.73 H new ATOM 151 N ILE A 17 8.249 -12.601 4.352 1.00 0.62 N ATOM 152 CA ILE A 17 6.983 -12.684 3.626 1.00 0.61 C ATOM 153 C ILE A 17 5.787 -12.554 4.586 1.00 0.57 C ATOM 154 O ILE A 17 5.640 -13.335 5.527 1.00 0.64 O ATOM 155 CB ILE A 17 6.873 -13.991 2.797 1.00 0.73 C ATOM 156 CG1 ILE A 17 5.547 -14.034 2.033 1.00 1.68 C ATOM 157 CG2 ILE A 17 7.021 -15.223 3.677 1.00 1.41 C ATOM 158 CD1 ILE A 17 5.404 -12.936 1.001 1.00 2.26 C ATOM 0 H ILE A 17 8.687 -13.504 4.534 1.00 0.62 H new ATOM 0 HA ILE A 17 6.961 -11.848 2.927 1.00 0.61 H new ATOM 0 HB ILE A 17 7.692 -13.996 2.077 1.00 0.73 H new ATOM 0 HG12 ILE A 17 5.454 -15.000 1.538 1.00 1.68 H new ATOM 0 HG13 ILE A 17 4.725 -13.961 2.745 1.00 1.68 H new ATOM 0 HG21 ILE A 17 6.939 -16.120 3.064 1.00 1.41 H new ATOM 0 HG22 ILE A 17 7.995 -15.206 4.166 1.00 1.41 H new ATOM 0 HG23 ILE A 17 6.235 -15.227 4.433 1.00 1.41 H new ATOM 0 HD11 ILE A 17 4.440 -13.031 0.500 1.00 2.26 H new ATOM 0 HD12 ILE A 17 5.464 -11.965 1.492 1.00 2.26 H new ATOM 0 HD13 ILE A 17 6.205 -13.021 0.266 1.00 2.26 H new ATOM 170 N ILE A 18 4.981 -11.513 4.388 1.00 0.49 N ATOM 171 CA ILE A 18 3.805 -11.270 5.223 1.00 0.48 C ATOM 172 C ILE A 18 2.568 -11.979 4.644 1.00 0.48 C ATOM 173 O ILE A 18 2.617 -13.162 4.304 1.00 0.52 O ATOM 174 CB ILE A 18 3.509 -9.759 5.415 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.800 -8.975 5.625 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.592 -9.541 6.622 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.569 -7.496 5.844 1.00 0.94 C ATOM 0 H ILE A 18 5.122 -10.820 3.653 1.00 0.49 H new ATOM 0 HA ILE A 18 4.032 -11.684 6.205 1.00 0.48 H new ATOM 0 HB ILE A 18 3.015 -9.402 4.512 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.331 -9.385 6.484 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.446 -9.111 4.757 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.395 -8.476 6.742 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.651 -10.068 6.464 1.00 0.50 H new ATOM 0 HG23 ILE A 18 3.076 -9.924 7.521 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.527 -6.995 5.987 1.00 0.94 H new ATOM 0 HD12 ILE A 18 4.065 -7.074 4.975 1.00 0.94 H new ATOM 0 HD13 ILE A 18 3.949 -7.352 6.729 1.00 0.94 H new ATOM 189 N LYS A 19 1.470 -11.242 4.545 1.00 0.45 N ATOM 190 CA LYS A 19 0.177 -11.790 4.158 1.00 0.46 C ATOM 191 C LYS A 19 -0.149 -11.394 2.728 1.00 0.42 C ATOM 192 O LYS A 19 0.448 -10.471 2.186 1.00 0.49 O ATOM 193 CB LYS A 19 -0.916 -11.282 5.102 1.00 0.54 C ATOM 194 CG LYS A 19 -0.735 -11.728 6.541 1.00 1.13 C ATOM 195 CD LYS A 19 -1.808 -11.145 7.444 1.00 1.85 C ATOM 196 CE LYS A 19 -1.735 -11.728 8.846 1.00 2.57 C ATOM 197 NZ LYS A 19 -1.963 -13.197 8.844 1.00 2.68 N ATOM 0 H LYS A 19 1.451 -10.240 4.732 1.00 0.45 H new ATOM 0 HA LYS A 19 0.223 -12.877 4.224 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -0.935 -10.193 5.068 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -1.885 -11.629 4.742 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -0.767 -12.816 6.592 1.00 1.13 H new ATOM 0 HG3 LYS A 19 0.248 -11.421 6.897 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -1.694 -10.062 7.493 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -2.791 -11.343 7.017 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -0.758 -11.512 9.279 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -2.479 -11.245 9.480 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -2.225 -13.509 9.801 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -2.731 -13.428 8.182 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -1.093 -13.683 8.548 1.00 2.68 H new ATOM 211 N TYR A 20 -1.099 -12.087 2.124 1.00 0.37 N ATOM 212 CA TYR A 20 -1.399 -11.888 0.714 1.00 0.41 C ATOM 213 C TYR A 20 -2.874 -12.132 0.421 1.00 0.31 C ATOM 214 O TYR A 20 -3.568 -12.796 1.196 1.00 0.33 O ATOM 215 CB TYR A 20 -0.529 -12.825 -0.137 1.00 0.67 C ATOM 216 CG TYR A 20 -0.691 -14.297 0.190 1.00 1.13 C ATOM 217 CD1 TYR A 20 0.048 -14.893 1.206 1.00 1.45 C ATOM 218 CD2 TYR A 20 -1.586 -15.090 -0.520 1.00 1.34 C ATOM 219 CE1 TYR A 20 -0.097 -16.236 1.502 1.00 1.93 C ATOM 220 CE2 TYR A 20 -1.736 -16.433 -0.229 1.00 1.82 C ATOM 221 CZ TYR A 20 -0.985 -16.997 0.799 1.00 2.10 C ATOM 222 OH TYR A 20 -1.138 -18.340 1.070 1.00 2.59 O ATOM 0 H TYR A 20 -1.675 -12.791 2.585 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.176 -10.852 0.460 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -0.770 -12.670 -1.189 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.517 -12.549 -0.006 1.00 0.67 H new ATOM 0 HD1 TYR A 20 0.747 -14.297 1.774 1.00 1.45 H new ATOM 0 HD2 TYR A 20 -2.174 -14.649 -1.312 1.00 1.34 H new ATOM 0 HE1 TYR A 20 0.492 -16.682 2.289 1.00 1.93 H new ATOM 0 HE2 TYR A 20 -2.429 -17.039 -0.794 1.00 1.82 H new ATOM 0 HH TYR A 20 -1.815 -18.720 0.471 1.00 2.59 H new ATOM 232 N GLU A 21 -3.332 -11.577 -0.702 1.00 0.33 N ATOM 233 CA GLU A 21 -4.697 -11.754 -1.191 1.00 0.32 C ATOM 234 C GLU A 21 -5.720 -11.296 -0.169 1.00 0.28 C ATOM 235 O GLU A 21 -6.752 -11.938 0.057 1.00 0.30 O ATOM 236 CB GLU A 21 -4.941 -13.203 -1.581 1.00 0.35 C ATOM 237 CG GLU A 21 -6.131 -13.392 -2.505 1.00 0.98 C ATOM 238 CD GLU A 21 -6.394 -14.843 -2.817 1.00 1.16 C ATOM 239 OE1 GLU A 21 -5.662 -15.417 -3.645 1.00 1.73 O ATOM 240 OE2 GLU A 21 -7.340 -15.417 -2.236 1.00 1.53 O ATOM 0 H GLU A 21 -2.758 -10.986 -1.303 1.00 0.33 H new ATOM 0 HA GLU A 21 -4.814 -11.130 -2.077 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.048 -13.595 -2.068 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -5.096 -13.793 -0.677 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -7.018 -12.956 -2.044 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -5.955 -12.850 -3.434 1.00 0.98 H new ATOM 247 N PHE A 22 -5.422 -10.187 0.453 1.00 0.26 N ATOM 248 CA PHE A 22 -6.309 -9.606 1.417 1.00 0.26 C ATOM 249 C PHE A 22 -6.981 -8.444 0.741 1.00 0.24 C ATOM 250 O PHE A 22 -6.439 -7.870 -0.204 1.00 0.27 O ATOM 251 CB PHE A 22 -5.554 -9.162 2.680 1.00 0.32 C ATOM 252 CG PHE A 22 -4.372 -8.264 2.426 1.00 1.08 C ATOM 253 CD1 PHE A 22 -4.545 -6.904 2.227 1.00 1.98 C ATOM 254 CD2 PHE A 22 -3.087 -8.784 2.394 1.00 1.15 C ATOM 255 CE1 PHE A 22 -3.461 -6.081 1.998 1.00 2.89 C ATOM 256 CE2 PHE A 22 -1.999 -7.965 2.167 1.00 2.05 C ATOM 257 CZ PHE A 22 -2.185 -6.612 1.967 1.00 2.92 C ATOM 0 H PHE A 22 -4.559 -9.664 0.304 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.046 -10.336 1.751 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -6.251 -8.644 3.340 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -5.211 -10.049 3.212 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -5.539 -6.483 2.251 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -2.935 -9.842 2.548 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -3.610 -5.023 1.843 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -1.003 -8.383 2.146 1.00 2.05 H new ATOM 0 HZ PHE A 22 -1.336 -5.970 1.787 1.00 2.92 H new ATOM 267 N ILE A 23 -8.131 -8.079 1.217 1.00 0.22 N ATOM 268 CA ILE A 23 -8.861 -7.020 0.592 1.00 0.21 C ATOM 269 C ILE A 23 -8.611 -5.772 1.371 1.00 0.19 C ATOM 270 O ILE A 23 -8.670 -5.762 2.597 1.00 0.22 O ATOM 271 CB ILE A 23 -10.372 -7.282 0.545 1.00 0.28 C ATOM 272 CG1 ILE A 23 -10.664 -8.641 -0.097 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.066 -6.167 -0.223 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.116 -8.773 -1.502 1.00 0.84 C ATOM 0 H ILE A 23 -8.582 -8.496 2.031 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.520 -6.937 -0.440 1.00 0.21 H new ATOM 0 HB ILE A 23 -10.758 -7.300 1.564 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.239 -9.428 0.526 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -11.742 -8.800 -0.119 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.139 -6.359 -0.253 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -10.881 -5.214 0.273 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -10.676 -6.128 -1.240 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.359 -9.760 -1.896 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -10.560 -8.008 -2.139 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.034 -8.646 -1.484 1.00 0.84 H new ATOM 286 N LEU A 24 -8.297 -4.732 0.662 1.00 0.18 N ATOM 287 CA LEU A 24 -7.937 -3.501 1.309 1.00 0.19 C ATOM 288 C LEU A 24 -9.120 -2.564 1.341 1.00 0.20 C ATOM 289 O LEU A 24 -9.671 -2.217 0.304 1.00 0.23 O ATOM 290 CB LEU A 24 -6.771 -2.853 0.562 1.00 0.23 C ATOM 291 CG LEU A 24 -6.047 -1.757 1.332 1.00 0.53 C ATOM 292 CD1 LEU A 24 -4.630 -1.585 0.807 1.00 1.32 C ATOM 293 CD2 LEU A 24 -6.796 -0.435 1.265 1.00 1.41 C ATOM 0 H LEU A 24 -8.281 -4.707 -0.358 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.633 -3.711 2.335 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.051 -3.628 0.299 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.145 -2.434 -0.372 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.005 -2.064 2.377 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.127 -0.798 1.369 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -4.083 -2.520 0.924 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.663 -1.313 -0.248 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -6.248 0.322 1.826 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -6.887 -0.121 0.225 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -7.790 -0.558 1.696 1.00 1.41 H new ATOM 305 N ASN A 25 -9.508 -2.176 2.543 1.00 0.19 N ATOM 306 CA ASN A 25 -10.484 -1.125 2.738 1.00 0.19 C ATOM 307 C ASN A 25 -9.997 -0.253 3.868 1.00 0.18 C ATOM 308 O ASN A 25 -9.319 -0.727 4.752 1.00 0.22 O ATOM 309 CB ASN A 25 -11.905 -1.657 3.011 1.00 0.29 C ATOM 310 CG ASN A 25 -12.151 -2.107 4.441 1.00 0.92 C ATOM 311 OD1 ASN A 25 -11.273 -2.643 5.102 1.00 1.74 O ATOM 312 ND2 ASN A 25 -13.368 -1.896 4.923 1.00 1.72 N ATOM 0 H ASN A 25 -9.154 -2.582 3.409 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.572 -0.551 1.816 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -12.624 -0.877 2.761 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -12.099 -2.496 2.342 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -13.597 -2.184 5.874 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -14.076 -1.446 4.342 1.00 1.72 H new ATOM 319 N ASP A 26 -10.313 1.004 3.826 1.00 0.16 N ATOM 320 CA ASP A 26 -9.862 1.942 4.839 1.00 0.17 C ATOM 321 C ASP A 26 -10.855 2.059 5.971 1.00 0.18 C ATOM 322 O ASP A 26 -11.835 1.322 6.034 1.00 0.20 O ATOM 323 CB ASP A 26 -9.709 3.301 4.168 1.00 0.19 C ATOM 324 CG ASP A 26 -10.770 3.536 3.117 1.00 0.40 C ATOM 325 OD1 ASP A 26 -11.910 3.871 3.473 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.452 3.446 1.935 1.00 1.04 O ATOM 0 H ASP A 26 -10.889 1.421 3.095 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.920 1.591 5.261 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.765 4.086 4.922 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.723 3.370 3.709 1.00 0.19 H new ATOM 331 N ALA A 27 -10.527 2.921 6.912 1.00 0.21 N ATOM 332 CA ALA A 27 -11.402 3.207 8.055 1.00 0.25 C ATOM 333 C ALA A 27 -12.607 3.997 7.596 1.00 0.24 C ATOM 334 O ALA A 27 -13.632 4.060 8.279 1.00 0.28 O ATOM 335 CB ALA A 27 -10.672 3.947 9.164 1.00 0.32 C ATOM 0 H ALA A 27 -9.653 3.446 6.916 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.730 2.253 8.468 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.359 4.137 9.988 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -9.839 3.341 9.519 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.294 4.895 8.781 1.00 0.32 H new ATOM 341 N LEU A 28 -12.472 4.611 6.429 1.00 0.21 N ATOM 342 CA LEU A 28 -13.627 5.187 5.744 1.00 0.24 C ATOM 343 C LEU A 28 -14.461 4.045 5.241 1.00 0.23 C ATOM 344 O LEU A 28 -15.664 4.150 5.001 1.00 0.29 O ATOM 345 CB LEU A 28 -13.216 6.046 4.548 1.00 0.25 C ATOM 346 CG LEU A 28 -12.394 7.266 4.873 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.169 8.062 3.608 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.079 8.111 5.934 1.00 0.48 C ATOM 0 H LEU A 28 -11.585 4.724 5.938 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.169 5.825 6.442 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.651 5.424 3.854 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.118 6.366 4.027 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.430 6.956 5.276 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.575 8.947 3.836 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.640 7.447 2.880 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -13.130 8.367 3.194 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.467 8.986 6.153 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.055 8.432 5.569 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.207 7.522 6.842 1.00 0.48 H new ATOM 360 N ASN A 29 -13.748 2.951 5.117 1.00 0.20 N ATOM 361 CA ASN A 29 -14.210 1.707 4.568 1.00 0.23 C ATOM 362 C ASN A 29 -14.552 1.900 3.120 1.00 0.24 C ATOM 363 O ASN A 29 -15.723 1.929 2.746 1.00 0.28 O ATOM 364 CB ASN A 29 -15.447 1.161 5.279 1.00 0.29 C ATOM 365 CG ASN A 29 -15.390 1.231 6.798 1.00 0.60 C ATOM 366 OD1 ASN A 29 -16.409 1.437 7.456 1.00 1.32 O ATOM 367 ND2 ASN A 29 -14.211 1.048 7.372 1.00 1.30 N ATOM 0 H ASN A 29 -12.774 2.907 5.415 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.402 0.988 4.701 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.321 1.715 4.936 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.591 0.122 4.982 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -14.129 1.076 8.388 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -13.385 0.879 6.798 1.00 1.30 H new ATOM 374 N GLN A 30 -13.540 2.004 2.298 1.00 0.23 N ATOM 375 CA GLN A 30 -13.736 1.877 0.895 1.00 0.24 C ATOM 376 C GLN A 30 -12.716 0.891 0.418 1.00 0.22 C ATOM 377 O GLN A 30 -11.524 1.169 0.455 1.00 0.28 O ATOM 378 CB GLN A 30 -13.522 3.222 0.200 1.00 0.36 C ATOM 379 CG GLN A 30 -14.490 4.322 0.599 1.00 0.98 C ATOM 380 CD GLN A 30 -15.882 4.127 0.036 1.00 1.41 C ATOM 381 OE1 GLN A 30 -16.184 4.552 -1.075 1.00 2.21 O ATOM 382 NE2 GLN A 30 -16.746 3.488 0.801 1.00 1.84 N ATOM 0 H GLN A 30 -12.576 2.176 2.585 1.00 0.23 H new ATOM 0 HA GLN A 30 -14.751 1.549 0.669 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -12.507 3.562 0.407 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -13.594 3.071 -0.877 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -14.548 4.368 1.686 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -14.099 5.281 0.260 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -16.460 3.148 1.719 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -17.700 3.334 0.474 1.00 1.84 H new ATOM 391 N SER A 31 -13.147 -0.269 -0.017 1.00 0.23 N ATOM 392 CA SER A 31 -12.191 -1.202 -0.515 1.00 0.26 C ATOM 393 C SER A 31 -11.618 -0.613 -1.794 1.00 0.21 C ATOM 394 O SER A 31 -12.345 -0.337 -2.751 1.00 0.21 O ATOM 395 CB SER A 31 -12.840 -2.574 -0.712 1.00 0.36 C ATOM 396 OG SER A 31 -14.049 -2.488 -1.443 1.00 1.23 O ATOM 0 H SER A 31 -14.120 -0.574 -0.034 1.00 0.23 H new ATOM 0 HA SER A 31 -11.376 -1.367 0.190 1.00 0.26 H new ATOM 0 HB2 SER A 31 -12.146 -3.232 -1.235 1.00 0.36 H new ATOM 0 HB3 SER A 31 -13.036 -3.026 0.261 1.00 0.36 H new ATOM 0 HG SER A 31 -14.128 -1.596 -1.842 1.00 1.23 H new ATOM 402 N ILE A 32 -10.316 -0.396 -1.790 1.00 0.21 N ATOM 403 CA ILE A 32 -9.678 0.355 -2.848 1.00 0.20 C ATOM 404 C ILE A 32 -9.521 -0.475 -4.134 1.00 0.21 C ATOM 405 O ILE A 32 -8.695 -1.381 -4.217 1.00 0.24 O ATOM 406 CB ILE A 32 -8.320 0.959 -2.405 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.255 -0.111 -2.159 1.00 1.11 C ATOM 408 CG2 ILE A 32 -8.513 1.788 -1.147 1.00 1.23 C ATOM 409 CD1 ILE A 32 -5.864 0.465 -1.982 1.00 1.72 C ATOM 0 H ILE A 32 -9.682 -0.730 -1.064 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.345 1.187 -3.074 1.00 0.20 H new ATOM 0 HB ILE A 32 -7.965 1.589 -3.221 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -7.521 -0.682 -1.270 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.249 -0.809 -2.996 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -7.556 2.210 -0.839 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -9.218 2.595 -1.347 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -8.903 1.155 -0.350 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -5.154 -0.344 -1.811 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -5.580 1.013 -2.880 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -5.856 1.141 -1.127 1.00 1.72 H new ATOM 421 N ILE A 33 -10.361 -0.203 -5.120 1.00 0.21 N ATOM 422 CA ILE A 33 -10.330 -0.952 -6.376 1.00 0.24 C ATOM 423 C ILE A 33 -9.571 -0.153 -7.443 1.00 0.24 C ATOM 424 O ILE A 33 -9.577 1.079 -7.427 1.00 0.24 O ATOM 425 CB ILE A 33 -11.765 -1.211 -6.888 1.00 0.28 C ATOM 426 CG1 ILE A 33 -12.687 -1.586 -5.725 1.00 0.80 C ATOM 427 CG2 ILE A 33 -11.766 -2.316 -7.937 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.153 -1.642 -6.096 1.00 0.91 C ATOM 0 H ILE A 33 -11.072 0.527 -5.080 1.00 0.21 H new ATOM 0 HA ILE A 33 -9.830 -1.903 -6.191 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.137 -0.295 -7.347 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.384 -2.557 -5.333 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.554 -0.862 -4.921 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -12.785 -2.485 -8.286 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.138 -2.020 -8.778 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -11.376 -3.234 -7.498 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -14.740 -1.914 -5.219 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.474 -0.666 -6.459 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.302 -2.387 -6.878 1.00 0.91 H new ATOM 440 N ARG A 34 -8.928 -0.849 -8.376 1.00 0.31 N ATOM 441 CA ARG A 34 -8.216 -0.188 -9.463 1.00 0.35 C ATOM 442 C ARG A 34 -9.224 0.285 -10.506 1.00 0.36 C ATOM 443 O ARG A 34 -9.876 -0.526 -11.159 1.00 0.42 O ATOM 444 CB ARG A 34 -7.197 -1.145 -10.093 1.00 0.48 C ATOM 445 CG ARG A 34 -6.199 -0.468 -11.021 1.00 1.04 C ATOM 446 CD ARG A 34 -5.223 -1.474 -11.617 1.00 1.16 C ATOM 447 NE ARG A 34 -4.136 -0.825 -12.359 1.00 1.48 N ATOM 448 CZ ARG A 34 -3.348 -1.459 -13.234 1.00 1.79 C ATOM 449 NH1 ARG A 34 -3.560 -2.739 -13.517 1.00 2.09 N ATOM 450 NH2 ARG A 34 -2.362 -0.804 -13.842 1.00 2.47 N ATOM 0 H ARG A 34 -8.886 -1.868 -8.401 1.00 0.31 H new ATOM 0 HA ARG A 34 -7.673 0.672 -9.072 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -6.651 -1.652 -9.297 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -7.733 -1.913 -10.651 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -6.733 0.042 -11.823 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -5.647 0.294 -10.471 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -4.801 -2.084 -10.818 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -5.762 -2.149 -12.282 1.00 1.16 H new ATOM 0 HE ARG A 34 -3.972 0.169 -12.198 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -4.325 -3.241 -13.067 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -2.958 -3.220 -14.185 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -2.206 0.184 -13.641 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -1.762 -1.290 -14.509 1.00 2.47 H new ATOM 464 N ALA A 35 -9.347 1.599 -10.652 1.00 0.37 N ATOM 465 CA ALA A 35 -10.371 2.181 -11.517 1.00 0.46 C ATOM 466 C ALA A 35 -9.806 2.394 -12.906 1.00 0.53 C ATOM 467 O ALA A 35 -10.487 2.240 -13.917 1.00 0.63 O ATOM 468 CB ALA A 35 -10.873 3.497 -10.935 1.00 0.54 C ATOM 0 H ALA A 35 -8.752 2.283 -10.184 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.215 1.494 -11.581 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.635 3.918 -11.591 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.301 3.319 -9.949 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -10.042 4.197 -10.849 1.00 0.54 H new ATOM 474 N ASN A 36 -8.539 2.732 -12.919 1.00 0.53 N ATOM 475 CA ASN A 36 -7.799 2.972 -14.133 1.00 0.66 C ATOM 476 C ASN A 36 -6.408 2.405 -13.926 1.00 0.65 C ATOM 477 O ASN A 36 -6.001 2.168 -12.787 1.00 0.55 O ATOM 478 CB ASN A 36 -7.757 4.483 -14.419 1.00 0.76 C ATOM 479 CG ASN A 36 -6.894 4.845 -15.610 1.00 1.43 C ATOM 480 OD1 ASN A 36 -5.705 5.128 -15.462 1.00 2.25 O ATOM 481 ND2 ASN A 36 -7.478 4.828 -16.796 1.00 1.93 N ATOM 0 H ASN A 36 -7.984 2.850 -12.071 1.00 0.53 H new ATOM 0 HA ASN A 36 -8.267 2.493 -14.993 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -8.772 4.841 -14.593 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -7.382 5.002 -13.537 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -6.940 5.055 -17.633 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -8.466 4.588 -16.874 1.00 1.93 H new ATOM 488 N ASP A 37 -5.680 2.175 -15.002 1.00 0.81 N ATOM 489 CA ASP A 37 -4.385 1.524 -14.901 1.00 0.88 C ATOM 490 C ASP A 37 -3.351 2.439 -14.253 1.00 0.79 C ATOM 491 O ASP A 37 -2.248 2.000 -13.926 1.00 0.88 O ATOM 492 CB ASP A 37 -3.899 1.058 -16.280 1.00 1.10 C ATOM 493 CG ASP A 37 -3.643 2.197 -17.249 1.00 1.76 C ATOM 494 OD1 ASP A 37 -4.615 2.857 -17.667 1.00 2.10 O ATOM 495 OD2 ASP A 37 -2.463 2.465 -17.561 1.00 2.51 O ATOM 0 H ASP A 37 -5.959 2.427 -15.950 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.506 0.649 -14.262 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -2.981 0.483 -16.158 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -4.642 0.386 -16.710 1.00 1.10 H new ATOM 500 N GLN A 38 -3.721 3.699 -14.048 1.00 0.68 N ATOM 501 CA GLN A 38 -2.828 4.667 -13.422 1.00 0.60 C ATOM 502 C GLN A 38 -3.447 5.264 -12.155 1.00 0.44 C ATOM 503 O GLN A 38 -2.733 5.756 -11.282 1.00 0.39 O ATOM 504 CB GLN A 38 -2.478 5.783 -14.406 1.00 0.71 C ATOM 505 CG GLN A 38 -1.843 5.287 -15.695 1.00 1.53 C ATOM 506 CD GLN A 38 -1.403 6.420 -16.594 1.00 2.01 C ATOM 507 OE1 GLN A 38 -2.177 6.914 -17.413 1.00 2.57 O ATOM 508 NE2 GLN A 38 -0.156 6.832 -16.455 1.00 2.58 N ATOM 0 H GLN A 38 -4.634 4.074 -14.307 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.917 4.140 -13.138 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -3.384 6.338 -14.648 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -1.796 6.482 -13.921 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -0.983 4.662 -15.456 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -2.555 4.658 -16.229 1.00 1.53 H new ATOM 0 HE21 GLN A 38 0.452 6.394 -15.763 1.00 2.58 H new ATOM 0 HE22 GLN A 38 0.199 7.588 -17.040 1.00 2.58 H new ATOM 517 N TYR A 39 -4.773 5.220 -12.059 1.00 0.43 N ATOM 518 CA TYR A 39 -5.480 5.824 -10.932 1.00 0.41 C ATOM 519 C TYR A 39 -6.365 4.806 -10.221 1.00 0.34 C ATOM 520 O TYR A 39 -6.982 3.946 -10.852 1.00 0.36 O ATOM 521 CB TYR A 39 -6.320 7.017 -11.396 1.00 0.64 C ATOM 522 CG TYR A 39 -5.492 8.220 -11.782 1.00 0.92 C ATOM 523 CD1 TYR A 39 -4.993 9.086 -10.818 1.00 1.50 C ATOM 524 CD2 TYR A 39 -5.215 8.490 -13.116 1.00 1.31 C ATOM 525 CE1 TYR A 39 -4.243 10.192 -11.175 1.00 2.23 C ATOM 526 CE2 TYR A 39 -4.466 9.592 -13.479 1.00 1.97 C ATOM 527 CZ TYR A 39 -3.956 10.431 -12.477 1.00 2.39 C ATOM 528 OH TYR A 39 -3.236 11.541 -12.868 1.00 3.17 O ATOM 0 H TYR A 39 -5.380 4.773 -12.747 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.729 6.175 -10.224 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.927 6.714 -12.249 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -7.008 7.299 -10.599 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -5.193 8.893 -9.774 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -5.591 7.828 -13.882 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -3.885 10.868 -10.413 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -4.275 9.805 -14.520 1.00 1.97 H new ATOM 0 HH TYR A 39 -3.132 11.537 -13.842 1.00 3.17 H new ATOM 538 N LEU A 40 -6.433 4.919 -8.904 1.00 0.31 N ATOM 539 CA LEU A 40 -7.197 3.988 -8.090 1.00 0.28 C ATOM 540 C LEU A 40 -8.184 4.744 -7.207 1.00 0.25 C ATOM 541 O LEU A 40 -7.822 5.705 -6.531 1.00 0.29 O ATOM 542 CB LEU A 40 -6.224 3.140 -7.255 1.00 0.30 C ATOM 543 CG LEU A 40 -6.825 1.944 -6.508 1.00 0.51 C ATOM 544 CD1 LEU A 40 -5.742 0.926 -6.188 1.00 1.21 C ATOM 545 CD2 LEU A 40 -7.500 2.390 -5.224 1.00 1.31 C ATOM 0 H LEU A 40 -5.964 5.653 -8.373 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.778 3.323 -8.729 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.440 2.770 -7.916 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -5.744 3.792 -6.525 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.573 1.485 -7.154 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -6.182 0.081 -5.657 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -5.287 0.575 -7.114 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -4.980 1.390 -5.562 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -7.918 1.523 -4.713 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -6.768 2.874 -4.578 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -8.299 3.093 -5.458 1.00 1.31 H new ATOM 557 N THR A 41 -9.433 4.302 -7.231 1.00 0.24 N ATOM 558 CA THR A 41 -10.475 4.898 -6.417 1.00 0.22 C ATOM 559 C THR A 41 -11.037 3.853 -5.461 1.00 0.19 C ATOM 560 O THR A 41 -11.267 2.703 -5.842 1.00 0.21 O ATOM 561 CB THR A 41 -11.609 5.468 -7.297 1.00 0.27 C ATOM 562 OG1 THR A 41 -11.061 6.379 -8.260 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.654 6.189 -6.455 1.00 1.28 C ATOM 0 H THR A 41 -9.748 3.525 -7.812 1.00 0.24 H new ATOM 0 HA THR A 41 -10.041 5.720 -5.848 1.00 0.22 H new ATOM 0 HB THR A 41 -12.094 4.635 -7.805 1.00 0.27 H new ATOM 0 HG1 THR A 41 -11.782 6.738 -8.818 1.00 1.36 H new ATOM 0 HG21 THR A 41 -13.438 6.579 -7.104 1.00 1.28 H new ATOM 0 HG22 THR A 41 -13.089 5.492 -5.739 1.00 1.28 H new ATOM 0 HG23 THR A 41 -12.184 7.013 -5.919 1.00 1.28 H new ATOM 571 N ALA A 42 -11.250 4.263 -4.230 1.00 0.19 N ATOM 572 CA ALA A 42 -11.720 3.378 -3.189 1.00 0.20 C ATOM 573 C ALA A 42 -13.242 3.364 -3.141 1.00 0.20 C ATOM 574 O ALA A 42 -13.885 4.397 -3.320 1.00 0.27 O ATOM 575 CB ALA A 42 -11.138 3.814 -1.860 1.00 0.26 C ATOM 0 H ALA A 42 -11.101 5.224 -3.922 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.389 2.362 -3.404 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.491 3.148 -1.072 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -10.050 3.774 -1.909 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.454 4.834 -1.641 1.00 0.26 H new ATOM 581 N ALA A 43 -13.810 2.185 -2.924 1.00 0.20 N ATOM 582 CA ALA A 43 -15.266 2.026 -2.887 1.00 0.29 C ATOM 583 C ALA A 43 -15.675 0.909 -1.925 1.00 0.35 C ATOM 584 O ALA A 43 -15.078 -0.161 -1.930 1.00 0.40 O ATOM 585 CB ALA A 43 -15.791 1.725 -4.282 1.00 0.38 C ATOM 0 H ALA A 43 -13.288 1.322 -2.770 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.700 2.960 -2.529 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -16.874 1.608 -4.246 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.537 2.547 -4.952 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.339 0.804 -4.650 1.00 0.38 H new ATOM 591 N ALA A 44 -16.702 1.164 -1.110 1.00 0.63 N ATOM 592 CA ALA A 44 -17.148 0.222 -0.087 1.00 0.65 C ATOM 593 C ALA A 44 -17.532 -1.142 -0.649 1.00 0.46 C ATOM 594 O ALA A 44 -18.347 -1.263 -1.568 1.00 0.79 O ATOM 595 CB ALA A 44 -18.328 0.801 0.676 1.00 1.13 C ATOM 0 H ALA A 44 -17.244 2.027 -1.143 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.299 0.068 0.579 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.653 0.091 1.436 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -18.030 1.734 1.154 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -19.149 0.994 -0.015 1.00 1.13 H new ATOM 601 N LEU A 45 -16.919 -2.156 -0.064 1.00 0.47 N ATOM 602 CA LEU A 45 -17.196 -3.544 -0.347 1.00 0.66 C ATOM 603 C LEU A 45 -18.545 -3.961 0.213 1.00 0.62 C ATOM 604 O LEU A 45 -19.062 -3.347 1.143 1.00 0.88 O ATOM 605 CB LEU A 45 -16.073 -4.450 0.215 1.00 1.23 C ATOM 606 CG LEU A 45 -15.832 -4.464 1.752 1.00 2.25 C ATOM 607 CD1 LEU A 45 -15.631 -3.068 2.327 1.00 2.87 C ATOM 608 CD2 LEU A 45 -16.941 -5.196 2.500 1.00 2.93 C ATOM 0 H LEU A 45 -16.194 -2.027 0.642 1.00 0.47 H new ATOM 0 HA LEU A 45 -17.230 -3.663 -1.430 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -16.284 -5.473 -0.097 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -15.139 -4.157 -0.265 1.00 1.23 H new ATOM 0 HG LEU A 45 -14.904 -5.015 1.900 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -15.467 -3.138 3.402 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -14.765 -2.602 1.857 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -16.517 -2.464 2.133 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -16.730 -5.180 3.569 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -17.894 -4.703 2.311 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -16.992 -6.229 2.155 1.00 2.93 H new ATOM 620 N HIS A 46 -19.114 -4.988 -0.385 1.00 0.61 N ATOM 621 CA HIS A 46 -20.287 -5.653 0.171 1.00 0.80 C ATOM 622 C HIS A 46 -20.116 -7.156 0.007 1.00 0.76 C ATOM 623 O HIS A 46 -20.782 -7.948 0.671 1.00 0.94 O ATOM 624 CB HIS A 46 -21.583 -5.195 -0.507 1.00 1.06 C ATOM 625 CG HIS A 46 -22.097 -3.868 -0.030 1.00 1.87 C ATOM 626 ND1 HIS A 46 -22.727 -2.967 -0.858 1.00 2.69 N ATOM 627 CD2 HIS A 46 -22.094 -3.303 1.200 1.00 2.79 C ATOM 628 CE1 HIS A 46 -23.084 -1.906 -0.163 1.00 3.63 C ATOM 629 NE2 HIS A 46 -22.713 -2.080 1.093 1.00 3.71 N ATOM 0 H HIS A 46 -18.784 -5.387 -1.264 1.00 0.61 H new ATOM 0 HA HIS A 46 -20.367 -5.389 1.226 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -21.416 -5.141 -1.583 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -22.352 -5.950 -0.341 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -21.681 -3.734 2.100 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -23.595 -1.039 -0.555 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -22.861 -1.418 1.855 1.00 3.71 H new ATOM 638 N ASN A 47 -19.193 -7.536 -0.869 1.00 0.66 N ATOM 639 CA ASN A 47 -18.777 -8.928 -1.001 1.00 0.71 C ATOM 640 C ASN A 47 -17.501 -9.163 -0.208 1.00 0.76 C ATOM 641 O ASN A 47 -16.974 -10.272 -0.198 1.00 0.88 O ATOM 642 CB ASN A 47 -18.476 -9.273 -2.457 1.00 0.74 C ATOM 643 CG ASN A 47 -19.559 -8.831 -3.421 1.00 1.42 C ATOM 644 OD1 ASN A 47 -20.737 -8.771 -3.075 1.00 2.21 O ATOM 645 ND2 ASN A 47 -19.158 -8.520 -4.643 1.00 1.94 N ATOM 0 H ASN A 47 -18.715 -6.895 -1.503 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.592 -9.550 -0.630 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -17.533 -8.808 -2.745 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -18.340 -10.351 -2.546 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -19.837 -8.216 -5.341 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -18.170 -8.584 -4.887 1.00 1.94 H new ATOM 652 N LEU A 48 -17.023 -8.108 0.458 1.00 0.77 N ATOM 653 CA LEU A 48 -15.696 -8.093 1.076 1.00 0.89 C ATOM 654 C LEU A 48 -14.608 -8.125 0.001 1.00 0.81 C ATOM 655 O LEU A 48 -13.885 -7.148 -0.175 1.00 0.78 O ATOM 656 CB LEU A 48 -15.552 -9.242 2.072 1.00 1.15 C ATOM 657 CG LEU A 48 -16.392 -9.084 3.341 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.615 -10.432 4.007 1.00 1.71 C ATOM 659 CD2 LEU A 48 -15.714 -8.124 4.308 1.00 1.66 C ATOM 0 H LEU A 48 -17.546 -7.241 0.583 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.576 -7.165 1.636 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.832 -10.173 1.578 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.503 -9.334 2.354 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.362 -8.673 3.062 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.214 -10.298 4.908 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.138 -11.096 3.319 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.653 -10.870 4.273 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.323 -8.022 5.206 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -14.732 -8.513 4.578 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -15.600 -7.149 3.833 1.00 1.66 H new ATOM 671 N ASP A 49 -14.526 -9.219 -0.742 1.00 0.83 N ATOM 672 CA ASP A 49 -13.638 -9.304 -1.901 1.00 0.83 C ATOM 673 C ASP A 49 -14.291 -8.561 -3.057 1.00 0.75 C ATOM 674 O ASP A 49 -15.092 -9.114 -3.812 1.00 0.83 O ATOM 675 CB ASP A 49 -13.359 -10.761 -2.292 1.00 1.00 C ATOM 676 CG ASP A 49 -12.377 -10.901 -3.448 1.00 1.20 C ATOM 677 OD1 ASP A 49 -12.755 -10.590 -4.594 1.00 1.53 O ATOM 678 OD2 ASP A 49 -11.215 -11.303 -3.215 1.00 1.87 O ATOM 0 H ASP A 49 -15.065 -10.066 -0.565 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.678 -8.851 -1.651 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.966 -11.293 -1.425 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -14.298 -11.243 -2.563 1.00 1.00 H new ATOM 683 N GLU A 50 -13.979 -7.283 -3.132 1.00 0.66 N ATOM 684 CA GLU A 50 -14.630 -6.359 -4.045 1.00 0.72 C ATOM 685 C GLU A 50 -13.580 -5.407 -4.595 1.00 0.62 C ATOM 686 O GLU A 50 -13.627 -4.988 -5.754 1.00 0.68 O ATOM 687 CB GLU A 50 -15.683 -5.560 -3.270 1.00 0.94 C ATOM 688 CG GLU A 50 -16.524 -4.632 -4.125 1.00 1.25 C ATOM 689 CD GLU A 50 -17.832 -5.263 -4.532 1.00 1.93 C ATOM 690 OE1 GLU A 50 -18.750 -5.337 -3.688 1.00 2.66 O ATOM 691 OE2 GLU A 50 -17.940 -5.684 -5.702 1.00 2.35 O ATOM 0 H GLU A 50 -13.258 -6.850 -2.555 1.00 0.66 H new ATOM 0 HA GLU A 50 -15.107 -6.900 -4.862 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.344 -6.258 -2.755 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.181 -4.971 -2.502 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -16.722 -3.713 -3.574 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -15.963 -4.355 -5.017 1.00 1.25 H new ATOM 698 N ALA A 51 -12.618 -5.103 -3.742 1.00 0.52 N ATOM 699 CA ALA A 51 -11.454 -4.321 -4.109 1.00 0.43 C ATOM 700 C ALA A 51 -10.396 -5.201 -4.726 1.00 0.32 C ATOM 701 O ALA A 51 -10.456 -6.430 -4.625 1.00 0.33 O ATOM 702 CB ALA A 51 -10.863 -3.637 -2.900 1.00 0.50 C ATOM 0 H ALA A 51 -12.624 -5.396 -2.765 1.00 0.52 H new ATOM 0 HA ALA A 51 -11.779 -3.571 -4.831 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -9.991 -3.056 -3.201 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -11.606 -2.973 -2.458 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -10.565 -4.387 -2.167 1.00 0.50 H new ATOM 708 N VAL A 52 -9.440 -4.571 -5.380 1.00 0.28 N ATOM 709 CA VAL A 52 -8.263 -5.270 -5.810 1.00 0.26 C ATOM 710 C VAL A 52 -7.454 -5.620 -4.575 1.00 0.22 C ATOM 711 O VAL A 52 -7.224 -4.793 -3.694 1.00 0.23 O ATOM 712 CB VAL A 52 -7.401 -4.456 -6.808 1.00 0.29 C ATOM 713 CG1 VAL A 52 -8.133 -4.304 -8.132 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.036 -3.090 -6.244 1.00 0.31 C ATOM 0 H VAL A 52 -9.462 -3.580 -5.621 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.572 -6.166 -6.348 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.474 -5.004 -6.975 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.517 -3.730 -8.825 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.331 -5.290 -8.553 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -9.076 -3.783 -7.968 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.432 -2.546 -6.970 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -7.946 -2.527 -6.036 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.469 -3.217 -5.322 1.00 0.31 H new ATOM 724 N LYS A 53 -7.079 -6.866 -4.513 1.00 0.22 N ATOM 725 CA LYS A 53 -6.480 -7.443 -3.321 1.00 0.22 C ATOM 726 C LYS A 53 -4.984 -7.403 -3.402 1.00 0.18 C ATOM 727 O LYS A 53 -4.386 -7.740 -4.420 1.00 0.24 O ATOM 728 CB LYS A 53 -6.988 -8.870 -3.094 1.00 0.35 C ATOM 729 CG LYS A 53 -7.275 -9.652 -4.366 1.00 0.78 C ATOM 730 CD LYS A 53 -8.081 -10.901 -4.053 1.00 1.12 C ATOM 731 CE LYS A 53 -8.637 -11.550 -5.308 1.00 1.37 C ATOM 732 NZ LYS A 53 -9.649 -12.590 -4.982 1.00 1.59 N ATOM 0 H LYS A 53 -7.177 -7.522 -5.288 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.781 -6.842 -2.463 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.249 -9.415 -2.507 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -7.899 -8.826 -2.497 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -7.823 -9.025 -5.069 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -6.338 -9.929 -4.849 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -7.451 -11.616 -3.524 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -8.902 -10.644 -3.384 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -9.089 -10.788 -5.943 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -7.823 -11.999 -5.878 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -10.355 -12.638 -5.744 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -9.180 -13.513 -4.886 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -10.121 -12.347 -4.088 1.00 1.59 H new ATOM 746 N PHE A 54 -4.402 -6.922 -2.325 1.00 0.18 N ATOM 747 CA PHE A 54 -3.004 -6.674 -2.259 1.00 0.19 C ATOM 748 C PHE A 54 -2.305 -7.787 -1.519 1.00 0.20 C ATOM 749 O PHE A 54 -2.932 -8.620 -0.860 1.00 0.23 O ATOM 750 CB PHE A 54 -2.737 -5.337 -1.555 1.00 0.25 C ATOM 751 CG PHE A 54 -3.161 -4.127 -2.342 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.495 -3.753 -2.392 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.233 -3.368 -3.033 1.00 1.95 C ATOM 754 CE1 PHE A 54 -4.895 -2.646 -3.116 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.627 -2.259 -3.758 1.00 2.98 C ATOM 756 CZ PHE A 54 -3.931 -1.885 -3.794 1.00 3.31 C ATOM 0 H PHE A 54 -4.905 -6.694 -1.467 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.614 -6.628 -3.276 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.258 -5.334 -0.597 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.671 -5.260 -1.339 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.232 -4.335 -1.858 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.190 -3.645 -3.006 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -5.938 -2.370 -3.159 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -1.890 -1.685 -4.301 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.226 -1.003 -4.343 1.00 3.31 H new ATOM 766 N ASP A 55 -1.003 -7.763 -1.626 1.00 0.21 N ATOM 767 CA ASP A 55 -0.146 -8.679 -0.896 1.00 0.22 C ATOM 768 C ASP A 55 1.017 -7.883 -0.343 1.00 0.23 C ATOM 769 O ASP A 55 1.660 -7.123 -1.070 1.00 0.27 O ATOM 770 CB ASP A 55 0.430 -9.774 -1.811 1.00 0.24 C ATOM 771 CG ASP A 55 -0.555 -10.329 -2.821 1.00 1.33 C ATOM 772 OD1 ASP A 55 -1.523 -10.992 -2.405 1.00 1.89 O ATOM 773 OD2 ASP A 55 -0.380 -10.098 -4.025 1.00 1.93 O ATOM 0 H ASP A 55 -0.498 -7.107 -2.223 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.736 -9.155 -0.113 1.00 0.22 H new ATOM 0 HB2 ASP A 55 1.290 -9.369 -2.345 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.796 -10.593 -1.191 1.00 0.24 H new ATOM 778 N MET A 56 1.266 -8.040 0.946 1.00 0.24 N ATOM 779 CA MET A 56 2.323 -7.324 1.606 1.00 0.25 C ATOM 780 C MET A 56 3.454 -8.258 1.974 1.00 0.25 C ATOM 781 O MET A 56 3.246 -9.372 2.456 1.00 0.30 O ATOM 782 CB MET A 56 1.808 -6.588 2.848 1.00 0.33 C ATOM 783 CG MET A 56 1.115 -7.481 3.863 1.00 0.97 C ATOM 784 SD MET A 56 0.700 -6.608 5.386 1.00 1.19 S ATOM 785 CE MET A 56 -0.272 -5.246 4.747 1.00 1.85 C ATOM 0 H MET A 56 0.739 -8.666 1.554 1.00 0.24 H new ATOM 0 HA MET A 56 2.703 -6.578 0.908 1.00 0.25 H new ATOM 0 HB2 MET A 56 2.647 -6.089 3.334 1.00 0.33 H new ATOM 0 HB3 MET A 56 1.113 -5.810 2.532 1.00 0.33 H new ATOM 0 HG2 MET A 56 0.205 -7.888 3.422 1.00 0.97 H new ATOM 0 HG3 MET A 56 1.761 -8.327 4.098 1.00 0.97 H new ATOM 0 HE1 MET A 56 -0.733 -4.708 5.575 1.00 1.85 H new ATOM 0 HE2 MET A 56 0.374 -4.568 4.189 1.00 1.85 H new ATOM 0 HE3 MET A 56 -1.049 -5.632 4.087 1.00 1.85 H new ATOM 795 N GLY A 57 4.643 -7.790 1.730 1.00 0.26 N ATOM 796 CA GLY A 57 5.826 -8.484 2.135 1.00 0.32 C ATOM 797 C GLY A 57 6.772 -7.499 2.739 1.00 0.31 C ATOM 798 O GLY A 57 7.039 -6.469 2.133 1.00 0.35 O ATOM 0 H GLY A 57 4.818 -6.912 1.242 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.579 -9.263 2.856 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.288 -8.976 1.279 1.00 0.32 H new ATOM 802 N ALA A 58 7.266 -7.762 3.928 1.00 0.37 N ATOM 803 CA ALA A 58 8.096 -6.781 4.569 1.00 0.38 C ATOM 804 C ALA A 58 9.495 -6.982 4.075 1.00 0.42 C ATOM 805 O ALA A 58 9.951 -8.112 3.918 1.00 0.61 O ATOM 806 CB ALA A 58 8.033 -6.909 6.084 1.00 0.51 C ATOM 0 H ALA A 58 7.111 -8.622 4.454 1.00 0.37 H new ATOM 0 HA ALA A 58 7.746 -5.778 4.325 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.672 -6.153 6.540 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.006 -6.766 6.419 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.376 -7.900 6.380 1.00 0.51 H new ATOM 812 N TYR A 59 10.166 -5.901 3.791 1.00 0.45 N ATOM 813 CA TYR A 59 11.506 -5.983 3.262 1.00 0.61 C ATOM 814 C TYR A 59 12.363 -4.929 3.925 1.00 0.72 C ATOM 815 O TYR A 59 11.844 -3.913 4.371 1.00 0.81 O ATOM 816 CB TYR A 59 11.475 -5.865 1.741 1.00 0.93 C ATOM 817 CG TYR A 59 10.821 -7.061 1.070 1.00 1.64 C ATOM 818 CD1 TYR A 59 11.341 -8.339 1.212 1.00 2.54 C ATOM 819 CD2 TYR A 59 9.687 -6.905 0.282 1.00 2.01 C ATOM 820 CE1 TYR A 59 10.752 -9.425 0.595 1.00 3.70 C ATOM 821 CE2 TYR A 59 9.092 -7.985 -0.340 1.00 3.08 C ATOM 822 CZ TYR A 59 9.620 -9.261 -0.139 1.00 3.92 C ATOM 823 OH TYR A 59 9.044 -10.320 -0.802 1.00 5.11 O ATOM 0 H TYR A 59 9.811 -4.953 3.915 1.00 0.45 H new ATOM 0 HA TYR A 59 11.951 -6.952 3.485 1.00 0.61 H new ATOM 0 HB2 TYR A 59 10.937 -4.959 1.463 1.00 0.93 H new ATOM 0 HB3 TYR A 59 12.494 -5.758 1.369 1.00 0.93 H new ATOM 0 HD1 TYR A 59 12.223 -8.488 1.817 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.263 -5.920 0.154 1.00 2.01 H new ATOM 0 HE1 TYR A 59 11.192 -10.406 0.696 1.00 3.70 H new ATOM 0 HE2 TYR A 59 8.229 -7.844 -0.974 1.00 3.08 H new ATOM 0 HH TYR A 59 8.092 -10.138 -0.944 1.00 5.11 H new ATOM 833 N LYS A 60 13.665 -5.150 4.024 1.00 0.92 N ATOM 834 CA LYS A 60 14.439 -4.298 4.910 1.00 1.13 C ATOM 835 C LYS A 60 15.789 -3.883 4.361 1.00 1.50 C ATOM 836 O LYS A 60 16.580 -4.701 3.889 1.00 1.77 O ATOM 837 CB LYS A 60 14.631 -4.931 6.284 1.00 1.30 C ATOM 838 CG LYS A 60 14.726 -3.880 7.378 1.00 1.66 C ATOM 839 CD LYS A 60 15.085 -4.472 8.722 1.00 2.14 C ATOM 840 CE LYS A 60 14.865 -3.462 9.838 1.00 2.79 C ATOM 841 NZ LYS A 60 15.502 -2.145 9.551 1.00 3.47 N ATOM 0 H LYS A 60 14.186 -5.874 3.529 1.00 0.92 H new ATOM 0 HA LYS A 60 13.837 -3.393 4.999 1.00 1.13 H new ATOM 0 HB2 LYS A 60 13.798 -5.602 6.495 1.00 1.30 H new ATOM 0 HB3 LYS A 60 15.537 -5.537 6.282 1.00 1.30 H new ATOM 0 HG2 LYS A 60 15.475 -3.138 7.100 1.00 1.66 H new ATOM 0 HG3 LYS A 60 13.773 -3.357 7.458 1.00 1.66 H new ATOM 0 HD2 LYS A 60 14.480 -5.360 8.906 1.00 2.14 H new ATOM 0 HD3 LYS A 60 16.127 -4.792 8.716 1.00 2.14 H new ATOM 0 HE2 LYS A 60 13.795 -3.319 9.988 1.00 2.79 H new ATOM 0 HE3 LYS A 60 15.267 -3.861 10.769 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 15.411 -1.527 10.382 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 16.509 -2.287 9.334 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 15.031 -1.702 8.737 1.00 3.47 H new ATOM 855 N SER A 61 16.014 -2.590 4.428 1.00 1.67 N ATOM 856 CA SER A 61 17.332 -2.009 4.303 1.00 2.15 C ATOM 857 C SER A 61 17.466 -1.027 5.456 1.00 2.02 C ATOM 858 O SER A 61 16.451 -0.586 5.989 1.00 1.72 O ATOM 859 CB SER A 61 17.493 -1.306 2.955 1.00 2.67 C ATOM 860 OG SER A 61 16.470 -0.346 2.752 1.00 3.06 O ATOM 0 H SER A 61 15.275 -1.902 4.573 1.00 1.67 H new ATOM 0 HA SER A 61 18.110 -2.771 4.343 1.00 2.15 H new ATOM 0 HB2 SER A 61 18.467 -0.818 2.910 1.00 2.67 H new ATOM 0 HB3 SER A 61 17.468 -2.043 2.152 1.00 2.67 H new ATOM 0 HG SER A 61 16.598 0.090 1.884 1.00 3.06 H new ATOM 866 N SER A 62 18.676 -0.675 5.855 1.00 2.37 N ATOM 867 CA SER A 62 18.827 0.127 7.059 1.00 2.25 C ATOM 868 C SER A 62 18.692 1.615 6.747 1.00 2.37 C ATOM 869 O SER A 62 19.521 2.432 7.153 1.00 2.59 O ATOM 870 CB SER A 62 20.185 -0.162 7.702 1.00 2.65 C ATOM 871 OG SER A 62 20.390 -1.560 7.847 1.00 2.99 O ATOM 0 H SER A 62 19.545 -0.922 5.381 1.00 2.37 H new ATOM 0 HA SER A 62 18.034 -0.141 7.757 1.00 2.25 H new ATOM 0 HB2 SER A 62 20.980 0.265 7.090 1.00 2.65 H new ATOM 0 HB3 SER A 62 20.240 0.321 8.678 1.00 2.65 H new ATOM 0 HG SER A 62 21.265 -1.721 8.258 1.00 2.99 H new ATOM 877 N LYS A 63 17.646 1.950 6.001 1.00 2.37 N ATOM 878 CA LYS A 63 17.259 3.332 5.778 1.00 2.64 C ATOM 879 C LYS A 63 15.812 3.567 6.189 1.00 2.48 C ATOM 880 O LYS A 63 15.123 4.373 5.566 1.00 2.87 O ATOM 881 CB LYS A 63 17.437 3.715 4.307 1.00 3.20 C ATOM 882 CG LYS A 63 18.872 4.006 3.911 1.00 3.62 C ATOM 883 CD LYS A 63 18.969 4.391 2.445 1.00 4.18 C ATOM 884 CE LYS A 63 20.321 4.999 2.118 1.00 4.77 C ATOM 885 NZ LYS A 63 20.517 6.311 2.792 1.00 5.27 N ATOM 0 H LYS A 63 17.045 1.270 5.536 1.00 2.37 H new ATOM 0 HA LYS A 63 17.907 3.957 6.392 1.00 2.64 H new ATOM 0 HB2 LYS A 63 17.057 2.906 3.684 1.00 3.20 H new ATOM 0 HB3 LYS A 63 16.828 4.594 4.095 1.00 3.20 H new ATOM 0 HG2 LYS A 63 19.266 4.813 4.529 1.00 3.62 H new ATOM 0 HG3 LYS A 63 19.490 3.128 4.101 1.00 3.62 H new ATOM 0 HD2 LYS A 63 18.806 3.510 1.825 1.00 4.18 H new ATOM 0 HD3 LYS A 63 18.180 5.103 2.202 1.00 4.18 H new ATOM 0 HE2 LYS A 63 21.111 4.313 2.423 1.00 4.77 H new ATOM 0 HE3 LYS A 63 20.410 5.128 1.039 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 21.276 6.837 2.313 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 19.634 6.859 2.748 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 20.778 6.155 3.786 1.00 5.27 H new ATOM 899 N ASP A 64 15.336 2.864 7.216 1.00 2.02 N ATOM 900 CA ASP A 64 13.942 3.017 7.626 1.00 2.02 C ATOM 901 C ASP A 64 13.793 4.293 8.464 1.00 2.36 C ATOM 902 O ASP A 64 14.225 5.368 8.053 1.00 2.81 O ATOM 903 CB ASP A 64 13.526 1.805 8.484 1.00 1.53 C ATOM 904 CG ASP A 64 14.444 0.598 8.362 1.00 1.63 C ATOM 905 OD1 ASP A 64 15.621 0.687 8.773 1.00 1.89 O ATOM 906 OD2 ASP A 64 13.998 -0.435 7.811 1.00 1.88 O ATOM 0 H ASP A 64 15.879 2.199 7.767 1.00 2.02 H new ATOM 0 HA ASP A 64 13.310 3.080 6.741 1.00 2.02 H new ATOM 0 HB2 ASP A 64 13.488 2.112 9.529 1.00 1.53 H new ATOM 0 HB3 ASP A 64 12.516 1.507 8.203 1.00 1.53 H new ATOM 911 N ASP A 65 13.188 4.179 9.642 1.00 2.27 N ATOM 912 CA ASP A 65 13.475 5.087 10.747 1.00 2.65 C ATOM 913 C ASP A 65 13.820 4.256 11.976 1.00 2.35 C ATOM 914 O ASP A 65 14.984 3.997 12.274 1.00 2.28 O ATOM 915 CB ASP A 65 12.281 6.014 11.024 1.00 3.22 C ATOM 916 CG ASP A 65 12.509 6.931 12.214 1.00 3.59 C ATOM 917 OD1 ASP A 65 13.320 7.871 12.093 1.00 4.06 O ATOM 918 OD2 ASP A 65 11.884 6.713 13.274 1.00 3.75 O ATOM 0 H ASP A 65 12.493 3.464 9.856 1.00 2.27 H new ATOM 0 HA ASP A 65 14.320 5.725 10.487 1.00 2.65 H new ATOM 0 HB2 ASP A 65 12.083 6.618 10.139 1.00 3.22 H new ATOM 0 HB3 ASP A 65 11.392 5.410 11.202 1.00 3.22 H new ATOM 923 N ALA A 66 12.765 3.815 12.653 1.00 2.40 N ATOM 924 CA ALA A 66 12.813 2.733 13.626 1.00 2.34 C ATOM 925 C ALA A 66 11.700 1.746 13.292 1.00 2.24 C ATOM 926 O ALA A 66 11.274 0.937 14.118 1.00 2.63 O ATOM 927 CB ALA A 66 12.661 3.268 15.040 1.00 2.98 C ATOM 0 H ALA A 66 11.832 4.210 12.537 1.00 2.40 H new ATOM 0 HA ALA A 66 13.780 2.231 13.578 1.00 2.34 H new ATOM 0 HB1 ALA A 66 12.700 2.440 15.748 1.00 2.98 H new ATOM 0 HB2 ALA A 66 13.470 3.967 15.253 1.00 2.98 H new ATOM 0 HB3 ALA A 66 11.704 3.781 15.134 1.00 2.98 H new ATOM 933 N LYS A 67 11.242 1.841 12.055 1.00 1.96 N ATOM 934 CA LYS A 67 10.013 1.212 11.605 1.00 1.89 C ATOM 935 C LYS A 67 10.189 0.814 10.145 1.00 1.44 C ATOM 936 O LYS A 67 10.861 1.506 9.395 1.00 1.95 O ATOM 937 CB LYS A 67 8.834 2.168 11.797 1.00 2.82 C ATOM 938 CG LYS A 67 7.464 1.501 11.791 1.00 3.45 C ATOM 939 CD LYS A 67 7.332 0.461 12.895 1.00 4.32 C ATOM 940 CE LYS A 67 5.887 0.306 13.350 1.00 5.01 C ATOM 941 NZ LYS A 67 5.453 1.436 14.218 1.00 5.31 N ATOM 0 H LYS A 67 11.722 2.366 11.324 1.00 1.96 H new ATOM 0 HA LYS A 67 9.799 0.319 12.191 1.00 1.89 H new ATOM 0 HB2 LYS A 67 8.962 2.695 12.742 1.00 2.82 H new ATOM 0 HB3 LYS A 67 8.861 2.919 11.007 1.00 2.82 H new ATOM 0 HG2 LYS A 67 6.691 2.260 11.913 1.00 3.45 H new ATOM 0 HG3 LYS A 67 7.296 1.027 10.824 1.00 3.45 H new ATOM 0 HD2 LYS A 67 7.707 -0.498 12.538 1.00 4.32 H new ATOM 0 HD3 LYS A 67 7.952 0.750 13.744 1.00 4.32 H new ATOM 0 HE2 LYS A 67 5.236 0.248 12.478 1.00 5.01 H new ATOM 0 HE3 LYS A 67 5.776 -0.632 13.893 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 4.998 1.061 15.074 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 6.281 2.005 14.487 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 4.777 2.032 13.699 1.00 5.31 H new ATOM 955 N ILE A 68 9.555 -0.272 9.758 1.00 0.88 N ATOM 956 CA ILE A 68 10.024 -1.123 8.683 1.00 0.76 C ATOM 957 C ILE A 68 9.107 -0.974 7.515 1.00 0.43 C ATOM 958 O ILE A 68 7.944 -0.600 7.671 1.00 0.37 O ATOM 959 CB ILE A 68 10.078 -2.626 9.072 1.00 0.97 C ATOM 960 CG1 ILE A 68 10.328 -2.809 10.578 1.00 1.07 C ATOM 961 CG2 ILE A 68 11.161 -3.340 8.269 1.00 1.51 C ATOM 962 CD1 ILE A 68 11.679 -2.308 11.049 1.00 1.66 C ATOM 0 H ILE A 68 8.687 -0.594 10.187 1.00 0.88 H new ATOM 0 HA ILE A 68 11.040 -0.808 8.447 1.00 0.76 H new ATOM 0 HB ILE A 68 9.109 -3.066 8.837 1.00 0.97 H new ATOM 0 HG12 ILE A 68 9.547 -2.287 11.131 1.00 1.07 H new ATOM 0 HG13 ILE A 68 10.240 -3.867 10.824 1.00 1.07 H new ATOM 0 HG21 ILE A 68 11.189 -4.393 8.551 1.00 1.51 H new ATOM 0 HG22 ILE A 68 10.941 -3.255 7.205 1.00 1.51 H new ATOM 0 HG23 ILE A 68 12.129 -2.883 8.477 1.00 1.51 H new ATOM 0 HD11 ILE A 68 11.775 -2.474 12.122 1.00 1.66 H new ATOM 0 HD12 ILE A 68 12.469 -2.847 10.526 1.00 1.66 H new ATOM 0 HD13 ILE A 68 11.766 -1.242 10.838 1.00 1.66 H new ATOM 974 N THR A 69 9.620 -1.264 6.354 1.00 0.47 N ATOM 975 CA THR A 69 8.870 -1.063 5.163 1.00 0.38 C ATOM 976 C THR A 69 8.358 -2.388 4.636 1.00 0.34 C ATOM 977 O THR A 69 9.045 -3.411 4.651 1.00 0.46 O ATOM 978 CB THR A 69 9.707 -0.364 4.081 1.00 0.55 C ATOM 979 OG1 THR A 69 9.024 -0.431 2.830 1.00 1.50 O ATOM 980 CG2 THR A 69 11.091 -0.983 3.948 1.00 1.23 C ATOM 0 H THR A 69 10.557 -1.641 6.214 1.00 0.47 H new ATOM 0 HA THR A 69 8.026 -0.419 5.409 1.00 0.38 H new ATOM 0 HB THR A 69 9.838 0.676 4.378 1.00 0.55 H new ATOM 0 HG1 THR A 69 9.503 -1.038 2.228 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.651 -0.460 3.173 1.00 1.23 H new ATOM 0 HG22 THR A 69 11.620 -0.898 4.897 1.00 1.23 H new ATOM 0 HG23 THR A 69 10.995 -2.035 3.679 1.00 1.23 H new ATOM 988 N VAL A 70 7.123 -2.344 4.200 1.00 0.27 N ATOM 989 CA VAL A 70 6.432 -3.492 3.674 1.00 0.28 C ATOM 990 C VAL A 70 6.059 -3.158 2.252 1.00 0.26 C ATOM 991 O VAL A 70 6.104 -1.983 1.872 1.00 0.29 O ATOM 992 CB VAL A 70 5.157 -3.831 4.487 1.00 0.33 C ATOM 993 CG1 VAL A 70 5.502 -4.076 5.946 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.113 -2.728 4.365 1.00 1.06 C ATOM 0 H VAL A 70 6.561 -1.493 4.201 1.00 0.27 H new ATOM 0 HA VAL A 70 7.078 -4.368 3.732 1.00 0.28 H new ATOM 0 HB VAL A 70 4.731 -4.744 4.071 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.594 -4.312 6.500 1.00 0.98 H new ATOM 0 HG12 VAL A 70 6.200 -4.910 6.020 1.00 0.98 H new ATOM 0 HG13 VAL A 70 5.961 -3.181 6.367 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.231 -2.996 4.947 1.00 1.06 H new ATOM 0 HG22 VAL A 70 4.526 -1.793 4.743 1.00 1.06 H new ATOM 0 HG23 VAL A 70 3.834 -2.605 3.318 1.00 1.06 H new ATOM 1004 N ILE A 71 5.736 -4.167 1.469 1.00 0.25 N ATOM 1005 CA ILE A 71 5.483 -3.977 0.058 1.00 0.28 C ATOM 1006 C ILE A 71 4.001 -4.134 -0.225 1.00 0.28 C ATOM 1007 O ILE A 71 3.397 -5.120 0.181 1.00 0.33 O ATOM 1008 CB ILE A 71 6.308 -4.998 -0.770 1.00 0.39 C ATOM 1009 CG1 ILE A 71 7.683 -4.420 -1.140 1.00 1.29 C ATOM 1010 CG2 ILE A 71 5.564 -5.438 -2.024 1.00 1.34 C ATOM 1011 CD1 ILE A 71 8.476 -3.873 0.029 1.00 2.12 C ATOM 0 H ILE A 71 5.643 -5.131 1.789 1.00 0.25 H new ATOM 0 HA ILE A 71 5.788 -2.971 -0.230 1.00 0.28 H new ATOM 0 HB ILE A 71 6.456 -5.878 -0.144 1.00 0.39 H new ATOM 0 HG12 ILE A 71 8.270 -5.199 -1.627 1.00 1.29 H new ATOM 0 HG13 ILE A 71 7.542 -3.623 -1.870 1.00 1.29 H new ATOM 0 HG21 ILE A 71 6.174 -6.152 -2.577 1.00 1.34 H new ATOM 0 HG22 ILE A 71 4.621 -5.907 -1.742 1.00 1.34 H new ATOM 0 HG23 ILE A 71 5.364 -4.570 -2.652 1.00 1.34 H new ATOM 0 HD11 ILE A 71 9.431 -3.487 -0.328 1.00 2.12 H new ATOM 0 HD12 ILE A 71 7.915 -3.069 0.505 1.00 2.12 H new ATOM 0 HD13 ILE A 71 8.654 -4.669 0.752 1.00 2.12 H new ATOM 1023 N LEU A 72 3.412 -3.152 -0.884 1.00 0.28 N ATOM 1024 CA LEU A 72 2.006 -3.248 -1.256 1.00 0.29 C ATOM 1025 C LEU A 72 1.865 -3.502 -2.758 1.00 0.27 C ATOM 1026 O LEU A 72 2.227 -2.661 -3.577 1.00 0.30 O ATOM 1027 CB LEU A 72 1.263 -1.972 -0.847 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.246 -2.125 -0.649 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.538 -3.114 0.470 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -0.882 -0.775 -0.349 1.00 0.88 C ATOM 0 H LEU A 72 3.875 -2.289 -1.171 1.00 0.28 H new ATOM 0 HA LEU A 72 1.560 -4.091 -0.727 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.698 -1.600 0.081 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.437 -1.211 -1.608 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.679 -2.512 -1.571 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.616 -3.211 0.598 1.00 0.79 H new ATOM 0 HD12 LEU A 72 -0.114 -4.086 0.217 1.00 0.79 H new ATOM 0 HD13 LEU A 72 -0.094 -2.755 1.398 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -1.956 -0.901 -0.211 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.445 -0.361 0.560 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.701 -0.095 -1.181 1.00 0.88 H new ATOM 1042 N ARG A 73 1.321 -4.654 -3.111 1.00 0.24 N ATOM 1043 CA ARG A 73 1.128 -5.023 -4.511 1.00 0.24 C ATOM 1044 C ARG A 73 -0.268 -5.593 -4.683 1.00 0.21 C ATOM 1045 O ARG A 73 -0.800 -6.147 -3.745 1.00 0.24 O ATOM 1046 CB ARG A 73 2.139 -6.102 -4.913 1.00 0.28 C ATOM 1047 CG ARG A 73 1.527 -7.496 -4.943 1.00 0.43 C ATOM 1048 CD ARG A 73 2.583 -8.584 -5.032 1.00 0.58 C ATOM 1049 NE ARG A 73 1.963 -9.899 -5.103 1.00 0.91 N ATOM 1050 CZ ARG A 73 2.462 -10.946 -5.748 1.00 1.04 C ATOM 1051 NH1 ARG A 73 3.615 -10.852 -6.404 1.00 1.27 N ATOM 1052 NH2 ARG A 73 1.788 -12.086 -5.750 1.00 1.67 N ATOM 0 H ARG A 73 1.002 -5.357 -2.445 1.00 0.24 H new ATOM 0 HA ARG A 73 1.265 -4.139 -5.134 1.00 0.24 H new ATOM 0 HB2 ARG A 73 2.545 -5.866 -5.897 1.00 0.28 H new ATOM 0 HB3 ARG A 73 2.974 -6.091 -4.213 1.00 0.28 H new ATOM 0 HG2 ARG A 73 0.927 -7.647 -4.046 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.852 -7.576 -5.795 1.00 0.43 H new ATOM 0 HD2 ARG A 73 3.206 -8.422 -5.912 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.239 -8.532 -4.163 1.00 0.58 H new ATOM 0 HE ARG A 73 1.074 -10.026 -4.619 1.00 0.91 H new ATOM 0 HH11 ARG A 73 4.125 -9.969 -6.415 1.00 1.27 H new ATOM 0 HH12 ARG A 73 3.989 -11.663 -6.896 1.00 1.27 H new ATOM 0 HH21 ARG A 73 0.896 -12.152 -5.260 1.00 1.67 H new ATOM 0 HH22 ARG A 73 2.161 -12.898 -6.242 1.00 1.67 H new ATOM 1066 N ILE A 74 -0.863 -5.458 -5.853 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.089 -6.179 -6.144 1.00 0.24 C ATOM 1068 C ILE A 74 -1.773 -7.591 -6.638 1.00 0.27 C ATOM 1069 O ILE A 74 -0.928 -7.775 -7.499 1.00 0.30 O ATOM 1070 CB ILE A 74 -2.976 -5.451 -7.169 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.241 -5.239 -8.495 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.451 -4.124 -6.605 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.097 -4.608 -9.574 1.00 1.81 C ATOM 0 H ILE A 74 -0.523 -4.864 -6.609 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.650 -6.234 -5.211 1.00 0.24 H new ATOM 0 HB ILE A 74 -3.843 -6.080 -7.369 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -1.370 -4.608 -8.320 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -1.872 -6.200 -8.853 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.078 -3.619 -7.341 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.028 -4.300 -5.697 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -2.589 -3.498 -6.372 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -2.508 -4.490 -10.483 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -3.955 -5.248 -9.779 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -3.445 -3.631 -9.238 1.00 1.81 H new ATOM 1085 N SER A 75 -2.409 -8.581 -6.029 1.00 0.30 N ATOM 1086 CA SER A 75 -2.258 -9.989 -6.406 1.00 0.38 C ATOM 1087 C SER A 75 -2.426 -10.220 -7.916 1.00 0.44 C ATOM 1088 O SER A 75 -1.929 -11.204 -8.464 1.00 0.50 O ATOM 1089 CB SER A 75 -3.292 -10.830 -5.656 1.00 0.47 C ATOM 1090 OG SER A 75 -3.377 -10.447 -4.295 1.00 1.16 O ATOM 0 H SER A 75 -3.052 -8.434 -5.251 1.00 0.30 H new ATOM 0 HA SER A 75 -1.244 -10.286 -6.138 1.00 0.38 H new ATOM 0 HB2 SER A 75 -4.268 -10.718 -6.129 1.00 0.47 H new ATOM 0 HB3 SER A 75 -3.024 -11.884 -5.723 1.00 0.47 H new ATOM 0 HG SER A 75 -2.661 -10.883 -3.787 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.145 -9.319 -8.575 1.00 0.45 N ATOM 1097 CA LYS A 76 -3.579 -9.530 -9.953 1.00 0.54 C ATOM 1098 C LYS A 76 -2.483 -9.185 -10.970 1.00 0.55 C ATOM 1099 O LYS A 76 -2.082 -10.019 -11.782 1.00 0.61 O ATOM 1100 CB LYS A 76 -4.783 -8.619 -10.183 1.00 0.60 C ATOM 1101 CG LYS A 76 -5.590 -8.915 -11.433 1.00 1.21 C ATOM 1102 CD LYS A 76 -6.250 -10.282 -11.362 1.00 1.70 C ATOM 1103 CE LYS A 76 -7.339 -10.433 -12.412 1.00 2.16 C ATOM 1104 NZ LYS A 76 -6.844 -10.147 -13.784 1.00 2.51 N ATOM 0 H LYS A 76 -3.442 -8.429 -8.175 1.00 0.45 H new ATOM 0 HA LYS A 76 -3.822 -10.583 -10.095 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -5.443 -8.691 -9.319 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -4.434 -7.588 -10.232 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -6.353 -8.148 -11.564 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -4.939 -8.869 -12.306 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -5.497 -11.058 -11.503 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -6.677 -10.429 -10.370 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -7.737 -11.447 -12.376 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -8.163 -9.759 -12.177 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -7.553 -10.455 -14.480 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -6.679 -9.125 -13.887 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -5.954 -10.660 -13.946 1.00 2.51 H new ATOM 1118 N THR A 77 -2.009 -7.958 -10.902 1.00 0.51 N ATOM 1119 CA THR A 77 -0.945 -7.461 -11.771 1.00 0.53 C ATOM 1120 C THR A 77 0.287 -7.200 -10.913 1.00 0.47 C ATOM 1121 O THR A 77 0.187 -7.249 -9.699 1.00 0.46 O ATOM 1122 CB THR A 77 -1.390 -6.149 -12.456 1.00 0.62 C ATOM 1123 OG1 THR A 77 -2.762 -6.253 -12.867 1.00 1.45 O ATOM 1124 CG2 THR A 77 -0.526 -5.833 -13.666 1.00 1.29 C ATOM 0 H THR A 77 -2.351 -7.265 -10.237 1.00 0.51 H new ATOM 0 HA THR A 77 -0.720 -8.196 -12.544 1.00 0.53 H new ATOM 0 HB THR A 77 -1.278 -5.341 -11.733 1.00 0.62 H new ATOM 0 HG1 THR A 77 -3.038 -5.418 -13.299 1.00 1.45 H new ATOM 0 HG21 THR A 77 -0.866 -4.904 -14.124 1.00 1.29 H new ATOM 0 HG22 THR A 77 0.512 -5.724 -13.353 1.00 1.29 H new ATOM 0 HG23 THR A 77 -0.604 -6.644 -14.390 1.00 1.29 H new ATOM 1132 N GLN A 78 1.444 -6.902 -11.487 1.00 0.50 N ATOM 1133 CA GLN A 78 2.542 -6.492 -10.628 1.00 0.49 C ATOM 1134 C GLN A 78 2.630 -4.978 -10.659 1.00 0.46 C ATOM 1135 O GLN A 78 3.562 -4.359 -11.188 1.00 0.48 O ATOM 1136 CB GLN A 78 3.855 -7.139 -11.062 1.00 0.59 C ATOM 1137 CG GLN A 78 3.885 -8.647 -10.846 1.00 1.49 C ATOM 1138 CD GLN A 78 3.644 -9.040 -9.397 1.00 2.14 C ATOM 1139 OE1 GLN A 78 4.580 -9.137 -8.604 1.00 2.69 O ATOM 1140 NE2 GLN A 78 2.389 -9.277 -9.041 1.00 2.90 N ATOM 0 H GLN A 78 1.641 -6.933 -12.487 1.00 0.50 H new ATOM 0 HA GLN A 78 2.357 -6.825 -9.607 1.00 0.49 H new ATOM 0 HB2 GLN A 78 4.025 -6.927 -12.118 1.00 0.59 H new ATOM 0 HB3 GLN A 78 4.677 -6.683 -10.509 1.00 0.59 H new ATOM 0 HG2 GLN A 78 3.128 -9.115 -11.475 1.00 1.49 H new ATOM 0 HG3 GLN A 78 4.851 -9.036 -11.167 1.00 1.49 H new ATOM 0 HE21 GLN A 78 1.639 -9.186 -9.726 1.00 2.90 H new ATOM 0 HE22 GLN A 78 2.174 -9.550 -8.082 1.00 2.90 H new ATOM 1149 N LEU A 79 1.619 -4.412 -10.029 1.00 0.46 N ATOM 1150 CA LEU A 79 1.476 -2.990 -9.838 1.00 0.45 C ATOM 1151 C LEU A 79 1.902 -2.655 -8.420 1.00 0.42 C ATOM 1152 O LEU A 79 1.313 -3.178 -7.470 1.00 0.54 O ATOM 1153 CB LEU A 79 0.006 -2.609 -10.087 1.00 0.59 C ATOM 1154 CG LEU A 79 -0.290 -1.122 -10.270 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -0.081 -0.358 -8.974 1.00 1.95 C ATOM 1156 CD2 LEU A 79 0.574 -0.555 -11.385 1.00 1.61 C ATOM 0 H LEU A 79 0.853 -4.950 -9.625 1.00 0.46 H new ATOM 0 HA LEU A 79 2.101 -2.428 -10.532 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -0.338 -3.137 -10.976 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.588 -2.975 -9.249 1.00 0.59 H new ATOM 0 HG LEU A 79 -1.338 -1.008 -10.549 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -0.299 0.698 -9.135 1.00 1.95 H new ATOM 0 HD12 LEU A 79 -0.747 -0.753 -8.207 1.00 1.95 H new ATOM 0 HD13 LEU A 79 0.953 -0.469 -8.649 1.00 1.95 H new ATOM 0 HD21 LEU A 79 0.357 0.506 -11.510 1.00 1.61 H new ATOM 0 HD22 LEU A 79 1.626 -0.683 -11.131 1.00 1.61 H new ATOM 0 HD23 LEU A 79 0.359 -1.081 -12.315 1.00 1.61 H new ATOM 1168 N TYR A 80 2.909 -1.819 -8.247 1.00 0.34 N ATOM 1169 CA TYR A 80 3.317 -1.487 -6.904 1.00 0.38 C ATOM 1170 C TYR A 80 2.975 -0.040 -6.599 1.00 0.34 C ATOM 1171 O TYR A 80 2.827 0.787 -7.499 1.00 0.45 O ATOM 1172 CB TYR A 80 4.782 -1.906 -6.600 1.00 0.60 C ATOM 1173 CG TYR A 80 5.941 -0.955 -6.902 1.00 1.27 C ATOM 1174 CD1 TYR A 80 5.770 0.353 -7.320 1.00 2.27 C ATOM 1175 CD2 TYR A 80 7.245 -1.407 -6.726 1.00 1.56 C ATOM 1176 CE1 TYR A 80 6.853 1.176 -7.558 1.00 3.30 C ATOM 1177 CE2 TYR A 80 8.332 -0.590 -6.962 1.00 2.49 C ATOM 1178 CZ TYR A 80 8.129 0.701 -7.380 1.00 3.33 C ATOM 1179 OH TYR A 80 9.205 1.517 -7.628 1.00 4.39 O ATOM 0 H TYR A 80 3.441 -1.373 -8.994 1.00 0.34 H new ATOM 0 HA TYR A 80 2.743 -2.086 -6.198 1.00 0.38 H new ATOM 0 HB2 TYR A 80 4.833 -2.148 -5.539 1.00 0.60 H new ATOM 0 HB3 TYR A 80 4.973 -2.829 -7.147 1.00 0.60 H new ATOM 0 HD1 TYR A 80 4.771 0.737 -7.463 1.00 2.27 H new ATOM 0 HD2 TYR A 80 7.411 -2.422 -6.397 1.00 1.56 H new ATOM 0 HE1 TYR A 80 6.696 2.194 -7.884 1.00 3.30 H new ATOM 0 HE2 TYR A 80 9.335 -0.964 -6.819 1.00 2.49 H new ATOM 0 HH TYR A 80 8.899 2.444 -7.719 1.00 4.39 H new ATOM 1189 N VAL A 81 2.817 0.247 -5.337 1.00 0.32 N ATOM 1190 CA VAL A 81 2.359 1.551 -4.908 1.00 0.32 C ATOM 1191 C VAL A 81 3.520 2.520 -4.847 1.00 0.32 C ATOM 1192 O VAL A 81 4.488 2.281 -4.132 1.00 0.36 O ATOM 1193 CB VAL A 81 1.670 1.498 -3.533 1.00 0.36 C ATOM 1194 CG1 VAL A 81 1.071 2.852 -3.181 1.00 0.46 C ATOM 1195 CG2 VAL A 81 0.606 0.413 -3.503 1.00 0.38 C ATOM 0 H VAL A 81 2.999 -0.408 -4.576 1.00 0.32 H new ATOM 0 HA VAL A 81 1.627 1.891 -5.641 1.00 0.32 H new ATOM 0 HB VAL A 81 2.423 1.253 -2.784 1.00 0.36 H new ATOM 0 HG11 VAL A 81 0.588 2.794 -2.205 1.00 0.46 H new ATOM 0 HG12 VAL A 81 1.861 3.603 -3.151 1.00 0.46 H new ATOM 0 HG13 VAL A 81 0.334 3.131 -3.934 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.133 0.394 -2.521 1.00 0.38 H new ATOM 0 HG22 VAL A 81 -0.146 0.620 -4.264 1.00 0.38 H new ATOM 0 HG23 VAL A 81 1.067 -0.554 -3.702 1.00 0.38 H new ATOM 1205 N THR A 82 3.443 3.591 -5.617 1.00 0.32 N ATOM 1206 CA THR A 82 4.490 4.586 -5.594 1.00 0.32 C ATOM 1207 C THR A 82 4.073 5.716 -4.680 1.00 0.31 C ATOM 1208 O THR A 82 2.891 6.047 -4.563 1.00 0.32 O ATOM 1209 CB THR A 82 4.798 5.159 -7.002 1.00 0.32 C ATOM 1210 OG1 THR A 82 6.105 5.723 -7.054 1.00 1.22 O ATOM 1211 CG2 THR A 82 3.836 6.255 -7.382 1.00 1.37 C ATOM 0 H THR A 82 2.674 3.789 -6.258 1.00 0.32 H new ATOM 0 HA THR A 82 5.397 4.102 -5.233 1.00 0.32 H new ATOM 0 HB THR A 82 4.708 4.320 -7.691 1.00 0.32 H new ATOM 0 HG1 THR A 82 6.274 6.075 -7.953 1.00 1.22 H new ATOM 0 HG21 THR A 82 4.085 6.630 -8.375 1.00 1.37 H new ATOM 0 HG22 THR A 82 2.820 5.861 -7.388 1.00 1.37 H new ATOM 0 HG23 THR A 82 3.906 7.068 -6.659 1.00 1.37 H new ATOM 1219 N ALA A 83 5.037 6.268 -3.999 1.00 0.33 N ATOM 1220 CA ALA A 83 4.791 7.409 -3.155 1.00 0.32 C ATOM 1221 C ALA A 83 5.187 8.681 -3.886 1.00 0.27 C ATOM 1222 O ALA A 83 6.339 8.841 -4.297 1.00 0.31 O ATOM 1223 CB ALA A 83 5.545 7.265 -1.842 1.00 0.41 C ATOM 0 H ALA A 83 6.005 5.947 -4.010 1.00 0.33 H new ATOM 0 HA ALA A 83 3.728 7.466 -2.921 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.350 8.134 -1.213 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.212 6.363 -1.328 1.00 0.41 H new ATOM 0 HB3 ALA A 83 6.614 7.194 -2.042 1.00 0.41 H new ATOM 1229 N GLN A 84 4.219 9.571 -4.058 1.00 0.25 N ATOM 1230 CA GLN A 84 4.430 10.807 -4.795 1.00 0.26 C ATOM 1231 C GLN A 84 4.953 11.874 -3.839 1.00 0.25 C ATOM 1232 O GLN A 84 6.056 11.748 -3.321 1.00 0.28 O ATOM 1233 CB GLN A 84 3.135 11.254 -5.487 1.00 0.33 C ATOM 1234 CG GLN A 84 3.351 11.926 -6.838 1.00 0.77 C ATOM 1235 CD GLN A 84 4.161 13.206 -6.753 1.00 1.32 C ATOM 1236 OE1 GLN A 84 5.389 13.191 -6.854 1.00 2.05 O ATOM 1237 NE2 GLN A 84 3.477 14.319 -6.563 1.00 2.02 N ATOM 0 H GLN A 84 3.273 9.457 -3.693 1.00 0.25 H new ATOM 0 HA GLN A 84 5.171 10.645 -5.578 1.00 0.26 H new ATOM 0 HB2 GLN A 84 2.491 10.386 -5.624 1.00 0.33 H new ATOM 0 HB3 GLN A 84 2.605 11.944 -4.831 1.00 0.33 H new ATOM 0 HG2 GLN A 84 3.857 11.228 -7.505 1.00 0.77 H new ATOM 0 HG3 GLN A 84 2.381 12.148 -7.284 1.00 0.77 H new ATOM 0 HE21 GLN A 84 2.461 14.286 -6.485 1.00 2.02 H new ATOM 0 HE22 GLN A 84 3.965 15.212 -6.494 1.00 2.02 H new ATOM 1246 N ASP A 85 4.196 12.937 -3.623 1.00 0.24 N ATOM 1247 CA ASP A 85 4.602 13.931 -2.634 1.00 0.28 C ATOM 1248 C ASP A 85 3.400 14.531 -1.920 1.00 0.26 C ATOM 1249 O ASP A 85 2.686 15.363 -2.482 1.00 0.27 O ATOM 1250 CB ASP A 85 5.419 15.029 -3.313 1.00 0.34 C ATOM 1251 CG ASP A 85 6.000 16.020 -2.331 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.843 15.616 -1.505 1.00 0.53 O ATOM 1253 OD2 ASP A 85 5.594 17.201 -2.366 1.00 0.56 O ATOM 0 H ASP A 85 3.318 13.135 -4.103 1.00 0.24 H new ATOM 0 HA ASP A 85 5.216 13.434 -1.883 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.228 14.573 -3.884 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.786 15.559 -4.025 1.00 0.34 H new ATOM 1258 N GLU A 86 3.201 14.097 -0.672 1.00 0.27 N ATOM 1259 CA GLU A 86 2.107 14.566 0.172 1.00 0.29 C ATOM 1260 C GLU A 86 0.795 14.528 -0.619 1.00 0.22 C ATOM 1261 O GLU A 86 0.562 13.538 -1.287 1.00 0.19 O ATOM 1262 CB GLU A 86 2.443 15.918 0.806 1.00 0.40 C ATOM 1263 CG GLU A 86 1.389 16.433 1.786 1.00 0.51 C ATOM 1264 CD GLU A 86 1.834 17.654 2.565 1.00 0.78 C ATOM 1265 OE1 GLU A 86 1.857 18.756 1.978 1.00 1.62 O ATOM 1266 OE2 GLU A 86 2.173 17.516 3.758 1.00 1.04 O ATOM 0 H GLU A 86 3.800 13.406 -0.220 1.00 0.27 H new ATOM 0 HA GLU A 86 1.966 13.896 1.020 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.397 15.835 1.327 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.576 16.655 0.014 1.00 0.40 H new ATOM 0 HG2 GLU A 86 0.480 16.674 1.236 1.00 0.51 H new ATOM 0 HG3 GLU A 86 1.136 15.637 2.486 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.027 15.584 -0.601 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.333 15.535 -1.261 1.00 0.20 C ATOM 1275 C ASP A 87 -1.175 15.509 -2.773 1.00 0.23 C ATOM 1276 O ASP A 87 -1.324 16.515 -3.466 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.221 16.710 -0.844 1.00 0.28 C ATOM 1278 CG ASP A 87 -3.653 16.556 -1.341 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.477 15.946 -0.628 1.00 0.56 O ATOM 1280 OD2 ASP A 87 -3.968 17.040 -2.449 1.00 0.61 O ATOM 0 H ASP A 87 0.186 16.470 -0.143 1.00 0.22 H new ATOM 0 HA ASP A 87 -1.821 14.614 -0.942 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.223 16.794 0.243 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -1.801 17.637 -1.234 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.829 14.332 -3.241 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.812 13.965 -4.640 1.00 0.24 C ATOM 1287 C GLN A 88 -0.965 12.465 -4.667 1.00 0.21 C ATOM 1288 O GLN A 88 -0.189 11.767 -4.015 1.00 0.19 O ATOM 1289 CB GLN A 88 0.491 14.389 -5.329 1.00 0.32 C ATOM 1290 CG GLN A 88 0.540 15.860 -5.718 1.00 1.03 C ATOM 1291 CD GLN A 88 -0.443 16.215 -6.821 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -1.497 15.595 -6.968 1.00 1.89 O ATOM 1293 NE2 GLN A 88 -0.107 17.224 -7.604 1.00 1.93 N ATOM 0 H GLN A 88 -0.538 13.569 -2.630 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.611 14.469 -5.183 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.328 14.172 -4.665 1.00 0.32 H new ATOM 0 HB3 GLN A 88 0.630 13.783 -6.224 1.00 0.32 H new ATOM 0 HG2 GLN A 88 0.328 16.470 -4.840 1.00 1.03 H new ATOM 0 HG3 GLN A 88 1.549 16.111 -6.044 1.00 1.03 H new ATOM 0 HE21 GLN A 88 0.774 17.715 -7.453 1.00 1.93 H new ATOM 0 HE22 GLN A 88 -0.729 17.512 -8.360 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.951 11.939 -5.394 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.349 10.545 -5.235 1.00 0.24 C ATOM 1304 C PRO A 89 -1.213 9.585 -5.532 1.00 0.21 C ATOM 1305 O PRO A 89 -0.344 9.862 -6.360 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.478 10.370 -6.260 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.947 11.753 -6.565 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.746 12.638 -6.413 1.00 0.33 C ATOM 0 HA PRO A 89 -2.651 10.325 -4.211 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -3.120 9.869 -7.159 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.286 9.760 -5.856 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -4.352 11.814 -7.575 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.743 12.054 -5.884 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -2.200 12.742 -7.350 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -3.022 13.642 -6.091 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.229 8.464 -4.829 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.249 7.417 -5.032 1.00 0.24 C ATOM 1318 C VAL A 90 -0.382 6.879 -6.453 1.00 0.24 C ATOM 1319 O VAL A 90 -1.488 6.591 -6.918 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.416 6.287 -3.982 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -0.389 6.875 -2.582 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -1.700 5.498 -4.199 1.00 1.10 C ATOM 0 H VAL A 90 -1.919 8.258 -4.106 1.00 0.23 H new ATOM 0 HA VAL A 90 0.752 7.828 -4.900 1.00 0.24 H new ATOM 0 HB VAL A 90 0.417 5.594 -4.101 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.507 6.076 -1.850 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.563 7.380 -2.418 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -1.204 7.591 -2.472 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -1.779 4.717 -3.443 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -2.556 6.168 -4.119 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -1.685 5.044 -5.190 1.00 1.10 H new ATOM 1332 N LEU A 91 0.729 6.782 -7.168 1.00 0.22 N ATOM 1333 CA LEU A 91 0.669 6.525 -8.585 1.00 0.24 C ATOM 1334 C LEU A 91 0.900 5.051 -8.785 1.00 0.26 C ATOM 1335 O LEU A 91 1.632 4.429 -8.009 1.00 0.33 O ATOM 1336 CB LEU A 91 1.691 7.376 -9.349 1.00 0.30 C ATOM 1337 CG LEU A 91 1.645 8.878 -9.037 1.00 0.31 C ATOM 1338 CD1 LEU A 91 2.775 9.602 -9.750 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.301 9.465 -9.446 1.00 0.34 C ATOM 0 H LEU A 91 1.671 6.877 -6.788 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.306 6.804 -8.984 1.00 0.24 H new ATOM 0 HB2 LEU A 91 2.691 7.004 -9.126 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.531 7.237 -10.418 1.00 0.30 H new ATOM 0 HG LEU A 91 1.770 9.011 -7.962 1.00 0.31 H new ATOM 0 HD11 LEU A 91 2.729 10.666 -9.519 1.00 0.42 H new ATOM 0 HD12 LEU A 91 3.732 9.200 -9.417 1.00 0.42 H new ATOM 0 HD13 LEU A 91 2.676 9.460 -10.826 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.285 10.531 -9.218 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.151 9.321 -10.516 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.497 8.964 -8.897 1.00 0.34 H new ATOM 1351 N LEU A 92 0.277 4.454 -9.770 1.00 0.27 N ATOM 1352 CA LEU A 92 0.318 3.021 -9.837 1.00 0.28 C ATOM 1353 C LEU A 92 1.497 2.646 -10.698 1.00 0.29 C ATOM 1354 O LEU A 92 1.456 2.656 -11.929 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.990 2.481 -10.423 1.00 0.32 C ATOM 1356 CG LEU A 92 -2.261 2.863 -9.658 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -3.473 2.197 -10.285 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -2.146 2.484 -8.187 1.00 1.30 C ATOM 0 H LEU A 92 -0.246 4.920 -10.511 1.00 0.27 H new ATOM 0 HA LEU A 92 0.428 2.586 -8.844 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -1.083 2.838 -11.449 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.926 1.394 -10.468 1.00 0.32 H new ATOM 0 HG LEU A 92 -2.385 3.944 -9.720 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -4.369 2.477 -9.731 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.571 2.521 -11.321 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -3.350 1.114 -10.253 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -3.061 2.766 -7.666 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.995 1.408 -8.099 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -1.299 3.007 -7.742 1.00 1.30 H new ATOM 1370 N LYS A 93 2.564 2.336 -9.978 1.00 0.31 N ATOM 1371 CA LYS A 93 3.880 2.195 -10.519 1.00 0.37 C ATOM 1372 C LYS A 93 4.131 0.728 -10.783 1.00 0.38 C ATOM 1373 O LYS A 93 4.198 -0.058 -9.847 1.00 0.39 O ATOM 1374 CB LYS A 93 4.832 2.753 -9.460 1.00 0.46 C ATOM 1375 CG LYS A 93 6.160 3.255 -9.954 1.00 1.29 C ATOM 1376 CD LYS A 93 6.009 4.402 -10.940 1.00 2.11 C ATOM 1377 CE LYS A 93 7.333 5.118 -11.165 1.00 2.85 C ATOM 1378 NZ LYS A 93 8.374 4.218 -11.729 1.00 3.26 N ATOM 0 H LYS A 93 2.522 2.173 -8.972 1.00 0.31 H new ATOM 0 HA LYS A 93 4.018 2.727 -11.460 1.00 0.37 H new ATOM 0 HB2 LYS A 93 4.328 3.570 -8.944 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.015 1.974 -8.720 1.00 0.46 H new ATOM 0 HG2 LYS A 93 6.761 3.584 -9.106 1.00 1.29 H new ATOM 0 HG3 LYS A 93 6.701 2.438 -10.430 1.00 1.29 H new ATOM 0 HD2 LYS A 93 5.634 4.021 -11.890 1.00 2.11 H new ATOM 0 HD3 LYS A 93 5.269 5.110 -10.566 1.00 2.11 H new ATOM 0 HE2 LYS A 93 7.178 5.959 -11.841 1.00 2.85 H new ATOM 0 HE3 LYS A 93 7.686 5.530 -10.219 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 9.224 4.772 -11.959 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 8.616 3.487 -11.030 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 8.011 3.766 -12.592 1.00 3.26 H new ATOM 1392 N GLU A 94 4.291 0.332 -12.024 1.00 0.43 N ATOM 1393 CA GLU A 94 4.333 -1.078 -12.299 1.00 0.47 C ATOM 1394 C GLU A 94 5.764 -1.585 -12.342 1.00 0.52 C ATOM 1395 O GLU A 94 6.482 -1.487 -13.339 1.00 0.62 O ATOM 1396 CB GLU A 94 3.573 -1.372 -13.590 1.00 0.56 C ATOM 1397 CG GLU A 94 4.141 -0.726 -14.841 1.00 1.38 C ATOM 1398 CD GLU A 94 3.393 -1.154 -16.084 1.00 1.76 C ATOM 1399 OE1 GLU A 94 2.279 -0.635 -16.325 1.00 2.05 O ATOM 1400 OE2 GLU A 94 3.914 -1.999 -16.836 1.00 2.33 O ATOM 0 H GLU A 94 4.391 0.945 -12.833 1.00 0.43 H new ATOM 0 HA GLU A 94 3.841 -1.617 -11.490 1.00 0.47 H new ATOM 0 HB2 GLU A 94 3.547 -2.452 -13.739 1.00 0.56 H new ATOM 0 HB3 GLU A 94 2.541 -1.042 -13.468 1.00 0.56 H new ATOM 0 HG2 GLU A 94 4.093 0.359 -14.744 1.00 1.38 H new ATOM 0 HG3 GLU A 94 5.194 -0.991 -14.941 1.00 1.38 H new ATOM 1407 N MET A 95 6.165 -2.087 -11.188 1.00 0.50 N ATOM 1408 CA MET A 95 7.428 -2.773 -11.021 1.00 0.59 C ATOM 1409 C MET A 95 7.160 -4.234 -10.719 1.00 0.66 C ATOM 1410 O MET A 95 6.545 -4.567 -9.706 1.00 0.65 O ATOM 1411 CB MET A 95 8.247 -2.142 -9.899 1.00 0.60 C ATOM 1412 CG MET A 95 8.970 -0.870 -10.315 1.00 1.21 C ATOM 1413 SD MET A 95 10.111 -1.129 -11.688 1.00 1.67 S ATOM 1414 CE MET A 95 10.918 0.470 -11.758 1.00 2.39 C ATOM 0 H MET A 95 5.614 -2.028 -10.332 1.00 0.50 H new ATOM 0 HA MET A 95 8.005 -2.687 -11.942 1.00 0.59 H new ATOM 0 HB2 MET A 95 7.587 -1.918 -9.061 1.00 0.60 H new ATOM 0 HB3 MET A 95 8.979 -2.867 -9.543 1.00 0.60 H new ATOM 0 HG2 MET A 95 8.235 -0.116 -10.597 1.00 1.21 H new ATOM 0 HG3 MET A 95 9.520 -0.475 -9.461 1.00 1.21 H new ATOM 0 HE1 MET A 95 11.656 0.471 -12.561 1.00 2.39 H new ATOM 0 HE2 MET A 95 10.175 1.245 -11.948 1.00 2.39 H new ATOM 0 HE3 MET A 95 11.415 0.669 -10.808 1.00 2.39 H new ATOM 1424 N PRO A 96 7.608 -5.120 -11.603 1.00 0.82 N ATOM 1425 CA PRO A 96 7.281 -6.538 -11.525 1.00 0.95 C ATOM 1426 C PRO A 96 8.020 -7.289 -10.418 1.00 0.93 C ATOM 1427 O PRO A 96 9.243 -7.183 -10.280 1.00 0.98 O ATOM 1428 CB PRO A 96 7.680 -7.055 -12.905 1.00 1.19 C ATOM 1429 CG PRO A 96 8.781 -6.157 -13.342 1.00 1.26 C ATOM 1430 CD PRO A 96 8.473 -4.806 -12.758 1.00 0.99 C ATOM 0 HA PRO A 96 6.232 -6.693 -11.273 1.00 0.95 H new ATOM 0 HB2 PRO A 96 8.010 -8.093 -12.859 1.00 1.19 H new ATOM 0 HB3 PRO A 96 6.840 -7.019 -13.599 1.00 1.19 H new ATOM 0 HG2 PRO A 96 9.746 -6.523 -12.990 1.00 1.26 H new ATOM 0 HG3 PRO A 96 8.836 -6.108 -14.430 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.380 -4.285 -12.451 1.00 0.99 H new ATOM 0 HD3 PRO A 96 7.965 -4.164 -13.477 1.00 0.99 H new ATOM 1438 N GLU A 97 7.239 -8.043 -9.641 1.00 0.98 N ATOM 1439 CA GLU A 97 7.748 -8.963 -8.620 1.00 1.06 C ATOM 1440 C GLU A 97 8.314 -8.259 -7.388 1.00 0.90 C ATOM 1441 O GLU A 97 8.902 -7.182 -7.453 1.00 0.88 O ATOM 1442 CB GLU A 97 8.782 -9.914 -9.233 1.00 1.32 C ATOM 1443 CG GLU A 97 9.550 -10.763 -8.233 1.00 1.84 C ATOM 1444 CD GLU A 97 10.531 -11.695 -8.908 1.00 2.42 C ATOM 1445 OE1 GLU A 97 11.649 -11.252 -9.236 1.00 3.15 O ATOM 1446 OE2 GLU A 97 10.191 -12.877 -9.109 1.00 2.74 O ATOM 0 H GLU A 97 6.221 -8.032 -9.704 1.00 0.98 H new ATOM 0 HA GLU A 97 6.892 -9.537 -8.264 1.00 1.06 H new ATOM 0 HB2 GLU A 97 8.273 -10.576 -9.933 1.00 1.32 H new ATOM 0 HB3 GLU A 97 9.495 -9.326 -9.811 1.00 1.32 H new ATOM 0 HG2 GLU A 97 10.086 -10.112 -7.543 1.00 1.84 H new ATOM 0 HG3 GLU A 97 8.847 -11.347 -7.639 1.00 1.84 H new ATOM 1453 N ILE A 98 8.084 -8.912 -6.259 1.00 1.08 N ATOM 1454 CA ILE A 98 8.492 -8.429 -4.946 1.00 1.17 C ATOM 1455 C ILE A 98 10.003 -8.558 -4.738 1.00 1.10 C ATOM 1456 O ILE A 98 10.588 -9.618 -4.961 1.00 1.29 O ATOM 1457 CB ILE A 98 7.721 -9.157 -3.815 1.00 1.61 C ATOM 1458 CG1 ILE A 98 7.486 -10.644 -4.137 1.00 2.25 C ATOM 1459 CG2 ILE A 98 6.393 -8.466 -3.564 1.00 2.35 C ATOM 1460 CD1 ILE A 98 8.652 -11.549 -3.804 1.00 3.20 C ATOM 0 H ILE A 98 7.600 -9.809 -6.228 1.00 1.08 H new ATOM 0 HA ILE A 98 8.241 -7.369 -4.903 1.00 1.17 H new ATOM 0 HB ILE A 98 8.337 -9.109 -2.917 1.00 1.61 H new ATOM 0 HG12 ILE A 98 6.608 -10.987 -3.590 1.00 2.25 H new ATOM 0 HG13 ILE A 98 7.258 -10.741 -5.198 1.00 2.25 H new ATOM 0 HG21 ILE A 98 5.858 -8.984 -2.768 1.00 2.35 H new ATOM 0 HG22 ILE A 98 6.571 -7.432 -3.268 1.00 2.35 H new ATOM 0 HG23 ILE A 98 5.795 -8.485 -4.475 1.00 2.35 H new ATOM 0 HD11 ILE A 98 8.400 -12.577 -4.063 1.00 3.20 H new ATOM 0 HD12 ILE A 98 9.529 -11.236 -4.371 1.00 3.20 H new ATOM 0 HD13 ILE A 98 8.869 -11.486 -2.738 1.00 3.20 H new ATOM 1472 N PRO A 99 10.657 -7.460 -4.339 1.00 1.08 N ATOM 1473 CA PRO A 99 12.111 -7.414 -4.218 1.00 1.14 C ATOM 1474 C PRO A 99 12.659 -7.982 -2.902 1.00 1.08 C ATOM 1475 O PRO A 99 12.066 -7.835 -1.839 1.00 1.15 O ATOM 1476 CB PRO A 99 12.405 -5.919 -4.314 1.00 1.38 C ATOM 1477 CG PRO A 99 11.198 -5.251 -3.737 1.00 1.61 C ATOM 1478 CD PRO A 99 10.029 -6.172 -3.992 1.00 1.28 C ATOM 0 HA PRO A 99 12.588 -8.031 -4.979 1.00 1.14 H new ATOM 0 HB2 PRO A 99 13.305 -5.657 -3.758 1.00 1.38 H new ATOM 0 HB3 PRO A 99 12.569 -5.614 -5.348 1.00 1.38 H new ATOM 0 HG2 PRO A 99 11.326 -5.075 -2.669 1.00 1.61 H new ATOM 0 HG3 PRO A 99 11.034 -4.279 -4.203 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.393 -6.263 -3.111 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.400 -5.804 -4.803 1.00 1.28 H new ATOM 1486 N LYS A 100 13.819 -8.611 -3.018 1.00 1.10 N ATOM 1487 CA LYS A 100 14.622 -9.095 -1.889 1.00 1.07 C ATOM 1488 C LYS A 100 15.719 -8.073 -1.629 1.00 1.03 C ATOM 1489 O LYS A 100 16.455 -8.111 -0.638 1.00 0.99 O ATOM 1490 CB LYS A 100 15.230 -10.472 -2.191 1.00 1.15 C ATOM 1491 CG LYS A 100 16.094 -10.501 -3.441 1.00 1.99 C ATOM 1492 CD LYS A 100 16.720 -11.867 -3.660 1.00 2.34 C ATOM 1493 CE LYS A 100 17.545 -11.894 -4.936 1.00 3.09 C ATOM 1494 NZ LYS A 100 18.252 -13.189 -5.119 1.00 3.70 N ATOM 0 H LYS A 100 14.246 -8.808 -3.923 1.00 1.10 H new ATOM 0 HA LYS A 100 13.991 -9.211 -1.008 1.00 1.07 H new ATOM 0 HB2 LYS A 100 15.831 -10.788 -1.338 1.00 1.15 H new ATOM 0 HB3 LYS A 100 14.425 -11.198 -2.301 1.00 1.15 H new ATOM 0 HG2 LYS A 100 15.489 -10.235 -4.308 1.00 1.99 H new ATOM 0 HG3 LYS A 100 16.880 -9.750 -3.358 1.00 1.99 H new ATOM 0 HD2 LYS A 100 17.352 -12.121 -2.809 1.00 2.34 H new ATOM 0 HD3 LYS A 100 15.938 -12.624 -3.713 1.00 2.34 H new ATOM 0 HE2 LYS A 100 16.894 -11.713 -5.792 1.00 3.09 H new ATOM 0 HE3 LYS A 100 18.274 -11.084 -4.913 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 18.802 -13.163 -6.001 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 18.893 -13.351 -4.316 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 17.556 -13.960 -5.168 1.00 3.70 H new ATOM 1508 N THR A 101 15.824 -7.207 -2.610 1.00 1.10 N ATOM 1509 CA THR A 101 16.908 -6.288 -2.805 1.00 1.11 C ATOM 1510 C THR A 101 16.320 -4.927 -3.206 1.00 1.16 C ATOM 1511 O THR A 101 15.723 -4.820 -4.274 1.00 1.30 O ATOM 1512 CB THR A 101 17.823 -6.852 -3.914 1.00 1.30 C ATOM 1513 OG1 THR A 101 18.448 -8.059 -3.459 1.00 1.73 O ATOM 1514 CG2 THR A 101 18.887 -5.868 -4.358 1.00 1.92 C ATOM 0 H THR A 101 15.109 -7.125 -3.333 1.00 1.10 H new ATOM 0 HA THR A 101 17.496 -6.159 -1.897 1.00 1.11 H new ATOM 0 HB THR A 101 17.189 -7.052 -4.777 1.00 1.30 H new ATOM 0 HG1 THR A 101 19.026 -8.415 -4.166 1.00 1.73 H new ATOM 0 HG21 THR A 101 19.499 -6.321 -5.138 1.00 1.92 H new ATOM 0 HG22 THR A 101 18.411 -4.968 -4.747 1.00 1.92 H new ATOM 0 HG23 THR A 101 19.518 -5.607 -3.509 1.00 1.92 H new ATOM 1522 N ILE A 102 16.446 -3.894 -2.360 1.00 1.14 N ATOM 1523 CA ILE A 102 15.826 -2.609 -2.695 1.00 1.18 C ATOM 1524 C ILE A 102 16.863 -1.651 -3.221 1.00 1.22 C ATOM 1525 O ILE A 102 17.669 -1.143 -2.473 1.00 1.37 O ATOM 1526 CB ILE A 102 15.121 -1.937 -1.494 1.00 1.31 C ATOM 1527 CG1 ILE A 102 14.625 -0.539 -1.893 1.00 2.08 C ATOM 1528 CG2 ILE A 102 16.036 -1.862 -0.274 1.00 1.98 C ATOM 1529 CD1 ILE A 102 14.045 0.255 -0.747 1.00 2.69 C ATOM 0 H ILE A 102 16.951 -3.920 -1.474 1.00 1.14 H new ATOM 0 HA ILE A 102 15.072 -2.832 -3.450 1.00 1.18 H new ATOM 0 HB ILE A 102 14.264 -2.551 -1.216 1.00 1.31 H new ATOM 0 HG12 ILE A 102 15.454 0.020 -2.326 1.00 2.08 H new ATOM 0 HG13 ILE A 102 13.868 -0.641 -2.671 1.00 2.08 H new ATOM 0 HG21 ILE A 102 15.506 -1.384 0.550 1.00 1.98 H new ATOM 0 HG22 ILE A 102 16.332 -2.869 0.021 1.00 1.98 H new ATOM 0 HG23 ILE A 102 16.924 -1.280 -0.520 1.00 1.98 H new ATOM 0 HD11 ILE A 102 13.717 1.230 -1.109 1.00 2.69 H new ATOM 0 HD12 ILE A 102 13.194 -0.281 -0.327 1.00 2.69 H new ATOM 0 HD13 ILE A 102 14.804 0.390 0.023 1.00 2.69 H new ATOM 1541 N THR A 103 16.824 -1.347 -4.482 1.00 1.15 N ATOM 1542 CA THR A 103 17.870 -0.541 -5.041 1.00 1.20 C ATOM 1543 C THR A 103 17.276 0.678 -5.699 1.00 1.08 C ATOM 1544 O THR A 103 16.508 0.573 -6.642 1.00 1.05 O ATOM 1545 CB THR A 103 18.720 -1.346 -6.049 1.00 1.39 C ATOM 1546 OG1 THR A 103 19.377 -2.429 -5.377 1.00 1.58 O ATOM 1547 CG2 THR A 103 19.760 -0.465 -6.731 1.00 1.57 C ATOM 0 H THR A 103 16.095 -1.637 -5.134 1.00 1.15 H new ATOM 0 HA THR A 103 18.531 -0.224 -4.234 1.00 1.20 H new ATOM 0 HB THR A 103 18.049 -1.737 -6.814 1.00 1.39 H new ATOM 0 HG1 THR A 103 19.913 -2.937 -6.021 1.00 1.58 H new ATOM 0 HG21 THR A 103 20.340 -1.064 -7.433 1.00 1.57 H new ATOM 0 HG22 THR A 103 19.259 0.340 -7.268 1.00 1.57 H new ATOM 0 HG23 THR A 103 20.426 -0.040 -5.980 1.00 1.57 H new ATOM 1555 N GLY A 104 17.749 1.822 -5.226 1.00 1.08 N ATOM 1556 CA GLY A 104 17.161 3.131 -5.523 1.00 1.03 C ATOM 1557 C GLY A 104 15.669 3.148 -5.874 1.00 0.92 C ATOM 1558 O GLY A 104 14.854 3.491 -5.025 1.00 0.84 O ATOM 0 H GLY A 104 18.564 1.873 -4.615 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.315 3.778 -4.659 1.00 1.03 H new ATOM 0 HA3 GLY A 104 17.712 3.572 -6.354 1.00 1.03 H new ATOM 1562 N SER A 105 15.313 2.793 -7.102 1.00 0.96 N ATOM 1563 CA SER A 105 13.997 3.100 -7.672 1.00 0.92 C ATOM 1564 C SER A 105 12.805 2.406 -6.987 1.00 0.81 C ATOM 1565 O SER A 105 11.680 2.890 -7.098 1.00 0.77 O ATOM 1566 CB SER A 105 14.010 2.769 -9.166 1.00 1.05 C ATOM 1567 OG SER A 105 14.696 1.548 -9.420 1.00 1.47 O ATOM 0 H SER A 105 15.927 2.282 -7.737 1.00 0.96 H new ATOM 0 HA SER A 105 13.837 4.164 -7.499 1.00 0.92 H new ATOM 0 HB2 SER A 105 12.986 2.697 -9.533 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.489 3.579 -9.716 1.00 1.05 H new ATOM 0 HG SER A 105 14.529 0.920 -8.686 1.00 1.47 H new ATOM 1573 N GLU A 106 13.028 1.316 -6.259 1.00 0.79 N ATOM 1574 CA GLU A 106 11.918 0.559 -5.663 1.00 0.72 C ATOM 1575 C GLU A 106 11.407 1.251 -4.399 1.00 0.56 C ATOM 1576 O GLU A 106 10.517 0.751 -3.711 1.00 0.51 O ATOM 1577 CB GLU A 106 12.337 -0.878 -5.319 1.00 0.82 C ATOM 1578 CG GLU A 106 12.710 -1.732 -6.522 1.00 1.28 C ATOM 1579 CD GLU A 106 14.087 -1.418 -7.067 1.00 1.74 C ATOM 1580 OE1 GLU A 106 15.077 -1.946 -6.520 1.00 2.39 O ATOM 1581 OE2 GLU A 106 14.187 -0.638 -8.039 1.00 2.11 O ATOM 0 H GLU A 106 13.954 0.936 -6.066 1.00 0.79 H new ATOM 0 HA GLU A 106 11.120 0.522 -6.405 1.00 0.72 H new ATOM 0 HB2 GLU A 106 13.187 -0.842 -4.638 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.520 -1.363 -4.784 1.00 0.82 H new ATOM 0 HG2 GLU A 106 12.668 -2.784 -6.241 1.00 1.28 H new ATOM 0 HG3 GLU A 106 11.971 -1.583 -7.309 1.00 1.28 H new ATOM 1588 N THR A 107 11.965 2.420 -4.127 1.00 0.55 N ATOM 1589 CA THR A 107 11.711 3.163 -2.915 1.00 0.49 C ATOM 1590 C THR A 107 10.286 3.705 -2.878 1.00 0.37 C ATOM 1591 O THR A 107 9.831 4.196 -1.843 1.00 0.38 O ATOM 1592 CB THR A 107 12.711 4.336 -2.765 1.00 0.62 C ATOM 1593 OG1 THR A 107 12.503 5.007 -1.521 1.00 1.41 O ATOM 1594 CG2 THR A 107 12.564 5.335 -3.905 1.00 1.27 C ATOM 0 H THR A 107 12.619 2.883 -4.758 1.00 0.55 H new ATOM 0 HA THR A 107 11.842 2.470 -2.084 1.00 0.49 H new ATOM 0 HB THR A 107 13.717 3.919 -2.794 1.00 0.62 H new ATOM 0 HG1 THR A 107 11.544 5.034 -1.320 1.00 1.41 H new ATOM 0 HG21 THR A 107 13.279 6.147 -3.772 1.00 1.27 H new ATOM 0 HG22 THR A 107 12.756 4.835 -4.854 1.00 1.27 H new ATOM 0 HG23 THR A 107 11.552 5.740 -3.906 1.00 1.27 H new ATOM 1602 N ASN A 108 9.581 3.635 -4.007 1.00 0.34 N ATOM 1603 CA ASN A 108 8.219 4.104 -4.060 1.00 0.29 C ATOM 1604 C ASN A 108 7.347 3.196 -3.221 1.00 0.25 C ATOM 1605 O ASN A 108 6.411 3.640 -2.560 1.00 0.27 O ATOM 1606 CB ASN A 108 7.731 4.087 -5.506 1.00 0.40 C ATOM 1607 CG ASN A 108 8.740 4.662 -6.487 1.00 0.58 C ATOM 1608 OD1 ASN A 108 8.830 4.213 -7.628 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.485 5.673 -6.060 1.00 1.22 N ATOM 0 H ASN A 108 9.938 3.259 -4.885 1.00 0.34 H new ATOM 0 HA ASN A 108 8.166 5.122 -3.673 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.500 3.061 -5.792 1.00 0.40 H new ATOM 0 HB3 ASN A 108 6.803 4.654 -5.576 1.00 0.40 H new ATOM 0 HD21 ASN A 108 10.163 6.107 -6.686 1.00 1.22 H new ATOM 0 HD22 ASN A 108 9.380 6.016 -5.105 1.00 1.22 H new ATOM 1616 N LEU A 109 7.713 1.922 -3.230 1.00 0.25 N ATOM 1617 CA LEU A 109 6.944 0.889 -2.572 1.00 0.26 C ATOM 1618 C LEU A 109 7.384 0.647 -1.125 1.00 0.21 C ATOM 1619 O LEU A 109 7.350 -0.491 -0.651 1.00 0.23 O ATOM 1620 CB LEU A 109 7.106 -0.400 -3.377 1.00 0.41 C ATOM 1621 CG LEU A 109 6.214 -1.560 -2.962 1.00 0.54 C ATOM 1622 CD1 LEU A 109 4.764 -1.197 -3.181 1.00 0.83 C ATOM 1623 CD2 LEU A 109 6.581 -2.798 -3.757 1.00 0.95 C ATOM 0 H LEU A 109 8.554 1.581 -3.696 1.00 0.25 H new ATOM 0 HA LEU A 109 5.904 1.212 -2.530 1.00 0.26 H new ATOM 0 HB2 LEU A 109 6.914 -0.177 -4.426 1.00 0.41 H new ATOM 0 HB3 LEU A 109 8.145 -0.722 -3.305 1.00 0.41 H new ATOM 0 HG LEU A 109 6.362 -1.770 -1.903 1.00 0.54 H new ATOM 0 HD11 LEU A 109 4.131 -2.032 -2.882 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.514 -0.320 -2.584 1.00 0.83 H new ATOM 0 HD13 LEU A 109 4.599 -0.977 -4.236 1.00 0.83 H new ATOM 0 HD21 LEU A 109 5.940 -3.627 -3.457 1.00 0.95 H new ATOM 0 HD22 LEU A 109 6.445 -2.601 -4.820 1.00 0.95 H new ATOM 0 HD23 LEU A 109 7.622 -3.058 -3.566 1.00 0.95 H new ATOM 1635 N LEU A 110 7.761 1.689 -0.400 1.00 0.20 N ATOM 1636 CA LEU A 110 8.098 1.509 0.988 1.00 0.21 C ATOM 1637 C LEU A 110 6.937 1.954 1.862 1.00 0.23 C ATOM 1638 O LEU A 110 6.344 3.007 1.620 1.00 0.31 O ATOM 1639 CB LEU A 110 9.361 2.306 1.303 1.00 0.28 C ATOM 1640 CG LEU A 110 10.557 1.984 0.404 1.00 0.81 C ATOM 1641 CD1 LEU A 110 11.771 2.798 0.809 1.00 1.71 C ATOM 1642 CD2 LEU A 110 10.874 0.499 0.449 1.00 1.64 C ATOM 0 H LEU A 110 7.838 2.645 -0.747 1.00 0.20 H new ATOM 0 HA LEU A 110 8.289 0.456 1.193 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.135 3.369 1.218 1.00 0.28 H new ATOM 0 HB3 LEU A 110 9.642 2.122 2.340 1.00 0.28 H new ATOM 0 HG LEU A 110 10.293 2.251 -0.619 1.00 0.81 H new ATOM 0 HD11 LEU A 110 12.608 2.552 0.156 1.00 1.71 H new ATOM 0 HD12 LEU A 110 11.542 3.860 0.722 1.00 1.71 H new ATOM 0 HD13 LEU A 110 12.036 2.568 1.841 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.727 0.289 -0.196 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.113 0.209 1.472 1.00 1.64 H new ATOM 0 HD23 LEU A 110 10.010 -0.068 0.103 1.00 1.64 H new ATOM 1654 N PHE A 111 6.646 1.186 2.906 1.00 0.22 N ATOM 1655 CA PHE A 111 5.469 1.456 3.728 1.00 0.25 C ATOM 1656 C PHE A 111 5.713 1.248 5.216 1.00 0.23 C ATOM 1657 O PHE A 111 6.155 0.187 5.646 1.00 0.27 O ATOM 1658 CB PHE A 111 4.290 0.596 3.277 1.00 0.42 C ATOM 1659 CG PHE A 111 3.894 0.851 1.860 1.00 0.91 C ATOM 1660 CD1 PHE A 111 3.308 2.046 1.502 1.00 1.64 C ATOM 1661 CD2 PHE A 111 4.084 -0.115 0.891 1.00 1.18 C ATOM 1662 CE1 PHE A 111 2.916 2.275 0.207 1.00 2.38 C ATOM 1663 CE2 PHE A 111 3.694 0.111 -0.410 1.00 1.90 C ATOM 1664 CZ PHE A 111 3.212 1.337 -0.774 1.00 2.46 C ATOM 0 H PHE A 111 7.199 0.382 3.202 1.00 0.22 H new ATOM 0 HA PHE A 111 5.237 2.511 3.585 1.00 0.25 H new ATOM 0 HB2 PHE A 111 4.549 -0.456 3.393 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.437 0.788 3.928 1.00 0.42 H new ATOM 0 HD1 PHE A 111 3.156 2.811 2.249 1.00 1.64 H new ATOM 0 HD2 PHE A 111 4.543 -1.056 1.156 1.00 1.18 H new ATOM 0 HE1 PHE A 111 2.381 3.178 -0.048 1.00 2.38 H new ATOM 0 HE2 PHE A 111 3.769 -0.680 -1.142 1.00 1.90 H new ATOM 0 HZ PHE A 111 3.062 1.575 -1.817 1.00 2.46 H new ATOM 1674 N PHE A 112 5.408 2.284 5.985 1.00 0.21 N ATOM 1675 CA PHE A 112 5.466 2.233 7.442 1.00 0.25 C ATOM 1676 C PHE A 112 4.178 1.606 7.920 1.00 0.25 C ATOM 1677 O PHE A 112 3.130 2.251 7.905 1.00 0.26 O ATOM 1678 CB PHE A 112 5.557 3.633 8.081 1.00 0.30 C ATOM 1679 CG PHE A 112 6.930 4.236 8.225 1.00 0.57 C ATOM 1680 CD1 PHE A 112 7.890 3.618 9.011 1.00 0.79 C ATOM 1681 CD2 PHE A 112 7.282 5.377 7.532 1.00 0.95 C ATOM 1682 CE1 PHE A 112 9.166 4.136 9.113 1.00 1.21 C ATOM 1683 CE2 PHE A 112 8.561 5.896 7.625 1.00 1.43 C ATOM 1684 CZ PHE A 112 9.424 5.420 8.568 1.00 1.50 C ATOM 0 H PHE A 112 5.112 3.188 5.616 1.00 0.21 H new ATOM 0 HA PHE A 112 6.355 1.670 7.727 1.00 0.25 H new ATOM 0 HB2 PHE A 112 4.949 4.316 7.487 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.105 3.582 9.071 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.636 2.718 9.552 1.00 0.79 H new ATOM 0 HD2 PHE A 112 6.550 5.870 6.910 1.00 0.95 H new ATOM 0 HE1 PHE A 112 9.951 3.575 9.598 1.00 1.21 H new ATOM 0 HE2 PHE A 112 8.876 6.678 6.951 1.00 1.43 H new ATOM 0 HZ PHE A 112 10.276 6.001 8.889 1.00 1.50 H new ATOM 1694 N TRP A 113 4.252 0.364 8.342 1.00 0.31 N ATOM 1695 CA TRP A 113 3.054 -0.402 8.623 1.00 0.35 C ATOM 1696 C TRP A 113 2.677 -0.233 10.092 1.00 0.33 C ATOM 1697 O TRP A 113 3.281 -0.824 10.993 1.00 0.37 O ATOM 1698 CB TRP A 113 3.378 -1.867 8.289 1.00 0.48 C ATOM 1699 CG TRP A 113 2.271 -2.860 8.472 1.00 1.08 C ATOM 1700 CD1 TRP A 113 1.170 -3.017 7.688 1.00 2.30 C ATOM 1701 CD2 TRP A 113 2.202 -3.878 9.477 1.00 1.17 C ATOM 1702 NE1 TRP A 113 0.409 -4.062 8.152 1.00 3.02 N ATOM 1703 CE2 TRP A 113 1.019 -4.604 9.254 1.00 2.29 C ATOM 1704 CE3 TRP A 113 3.022 -4.240 10.551 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 0.638 -5.672 10.061 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 2.642 -5.299 11.352 1.00 1.47 C ATOM 1707 CH2 TRP A 113 1.459 -6.004 11.103 1.00 2.02 C ATOM 0 H TRP A 113 5.126 -0.138 8.499 1.00 0.31 H new ATOM 0 HA TRP A 113 2.204 -0.064 8.030 1.00 0.35 H new ATOM 0 HB2 TRP A 113 3.709 -1.914 7.252 1.00 0.48 H new ATOM 0 HB3 TRP A 113 4.220 -2.179 8.907 1.00 0.48 H new ATOM 0 HD1 TRP A 113 0.930 -2.410 6.828 1.00 2.30 H new ATOM 0 HE1 TRP A 113 -0.468 -4.383 7.743 1.00 3.02 H new ATOM 0 HE3 TRP A 113 3.936 -3.701 10.750 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 -0.274 -6.219 9.871 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 3.268 -5.588 12.184 1.00 1.47 H new ATOM 0 HH2 TRP A 113 1.189 -6.828 11.747 1.00 2.02 H new ATOM 1718 N GLU A 114 1.670 0.606 10.301 1.00 0.32 N ATOM 1719 CA GLU A 114 1.195 0.964 11.629 1.00 0.37 C ATOM 1720 C GLU A 114 -0.169 0.345 11.899 1.00 0.39 C ATOM 1721 O GLU A 114 -1.169 0.792 11.342 1.00 0.42 O ATOM 1722 CB GLU A 114 1.124 2.486 11.757 1.00 0.43 C ATOM 1723 CG GLU A 114 0.976 2.974 13.186 1.00 0.96 C ATOM 1724 CD GLU A 114 2.147 2.569 14.051 1.00 1.50 C ATOM 1725 OE1 GLU A 114 3.293 2.925 13.713 1.00 1.90 O ATOM 1726 OE2 GLU A 114 1.923 1.909 15.083 1.00 2.32 O ATOM 0 H GLU A 114 1.156 1.060 9.546 1.00 0.32 H new ATOM 0 HA GLU A 114 1.895 0.575 12.369 1.00 0.37 H new ATOM 0 HB2 GLU A 114 2.026 2.920 11.326 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.282 2.852 11.169 1.00 0.43 H new ATOM 0 HG2 GLU A 114 0.882 4.060 13.190 1.00 0.96 H new ATOM 0 HG3 GLU A 114 0.056 2.573 13.612 1.00 0.96 H new ATOM 1733 N THR A 115 -0.236 -0.643 12.768 1.00 0.47 N ATOM 1734 CA THR A 115 -1.498 -1.319 13.005 1.00 0.49 C ATOM 1735 C THR A 115 -2.170 -0.765 14.251 1.00 0.52 C ATOM 1736 O THR A 115 -1.606 -0.806 15.347 1.00 0.64 O ATOM 1737 CB THR A 115 -1.277 -2.831 13.167 1.00 0.67 C ATOM 1738 OG1 THR A 115 -0.419 -3.291 12.117 1.00 1.38 O ATOM 1739 CG2 THR A 115 -2.597 -3.590 13.119 1.00 1.39 C ATOM 0 H THR A 115 0.552 -0.992 13.314 1.00 0.47 H new ATOM 0 HA THR A 115 -2.144 -1.145 12.144 1.00 0.49 H new ATOM 0 HB THR A 115 -0.818 -3.015 14.138 1.00 0.67 H new ATOM 0 HG1 THR A 115 -0.659 -4.210 11.877 1.00 1.38 H new ATOM 0 HG21 THR A 115 -2.408 -4.657 13.236 1.00 1.39 H new ATOM 0 HG22 THR A 115 -3.244 -3.246 13.925 1.00 1.39 H new ATOM 0 HG23 THR A 115 -3.085 -3.411 12.161 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.366 -0.220 14.072 1.00 0.47 N ATOM 1748 CA HIS A 116 -4.117 0.351 15.176 1.00 0.56 C ATOM 1749 C HIS A 116 -5.569 -0.113 15.125 1.00 0.56 C ATOM 1750 O HIS A 116 -6.388 0.464 14.409 1.00 0.55 O ATOM 1751 CB HIS A 116 -4.027 1.882 15.111 1.00 0.66 C ATOM 1752 CG HIS A 116 -4.617 2.592 16.289 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -4.060 2.555 17.548 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -5.705 3.388 16.387 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -4.778 3.302 18.365 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -5.783 3.822 17.686 1.00 2.89 N ATOM 0 H HIS A 116 -3.836 -0.163 13.169 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.692 0.012 16.121 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -2.979 2.168 15.019 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.531 2.224 14.207 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -6.388 3.637 15.588 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -4.577 3.461 19.414 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -6.498 4.443 18.064 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.882 -1.140 15.901 1.00 0.64 N ATOM 1766 CA GLY A 117 -7.237 -1.651 15.962 1.00 0.71 C ATOM 1767 C GLY A 117 -7.627 -2.454 14.733 1.00 0.69 C ATOM 1768 O GLY A 117 -7.199 -3.598 14.567 1.00 0.74 O ATOM 0 H GLY A 117 -5.215 -1.633 16.495 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -7.343 -2.278 16.847 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.929 -0.817 16.078 1.00 0.71 H new ATOM 1772 N THR A 118 -8.442 -1.851 13.878 1.00 0.66 N ATOM 1773 CA THR A 118 -8.939 -2.520 12.682 1.00 0.69 C ATOM 1774 C THR A 118 -8.236 -2.007 11.426 1.00 0.56 C ATOM 1775 O THR A 118 -7.737 -2.787 10.613 1.00 0.57 O ATOM 1776 CB THR A 118 -10.458 -2.313 12.540 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.779 -0.918 12.668 1.00 1.60 O ATOM 1778 CG2 THR A 118 -11.216 -3.103 13.596 1.00 1.39 C ATOM 0 H THR A 118 -8.775 -0.894 13.991 1.00 0.66 H new ATOM 0 HA THR A 118 -8.727 -3.584 12.789 1.00 0.69 H new ATOM 0 HB THR A 118 -10.756 -2.670 11.554 1.00 0.81 H new ATOM 0 HG1 THR A 118 -11.747 -0.795 12.575 1.00 1.60 H new ATOM 0 HG21 THR A 118 -12.287 -2.940 13.474 1.00 1.39 H new ATOM 0 HG22 THR A 118 -10.996 -4.165 13.484 1.00 1.39 H new ATOM 0 HG23 THR A 118 -10.909 -2.772 14.588 1.00 1.39 H new ATOM 1786 N LYS A 119 -8.207 -0.689 11.280 1.00 0.50 N ATOM 1787 CA LYS A 119 -7.507 -0.045 10.181 1.00 0.41 C ATOM 1788 C LYS A 119 -6.005 0.027 10.509 1.00 0.35 C ATOM 1789 O LYS A 119 -5.583 -0.222 11.641 1.00 0.40 O ATOM 1790 CB LYS A 119 -8.102 1.348 9.910 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.902 2.384 11.006 1.00 0.98 C ATOM 1792 CD LYS A 119 -6.618 3.168 10.798 1.00 1.36 C ATOM 1793 CE LYS A 119 -6.639 4.483 11.550 1.00 1.79 C ATOM 1794 NZ LYS A 119 -7.610 5.453 10.974 1.00 2.49 N ATOM 0 H LYS A 119 -8.667 -0.040 11.918 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.631 -0.630 9.270 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.666 1.734 8.989 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -9.172 1.236 9.734 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -8.750 3.069 11.021 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -7.875 1.889 11.977 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -5.769 2.571 11.131 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -6.476 3.359 9.734 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -6.892 4.297 12.594 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -5.641 4.921 11.537 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -7.372 6.414 11.294 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -7.566 5.413 9.936 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -8.571 5.211 11.290 1.00 2.49 H new ATOM 1808 N ASN A 120 -5.226 0.372 9.514 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.776 0.330 9.568 1.00 0.28 C ATOM 1810 C ASN A 120 -3.236 1.381 8.593 1.00 0.28 C ATOM 1811 O ASN A 120 -3.886 1.678 7.593 1.00 0.32 O ATOM 1812 CB ASN A 120 -3.354 -1.095 9.175 1.00 0.36 C ATOM 1813 CG ASN A 120 -1.867 -1.393 9.234 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -1.017 -0.552 8.982 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -1.547 -2.630 9.570 1.00 2.07 N ATOM 0 H ASN A 120 -5.587 0.699 8.618 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.380 0.556 10.558 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -3.871 -1.798 9.829 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -3.702 -1.288 8.160 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -0.567 -2.906 9.625 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -2.280 -3.309 9.774 1.00 2.07 H new ATOM 1822 N TYR A 121 -2.073 1.944 8.889 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.520 3.046 8.097 1.00 0.37 C ATOM 1824 C TYR A 121 -0.344 2.567 7.246 1.00 0.30 C ATOM 1825 O TYR A 121 0.258 1.537 7.552 1.00 0.34 O ATOM 1826 CB TYR A 121 -0.989 4.150 9.019 1.00 0.66 C ATOM 1827 CG TYR A 121 -1.935 4.635 10.099 1.00 1.06 C ATOM 1828 CD1 TYR A 121 -1.979 4.010 11.339 1.00 1.46 C ATOM 1829 CD2 TYR A 121 -2.745 5.745 9.897 1.00 1.41 C ATOM 1830 CE1 TYR A 121 -2.808 4.468 12.342 1.00 1.98 C ATOM 1831 CE2 TYR A 121 -3.573 6.214 10.900 1.00 2.01 C ATOM 1832 CZ TYR A 121 -3.598 5.571 12.120 1.00 2.23 C ATOM 1833 OH TYR A 121 -4.420 6.034 13.123 1.00 2.84 O ATOM 0 H TYR A 121 -1.488 1.658 9.674 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.322 3.421 7.461 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -0.080 3.788 9.498 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -0.706 5.004 8.403 1.00 0.66 H new ATOM 0 HD1 TYR A 121 -1.352 3.149 11.521 1.00 1.46 H new ATOM 0 HD2 TYR A 121 -2.728 6.249 8.942 1.00 1.41 H new ATOM 0 HE1 TYR A 121 -2.836 3.963 13.296 1.00 1.98 H new ATOM 0 HE2 TYR A 121 -4.197 7.079 10.729 1.00 2.01 H new ATOM 0 HH TYR A 121 -4.911 6.821 12.806 1.00 2.84 H new ATOM 1843 N PHE A 122 0.006 3.318 6.193 1.00 0.30 N ATOM 1844 CA PHE A 122 1.273 3.103 5.521 1.00 0.29 C ATOM 1845 C PHE A 122 1.967 4.436 5.309 1.00 0.26 C ATOM 1846 O PHE A 122 1.665 5.144 4.362 1.00 0.32 O ATOM 1847 CB PHE A 122 1.096 2.424 4.164 1.00 0.34 C ATOM 1848 CG PHE A 122 0.415 1.086 4.207 1.00 1.05 C ATOM 1849 CD1 PHE A 122 1.078 -0.024 4.702 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.876 0.937 3.732 1.00 1.56 C ATOM 1851 CE1 PHE A 122 0.462 -1.259 4.728 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -1.495 -0.295 3.752 1.00 2.27 C ATOM 1853 CZ PHE A 122 -0.826 -1.396 4.251 1.00 2.54 C ATOM 0 H PHE A 122 -0.567 4.065 5.801 1.00 0.30 H new ATOM 0 HA PHE A 122 1.871 2.449 6.155 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.522 3.086 3.516 1.00 0.34 H new ATOM 0 HB3 PHE A 122 2.077 2.301 3.706 1.00 0.34 H new ATOM 0 HD1 PHE A 122 2.088 0.077 5.072 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -1.404 1.794 3.342 1.00 1.56 H new ATOM 0 HE1 PHE A 122 0.987 -2.117 5.121 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -2.503 -0.399 3.378 1.00 2.27 H new ATOM 0 HZ PHE A 122 -1.310 -2.362 4.268 1.00 2.54 H new ATOM 1863 N THR A 123 2.912 4.772 6.160 1.00 0.22 N ATOM 1864 CA THR A 123 3.649 6.006 5.997 1.00 0.22 C ATOM 1865 C THR A 123 4.845 5.706 5.118 1.00 0.20 C ATOM 1866 O THR A 123 5.416 4.642 5.230 1.00 0.19 O ATOM 1867 CB THR A 123 4.119 6.531 7.365 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.054 6.418 8.318 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.567 7.980 7.272 1.00 0.33 C ATOM 0 H THR A 123 3.187 4.212 6.967 1.00 0.22 H new ATOM 0 HA THR A 123 3.018 6.771 5.543 1.00 0.22 H new ATOM 0 HB THR A 123 4.969 5.929 7.687 1.00 0.24 H new ATOM 0 HG1 THR A 123 2.260 6.882 7.978 1.00 0.32 H new ATOM 0 HG21 THR A 123 4.894 8.324 8.254 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.393 8.061 6.566 1.00 0.33 H new ATOM 0 HG23 THR A 123 3.736 8.597 6.930 1.00 0.33 H new ATOM 1877 N SER A 124 5.211 6.578 4.206 1.00 0.21 N ATOM 1878 CA SER A 124 6.265 6.209 3.286 1.00 0.23 C ATOM 1879 C SER A 124 7.568 6.135 4.062 1.00 0.29 C ATOM 1880 O SER A 124 7.970 7.101 4.705 1.00 0.34 O ATOM 1881 CB SER A 124 6.372 7.212 2.138 1.00 0.26 C ATOM 1882 OG SER A 124 7.328 6.794 1.177 1.00 1.17 O ATOM 0 H SER A 124 4.815 7.510 4.082 1.00 0.21 H new ATOM 0 HA SER A 124 6.041 5.239 2.841 1.00 0.23 H new ATOM 0 HB2 SER A 124 5.399 7.327 1.660 1.00 0.26 H new ATOM 0 HB3 SER A 124 6.651 8.190 2.531 1.00 0.26 H new ATOM 0 HG SER A 124 7.374 7.453 0.453 1.00 1.17 H new ATOM 1888 N VAL A 125 8.222 4.970 4.012 1.00 0.33 N ATOM 1889 CA VAL A 125 9.380 4.729 4.854 1.00 0.43 C ATOM 1890 C VAL A 125 10.546 5.543 4.319 1.00 0.53 C ATOM 1891 O VAL A 125 11.494 5.851 5.038 1.00 0.65 O ATOM 1892 CB VAL A 125 9.747 3.206 4.937 1.00 0.48 C ATOM 1893 CG1 VAL A 125 10.972 2.869 4.102 1.00 0.81 C ATOM 1894 CG2 VAL A 125 9.987 2.795 6.376 1.00 0.47 C ATOM 0 H VAL A 125 7.967 4.193 3.403 1.00 0.33 H new ATOM 0 HA VAL A 125 9.144 5.040 5.872 1.00 0.43 H new ATOM 0 HB VAL A 125 8.900 2.651 4.534 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.190 1.805 4.189 1.00 0.81 H new ATOM 0 HG12 VAL A 125 10.780 3.116 3.058 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.826 3.444 4.460 1.00 0.81 H new ATOM 0 HG21 VAL A 125 10.240 1.736 6.414 1.00 0.47 H new ATOM 0 HG22 VAL A 125 10.809 3.380 6.789 1.00 0.47 H new ATOM 0 HG23 VAL A 125 9.085 2.974 6.961 1.00 0.47 H new ATOM 1904 N ALA A 126 10.441 5.911 3.048 1.00 0.53 N ATOM 1905 CA ALA A 126 11.398 6.812 2.438 1.00 0.63 C ATOM 1906 C ALA A 126 11.185 8.247 2.922 1.00 0.63 C ATOM 1907 O ALA A 126 12.140 8.937 3.277 1.00 0.72 O ATOM 1908 CB ALA A 126 11.287 6.745 0.923 1.00 0.68 C ATOM 0 H ALA A 126 9.699 5.596 2.422 1.00 0.53 H new ATOM 0 HA ALA A 126 12.399 6.499 2.735 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.011 7.426 0.475 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.490 5.728 0.588 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.281 7.033 0.619 1.00 0.68 H new ATOM 1914 N HIS A 127 9.928 8.698 2.928 1.00 0.56 N ATOM 1915 CA HIS A 127 9.601 10.038 3.350 1.00 0.58 C ATOM 1916 C HIS A 127 8.208 10.027 3.971 1.00 0.47 C ATOM 1917 O HIS A 127 7.215 9.895 3.265 1.00 0.44 O ATOM 1918 CB HIS A 127 9.655 10.984 2.145 1.00 0.72 C ATOM 1919 CG HIS A 127 9.707 12.440 2.496 1.00 1.15 C ATOM 1920 ND1 HIS A 127 9.888 13.429 1.555 1.00 1.70 N ATOM 1921 CD2 HIS A 127 9.603 13.074 3.686 1.00 1.99 C ATOM 1922 CE1 HIS A 127 9.892 14.607 2.151 1.00 2.29 C ATOM 1923 NE2 HIS A 127 9.720 14.418 3.444 1.00 2.47 N ATOM 0 H HIS A 127 9.124 8.141 2.641 1.00 0.56 H new ATOM 0 HA HIS A 127 10.319 10.390 4.090 1.00 0.58 H new ATOM 0 HB2 HIS A 127 10.531 10.737 1.545 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.780 10.805 1.520 1.00 0.72 H new ATOM 0 HD2 HIS A 127 9.455 12.608 4.649 1.00 1.99 H new ATOM 0 HE1 HIS A 127 10.015 15.562 1.663 1.00 2.29 H new ATOM 0 HE2 HIS A 127 9.680 15.153 4.150 1.00 2.47 H new ATOM 1932 N PRO A 128 8.131 10.183 5.289 1.00 0.47 N ATOM 1933 CA PRO A 128 6.870 10.269 6.051 1.00 0.43 C ATOM 1934 C PRO A 128 5.822 11.216 5.471 1.00 0.40 C ATOM 1935 O PRO A 128 4.624 10.950 5.573 1.00 0.39 O ATOM 1936 CB PRO A 128 7.339 10.794 7.376 1.00 0.53 C ATOM 1937 CG PRO A 128 8.662 10.156 7.559 1.00 0.79 C ATOM 1938 CD PRO A 128 9.298 10.225 6.198 1.00 0.60 C ATOM 0 HA PRO A 128 6.362 9.305 6.065 1.00 0.43 H new ATOM 0 HB2 PRO A 128 7.416 11.881 7.371 1.00 0.53 H new ATOM 0 HB3 PRO A 128 6.651 10.527 8.178 1.00 0.53 H new ATOM 0 HG2 PRO A 128 9.258 10.683 8.304 1.00 0.79 H new ATOM 0 HG3 PRO A 128 8.563 9.126 7.900 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.879 11.138 6.069 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.976 9.389 6.025 1.00 0.60 H new ATOM 1946 N ASN A 129 6.260 12.360 4.943 1.00 0.44 N ATOM 1947 CA ASN A 129 5.340 13.388 4.474 1.00 0.47 C ATOM 1948 C ASN A 129 4.565 12.888 3.255 1.00 0.39 C ATOM 1949 O ASN A 129 3.660 13.540 2.746 1.00 0.44 O ATOM 1950 CB ASN A 129 6.121 14.649 4.121 1.00 0.57 C ATOM 1951 CG ASN A 129 5.223 15.838 3.836 1.00 1.07 C ATOM 1952 OD1 ASN A 129 5.372 16.515 2.822 1.00 1.84 O ATOM 1953 ND2 ASN A 129 4.316 16.128 4.756 1.00 1.44 N ATOM 0 H ASN A 129 7.246 12.595 4.831 1.00 0.44 H new ATOM 0 HA ASN A 129 4.627 13.618 5.266 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.793 14.896 4.943 1.00 0.57 H new ATOM 0 HB3 ASN A 129 6.744 14.453 3.248 1.00 0.57 H new ATOM 0 HD21 ASN A 129 3.709 16.939 4.636 1.00 1.44 H new ATOM 0 HD22 ASN A 129 4.224 15.540 5.584 1.00 1.44 H new ATOM 1960 N LEU A 130 4.980 11.741 2.775 1.00 0.32 N ATOM 1961 CA LEU A 130 4.204 10.934 1.883 1.00 0.26 C ATOM 1962 C LEU A 130 3.526 9.898 2.764 1.00 0.24 C ATOM 1963 O LEU A 130 4.189 9.226 3.552 1.00 0.26 O ATOM 1964 CB LEU A 130 5.130 10.226 0.878 1.00 0.30 C ATOM 1965 CG LEU A 130 5.840 11.095 -0.182 1.00 0.58 C ATOM 1966 CD1 LEU A 130 6.500 12.330 0.414 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.892 10.264 -0.892 1.00 1.28 C ATOM 0 H LEU A 130 5.889 11.339 3.003 1.00 0.32 H new ATOM 0 HA LEU A 130 3.487 11.529 1.317 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.896 9.696 1.444 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.542 9.472 0.354 1.00 0.30 H new ATOM 0 HG LEU A 130 5.076 11.437 -0.880 1.00 0.58 H new ATOM 0 HD11 LEU A 130 6.983 12.902 -0.378 1.00 1.38 H new ATOM 0 HD12 LEU A 130 5.744 12.948 0.899 1.00 1.38 H new ATOM 0 HD13 LEU A 130 7.246 12.025 1.148 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.395 10.876 -1.641 1.00 1.28 H new ATOM 0 HD22 LEU A 130 7.623 9.905 -0.167 1.00 1.28 H new ATOM 0 HD23 LEU A 130 6.416 9.413 -1.379 1.00 1.28 H new ATOM 1979 N PHE A 131 2.250 9.716 2.605 1.00 0.23 N ATOM 1980 CA PHE A 131 1.526 8.785 3.456 1.00 0.27 C ATOM 1981 C PHE A 131 0.331 8.255 2.680 1.00 0.26 C ATOM 1982 O PHE A 131 -0.347 9.007 1.978 1.00 0.26 O ATOM 1983 CB PHE A 131 1.144 9.510 4.759 1.00 0.42 C ATOM 1984 CG PHE A 131 0.733 8.665 5.936 1.00 0.36 C ATOM 1985 CD1 PHE A 131 0.240 7.385 5.784 1.00 0.63 C ATOM 1986 CD2 PHE A 131 0.836 9.190 7.215 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.142 6.644 6.883 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.457 8.453 8.317 1.00 0.96 C ATOM 1989 CZ PHE A 131 -0.032 7.178 8.149 1.00 1.05 C ATOM 0 H PHE A 131 1.681 10.190 1.903 1.00 0.23 H new ATOM 0 HA PHE A 131 2.132 7.924 3.737 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.994 10.120 5.065 1.00 0.42 H new ATOM 0 HB3 PHE A 131 0.325 10.194 4.535 1.00 0.42 H new ATOM 0 HD1 PHE A 131 0.152 6.959 4.795 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.219 10.191 7.350 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -0.528 5.644 6.751 1.00 0.97 H new ATOM 0 HE2 PHE A 131 0.544 8.875 9.308 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.330 6.596 9.009 1.00 1.05 H new ATOM 1999 N ILE A 132 0.057 6.982 2.845 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.798 6.249 1.950 1.00 0.27 C ATOM 2001 C ILE A 132 -2.235 6.392 2.389 1.00 0.25 C ATOM 2002 O ILE A 132 -2.695 5.753 3.329 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.375 4.763 1.920 1.00 0.34 C ATOM 2004 CG1 ILE A 132 1.028 4.636 1.320 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.374 3.908 1.146 1.00 0.80 C ATOM 2006 CD1 ILE A 132 1.160 5.223 -0.066 1.00 1.39 C ATOM 0 H ILE A 132 0.427 6.423 3.614 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.703 6.652 0.942 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.361 4.392 2.945 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.741 5.129 1.981 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.303 3.582 1.284 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -1.042 2.870 1.147 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.354 3.976 1.618 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -1.441 4.266 0.119 1.00 0.80 H new ATOM 0 HD11 ILE A 132 2.183 5.093 -0.420 1.00 1.39 H new ATOM 0 HD12 ILE A 132 0.474 4.714 -0.743 1.00 1.39 H new ATOM 0 HD13 ILE A 132 0.919 6.286 -0.036 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.904 7.268 1.686 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.263 7.665 1.995 1.00 0.23 C ATOM 2020 C ALA A 133 -5.294 6.885 1.219 1.00 0.23 C ATOM 2021 O ALA A 133 -5.048 6.424 0.105 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.443 9.143 1.723 1.00 0.25 C ATOM 0 H ALA A 133 -2.517 7.737 0.867 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.420 7.449 3.052 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.467 9.434 1.958 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.752 9.714 2.344 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.240 9.347 0.672 1.00 0.25 H new ATOM 2028 N THR A 134 -6.458 6.788 1.816 1.00 0.23 N ATOM 2029 CA THR A 134 -7.615 6.206 1.190 1.00 0.25 C ATOM 2030 C THR A 134 -8.776 7.180 1.306 1.00 0.26 C ATOM 2031 O THR A 134 -9.030 7.748 2.368 1.00 0.31 O ATOM 2032 CB THR A 134 -7.955 4.865 1.817 1.00 0.31 C ATOM 2033 OG1 THR A 134 -7.879 5.008 3.218 1.00 0.96 O ATOM 2034 CG2 THR A 134 -6.993 3.786 1.350 1.00 1.01 C ATOM 0 H THR A 134 -6.628 7.118 2.766 1.00 0.23 H new ATOM 0 HA THR A 134 -7.406 6.021 0.136 1.00 0.25 H new ATOM 0 HB THR A 134 -8.958 4.563 1.516 1.00 0.31 H new ATOM 0 HG1 THR A 134 -7.930 5.958 3.453 1.00 0.96 H new ATOM 0 HG21 THR A 134 -7.259 2.836 1.814 1.00 1.01 H new ATOM 0 HG22 THR A 134 -7.053 3.690 0.266 1.00 1.01 H new ATOM 0 HG23 THR A 134 -5.976 4.057 1.635 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.417 7.419 0.200 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.467 8.424 0.117 1.00 0.31 C ATOM 2044 C LYS A 135 -11.829 7.748 -0.039 1.00 0.40 C ATOM 2045 O LYS A 135 -11.937 6.690 -0.649 1.00 0.47 O ATOM 2046 CB LYS A 135 -10.197 9.381 -1.053 1.00 0.35 C ATOM 2047 CG LYS A 135 -9.814 10.810 -0.646 1.00 0.69 C ATOM 2048 CD LYS A 135 -8.357 10.946 -0.191 1.00 0.76 C ATOM 2049 CE LYS A 135 -7.962 12.422 -0.057 1.00 0.89 C ATOM 2050 NZ LYS A 135 -6.546 12.626 0.396 1.00 0.63 N ATOM 0 H LYS A 135 -9.236 6.930 -0.677 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.474 9.006 1.039 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -9.396 8.966 -1.665 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -11.087 9.424 -1.680 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -9.987 11.478 -1.490 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -10.470 11.138 0.160 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -8.222 10.441 0.765 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -7.700 10.453 -0.908 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -8.102 12.916 -1.019 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.635 12.907 0.651 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.541 13.140 1.300 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -6.085 11.702 0.520 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.029 13.178 -0.318 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.862 8.390 0.497 1.00 0.49 N ATOM 2065 CA GLN A 136 -14.231 7.868 0.453 1.00 0.63 C ATOM 2066 C GLN A 136 -14.855 8.051 -0.921 1.00 0.58 C ATOM 2067 O GLN A 136 -15.770 7.333 -1.313 1.00 0.69 O ATOM 2068 CB GLN A 136 -15.094 8.583 1.501 1.00 0.82 C ATOM 2069 CG GLN A 136 -15.511 7.701 2.661 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.617 6.740 2.291 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -17.477 7.051 1.467 1.00 1.75 O ATOM 2072 NE2 GLN A 136 -16.598 5.559 2.879 1.00 1.20 N ATOM 0 H GLN A 136 -12.778 9.287 0.975 1.00 0.49 H new ATOM 0 HA GLN A 136 -14.187 6.801 0.669 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -14.542 9.439 1.889 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -15.988 8.974 1.015 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -14.647 7.137 3.013 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -15.841 8.328 3.489 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -15.868 5.338 3.557 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -17.313 4.867 2.656 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.386 9.058 -1.617 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.965 9.431 -2.911 1.00 0.52 C ATOM 2083 C ASP A 137 -13.895 9.608 -3.981 1.00 0.47 C ATOM 2084 O ASP A 137 -14.111 9.305 -5.156 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.787 10.717 -2.779 1.00 0.63 C ATOM 2086 CG ASP A 137 -16.332 11.200 -4.110 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -17.185 10.499 -4.697 1.00 1.43 O ATOM 2088 OD2 ASP A 137 -15.907 12.275 -4.581 1.00 2.21 O ATOM 0 H ASP A 137 -13.605 9.642 -1.320 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.618 8.615 -3.221 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -16.616 10.545 -2.092 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -15.166 11.498 -2.340 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.741 10.094 -3.561 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.682 10.466 -4.487 1.00 0.38 C ATOM 2095 C TYR A 138 -10.715 9.318 -4.673 1.00 0.32 C ATOM 2096 O TYR A 138 -10.898 8.249 -4.102 1.00 0.31 O ATOM 2097 CB TYR A 138 -10.926 11.698 -3.980 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.763 12.952 -3.920 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.727 13.113 -2.938 1.00 1.41 C ATOM 2100 CD2 TYR A 138 -11.596 13.970 -4.850 1.00 0.99 C ATOM 2101 CE1 TYR A 138 -13.501 14.254 -2.879 1.00 1.98 C ATOM 2102 CE2 TYR A 138 -12.365 15.113 -4.800 1.00 1.45 C ATOM 2103 CZ TYR A 138 -13.293 15.268 -3.807 1.00 1.94 C ATOM 2104 OH TYR A 138 -14.090 16.390 -3.764 1.00 2.50 O ATOM 0 H TYR A 138 -12.511 10.242 -2.578 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.142 10.705 -5.446 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.535 11.487 -2.985 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.068 11.877 -4.628 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -12.875 12.332 -2.206 1.00 1.41 H new ATOM 0 HD2 TYR A 138 -10.851 13.864 -5.625 1.00 0.99 H new ATOM 0 HE1 TYR A 138 -14.261 14.358 -2.119 1.00 1.98 H new ATOM 0 HE2 TYR A 138 -12.235 15.885 -5.544 1.00 1.45 H new ATOM 0 HH TYR A 138 -13.822 17.009 -4.475 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.682 9.548 -5.459 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.655 8.548 -5.668 1.00 0.33 C ATOM 2116 C TRP A 139 -7.844 8.403 -4.388 1.00 0.30 C ATOM 2117 O TRP A 139 -7.854 9.299 -3.537 1.00 0.32 O ATOM 2118 CB TRP A 139 -7.732 8.973 -6.816 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.436 9.715 -7.908 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -9.101 9.182 -8.973 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -8.543 11.135 -8.036 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -9.615 10.188 -9.755 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -9.285 11.395 -9.200 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -8.081 12.214 -7.275 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -9.577 12.688 -9.623 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -8.371 13.498 -7.695 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -9.113 13.726 -8.861 1.00 2.74 C ATOM 0 H TRP A 139 -9.532 10.421 -5.964 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.120 7.596 -5.926 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -6.935 9.601 -6.417 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -7.258 8.086 -7.237 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -9.208 8.126 -9.172 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -10.155 10.057 -10.610 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -7.508 12.046 -6.375 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -10.150 12.866 -10.521 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -8.020 14.339 -7.115 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -9.323 14.741 -9.165 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.156 7.285 -4.239 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.313 7.088 -3.077 1.00 0.33 C ATOM 2140 C VAL A 140 -5.108 8.003 -3.179 1.00 0.30 C ATOM 2141 O VAL A 140 -4.198 7.783 -3.976 1.00 0.32 O ATOM 2142 CB VAL A 140 -5.870 5.616 -2.913 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -7.037 4.767 -2.444 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -5.310 5.059 -4.214 1.00 1.28 C ATOM 0 H VAL A 140 -7.164 6.509 -4.901 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.894 7.336 -2.189 1.00 0.33 H new ATOM 0 HB VAL A 140 -5.079 5.585 -2.163 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -6.713 3.732 -2.332 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -7.396 5.140 -1.485 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -7.842 4.818 -3.177 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -5.007 4.022 -4.066 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -6.075 5.106 -4.989 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -4.446 5.649 -4.520 1.00 1.28 H new ATOM 2154 N CYS A 141 -5.125 9.057 -2.391 1.00 0.30 N ATOM 2155 CA CYS A 141 -4.125 10.084 -2.526 1.00 0.26 C ATOM 2156 C CYS A 141 -3.022 9.875 -1.498 1.00 0.25 C ATOM 2157 O CYS A 141 -2.870 8.788 -0.941 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.807 11.451 -2.342 1.00 0.33 C ATOM 2159 SG CYS A 141 -3.784 12.887 -2.749 1.00 1.21 S ATOM 0 H CYS A 141 -5.815 9.221 -1.658 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.666 10.042 -3.514 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.704 11.477 -2.961 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -5.132 11.540 -1.306 1.00 0.33 H new ATOM 0 HG CYS A 141 -4.468 13.976 -2.556 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.267 10.914 -1.250 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.161 10.874 -0.346 1.00 0.23 C ATOM 2167 C LEU A 142 -1.206 12.150 0.446 1.00 0.24 C ATOM 2168 O LEU A 142 -1.808 13.112 -0.011 1.00 0.23 O ATOM 2169 CB LEU A 142 0.096 10.754 -1.219 1.00 0.21 C ATOM 2170 CG LEU A 142 1.410 10.434 -0.539 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.547 8.937 -0.321 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.566 10.948 -1.375 1.00 0.25 C ATOM 0 H LEU A 142 -2.412 11.826 -1.682 1.00 0.21 H new ATOM 0 HA LEU A 142 -1.177 10.041 0.357 1.00 0.23 H new ATOM 0 HB2 LEU A 142 -0.089 9.982 -1.966 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.219 11.694 -1.757 1.00 0.21 H new ATOM 0 HG LEU A 142 1.428 10.927 0.433 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.498 8.726 0.169 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.729 8.584 0.307 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.513 8.425 -1.282 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.507 10.713 -0.878 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.545 10.473 -2.356 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.478 12.028 -1.493 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.688 12.139 1.649 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.290 13.355 2.314 1.00 0.33 C ATOM 2186 C ALA A 143 0.455 12.966 3.550 1.00 0.60 C ATOM 2187 O ALA A 143 0.172 11.935 4.116 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.499 14.213 2.676 1.00 0.38 C ATOM 0 H ALA A 143 -0.531 11.291 2.193 1.00 0.34 H new ATOM 0 HA ALA A 143 0.337 13.951 1.651 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.164 15.122 3.176 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.042 14.477 1.769 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -2.156 13.654 3.342 1.00 0.38 H new ATOM 2194 N GLY A 144 1.326 13.801 4.028 1.00 0.63 N ATOM 2195 CA GLY A 144 1.875 13.573 5.337 1.00 0.93 C ATOM 2196 C GLY A 144 1.097 14.384 6.307 1.00 0.93 C ATOM 2197 O GLY A 144 1.605 14.805 7.343 1.00 1.13 O ATOM 0 H GLY A 144 1.669 14.632 3.546 1.00 0.63 H new ATOM 0 HA2 GLY A 144 1.821 12.515 5.594 1.00 0.93 H new ATOM 0 HA3 GLY A 144 2.928 13.854 5.363 1.00 0.93 H new ATOM 2236 N SER A 148 -6.172 13.221 4.721 1.00 0.49 N ATOM 2237 CA SER A 148 -6.024 11.979 4.030 1.00 0.43 C ATOM 2238 C SER A 148 -6.284 10.869 5.023 1.00 0.37 C ATOM 2239 O SER A 148 -5.658 10.800 6.080 1.00 0.37 O ATOM 2240 CB SER A 148 -4.627 11.863 3.423 1.00 0.57 C ATOM 2241 OG SER A 148 -4.523 12.638 2.238 1.00 0.64 O ATOM 0 HA SER A 148 -6.733 11.913 3.205 1.00 0.43 H new ATOM 0 HB2 SER A 148 -3.883 12.196 4.147 1.00 0.57 H new ATOM 0 HB3 SER A 148 -4.409 10.819 3.200 1.00 0.57 H new ATOM 0 HG SER A 148 -3.620 12.550 1.868 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.216 10.016 4.678 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.622 8.949 5.544 1.00 0.32 C ATOM 2249 C ILE A 149 -6.821 7.755 5.160 1.00 0.26 C ATOM 2250 O ILE A 149 -7.159 7.058 4.253 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.145 8.691 5.486 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -9.920 9.984 5.149 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.621 8.183 6.833 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -9.896 10.390 3.686 1.00 1.21 C ATOM 0 H ILE A 149 -7.712 10.046 3.787 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.433 9.209 6.585 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.332 7.953 4.706 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -10.958 9.857 5.457 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -9.509 10.800 5.743 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.695 8.000 6.794 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -9.104 7.255 7.075 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -9.407 8.928 7.599 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -10.468 11.309 3.554 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -8.866 10.555 3.371 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -10.337 9.598 3.081 1.00 1.21 H new ATOM 2266 N THR A 150 -5.727 7.577 5.839 1.00 0.24 N ATOM 2267 CA THR A 150 -4.658 6.727 5.381 1.00 0.25 C ATOM 2268 C THR A 150 -4.871 5.340 5.915 1.00 0.26 C ATOM 2269 O THR A 150 -3.946 4.671 6.349 1.00 0.34 O ATOM 2270 CB THR A 150 -3.297 7.288 5.865 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.374 7.621 7.261 1.00 0.53 O ATOM 2272 CG2 THR A 150 -2.920 8.536 5.079 1.00 0.69 C ATOM 0 H THR A 150 -5.545 8.022 6.739 1.00 0.24 H new ATOM 0 HA THR A 150 -4.652 6.696 4.291 1.00 0.25 H new ATOM 0 HB THR A 150 -2.537 6.523 5.707 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.472 7.633 7.645 1.00 0.53 H new ATOM 0 HG21 THR A 150 -1.961 8.914 5.434 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.843 8.290 4.020 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.685 9.299 5.219 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.108 4.921 5.926 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.418 3.647 6.485 1.00 0.25 C ATOM 2282 C ASP A 151 -6.481 2.543 5.456 1.00 0.26 C ATOM 2283 O ASP A 151 -6.816 2.734 4.303 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.693 3.684 7.289 1.00 0.29 C ATOM 2285 CG ASP A 151 -8.332 5.046 7.347 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -7.991 5.822 8.271 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -9.207 5.322 6.515 1.00 1.07 O ATOM 0 H ASP A 151 -6.904 5.441 5.557 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.589 3.415 7.154 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.403 2.977 6.860 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -7.482 3.348 8.304 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.079 1.400 5.893 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.487 0.163 5.312 1.00 0.27 C ATOM 2294 C PHE A 152 -6.861 -0.789 6.434 1.00 0.28 C ATOM 2295 O PHE A 152 -6.597 -0.526 7.586 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.372 -0.397 4.431 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.742 -1.693 4.887 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -3.800 -1.701 5.907 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -5.105 -2.900 4.314 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -3.233 -2.884 6.340 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -4.538 -4.086 4.742 1.00 3.35 C ATOM 2302 CZ PHE A 152 -3.565 -4.079 5.699 1.00 3.93 C ATOM 0 H PHE A 152 -5.442 1.294 6.683 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.356 0.306 4.669 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.771 -0.546 3.428 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.587 0.356 4.353 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.507 -0.770 6.368 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -5.840 -2.915 3.523 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -2.539 -2.884 7.167 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -4.867 -5.023 4.317 1.00 3.35 H new ATOM 0 HZ PHE A 152 -3.054 -4.994 5.959 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.460 -1.881 6.070 1.00 0.30 N ATOM 2313 CA GLN A 153 -8.011 -2.855 6.987 1.00 0.33 C ATOM 2314 C GLN A 153 -7.962 -4.179 6.268 1.00 0.38 C ATOM 2315 O GLN A 153 -8.096 -4.207 5.042 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.465 -2.544 7.382 1.00 0.44 C ATOM 2317 CG GLN A 153 -9.742 -1.097 7.770 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.149 -0.901 8.299 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -11.400 -0.045 9.149 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -12.078 -1.688 7.785 1.00 1.20 N ATOM 0 H GLN A 153 -7.588 -2.136 5.091 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.435 -2.852 7.912 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -10.115 -2.809 6.548 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -9.742 -3.186 8.218 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -9.024 -0.783 8.528 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -9.590 -0.455 6.902 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -11.826 -2.384 7.083 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -13.047 -1.600 8.090 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.745 -5.268 6.970 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.562 -6.522 6.280 1.00 0.45 C ATOM 2331 C ILE A 154 -8.910 -7.202 6.168 1.00 0.44 C ATOM 2332 O ILE A 154 -9.522 -7.605 7.161 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.576 -7.467 7.017 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -5.198 -6.816 7.209 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -6.429 -8.780 6.260 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -5.121 -5.860 8.384 1.00 1.63 C ATOM 0 H ILE A 154 -7.692 -5.312 7.988 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.136 -6.311 5.299 1.00 0.45 H new ATOM 0 HB ILE A 154 -6.994 -7.666 8.004 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -4.453 -7.601 7.344 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -4.933 -6.278 6.299 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -5.734 -9.430 6.791 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -7.400 -9.269 6.188 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -6.047 -8.582 5.258 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -4.116 -5.444 8.449 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -5.839 -5.052 8.244 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -5.353 -6.396 9.305 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.351 -7.319 4.930 1.00 0.43 N ATOM 2349 CA LEU A 155 -10.675 -7.807 4.620 1.00 0.44 C ATOM 2350 C LEU A 155 -10.605 -9.220 4.070 1.00 0.57 C ATOM 2351 O LEU A 155 -9.972 -9.479 3.048 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.386 -6.898 3.602 1.00 0.53 C ATOM 2353 CG LEU A 155 -11.890 -5.532 4.099 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.025 -5.079 3.208 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -12.346 -5.610 5.554 1.00 0.73 C ATOM 0 H LEU A 155 -8.796 -7.076 4.109 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.248 -7.804 5.547 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -10.701 -6.722 2.772 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.239 -7.445 3.201 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.075 -4.810 4.053 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.392 -4.111 3.550 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -12.669 -4.990 2.182 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -13.834 -5.809 3.250 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -12.697 -4.630 5.878 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -13.156 -6.334 5.643 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -11.511 -5.922 6.181 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.229 -10.125 4.780 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.376 -11.491 4.330 1.00 0.89 C ATOM 2369 C GLU A 156 -12.633 -11.572 3.467 1.00 0.99 C ATOM 2370 O GLU A 156 -13.528 -10.749 3.614 1.00 0.90 O ATOM 2371 CB GLU A 156 -11.499 -12.394 5.564 1.00 1.04 C ATOM 2372 CG GLU A 156 -11.486 -13.883 5.278 1.00 1.58 C ATOM 2373 CD GLU A 156 -11.638 -14.695 6.547 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -10.621 -14.922 7.237 1.00 2.53 O ATOM 2375 OE2 GLU A 156 -12.776 -15.087 6.875 1.00 2.57 O ATOM 0 H GLU A 156 -11.652 -9.938 5.689 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.518 -11.815 3.741 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -10.680 -12.164 6.246 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -12.425 -12.148 6.084 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -12.294 -14.129 4.589 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -10.552 -14.151 4.783 1.00 1.58 H new ATOM 2382 N ASN A 157 -12.701 -12.547 2.573 1.00 1.23 N ATOM 2383 CA ASN A 157 -13.879 -12.709 1.720 1.00 1.41 C ATOM 2384 C ASN A 157 -14.913 -13.552 2.464 1.00 1.66 C ATOM 2385 O ASN A 157 -14.560 -14.302 3.373 1.00 1.82 O ATOM 2386 CB ASN A 157 -13.483 -13.417 0.416 1.00 1.68 C ATOM 2387 CG ASN A 157 -14.583 -13.418 -0.635 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -15.309 -12.439 -0.797 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -14.723 -14.525 -1.347 1.00 2.44 N ATOM 0 H ASN A 157 -11.964 -13.235 2.416 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.297 -11.731 1.481 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -12.598 -12.932 0.003 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -13.206 -14.447 0.641 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -15.452 -14.585 -2.058 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -14.102 -15.318 -1.185 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.179 -13.440 2.085 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.235 -14.177 2.756 1.00 2.06 C ATOM 2398 C GLN A 158 -17.176 -15.665 2.409 1.00 2.49 C ATOM 2399 O GLN A 158 -17.124 -16.517 3.297 1.00 2.73 O ATOM 2400 CB GLN A 158 -18.595 -13.573 2.393 1.00 2.08 C ATOM 2401 CG GLN A 158 -18.765 -13.274 0.911 1.00 2.54 C ATOM 2402 CD GLN A 158 -20.066 -12.563 0.594 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -20.628 -12.733 -0.487 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -20.551 -11.759 1.525 1.00 2.98 N ATOM 0 H GLN A 158 -16.497 -12.847 1.318 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.093 -14.094 3.834 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -19.381 -14.260 2.707 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -18.733 -12.651 2.957 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -17.930 -12.660 0.572 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -18.722 -14.208 0.351 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -20.055 -11.645 2.409 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -21.421 -11.253 1.359 1.00 2.98 H new ATOM 2413 N ALA A 159 -17.165 -15.968 1.120 1.00 2.67 N ATOM 2414 CA ALA A 159 -17.049 -17.337 0.651 1.00 3.14 C ATOM 2415 C ALA A 159 -16.385 -17.364 -0.717 1.00 3.38 C ATOM 2416 O ALA A 159 -15.191 -17.724 -0.801 1.00 3.55 O ATOM 2417 CB ALA A 159 -18.419 -17.997 0.595 1.00 3.37 C ATOM 2418 OXT ALA A 159 -17.050 -16.993 -1.700 1.00 3.78 O ATOM 0 H ALA A 159 -17.236 -15.275 0.375 1.00 2.67 H new ATOM 0 HA ALA A 159 -16.429 -17.898 1.350 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -18.315 -19.023 0.241 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -18.863 -18.000 1.591 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -19.063 -17.442 -0.087 1.00 3.37 H new