USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1036 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 65 THR OG1 : rot 83:sc= -1.86! USER MOD Set 1.2: A 68 ASN : amide:sc= 0.969 K(o=-0.4,f=-21!) USER MOD Set 1.3: A 72 LYS NZ :NH3+ -176:sc= 0.773 (180deg=0) USER MOD Set 1.4: A 118 SER OG : rot 97:sc= 0.755 USER MOD Set 1.5: A 122 LYS NZ :NH3+ 174:sc= -1.03 (180deg=-1.12) USER MOD Set 2.1: A 48 LYS NZ :NH3+ -176:sc=8.32e-05 (180deg=0) USER MOD Set 2.2: A 64 HIS :FLIP no HD1:sc= -1.17 F(o=-2.7,f=-1.2) USER MOD Set 3.1: A 13 THR OG1 : rot -58:sc= 0.68 USER MOD Set 3.2: A 14 LYS NZ :NH3+ 161:sc= -5.64! (180deg=-7.71!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.0308 X(o=-0.031,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.149 K(o=-0.15,f=-1.6!) USER MOD Single : A 21 ASN : amide:sc= -0.231 K(o=-0.23,f=-1.2) USER MOD Single : A 23 THR OG1 : rot 118:sc= 1 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.267 K(o=-0.27,f=-2.5!) USER MOD Single : A 34 MET CE :methyl -132:sc= -0.273 (180deg=-2.61!) USER MOD Single : A 38 ASN : amide:sc= -0.128 X(o=-0.13,f=-0.33) USER MOD Single : A 45 HIS :FLIP no HD1:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl 161:sc= -4.82! (180deg=-4.93!) USER MOD Single : A 53 THR OG1 : rot 68:sc= 0.0571 USER MOD Single : A 54 MET CE :methyl -120:sc= -3.15! (180deg=-7.87!) USER MOD Single : A 57 SER OG : rot 101:sc= 0.176 USER MOD Single : A 58 SER OG : rot 180:sc= -0.0428 USER MOD Single : A 59 MET CE :methyl -105:sc= -10.7! (180deg=-12!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 180:sc= -3.34! USER MOD Single : A 75 ASN : amide:sc= -0.0576 K(o=-0.058,f=-2.1!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -162:sc= -0.57 (180deg=-0.938) USER MOD Single : A 81 THR OG1 : rot 160:sc= -1 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl 144:sc= -0.634 (180deg=-3.64!) USER MOD Single : A 96 THR OG1 : rot 91:sc= 0.736 USER MOD Single : A 98 MET CE :methyl 173:sc= -6.33 (180deg=-6.46) USER MOD Single : A 101 LYS NZ :NH3+ -98:sc= -0.918 (180deg=-2.28!) USER MOD Single : A 104 SER OG : rot -73:sc= 0.645 USER MOD Single : A 107 SER OG : rot 41:sc= 0.0712 USER MOD Single : A 113 ASN : amide:sc= -4! C(o=-4!,f=-8.1!) USER MOD Single : A 120 THR OG1 : rot 87:sc= 0.845 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0.114 USER MOD Single : A 127 SER OG : rot 57:sc= 0.381 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.611 -28.749 3.204 1.00 0.00 N ATOM 2 CA MET A 1 4.101 -28.797 3.268 1.00 0.00 C ATOM 3 C MET A 1 4.682 -27.386 3.145 1.00 0.00 C ATOM 4 O MET A 1 5.552 -27.132 2.336 1.00 0.00 O ATOM 5 CB MET A 1 4.518 -29.657 2.073 1.00 0.00 C ATOM 6 CG MET A 1 5.597 -30.649 2.508 1.00 0.00 C ATOM 7 SD MET A 1 7.110 -29.749 2.932 1.00 0.00 S ATOM 8 CE MET A 1 8.247 -31.152 2.815 1.00 0.00 C ATOM 0 H1 MET A 1 2.229 -29.712 3.289 1.00 0.00 H new ATOM 0 H2 MET A 1 2.249 -28.163 3.983 1.00 0.00 H new ATOM 0 H3 MET A 1 2.316 -28.338 2.296 1.00 0.00 H new ATOM 0 HA MET A 1 4.463 -29.206 4.211 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.655 -30.193 1.679 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.894 -29.024 1.270 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.251 -31.225 3.366 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.797 -31.360 1.706 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.260 -30.819 3.042 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.949 -31.922 3.527 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.217 -31.561 1.805 1.00 0.00 H new ATOM 20 N MET A 2 4.208 -26.464 3.940 1.00 0.00 N ATOM 21 CA MET A 2 4.738 -25.072 3.864 1.00 0.00 C ATOM 22 C MET A 2 6.263 -25.096 3.734 1.00 0.00 C ATOM 23 O MET A 2 6.967 -25.480 4.647 1.00 0.00 O ATOM 24 CB MET A 2 4.322 -24.413 5.178 1.00 0.00 C ATOM 25 CG MET A 2 4.138 -22.911 4.957 1.00 0.00 C ATOM 26 SD MET A 2 4.470 -22.027 6.500 1.00 0.00 S ATOM 27 CE MET A 2 5.324 -20.608 5.768 1.00 0.00 C ATOM 0 H MET A 2 3.479 -26.614 4.637 1.00 0.00 H new ATOM 0 HA MET A 2 4.353 -24.531 3.000 1.00 0.00 H new ATOM 0 HB2 MET A 2 3.394 -24.855 5.541 1.00 0.00 H new ATOM 0 HB3 MET A 2 5.079 -24.589 5.942 1.00 0.00 H new ATOM 0 HG2 MET A 2 4.812 -22.563 4.174 1.00 0.00 H new ATOM 0 HG3 MET A 2 3.123 -22.704 4.619 1.00 0.00 H new ATOM 0 HE1 MET A 2 5.625 -19.918 6.556 1.00 0.00 H new ATOM 0 HE2 MET A 2 6.208 -20.953 5.231 1.00 0.00 H new ATOM 0 HE3 MET A 2 4.654 -20.098 5.075 1.00 0.00 H new ATOM 37 N GLU A 3 6.778 -24.695 2.604 1.00 0.00 N ATOM 38 CA GLU A 3 8.258 -24.703 2.415 1.00 0.00 C ATOM 39 C GLU A 3 8.842 -23.307 2.573 1.00 0.00 C ATOM 40 O GLU A 3 8.292 -22.447 3.235 1.00 0.00 O ATOM 41 CB GLU A 3 8.480 -25.149 0.982 1.00 0.00 C ATOM 42 CG GLU A 3 8.020 -24.034 0.039 1.00 0.00 C ATOM 43 CD GLU A 3 8.397 -24.391 -1.399 1.00 0.00 C ATOM 44 OE1 GLU A 3 9.517 -24.830 -1.605 1.00 0.00 O ATOM 45 OE2 GLU A 3 7.561 -24.219 -2.270 1.00 0.00 O ATOM 0 H GLU A 3 6.240 -24.362 1.804 1.00 0.00 H new ATOM 0 HA GLU A 3 8.734 -25.351 3.151 1.00 0.00 H new ATOM 0 HB2 GLU A 3 9.534 -25.373 0.816 1.00 0.00 H new ATOM 0 HB3 GLU A 3 7.924 -26.065 0.782 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.942 -23.897 0.120 1.00 0.00 H new ATOM 0 HG3 GLU A 3 8.483 -23.089 0.323 1.00 0.00 H new ATOM 52 N GLU A 4 9.958 -23.077 1.938 1.00 0.00 N ATOM 53 CA GLU A 4 10.580 -21.744 2.033 1.00 0.00 C ATOM 54 C GLU A 4 10.124 -20.825 0.907 1.00 0.00 C ATOM 55 O GLU A 4 9.993 -19.631 1.085 1.00 0.00 O ATOM 56 CB GLU A 4 12.088 -21.980 1.975 1.00 0.00 C ATOM 57 CG GLU A 4 12.531 -22.782 3.198 1.00 0.00 C ATOM 58 CD GLU A 4 13.386 -21.898 4.107 1.00 0.00 C ATOM 59 OE1 GLU A 4 13.036 -20.742 4.276 1.00 0.00 O ATOM 60 OE2 GLU A 4 14.378 -22.391 4.618 1.00 0.00 O ATOM 0 H GLU A 4 10.457 -23.755 1.363 1.00 0.00 H new ATOM 0 HA GLU A 4 10.288 -21.244 2.957 1.00 0.00 H new ATOM 0 HB2 GLU A 4 12.347 -22.517 1.063 1.00 0.00 H new ATOM 0 HB3 GLU A 4 12.614 -21.026 1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.660 -23.146 3.742 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.100 -23.658 2.885 1.00 0.00 H new ATOM 67 N TYR A 5 9.892 -21.366 -0.243 1.00 0.00 N ATOM 68 CA TYR A 5 9.452 -20.515 -1.385 1.00 0.00 C ATOM 69 C TYR A 5 8.407 -19.516 -0.913 1.00 0.00 C ATOM 70 O TYR A 5 8.486 -18.333 -1.180 1.00 0.00 O ATOM 71 CB TYR A 5 8.864 -21.478 -2.415 1.00 0.00 C ATOM 72 CG TYR A 5 9.161 -20.967 -3.804 1.00 0.00 C ATOM 73 CD1 TYR A 5 9.035 -19.603 -4.089 1.00 0.00 C ATOM 74 CD2 TYR A 5 9.566 -21.858 -4.806 1.00 0.00 C ATOM 75 CE1 TYR A 5 9.312 -19.128 -5.377 1.00 0.00 C ATOM 76 CE2 TYR A 5 9.844 -21.382 -6.094 1.00 0.00 C ATOM 77 CZ TYR A 5 9.717 -20.018 -6.378 1.00 0.00 C ATOM 78 OH TYR A 5 9.992 -19.549 -7.648 1.00 0.00 O ATOM 0 H TYR A 5 9.986 -22.360 -0.450 1.00 0.00 H new ATOM 0 HA TYR A 5 10.274 -19.939 -1.811 1.00 0.00 H new ATOM 0 HB2 TYR A 5 9.289 -22.473 -2.283 1.00 0.00 H new ATOM 0 HB3 TYR A 5 7.787 -21.569 -2.271 1.00 0.00 H new ATOM 0 HD1 TYR A 5 8.724 -18.916 -3.316 1.00 0.00 H new ATOM 0 HD2 TYR A 5 9.664 -22.911 -4.586 1.00 0.00 H new ATOM 0 HE1 TYR A 5 9.213 -18.075 -5.598 1.00 0.00 H new ATOM 0 HE2 TYR A 5 10.156 -22.068 -6.868 1.00 0.00 H new ATOM 0 HH TYR A 5 10.261 -20.297 -8.222 1.00 0.00 H new ATOM 88 N LEU A 6 7.441 -19.985 -0.196 1.00 0.00 N ATOM 89 CA LEU A 6 6.389 -19.070 0.323 1.00 0.00 C ATOM 90 C LEU A 6 6.796 -18.546 1.704 1.00 0.00 C ATOM 91 O LEU A 6 6.393 -17.475 2.113 1.00 0.00 O ATOM 92 CB LEU A 6 5.097 -19.902 0.378 1.00 0.00 C ATOM 93 CG LEU A 6 5.077 -20.825 1.603 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.680 -20.803 2.227 1.00 0.00 C ATOM 95 CD2 LEU A 6 5.411 -22.254 1.168 1.00 0.00 C ATOM 0 H LEU A 6 7.328 -20.966 0.058 1.00 0.00 H new ATOM 0 HA LEU A 6 6.246 -18.194 -0.310 1.00 0.00 H new ATOM 0 HB2 LEU A 6 4.235 -19.236 0.408 1.00 0.00 H new ATOM 0 HB3 LEU A 6 5.008 -20.498 -0.530 1.00 0.00 H new ATOM 0 HG LEU A 6 5.812 -20.483 2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.660 -21.458 3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 6 3.434 -19.786 2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 6 2.950 -21.150 1.496 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.397 -22.912 2.037 1.00 0.00 H new ATOM 0 HD22 LEU A 6 4.672 -22.596 0.443 1.00 0.00 H new ATOM 0 HD23 LEU A 6 6.402 -22.274 0.714 1.00 0.00 H new ATOM 107 N GLY A 7 7.601 -19.287 2.423 1.00 0.00 N ATOM 108 CA GLY A 7 8.036 -18.818 3.768 1.00 0.00 C ATOM 109 C GLY A 7 8.805 -17.503 3.622 1.00 0.00 C ATOM 110 O GLY A 7 8.686 -16.611 4.439 1.00 0.00 O ATOM 0 H GLY A 7 7.973 -20.192 2.136 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.170 -18.676 4.414 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.667 -19.570 4.242 1.00 0.00 H new ATOM 114 N VAL A 8 9.594 -17.372 2.586 1.00 0.00 N ATOM 115 CA VAL A 8 10.364 -16.108 2.396 1.00 0.00 C ATOM 116 C VAL A 8 9.538 -15.108 1.598 1.00 0.00 C ATOM 117 O VAL A 8 9.608 -13.912 1.805 1.00 0.00 O ATOM 118 CB VAL A 8 11.621 -16.510 1.625 1.00 0.00 C ATOM 119 CG1 VAL A 8 12.443 -15.262 1.304 1.00 0.00 C ATOM 120 CG2 VAL A 8 12.457 -17.465 2.479 1.00 0.00 C ATOM 0 H VAL A 8 9.737 -18.082 1.868 1.00 0.00 H new ATOM 0 HA VAL A 8 10.612 -15.631 3.344 1.00 0.00 H new ATOM 0 HB VAL A 8 11.336 -17.006 0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.340 -15.548 0.754 1.00 0.00 H new ATOM 0 HG12 VAL A 8 11.847 -14.580 0.697 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.729 -14.766 2.232 1.00 0.00 H new ATOM 0 HG21 VAL A 8 13.354 -17.753 1.931 1.00 0.00 H new ATOM 0 HG22 VAL A 8 12.742 -16.969 3.407 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.871 -18.355 2.709 1.00 0.00 H new ATOM 130 N PHE A 9 8.750 -15.599 0.702 1.00 0.00 N ATOM 131 CA PHE A 9 7.891 -14.697 -0.115 1.00 0.00 C ATOM 132 C PHE A 9 6.808 -14.090 0.778 1.00 0.00 C ATOM 133 O PHE A 9 6.367 -12.976 0.574 1.00 0.00 O ATOM 134 CB PHE A 9 7.271 -15.595 -1.186 1.00 0.00 C ATOM 135 CG PHE A 9 8.065 -15.466 -2.462 1.00 0.00 C ATOM 136 CD1 PHE A 9 9.385 -15.932 -2.513 1.00 0.00 C ATOM 137 CD2 PHE A 9 7.485 -14.880 -3.593 1.00 0.00 C ATOM 138 CE1 PHE A 9 10.124 -15.812 -3.697 1.00 0.00 C ATOM 139 CE2 PHE A 9 8.224 -14.759 -4.775 1.00 0.00 C ATOM 140 CZ PHE A 9 9.543 -15.224 -4.827 1.00 0.00 C ATOM 0 H PHE A 9 8.657 -16.593 0.492 1.00 0.00 H new ATOM 0 HA PHE A 9 8.447 -13.873 -0.562 1.00 0.00 H new ATOM 0 HB2 PHE A 9 7.266 -16.632 -0.850 1.00 0.00 H new ATOM 0 HB3 PHE A 9 6.233 -15.311 -1.359 1.00 0.00 H new ATOM 0 HD1 PHE A 9 9.833 -16.384 -1.640 1.00 0.00 H new ATOM 0 HD2 PHE A 9 6.467 -14.521 -3.553 1.00 0.00 H new ATOM 0 HE1 PHE A 9 11.141 -16.173 -3.738 1.00 0.00 H new ATOM 0 HE2 PHE A 9 7.776 -14.307 -5.648 1.00 0.00 H new ATOM 0 HZ PHE A 9 10.113 -15.129 -5.739 1.00 0.00 H new ATOM 150 N VAL A 10 6.393 -14.816 1.779 1.00 0.00 N ATOM 151 CA VAL A 10 5.356 -14.290 2.708 1.00 0.00 C ATOM 152 C VAL A 10 6.031 -13.468 3.804 1.00 0.00 C ATOM 153 O VAL A 10 5.498 -12.483 4.272 1.00 0.00 O ATOM 154 CB VAL A 10 4.686 -15.534 3.294 1.00 0.00 C ATOM 155 CG1 VAL A 10 3.775 -15.127 4.454 1.00 0.00 C ATOM 156 CG2 VAL A 10 3.852 -16.220 2.210 1.00 0.00 C ATOM 0 H VAL A 10 6.729 -15.755 1.994 1.00 0.00 H new ATOM 0 HA VAL A 10 4.632 -13.641 2.216 1.00 0.00 H new ATOM 0 HB VAL A 10 5.451 -16.221 3.657 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.298 -16.014 4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.367 -14.636 5.227 1.00 0.00 H new ATOM 0 HG13 VAL A 10 3.010 -14.440 4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 10 3.374 -17.107 2.626 1.00 0.00 H new ATOM 0 HG22 VAL A 10 3.088 -15.532 1.848 1.00 0.00 H new ATOM 0 HG23 VAL A 10 4.499 -16.511 1.383 1.00 0.00 H new ATOM 166 N ASP A 11 7.213 -13.856 4.205 1.00 0.00 N ATOM 167 CA ASP A 11 7.927 -13.081 5.256 1.00 0.00 C ATOM 168 C ASP A 11 8.323 -11.720 4.696 1.00 0.00 C ATOM 169 O ASP A 11 8.613 -10.791 5.419 1.00 0.00 O ATOM 170 CB ASP A 11 9.163 -13.911 5.605 1.00 0.00 C ATOM 171 CG ASP A 11 8.815 -14.900 6.720 1.00 0.00 C ATOM 172 OD1 ASP A 11 7.667 -14.915 7.136 1.00 0.00 O ATOM 173 OD2 ASP A 11 9.700 -15.627 7.139 1.00 0.00 O ATOM 0 H ASP A 11 7.711 -14.673 3.851 1.00 0.00 H new ATOM 0 HA ASP A 11 7.313 -12.903 6.139 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.514 -14.448 4.724 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.975 -13.257 5.924 1.00 0.00 H new ATOM 178 N GLU A 12 8.314 -11.601 3.405 1.00 0.00 N ATOM 179 CA GLU A 12 8.666 -10.305 2.764 1.00 0.00 C ATOM 180 C GLU A 12 7.412 -9.441 2.660 1.00 0.00 C ATOM 181 O GLU A 12 7.426 -8.260 2.946 1.00 0.00 O ATOM 182 CB GLU A 12 9.178 -10.674 1.372 1.00 0.00 C ATOM 183 CG GLU A 12 10.686 -10.910 1.430 1.00 0.00 C ATOM 184 CD GLU A 12 11.161 -11.510 0.105 1.00 0.00 C ATOM 185 OE1 GLU A 12 11.036 -12.714 -0.056 1.00 0.00 O ATOM 186 OE2 GLU A 12 11.642 -10.758 -0.726 1.00 0.00 O ATOM 0 H GLU A 12 8.076 -12.351 2.757 1.00 0.00 H new ATOM 0 HA GLU A 12 9.410 -9.743 3.328 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.672 -11.570 1.013 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.951 -9.875 0.666 1.00 0.00 H new ATOM 0 HG2 GLU A 12 11.204 -9.971 1.623 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.928 -11.582 2.253 1.00 0.00 H new ATOM 193 N THR A 13 6.322 -10.031 2.259 1.00 0.00 N ATOM 194 CA THR A 13 5.055 -9.259 2.140 1.00 0.00 C ATOM 195 C THR A 13 4.759 -8.539 3.457 1.00 0.00 C ATOM 196 O THR A 13 4.508 -7.353 3.483 1.00 0.00 O ATOM 197 CB THR A 13 3.978 -10.302 1.843 1.00 0.00 C ATOM 198 OG1 THR A 13 3.820 -11.154 2.970 1.00 0.00 O ATOM 199 CG2 THR A 13 4.391 -11.132 0.628 1.00 0.00 C ATOM 0 H THR A 13 6.254 -11.017 2.008 1.00 0.00 H new ATOM 0 HA THR A 13 5.104 -8.497 1.362 1.00 0.00 H new ATOM 0 HB THR A 13 3.034 -9.799 1.633 1.00 0.00 H new ATOM 0 HG1 THR A 13 4.677 -11.582 3.180 1.00 0.00 H new ATOM 0 HG21 THR A 13 3.622 -11.876 0.417 1.00 0.00 H new ATOM 0 HG22 THR A 13 4.510 -10.478 -0.236 1.00 0.00 H new ATOM 0 HG23 THR A 13 5.335 -11.635 0.835 1.00 0.00 H new ATOM 207 N LYS A 14 4.794 -9.249 4.553 1.00 0.00 N ATOM 208 CA LYS A 14 4.520 -8.602 5.867 1.00 0.00 C ATOM 209 C LYS A 14 5.682 -7.683 6.241 1.00 0.00 C ATOM 210 O LYS A 14 5.489 -6.611 6.780 1.00 0.00 O ATOM 211 CB LYS A 14 4.396 -9.755 6.863 1.00 0.00 C ATOM 212 CG LYS A 14 3.281 -10.699 6.408 1.00 0.00 C ATOM 213 CD LYS A 14 3.652 -12.141 6.761 1.00 0.00 C ATOM 214 CE LYS A 14 2.497 -13.072 6.386 1.00 0.00 C ATOM 215 NZ LYS A 14 2.234 -12.801 4.943 1.00 0.00 N ATOM 0 H LYS A 14 5.000 -10.247 4.594 1.00 0.00 H new ATOM 0 HA LYS A 14 3.619 -7.989 5.852 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.340 -10.295 6.931 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.177 -9.369 7.859 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.342 -10.427 6.889 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.128 -10.605 5.333 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.557 -12.435 6.230 1.00 0.00 H new ATOM 0 HD3 LYS A 14 3.867 -12.222 7.827 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.763 -14.116 6.549 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.614 -12.870 6.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 1.701 -13.594 4.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.679 -11.926 4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.138 -12.693 4.440 1.00 0.00 H new ATOM 229 N GLU A 15 6.888 -8.085 5.947 1.00 0.00 N ATOM 230 CA GLU A 15 8.052 -7.219 6.276 1.00 0.00 C ATOM 231 C GLU A 15 7.967 -5.937 5.465 1.00 0.00 C ATOM 232 O GLU A 15 8.514 -4.912 5.819 1.00 0.00 O ATOM 233 CB GLU A 15 9.285 -8.026 5.876 1.00 0.00 C ATOM 234 CG GLU A 15 9.714 -8.902 7.049 1.00 0.00 C ATOM 235 CD GLU A 15 11.131 -9.425 6.804 1.00 0.00 C ATOM 236 OE1 GLU A 15 11.519 -9.511 5.650 1.00 0.00 O ATOM 237 OE2 GLU A 15 11.804 -9.729 7.775 1.00 0.00 O ATOM 0 H GLU A 15 7.116 -8.971 5.496 1.00 0.00 H new ATOM 0 HA GLU A 15 8.084 -6.942 7.330 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.063 -8.645 5.007 1.00 0.00 H new ATOM 0 HB3 GLU A 15 10.096 -7.356 5.591 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.682 -8.329 7.976 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.022 -9.736 7.166 1.00 0.00 H new ATOM 244 N TYR A 16 7.266 -6.004 4.382 1.00 0.00 N ATOM 245 CA TYR A 16 7.098 -4.813 3.510 1.00 0.00 C ATOM 246 C TYR A 16 5.892 -3.999 3.980 1.00 0.00 C ATOM 247 O TYR A 16 5.857 -2.795 3.840 1.00 0.00 O ATOM 248 CB TYR A 16 6.871 -5.371 2.104 1.00 0.00 C ATOM 249 CG TYR A 16 8.199 -5.497 1.392 1.00 0.00 C ATOM 250 CD1 TYR A 16 9.078 -4.407 1.352 1.00 0.00 C ATOM 251 CD2 TYR A 16 8.551 -6.701 0.770 1.00 0.00 C ATOM 252 CE1 TYR A 16 10.309 -4.523 0.693 1.00 0.00 C ATOM 253 CE2 TYR A 16 9.781 -6.817 0.111 1.00 0.00 C ATOM 254 CZ TYR A 16 10.660 -5.728 0.072 1.00 0.00 C ATOM 255 OH TYR A 16 11.871 -5.842 -0.578 1.00 0.00 O ATOM 0 H TYR A 16 6.792 -6.845 4.054 1.00 0.00 H new ATOM 0 HA TYR A 16 7.962 -4.148 3.536 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.383 -6.344 2.162 1.00 0.00 H new ATOM 0 HB3 TYR A 16 6.206 -4.714 1.543 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.807 -3.477 1.829 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.873 -7.541 0.799 1.00 0.00 H new ATOM 0 HE1 TYR A 16 10.987 -3.683 0.664 1.00 0.00 H new ATOM 0 HE2 TYR A 16 10.052 -7.747 -0.367 1.00 0.00 H new ATOM 0 HH TYR A 16 11.957 -6.743 -0.953 1.00 0.00 H new ATOM 265 N LEU A 17 4.910 -4.640 4.559 1.00 0.00 N ATOM 266 CA LEU A 17 3.731 -3.878 5.056 1.00 0.00 C ATOM 267 C LEU A 17 4.195 -2.956 6.174 1.00 0.00 C ATOM 268 O LEU A 17 3.801 -1.810 6.266 1.00 0.00 O ATOM 269 CB LEU A 17 2.759 -4.927 5.591 1.00 0.00 C ATOM 270 CG LEU A 17 2.167 -5.704 4.421 1.00 0.00 C ATOM 271 CD1 LEU A 17 1.452 -6.952 4.942 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.169 -4.815 3.676 1.00 0.00 C ATOM 0 H LEU A 17 4.875 -5.649 4.707 1.00 0.00 H new ATOM 0 HA LEU A 17 3.259 -3.270 4.285 1.00 0.00 H new ATOM 0 HB2 LEU A 17 3.275 -5.606 6.270 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.965 -4.447 6.163 1.00 0.00 H new ATOM 0 HG LEU A 17 2.965 -6.004 3.743 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.030 -7.506 4.104 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.164 -7.584 5.473 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.652 -6.656 5.621 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.744 -5.368 2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.371 -4.515 4.355 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.680 -3.928 3.303 1.00 0.00 H new ATOM 284 N GLN A 18 5.066 -3.449 7.005 1.00 0.00 N ATOM 285 CA GLN A 18 5.608 -2.611 8.102 1.00 0.00 C ATOM 286 C GLN A 18 6.472 -1.545 7.468 1.00 0.00 C ATOM 287 O GLN A 18 6.328 -0.365 7.711 1.00 0.00 O ATOM 288 CB GLN A 18 6.408 -3.587 8.966 1.00 0.00 C ATOM 289 CG GLN A 18 7.887 -3.184 9.054 1.00 0.00 C ATOM 290 CD GLN A 18 8.539 -3.885 10.247 1.00 0.00 C ATOM 291 OE1 GLN A 18 9.418 -4.707 10.080 1.00 0.00 O ATOM 292 NE2 GLN A 18 8.142 -3.590 11.455 1.00 0.00 N ATOM 0 H GLN A 18 5.427 -4.402 6.970 1.00 0.00 H new ATOM 0 HA GLN A 18 4.861 -2.101 8.711 1.00 0.00 H new ATOM 0 HB2 GLN A 18 5.980 -3.622 9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 18 6.328 -4.591 8.550 1.00 0.00 H new ATOM 0 HG2 GLN A 18 8.404 -3.455 8.133 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.974 -2.103 9.162 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.404 -2.900 11.595 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.570 -4.050 12.259 1.00 0.00 H new ATOM 301 N ASN A 19 7.329 -1.970 6.605 1.00 0.00 N ATOM 302 CA ASN A 19 8.174 -1.005 5.875 1.00 0.00 C ATOM 303 C ASN A 19 7.238 -0.101 5.091 1.00 0.00 C ATOM 304 O ASN A 19 7.543 1.032 4.773 1.00 0.00 O ATOM 305 CB ASN A 19 9.042 -1.858 4.944 1.00 0.00 C ATOM 306 CG ASN A 19 10.465 -1.931 5.501 1.00 0.00 C ATOM 307 OD1 ASN A 19 10.687 -1.667 6.666 1.00 0.00 O ATOM 308 ND2 ASN A 19 11.446 -2.281 4.715 1.00 0.00 N ATOM 0 H ASN A 19 7.484 -2.950 6.370 1.00 0.00 H new ATOM 0 HA ASN A 19 8.803 -0.383 6.511 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.623 -2.860 4.855 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.053 -1.427 3.943 1.00 0.00 H new ATOM 0 HD21 ASN A 19 12.397 -2.333 5.079 1.00 0.00 H new ATOM 0 HD22 ASN A 19 11.261 -2.503 3.737 1.00 0.00 H new ATOM 315 N LEU A 20 6.073 -0.609 4.814 1.00 0.00 N ATOM 316 CA LEU A 20 5.055 0.186 4.082 1.00 0.00 C ATOM 317 C LEU A 20 4.175 0.923 5.083 1.00 0.00 C ATOM 318 O LEU A 20 3.440 1.827 4.737 1.00 0.00 O ATOM 319 CB LEU A 20 4.243 -0.830 3.281 1.00 0.00 C ATOM 320 CG LEU A 20 3.038 -0.136 2.648 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.522 0.950 1.686 1.00 0.00 C ATOM 322 CD2 LEU A 20 2.206 -1.166 1.881 1.00 0.00 C ATOM 0 H LEU A 20 5.780 -1.553 5.067 1.00 0.00 H new ATOM 0 HA LEU A 20 5.498 0.936 3.427 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.865 -1.279 2.507 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.910 -1.639 3.931 1.00 0.00 H new ATOM 0 HG LEU A 20 2.427 0.318 3.428 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.663 1.445 1.234 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.116 1.682 2.233 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.132 0.498 0.904 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.345 -0.674 1.428 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.817 -1.619 1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.862 -1.940 2.567 1.00 0.00 H new ATOM 334 N ASN A 21 4.283 0.574 6.333 1.00 0.00 N ATOM 335 CA ASN A 21 3.506 1.278 7.369 1.00 0.00 C ATOM 336 C ASN A 21 4.397 2.378 7.873 1.00 0.00 C ATOM 337 O ASN A 21 3.966 3.445 8.256 1.00 0.00 O ATOM 338 CB ASN A 21 3.226 0.248 8.458 1.00 0.00 C ATOM 339 CG ASN A 21 1.830 -0.345 8.259 1.00 0.00 C ATOM 340 OD1 ASN A 21 1.011 -0.318 9.156 1.00 0.00 O ATOM 341 ND2 ASN A 21 1.523 -0.888 7.113 1.00 0.00 N ATOM 0 H ASN A 21 4.883 -0.176 6.677 1.00 0.00 H new ATOM 0 HA ASN A 21 2.564 1.701 7.020 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.976 -0.543 8.426 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.297 0.715 9.440 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.596 -1.289 6.971 1.00 0.00 H new ATOM 0 HD22 ASN A 21 2.210 -0.911 6.359 1.00 0.00 H new ATOM 348 N ASP A 22 5.665 2.113 7.829 1.00 0.00 N ATOM 349 CA ASP A 22 6.638 3.125 8.256 1.00 0.00 C ATOM 350 C ASP A 22 6.684 4.197 7.191 1.00 0.00 C ATOM 351 O ASP A 22 6.944 5.356 7.440 1.00 0.00 O ATOM 352 CB ASP A 22 7.977 2.398 8.389 1.00 0.00 C ATOM 353 CG ASP A 22 8.222 2.039 9.856 1.00 0.00 C ATOM 354 OD1 ASP A 22 7.869 2.838 10.708 1.00 0.00 O ATOM 355 OD2 ASP A 22 8.759 0.972 10.102 1.00 0.00 O ATOM 0 H ASP A 22 6.066 1.230 7.512 1.00 0.00 H new ATOM 0 HA ASP A 22 6.385 3.601 9.204 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.974 1.495 7.779 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.784 3.030 8.019 1.00 0.00 H new ATOM 360 N THR A 23 6.387 3.795 6.007 1.00 0.00 N ATOM 361 CA THR A 23 6.343 4.732 4.867 1.00 0.00 C ATOM 362 C THR A 23 4.998 5.438 4.871 1.00 0.00 C ATOM 363 O THR A 23 4.889 6.612 4.589 1.00 0.00 O ATOM 364 CB THR A 23 6.408 3.815 3.668 1.00 0.00 C ATOM 365 OG1 THR A 23 7.634 3.098 3.681 1.00 0.00 O ATOM 366 CG2 THR A 23 6.288 4.630 2.380 1.00 0.00 C ATOM 0 H THR A 23 6.166 2.828 5.770 1.00 0.00 H new ATOM 0 HA THR A 23 7.131 5.485 4.885 1.00 0.00 H new ATOM 0 HB THR A 23 5.581 3.107 3.712 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.451 2.139 3.760 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.336 3.961 1.521 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.337 5.162 2.373 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.106 5.349 2.327 1.00 0.00 H new ATOM 374 N LEU A 24 3.968 4.705 5.193 1.00 0.00 N ATOM 375 CA LEU A 24 2.608 5.293 5.222 1.00 0.00 C ATOM 376 C LEU A 24 2.402 6.019 6.537 1.00 0.00 C ATOM 377 O LEU A 24 1.658 6.977 6.616 1.00 0.00 O ATOM 378 CB LEU A 24 1.650 4.107 5.103 1.00 0.00 C ATOM 379 CG LEU A 24 1.658 3.582 3.667 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.722 2.376 3.559 1.00 0.00 C ATOM 381 CD2 LEU A 24 1.176 4.685 2.721 1.00 0.00 C ATOM 0 H LEU A 24 4.015 3.716 5.439 1.00 0.00 H new ATOM 0 HA LEU A 24 2.446 6.014 4.421 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.947 3.316 5.792 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.642 4.412 5.384 1.00 0.00 H new ATOM 0 HG LEU A 24 2.670 3.282 3.395 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.728 2.002 2.535 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.061 1.591 4.234 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.290 2.676 3.830 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.181 4.313 1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.164 4.982 2.995 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.840 5.546 2.798 1.00 0.00 H new ATOM 393 N LEU A 25 3.065 5.595 7.576 1.00 0.00 N ATOM 394 CA LEU A 25 2.879 6.322 8.862 1.00 0.00 C ATOM 395 C LEU A 25 3.821 7.506 8.913 1.00 0.00 C ATOM 396 O LEU A 25 3.615 8.460 9.635 1.00 0.00 O ATOM 397 CB LEU A 25 3.145 5.320 9.970 1.00 0.00 C ATOM 398 CG LEU A 25 4.632 5.198 10.200 1.00 0.00 C ATOM 399 CD1 LEU A 25 5.111 6.340 11.102 1.00 0.00 C ATOM 400 CD2 LEU A 25 4.923 3.855 10.870 1.00 0.00 C ATOM 0 H LEU A 25 3.707 4.803 7.594 1.00 0.00 H new ATOM 0 HA LEU A 25 1.871 6.722 8.971 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.650 5.638 10.888 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.728 4.349 9.703 1.00 0.00 H new ATOM 0 HG LEU A 25 5.157 5.255 9.247 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.185 6.248 11.266 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.897 7.296 10.624 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.592 6.289 12.059 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.995 3.758 11.040 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.398 3.803 11.824 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.583 3.045 10.224 1.00 0.00 H new ATOM 412 N GLU A 26 4.809 7.477 8.091 1.00 0.00 N ATOM 413 CA GLU A 26 5.729 8.626 8.004 1.00 0.00 C ATOM 414 C GLU A 26 5.181 9.503 6.911 1.00 0.00 C ATOM 415 O GLU A 26 5.374 10.702 6.876 1.00 0.00 O ATOM 416 CB GLU A 26 7.099 8.065 7.643 1.00 0.00 C ATOM 417 CG GLU A 26 7.693 7.348 8.857 1.00 0.00 C ATOM 418 CD GLU A 26 7.862 8.344 10.006 1.00 0.00 C ATOM 419 OE1 GLU A 26 8.296 9.453 9.743 1.00 0.00 O ATOM 420 OE2 GLU A 26 7.554 7.980 11.129 1.00 0.00 O ATOM 0 H GLU A 26 5.025 6.700 7.467 1.00 0.00 H new ATOM 0 HA GLU A 26 5.820 9.201 8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.011 7.373 6.806 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.761 8.870 7.323 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.042 6.530 9.164 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.656 6.909 8.598 1.00 0.00 H new ATOM 427 N LEU A 27 4.465 8.886 6.021 1.00 0.00 N ATOM 428 CA LEU A 27 3.851 9.629 4.921 1.00 0.00 C ATOM 429 C LEU A 27 2.836 10.604 5.502 1.00 0.00 C ATOM 430 O LEU A 27 2.626 11.684 4.989 1.00 0.00 O ATOM 431 CB LEU A 27 3.166 8.574 4.048 1.00 0.00 C ATOM 432 CG LEU A 27 2.192 9.247 3.083 1.00 0.00 C ATOM 433 CD1 LEU A 27 2.975 9.896 1.941 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.238 8.193 2.515 1.00 0.00 C ATOM 0 H LEU A 27 4.283 7.882 6.018 1.00 0.00 H new ATOM 0 HA LEU A 27 4.569 10.205 4.338 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.914 8.011 3.489 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.633 7.860 4.676 1.00 0.00 H new ATOM 0 HG LEU A 27 1.621 10.011 3.610 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.281 10.377 1.251 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.659 10.642 2.346 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.544 9.133 1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.540 8.668 1.825 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.811 7.432 1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.683 7.728 3.330 1.00 0.00 H new ATOM 446 N GLU A 28 2.214 10.235 6.587 1.00 0.00 N ATOM 447 CA GLU A 28 1.228 11.151 7.213 1.00 0.00 C ATOM 448 C GLU A 28 1.961 12.384 7.731 1.00 0.00 C ATOM 449 O GLU A 28 1.513 13.503 7.577 1.00 0.00 O ATOM 450 CB GLU A 28 0.620 10.335 8.347 1.00 0.00 C ATOM 451 CG GLU A 28 1.432 10.506 9.630 1.00 0.00 C ATOM 452 CD GLU A 28 0.791 9.694 10.757 1.00 0.00 C ATOM 453 OE1 GLU A 28 0.899 8.480 10.723 1.00 0.00 O ATOM 454 OE2 GLU A 28 0.203 10.302 11.639 1.00 0.00 O ATOM 0 H GLU A 28 2.347 9.343 7.063 1.00 0.00 H new ATOM 0 HA GLU A 28 0.457 11.507 6.529 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.409 10.650 8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.589 9.282 8.068 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.458 10.176 9.469 1.00 0.00 H new ATOM 0 HG3 GLU A 28 1.476 11.559 9.907 1.00 0.00 H new ATOM 461 N LYS A 29 3.111 12.180 8.310 1.00 0.00 N ATOM 462 CA LYS A 29 3.903 13.336 8.797 1.00 0.00 C ATOM 463 C LYS A 29 4.599 13.954 7.599 1.00 0.00 C ATOM 464 O LYS A 29 5.092 15.064 7.637 1.00 0.00 O ATOM 465 CB LYS A 29 4.929 12.770 9.779 1.00 0.00 C ATOM 466 CG LYS A 29 4.216 11.957 10.854 1.00 0.00 C ATOM 467 CD LYS A 29 5.054 10.730 11.187 1.00 0.00 C ATOM 468 CE LYS A 29 6.387 11.171 11.798 1.00 0.00 C ATOM 469 NZ LYS A 29 6.339 10.697 13.209 1.00 0.00 N ATOM 0 H LYS A 29 3.533 11.265 8.465 1.00 0.00 H new ATOM 0 HA LYS A 29 3.292 14.096 9.284 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.646 12.142 9.250 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.494 13.581 10.238 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.066 12.564 11.747 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.229 11.655 10.504 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.517 10.088 11.885 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.232 10.143 10.286 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.230 10.734 11.263 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.505 12.253 11.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.220 10.962 13.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.530 11.135 13.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.233 9.662 13.224 1.00 0.00 H new ATOM 483 N ASN A 30 4.611 13.227 6.524 1.00 0.00 N ATOM 484 CA ASN A 30 5.243 13.738 5.275 1.00 0.00 C ATOM 485 C ASN A 30 4.475 13.192 4.094 1.00 0.00 C ATOM 486 O ASN A 30 4.888 12.263 3.428 1.00 0.00 O ATOM 487 CB ASN A 30 6.690 13.246 5.295 1.00 0.00 C ATOM 488 CG ASN A 30 7.562 14.261 6.039 1.00 0.00 C ATOM 489 OD1 ASN A 30 7.292 15.445 6.013 1.00 0.00 O ATOM 490 ND2 ASN A 30 8.604 13.844 6.703 1.00 0.00 N ATOM 0 H ASN A 30 4.208 12.293 6.452 1.00 0.00 H new ATOM 0 HA ASN A 30 5.228 14.825 5.201 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.748 12.273 5.783 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.055 13.114 4.276 1.00 0.00 H new ATOM 0 HD21 ASN A 30 9.192 14.512 7.201 1.00 0.00 H new ATOM 0 HD22 ASN A 30 8.831 12.850 6.725 1.00 0.00 H new ATOM 497 N PRO A 31 3.342 13.791 3.924 1.00 0.00 N ATOM 498 CA PRO A 31 2.409 13.394 2.865 1.00 0.00 C ATOM 499 C PRO A 31 2.720 14.097 1.543 1.00 0.00 C ATOM 500 O PRO A 31 1.935 14.071 0.617 1.00 0.00 O ATOM 501 CB PRO A 31 1.078 13.856 3.430 1.00 0.00 C ATOM 502 CG PRO A 31 1.379 14.989 4.358 1.00 0.00 C ATOM 503 CD PRO A 31 2.830 14.907 4.722 1.00 0.00 C ATOM 0 HA PRO A 31 2.447 12.331 2.629 1.00 0.00 H new ATOM 0 HB2 PRO A 31 0.408 14.176 2.632 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.579 13.044 3.959 1.00 0.00 H new ATOM 0 HG2 PRO A 31 1.158 15.944 3.880 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.757 14.928 5.251 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.352 15.835 4.488 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.963 14.727 5.789 1.00 0.00 H new ATOM 511 N GLU A 32 3.854 14.726 1.443 1.00 0.00 N ATOM 512 CA GLU A 32 4.203 15.429 0.176 1.00 0.00 C ATOM 513 C GLU A 32 5.712 15.365 -0.060 1.00 0.00 C ATOM 514 O GLU A 32 6.245 16.032 -0.923 1.00 0.00 O ATOM 515 CB GLU A 32 3.742 16.886 0.350 1.00 0.00 C ATOM 516 CG GLU A 32 3.582 17.232 1.835 1.00 0.00 C ATOM 517 CD GLU A 32 3.676 18.747 2.018 1.00 0.00 C ATOM 518 OE1 GLU A 32 4.780 19.264 1.970 1.00 0.00 O ATOM 519 OE2 GLU A 32 2.642 19.367 2.203 1.00 0.00 O ATOM 0 H GLU A 32 4.555 14.785 2.181 1.00 0.00 H new ATOM 0 HA GLU A 32 3.720 14.967 -0.685 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.466 17.559 -0.109 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.795 17.037 -0.167 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.622 16.869 2.203 1.00 0.00 H new ATOM 0 HG3 GLU A 32 4.356 16.735 2.421 1.00 0.00 H new ATOM 526 N ASP A 33 6.406 14.560 0.699 1.00 0.00 N ATOM 527 CA ASP A 33 7.878 14.451 0.511 1.00 0.00 C ATOM 528 C ASP A 33 8.185 13.738 -0.802 1.00 0.00 C ATOM 529 O ASP A 33 9.307 13.717 -1.271 1.00 0.00 O ATOM 530 CB ASP A 33 8.372 13.632 1.701 1.00 0.00 C ATOM 531 CG ASP A 33 8.831 14.575 2.815 1.00 0.00 C ATOM 532 OD1 ASP A 33 8.095 15.496 3.124 1.00 0.00 O ATOM 533 OD2 ASP A 33 9.912 14.358 3.339 1.00 0.00 O ATOM 0 H ASP A 33 6.017 13.975 1.439 1.00 0.00 H new ATOM 0 HA ASP A 33 8.364 15.425 0.464 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.576 12.983 2.065 1.00 0.00 H new ATOM 0 HB3 ASP A 33 9.195 12.986 1.395 1.00 0.00 H new ATOM 538 N MET A 34 7.189 13.148 -1.388 1.00 0.00 N ATOM 539 CA MET A 34 7.381 12.415 -2.667 1.00 0.00 C ATOM 540 C MET A 34 8.287 11.211 -2.450 1.00 0.00 C ATOM 541 O MET A 34 8.632 10.505 -3.376 1.00 0.00 O ATOM 542 CB MET A 34 8.019 13.421 -3.624 1.00 0.00 C ATOM 543 CG MET A 34 6.977 13.868 -4.649 1.00 0.00 C ATOM 544 SD MET A 34 7.403 13.191 -6.274 1.00 0.00 S ATOM 545 CE MET A 34 5.816 13.508 -7.079 1.00 0.00 C ATOM 0 H MET A 34 6.234 13.141 -1.031 1.00 0.00 H new ATOM 0 HA MET A 34 6.442 12.032 -3.067 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.394 14.281 -3.070 1.00 0.00 H new ATOM 0 HB3 MET A 34 8.873 12.970 -4.129 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.986 13.527 -4.349 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.939 14.956 -4.695 1.00 0.00 H new ATOM 0 HE1 MET A 34 5.488 12.610 -7.603 1.00 0.00 H new ATOM 0 HE2 MET A 34 5.075 13.781 -6.328 1.00 0.00 H new ATOM 0 HE3 MET A 34 5.927 14.324 -7.793 1.00 0.00 H new ATOM 555 N GLU A 35 8.641 10.945 -1.228 1.00 0.00 N ATOM 556 CA GLU A 35 9.479 9.763 -0.952 1.00 0.00 C ATOM 557 C GLU A 35 8.592 8.730 -0.289 1.00 0.00 C ATOM 558 O GLU A 35 8.623 7.562 -0.614 1.00 0.00 O ATOM 559 CB GLU A 35 10.584 10.245 -0.016 1.00 0.00 C ATOM 560 CG GLU A 35 11.692 10.894 -0.844 1.00 0.00 C ATOM 561 CD GLU A 35 13.017 10.811 -0.083 1.00 0.00 C ATOM 562 OE1 GLU A 35 13.121 11.442 0.955 1.00 0.00 O ATOM 563 OE2 GLU A 35 13.903 10.117 -0.553 1.00 0.00 O ATOM 0 H GLU A 35 8.384 11.499 -0.411 1.00 0.00 H new ATOM 0 HA GLU A 35 9.922 9.315 -1.842 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.183 10.960 0.702 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.984 9.408 0.557 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.782 10.391 -1.807 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.444 11.935 -1.050 1.00 0.00 H new ATOM 570 N LEU A 36 7.749 9.167 0.602 1.00 0.00 N ATOM 571 CA LEU A 36 6.810 8.212 1.234 1.00 0.00 C ATOM 572 C LEU A 36 5.683 7.964 0.242 1.00 0.00 C ATOM 573 O LEU A 36 5.026 6.941 0.262 1.00 0.00 O ATOM 574 CB LEU A 36 6.297 8.898 2.497 1.00 0.00 C ATOM 575 CG LEU A 36 7.483 9.267 3.380 1.00 0.00 C ATOM 576 CD1 LEU A 36 7.403 10.745 3.750 1.00 0.00 C ATOM 577 CD2 LEU A 36 7.459 8.416 4.650 1.00 0.00 C ATOM 0 H LEU A 36 7.672 10.135 0.915 1.00 0.00 H new ATOM 0 HA LEU A 36 7.265 7.255 1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.730 9.792 2.236 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.619 8.236 3.035 1.00 0.00 H new ATOM 0 HG LEU A 36 8.411 9.081 2.839 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.251 11.008 4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 36 7.425 11.349 2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.476 10.935 4.290 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.307 8.680 5.281 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.532 8.599 5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.521 7.361 4.382 1.00 0.00 H new ATOM 589 N ILE A 37 5.482 8.891 -0.660 1.00 0.00 N ATOM 590 CA ILE A 37 4.429 8.705 -1.687 1.00 0.00 C ATOM 591 C ILE A 37 4.951 7.723 -2.733 1.00 0.00 C ATOM 592 O ILE A 37 4.212 6.935 -3.289 1.00 0.00 O ATOM 593 CB ILE A 37 4.213 10.092 -2.292 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.583 11.007 -1.238 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.283 9.984 -3.503 1.00 0.00 C ATOM 596 CD1 ILE A 37 3.197 12.341 -1.877 1.00 0.00 C ATOM 0 H ILE A 37 6.004 9.765 -0.725 1.00 0.00 H new ATOM 0 HA ILE A 37 3.496 8.306 -1.289 1.00 0.00 H new ATOM 0 HB ILE A 37 5.169 10.507 -2.611 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.702 10.530 -0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.285 11.174 -0.421 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.130 10.974 -3.933 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.732 9.329 -4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.324 9.572 -3.189 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.749 12.989 -1.124 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.087 12.820 -2.285 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.479 12.166 -2.679 1.00 0.00 H new ATOM 608 N ASN A 38 6.236 7.752 -2.986 1.00 0.00 N ATOM 609 CA ASN A 38 6.816 6.807 -3.976 1.00 0.00 C ATOM 610 C ASN A 38 7.270 5.539 -3.266 1.00 0.00 C ATOM 611 O ASN A 38 7.185 4.449 -3.794 1.00 0.00 O ATOM 612 CB ASN A 38 8.003 7.543 -4.601 1.00 0.00 C ATOM 613 CG ASN A 38 8.267 6.992 -6.004 1.00 0.00 C ATOM 614 OD1 ASN A 38 7.364 6.890 -6.809 1.00 0.00 O ATOM 615 ND2 ASN A 38 9.478 6.633 -6.334 1.00 0.00 N ATOM 0 H ASN A 38 6.903 8.389 -2.549 1.00 0.00 H new ATOM 0 HA ASN A 38 6.096 6.508 -4.738 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.795 8.612 -4.652 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.889 7.420 -3.978 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.665 6.267 -7.268 1.00 0.00 H new ATOM 0 HD22 ASN A 38 10.237 6.718 -5.658 1.00 0.00 H new ATOM 622 N GLU A 39 7.729 5.676 -2.063 1.00 0.00 N ATOM 623 CA GLU A 39 8.169 4.475 -1.301 1.00 0.00 C ATOM 624 C GLU A 39 6.955 3.594 -1.043 1.00 0.00 C ATOM 625 O GLU A 39 7.057 2.400 -0.838 1.00 0.00 O ATOM 626 CB GLU A 39 8.748 5.006 0.011 1.00 0.00 C ATOM 627 CG GLU A 39 10.157 5.550 -0.235 1.00 0.00 C ATOM 628 CD GLU A 39 11.181 4.436 -0.015 1.00 0.00 C ATOM 629 OE1 GLU A 39 11.160 3.481 -0.775 1.00 0.00 O ATOM 630 OE2 GLU A 39 11.969 4.556 0.908 1.00 0.00 O ATOM 0 H GLU A 39 7.821 6.564 -1.570 1.00 0.00 H new ATOM 0 HA GLU A 39 8.909 3.879 -1.835 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.108 5.792 0.411 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.779 4.210 0.755 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.237 5.936 -1.251 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.359 6.382 0.439 1.00 0.00 H new ATOM 637 N ALA A 40 5.806 4.191 -1.076 1.00 0.00 N ATOM 638 CA ALA A 40 4.551 3.427 -0.859 1.00 0.00 C ATOM 639 C ALA A 40 4.016 2.931 -2.206 1.00 0.00 C ATOM 640 O ALA A 40 3.820 1.748 -2.404 1.00 0.00 O ATOM 641 CB ALA A 40 3.583 4.422 -0.222 1.00 0.00 C ATOM 0 H ALA A 40 5.678 5.189 -1.246 1.00 0.00 H new ATOM 0 HA ALA A 40 4.695 2.551 -0.226 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.629 3.930 -0.031 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.000 4.784 0.718 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.428 5.263 -0.898 1.00 0.00 H new ATOM 647 N PHE A 41 3.788 3.822 -3.139 1.00 0.00 N ATOM 648 CA PHE A 41 3.281 3.378 -4.471 1.00 0.00 C ATOM 649 C PHE A 41 4.060 2.144 -4.934 1.00 0.00 C ATOM 650 O PHE A 41 3.544 1.297 -5.636 1.00 0.00 O ATOM 651 CB PHE A 41 3.536 4.559 -5.408 1.00 0.00 C ATOM 652 CG PHE A 41 3.357 4.115 -6.842 1.00 0.00 C ATOM 653 CD1 PHE A 41 4.412 3.492 -7.520 1.00 0.00 C ATOM 654 CD2 PHE A 41 2.138 4.332 -7.494 1.00 0.00 C ATOM 655 CE1 PHE A 41 4.245 3.085 -8.849 1.00 0.00 C ATOM 656 CE2 PHE A 41 1.971 3.924 -8.823 1.00 0.00 C ATOM 657 CZ PHE A 41 3.025 3.301 -9.500 1.00 0.00 C ATOM 0 H PHE A 41 3.930 4.827 -3.037 1.00 0.00 H new ATOM 0 HA PHE A 41 2.226 3.104 -4.447 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.848 5.373 -5.180 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.545 4.944 -5.259 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.354 3.326 -7.018 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.325 4.815 -6.972 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.058 2.604 -9.372 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.029 4.090 -9.325 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.897 2.987 -10.525 1.00 0.00 H new ATOM 667 N ARG A 42 5.300 2.034 -4.536 1.00 0.00 N ATOM 668 CA ARG A 42 6.115 0.853 -4.943 1.00 0.00 C ATOM 669 C ARG A 42 5.767 -0.347 -4.058 1.00 0.00 C ATOM 670 O ARG A 42 5.263 -1.348 -4.524 1.00 0.00 O ATOM 671 CB ARG A 42 7.568 1.273 -4.724 1.00 0.00 C ATOM 672 CG ARG A 42 7.883 2.498 -5.585 1.00 0.00 C ATOM 673 CD ARG A 42 9.179 3.147 -5.094 1.00 0.00 C ATOM 674 NE ARG A 42 10.201 2.802 -6.121 1.00 0.00 N ATOM 675 CZ ARG A 42 11.467 3.024 -5.884 1.00 0.00 C ATOM 676 NH1 ARG A 42 11.927 4.245 -5.889 1.00 0.00 N ATOM 677 NH2 ARG A 42 12.272 2.025 -5.645 1.00 0.00 N ATOM 0 H ARG A 42 5.783 2.712 -3.946 1.00 0.00 H new ATOM 0 HA ARG A 42 5.931 0.559 -5.976 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.736 1.502 -3.672 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.237 0.452 -4.982 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.984 2.205 -6.630 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.063 3.214 -5.532 1.00 0.00 H new ATOM 0 HD2 ARG A 42 9.067 4.227 -4.997 1.00 0.00 H new ATOM 0 HD3 ARG A 42 9.463 2.767 -4.113 1.00 0.00 H new ATOM 0 HE ARG A 42 9.913 2.392 -7.010 1.00 0.00 H new ATOM 0 HH11 ARG A 42 11.299 5.026 -6.078 1.00 0.00 H new ATOM 0 HH12 ARG A 42 12.915 4.419 -5.704 1.00 0.00 H new ATOM 0 HH21 ARG A 42 11.913 1.070 -5.643 1.00 0.00 H new ATOM 0 HH22 ARG A 42 13.260 2.199 -5.460 1.00 0.00 H new ATOM 691 N ALA A 43 6.026 -0.249 -2.781 1.00 0.00 N ATOM 692 CA ALA A 43 5.701 -1.381 -1.868 1.00 0.00 C ATOM 693 C ALA A 43 4.317 -1.934 -2.201 1.00 0.00 C ATOM 694 O ALA A 43 4.146 -3.119 -2.405 1.00 0.00 O ATOM 695 CB ALA A 43 5.714 -0.776 -0.464 1.00 0.00 C ATOM 0 H ALA A 43 6.448 0.564 -2.332 1.00 0.00 H new ATOM 0 HA ALA A 43 6.408 -2.206 -1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.483 -1.550 0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.701 -0.362 -0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.968 0.016 -0.402 1.00 0.00 H new ATOM 701 N LEU A 44 3.330 -1.086 -2.270 1.00 0.00 N ATOM 702 CA LEU A 44 1.962 -1.568 -2.603 1.00 0.00 C ATOM 703 C LEU A 44 1.962 -2.149 -4.015 1.00 0.00 C ATOM 704 O LEU A 44 1.392 -3.191 -4.271 1.00 0.00 O ATOM 705 CB LEU A 44 1.076 -0.327 -2.520 1.00 0.00 C ATOM 706 CG LEU A 44 0.883 0.063 -1.053 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.642 1.571 -0.955 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.322 -0.687 -0.481 1.00 0.00 C ATOM 0 H LEU A 44 3.411 -0.082 -2.111 1.00 0.00 H new ATOM 0 HA LEU A 44 1.610 -2.352 -1.932 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.532 0.496 -3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.110 -0.524 -2.985 1.00 0.00 H new ATOM 0 HG LEU A 44 1.776 -0.199 -0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.504 1.850 0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.501 2.104 -1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.251 1.834 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.460 -0.410 0.564 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.216 -0.425 -1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.149 -1.761 -0.552 1.00 0.00 H new ATOM 720 N HIS A 45 2.623 -1.496 -4.928 1.00 0.00 N ATOM 721 CA HIS A 45 2.689 -2.027 -6.316 1.00 0.00 C ATOM 722 C HIS A 45 3.449 -3.348 -6.284 1.00 0.00 C ATOM 723 O HIS A 45 3.151 -4.275 -7.011 1.00 0.00 O ATOM 724 CB HIS A 45 3.455 -0.963 -7.108 1.00 0.00 C ATOM 725 CG HIS A 45 4.063 -1.580 -8.339 1.00 0.00 C ATOM 726 ND1 HIS A 45 3.539 -2.390 -9.315 1.00 0.00 N flip ATOM 727 CD2 HIS A 45 5.392 -1.385 -8.683 1.00 0.00 C flip ATOM 728 CE1 HIS A 45 4.524 -2.696 -10.250 1.00 0.00 C flip ATOM 729 NE2 HIS A 45 5.620 -2.066 -9.820 1.00 0.00 N flip ATOM 0 H HIS A 45 3.120 -0.619 -4.773 1.00 0.00 H new ATOM 0 HA HIS A 45 1.713 -2.216 -6.763 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.782 -0.153 -7.391 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.236 -0.526 -6.486 1.00 0.00 H new ATOM 0 HD2 HIS A 45 6.113 -0.794 -8.137 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.423 -3.310 -11.133 1.00 0.00 H new ATOM 0 HE2 HIS A 45 6.521 -2.097 -10.296 1.00 0.00 H new ATOM 737 N THR A 46 4.418 -3.440 -5.418 1.00 0.00 N ATOM 738 CA THR A 46 5.197 -4.697 -5.297 1.00 0.00 C ATOM 739 C THR A 46 4.349 -5.724 -4.538 1.00 0.00 C ATOM 740 O THR A 46 4.276 -6.880 -4.902 1.00 0.00 O ATOM 741 CB THR A 46 6.460 -4.293 -4.514 1.00 0.00 C ATOM 742 OG1 THR A 46 7.560 -4.213 -5.410 1.00 0.00 O ATOM 743 CG2 THR A 46 6.777 -5.315 -3.416 1.00 0.00 C ATOM 0 H THR A 46 4.704 -2.692 -4.786 1.00 0.00 H new ATOM 0 HA THR A 46 5.464 -5.152 -6.251 1.00 0.00 H new ATOM 0 HB THR A 46 6.282 -3.325 -4.045 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.366 -3.954 -4.916 1.00 0.00 H new ATOM 0 HG21 THR A 46 7.673 -5.005 -2.879 1.00 0.00 H new ATOM 0 HG22 THR A 46 5.939 -5.374 -2.721 1.00 0.00 H new ATOM 0 HG23 THR A 46 6.944 -6.293 -3.867 1.00 0.00 H new ATOM 751 N LEU A 47 3.697 -5.297 -3.490 1.00 0.00 N ATOM 752 CA LEU A 47 2.843 -6.228 -2.708 1.00 0.00 C ATOM 753 C LEU A 47 1.598 -6.585 -3.520 1.00 0.00 C ATOM 754 O LEU A 47 1.151 -7.715 -3.527 1.00 0.00 O ATOM 755 CB LEU A 47 2.468 -5.443 -1.452 1.00 0.00 C ATOM 756 CG LEU A 47 3.255 -5.988 -0.262 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.193 -4.989 0.893 1.00 0.00 C ATOM 758 CD2 LEU A 47 2.648 -7.322 0.181 1.00 0.00 C ATOM 0 H LEU A 47 3.721 -4.338 -3.143 1.00 0.00 H new ATOM 0 HA LEU A 47 3.344 -7.165 -2.465 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.686 -4.384 -1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.398 -5.526 -1.263 1.00 0.00 H new ATOM 0 HG LEU A 47 4.295 -6.140 -0.552 1.00 0.00 H new ATOM 0 HD11 LEU A 47 3.755 -5.379 1.742 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.625 -4.040 0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.154 -4.835 1.185 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.208 -7.713 1.030 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.608 -7.170 0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.694 -8.034 -0.643 1.00 0.00 H new ATOM 770 N LYS A 48 1.045 -5.631 -4.219 1.00 0.00 N ATOM 771 CA LYS A 48 -0.160 -5.911 -5.043 1.00 0.00 C ATOM 772 C LYS A 48 0.153 -7.033 -6.039 1.00 0.00 C ATOM 773 O LYS A 48 -0.678 -7.868 -6.335 1.00 0.00 O ATOM 774 CB LYS A 48 -0.434 -4.589 -5.763 1.00 0.00 C ATOM 775 CG LYS A 48 -1.252 -4.826 -7.034 1.00 0.00 C ATOM 776 CD LYS A 48 -1.217 -3.555 -7.879 1.00 0.00 C ATOM 777 CE LYS A 48 -0.012 -3.605 -8.818 1.00 0.00 C ATOM 778 NZ LYS A 48 -0.421 -2.817 -10.013 1.00 0.00 N ATOM 0 H LYS A 48 1.379 -4.668 -4.253 1.00 0.00 H new ATOM 0 HA LYS A 48 -1.020 -6.241 -4.460 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.972 -3.912 -5.099 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.509 -4.105 -6.016 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -0.843 -5.666 -7.596 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.280 -5.083 -6.780 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.138 -3.462 -8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.154 -2.678 -7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.873 -3.177 -8.347 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.235 -4.632 -9.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.329 -2.862 -10.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -1.300 -3.211 -10.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.578 -1.826 -9.738 1.00 0.00 H new ATOM 792 N GLY A 49 1.352 -7.058 -6.553 1.00 0.00 N ATOM 793 CA GLY A 49 1.725 -8.124 -7.527 1.00 0.00 C ATOM 794 C GLY A 49 1.914 -9.449 -6.786 1.00 0.00 C ATOM 795 O GLY A 49 1.286 -10.441 -7.099 1.00 0.00 O ATOM 0 H GLY A 49 2.090 -6.387 -6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.948 -8.227 -8.285 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.644 -7.851 -8.047 1.00 0.00 H new ATOM 799 N MET A 50 2.774 -9.476 -5.804 1.00 0.00 N ATOM 800 CA MET A 50 3.000 -10.740 -5.045 1.00 0.00 C ATOM 801 C MET A 50 1.663 -11.307 -4.557 1.00 0.00 C ATOM 802 O MET A 50 1.485 -12.505 -4.455 1.00 0.00 O ATOM 803 CB MET A 50 3.881 -10.341 -3.859 1.00 0.00 C ATOM 804 CG MET A 50 5.333 -10.202 -4.324 1.00 0.00 C ATOM 805 SD MET A 50 6.080 -8.749 -3.544 1.00 0.00 S ATOM 806 CE MET A 50 5.462 -9.042 -1.868 1.00 0.00 C ATOM 0 H MET A 50 3.329 -8.678 -5.495 1.00 0.00 H new ATOM 0 HA MET A 50 3.469 -11.511 -5.656 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.533 -9.400 -3.434 1.00 0.00 H new ATOM 0 HB3 MET A 50 3.811 -11.091 -3.072 1.00 0.00 H new ATOM 0 HG2 MET A 50 5.897 -11.098 -4.064 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.371 -10.105 -5.409 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.059 -8.473 -1.155 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.421 -8.726 -1.804 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.533 -10.104 -1.634 1.00 0.00 H new ATOM 816 N ALA A 51 0.722 -10.454 -4.257 1.00 0.00 N ATOM 817 CA ALA A 51 -0.606 -10.937 -3.779 1.00 0.00 C ATOM 818 C ALA A 51 -1.551 -11.139 -4.963 1.00 0.00 C ATOM 819 O ALA A 51 -2.650 -11.636 -4.814 1.00 0.00 O ATOM 820 CB ALA A 51 -1.123 -9.827 -2.867 1.00 0.00 C ATOM 0 H ALA A 51 0.815 -9.440 -4.322 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.537 -11.893 -3.261 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.100 -10.106 -2.472 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.427 -9.681 -2.041 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.212 -8.901 -3.435 1.00 0.00 H new ATOM 826 N GLY A 52 -1.137 -10.754 -6.138 1.00 0.00 N ATOM 827 CA GLY A 52 -2.020 -10.922 -7.324 1.00 0.00 C ATOM 828 C GLY A 52 -1.793 -12.297 -7.952 1.00 0.00 C ATOM 829 O GLY A 52 -1.917 -12.473 -9.148 1.00 0.00 O ATOM 0 H GLY A 52 -0.228 -10.332 -6.327 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -3.064 -10.815 -7.029 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.814 -10.140 -8.055 1.00 0.00 H new ATOM 833 N THR A 53 -1.470 -13.276 -7.154 1.00 0.00 N ATOM 834 CA THR A 53 -1.245 -14.645 -7.700 1.00 0.00 C ATOM 835 C THR A 53 -0.950 -15.608 -6.555 1.00 0.00 C ATOM 836 O THR A 53 -1.342 -16.758 -6.561 1.00 0.00 O ATOM 837 CB THR A 53 -0.061 -14.498 -8.679 1.00 0.00 C ATOM 838 OG1 THR A 53 -0.477 -14.894 -9.977 1.00 0.00 O ATOM 839 CG2 THR A 53 1.131 -15.362 -8.247 1.00 0.00 C ATOM 0 H THR A 53 -1.352 -13.188 -6.145 1.00 0.00 H new ATOM 0 HA THR A 53 -2.113 -15.054 -8.217 1.00 0.00 H new ATOM 0 HB THR A 53 0.254 -13.455 -8.681 1.00 0.00 H new ATOM 0 HG1 THR A 53 -1.133 -14.252 -10.321 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.948 -15.236 -8.957 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.462 -15.055 -7.255 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.831 -16.410 -8.222 1.00 0.00 H new ATOM 847 N MET A 54 -0.280 -15.119 -5.572 1.00 0.00 N ATOM 848 CA MET A 54 0.047 -15.952 -4.387 1.00 0.00 C ATOM 849 C MET A 54 -0.709 -15.413 -3.184 1.00 0.00 C ATOM 850 O MET A 54 -0.832 -16.056 -2.160 1.00 0.00 O ATOM 851 CB MET A 54 1.540 -15.775 -4.188 1.00 0.00 C ATOM 852 CG MET A 54 2.160 -17.101 -3.746 1.00 0.00 C ATOM 853 SD MET A 54 3.370 -16.794 -2.436 1.00 0.00 S ATOM 854 CE MET A 54 4.646 -16.054 -3.483 1.00 0.00 C ATOM 0 H MET A 54 0.065 -14.160 -5.530 1.00 0.00 H new ATOM 0 HA MET A 54 -0.224 -17.000 -4.514 1.00 0.00 H new ATOM 0 HB2 MET A 54 2.003 -15.437 -5.115 1.00 0.00 H new ATOM 0 HB3 MET A 54 1.728 -15.006 -3.439 1.00 0.00 H new ATOM 0 HG2 MET A 54 1.383 -17.776 -3.387 1.00 0.00 H new ATOM 0 HG3 MET A 54 2.641 -17.590 -4.593 1.00 0.00 H new ATOM 0 HE1 MET A 54 5.558 -16.648 -3.420 1.00 0.00 H new ATOM 0 HE2 MET A 54 4.300 -16.029 -4.516 1.00 0.00 H new ATOM 0 HE3 MET A 54 4.851 -15.038 -3.144 1.00 0.00 H new ATOM 864 N GLY A 55 -1.231 -14.238 -3.322 1.00 0.00 N ATOM 865 CA GLY A 55 -2.010 -13.623 -2.218 1.00 0.00 C ATOM 866 C GLY A 55 -3.410 -13.326 -2.740 1.00 0.00 C ATOM 867 O GLY A 55 -4.224 -12.720 -2.074 1.00 0.00 O ATOM 0 H GLY A 55 -1.152 -13.666 -4.163 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -2.057 -14.297 -1.363 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.528 -12.707 -1.876 1.00 0.00 H new ATOM 871 N PHE A 56 -3.688 -13.752 -3.944 1.00 0.00 N ATOM 872 CA PHE A 56 -5.032 -13.501 -4.538 1.00 0.00 C ATOM 873 C PHE A 56 -5.196 -12.009 -4.836 1.00 0.00 C ATOM 874 O PHE A 56 -5.161 -11.182 -3.947 1.00 0.00 O ATOM 875 CB PHE A 56 -6.035 -13.960 -3.479 1.00 0.00 C ATOM 876 CG PHE A 56 -6.912 -15.041 -4.062 1.00 0.00 C ATOM 877 CD1 PHE A 56 -6.508 -16.379 -4.000 1.00 0.00 C ATOM 878 CD2 PHE A 56 -8.130 -14.705 -4.667 1.00 0.00 C ATOM 879 CE1 PHE A 56 -7.320 -17.383 -4.544 1.00 0.00 C ATOM 880 CE2 PHE A 56 -8.943 -15.709 -5.209 1.00 0.00 C ATOM 881 CZ PHE A 56 -8.537 -17.046 -5.148 1.00 0.00 C ATOM 0 H PHE A 56 -3.040 -14.264 -4.542 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.177 -14.032 -5.479 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.509 -14.336 -2.601 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -6.645 -13.119 -3.149 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -5.570 -16.638 -3.532 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -8.442 -13.672 -4.716 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -7.007 -18.416 -4.497 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -9.883 -15.451 -5.674 1.00 0.00 H new ATOM 0 HZ PHE A 56 -9.163 -17.819 -5.567 1.00 0.00 H new ATOM 891 N SER A 57 -5.371 -11.661 -6.080 1.00 0.00 N ATOM 892 CA SER A 57 -5.529 -10.224 -6.435 1.00 0.00 C ATOM 893 C SER A 57 -6.696 -9.624 -5.667 1.00 0.00 C ATOM 894 O SER A 57 -6.815 -8.425 -5.523 1.00 0.00 O ATOM 895 CB SER A 57 -5.805 -10.208 -7.937 1.00 0.00 C ATOM 896 OG SER A 57 -5.157 -11.317 -8.545 1.00 0.00 O ATOM 0 H SER A 57 -5.411 -12.310 -6.866 1.00 0.00 H new ATOM 0 HA SER A 57 -4.646 -9.637 -6.183 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.878 -10.253 -8.122 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.445 -9.277 -8.375 1.00 0.00 H new ATOM 0 HG SER A 57 -5.811 -12.028 -8.710 1.00 0.00 H new ATOM 902 N SER A 58 -7.547 -10.456 -5.156 1.00 0.00 N ATOM 903 CA SER A 58 -8.706 -9.949 -4.381 1.00 0.00 C ATOM 904 C SER A 58 -8.187 -9.121 -3.216 1.00 0.00 C ATOM 905 O SER A 58 -8.868 -8.272 -2.678 1.00 0.00 O ATOM 906 CB SER A 58 -9.437 -11.193 -3.884 1.00 0.00 C ATOM 907 OG SER A 58 -9.950 -11.913 -4.997 1.00 0.00 O ATOM 0 H SER A 58 -7.492 -11.471 -5.241 1.00 0.00 H new ATOM 0 HA SER A 58 -9.371 -9.316 -4.969 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.757 -11.823 -3.311 1.00 0.00 H new ATOM 0 HB3 SER A 58 -10.249 -10.909 -3.215 1.00 0.00 H new ATOM 0 HG SER A 58 -10.419 -12.714 -4.681 1.00 0.00 H new ATOM 913 N MET A 59 -6.965 -9.357 -2.839 1.00 0.00 N ATOM 914 CA MET A 59 -6.363 -8.586 -1.727 1.00 0.00 C ATOM 915 C MET A 59 -5.270 -7.682 -2.290 1.00 0.00 C ATOM 916 O MET A 59 -4.930 -6.661 -1.724 1.00 0.00 O ATOM 917 CB MET A 59 -5.779 -9.638 -0.784 1.00 0.00 C ATOM 918 CG MET A 59 -4.924 -8.953 0.283 1.00 0.00 C ATOM 919 SD MET A 59 -3.682 -10.116 0.897 1.00 0.00 S ATOM 920 CE MET A 59 -2.797 -10.336 -0.667 1.00 0.00 C ATOM 0 H MET A 59 -6.354 -10.058 -3.259 1.00 0.00 H new ATOM 0 HA MET A 59 -7.078 -7.949 -1.207 1.00 0.00 H new ATOM 0 HB2 MET A 59 -6.582 -10.204 -0.312 1.00 0.00 H new ATOM 0 HB3 MET A 59 -5.175 -10.350 -1.347 1.00 0.00 H new ATOM 0 HG2 MET A 59 -4.437 -8.072 -0.136 1.00 0.00 H new ATOM 0 HG3 MET A 59 -5.554 -8.610 1.104 1.00 0.00 H new ATOM 0 HE1 MET A 59 -3.048 -11.307 -1.093 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.087 -9.549 -1.363 1.00 0.00 H new ATOM 0 HE3 MET A 59 -1.723 -10.285 -0.488 1.00 0.00 H new ATOM 930 N ALA A 60 -4.726 -8.050 -3.417 1.00 0.00 N ATOM 931 CA ALA A 60 -3.664 -7.217 -4.037 1.00 0.00 C ATOM 932 C ALA A 60 -4.302 -6.063 -4.810 1.00 0.00 C ATOM 933 O ALA A 60 -3.743 -4.989 -4.904 1.00 0.00 O ATOM 934 CB ALA A 60 -2.914 -8.158 -4.978 1.00 0.00 C ATOM 0 H ALA A 60 -4.973 -8.894 -3.934 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.993 -6.776 -3.300 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.111 -7.613 -5.474 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.492 -8.984 -4.406 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.603 -8.550 -5.726 1.00 0.00 H new ATOM 940 N LYS A 61 -5.483 -6.256 -5.337 1.00 0.00 N ATOM 941 CA LYS A 61 -6.141 -5.135 -6.057 1.00 0.00 C ATOM 942 C LYS A 61 -6.340 -4.019 -5.052 1.00 0.00 C ATOM 943 O LYS A 61 -6.176 -2.850 -5.343 1.00 0.00 O ATOM 944 CB LYS A 61 -7.488 -5.677 -6.530 1.00 0.00 C ATOM 945 CG LYS A 61 -7.268 -6.811 -7.528 1.00 0.00 C ATOM 946 CD LYS A 61 -8.478 -7.743 -7.492 1.00 0.00 C ATOM 947 CE LYS A 61 -9.728 -6.957 -7.887 1.00 0.00 C ATOM 948 NZ LYS A 61 -10.048 -7.404 -9.272 1.00 0.00 N ATOM 0 H LYS A 61 -6.011 -7.128 -5.300 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.565 -4.759 -6.903 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -8.065 -6.037 -5.678 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.068 -4.880 -6.994 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.132 -6.409 -8.532 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.361 -7.361 -7.279 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -8.329 -8.579 -8.175 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.599 -8.164 -6.494 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -10.554 -7.162 -7.206 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.545 -5.883 -7.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.896 -6.906 -9.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.247 -7.189 -9.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.224 -8.429 -9.274 1.00 0.00 H new ATOM 962 N LEU A 62 -6.655 -4.394 -3.847 1.00 0.00 N ATOM 963 CA LEU A 62 -6.827 -3.393 -2.778 1.00 0.00 C ATOM 964 C LEU A 62 -5.484 -2.706 -2.562 1.00 0.00 C ATOM 965 O LEU A 62 -5.409 -1.512 -2.362 1.00 0.00 O ATOM 966 CB LEU A 62 -7.232 -4.208 -1.552 1.00 0.00 C ATOM 967 CG LEU A 62 -7.216 -3.313 -0.317 1.00 0.00 C ATOM 968 CD1 LEU A 62 -8.116 -2.098 -0.550 1.00 0.00 C ATOM 969 CD2 LEU A 62 -7.734 -4.103 0.886 1.00 0.00 C ATOM 0 H LEU A 62 -6.801 -5.362 -3.560 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.567 -2.624 -3.000 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.227 -4.630 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.547 -5.045 -1.416 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.197 -2.977 -0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -8.103 -1.460 0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.752 -1.535 -1.409 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.136 -2.432 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.724 -3.467 1.771 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.753 -4.437 0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.095 -4.969 1.055 1.00 0.00 H new ATOM 981 N CYS A 63 -4.415 -3.457 -2.637 1.00 0.00 N ATOM 982 CA CYS A 63 -3.071 -2.850 -2.471 1.00 0.00 C ATOM 983 C CYS A 63 -2.853 -1.855 -3.607 1.00 0.00 C ATOM 984 O CYS A 63 -2.290 -0.793 -3.428 1.00 0.00 O ATOM 985 CB CYS A 63 -2.086 -4.015 -2.570 1.00 0.00 C ATOM 986 SG CYS A 63 -1.900 -4.790 -0.945 1.00 0.00 S ATOM 0 H CYS A 63 -4.420 -4.463 -2.806 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.950 -2.318 -1.527 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.444 -4.747 -3.295 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.120 -3.659 -2.927 1.00 0.00 H new ATOM 0 HG CYS A 63 -1.064 -5.782 -1.030 1.00 0.00 H new ATOM 992 N HIS A 64 -3.328 -2.190 -4.775 1.00 0.00 N ATOM 993 CA HIS A 64 -3.193 -1.267 -5.930 1.00 0.00 C ATOM 994 C HIS A 64 -4.014 -0.018 -5.644 1.00 0.00 C ATOM 995 O HIS A 64 -3.622 1.091 -5.947 1.00 0.00 O ATOM 996 CB HIS A 64 -3.777 -2.032 -7.118 1.00 0.00 C ATOM 997 CG HIS A 64 -3.444 -1.314 -8.397 1.00 0.00 C ATOM 998 ND1 HIS A 64 -2.435 -0.441 -8.723 1.00 0.00 N flip ATOM 999 CD2 HIS A 64 -4.207 -1.457 -9.546 1.00 0.00 C flip ATOM 1000 CE1 HIS A 64 -2.568 -0.048 -10.052 1.00 0.00 C flip ATOM 1001 NE2 HIS A 64 -3.650 -0.689 -10.501 1.00 0.00 N flip ATOM 0 H HIS A 64 -3.806 -3.068 -4.977 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.165 -0.961 -6.122 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.375 -3.045 -7.143 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.858 -2.120 -7.010 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -5.088 -2.072 -9.655 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -1.932 0.630 -10.602 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -4.010 -0.607 -11.452 1.00 0.00 H new ATOM 1009 N THR A 65 -5.154 -0.206 -5.041 1.00 0.00 N ATOM 1010 CA THR A 65 -6.022 0.950 -4.702 1.00 0.00 C ATOM 1011 C THR A 65 -5.228 1.945 -3.845 1.00 0.00 C ATOM 1012 O THR A 65 -5.131 3.110 -4.166 1.00 0.00 O ATOM 1013 CB THR A 65 -7.195 0.322 -3.929 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.307 0.184 -4.801 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.593 1.196 -2.737 1.00 0.00 C ATOM 0 H THR A 65 -5.522 -1.117 -4.768 1.00 0.00 H new ATOM 0 HA THR A 65 -6.375 1.510 -5.568 1.00 0.00 H new ATOM 0 HB THR A 65 -6.884 -0.654 -3.555 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.212 -0.639 -5.325 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.424 0.731 -2.206 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.744 1.299 -2.062 1.00 0.00 H new ATOM 0 HG23 THR A 65 -7.895 2.181 -3.093 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.642 1.487 -2.771 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.837 2.400 -1.912 1.00 0.00 C ATOM 1025 C LEU A 66 -2.765 3.059 -2.772 1.00 0.00 C ATOM 1026 O LEU A 66 -2.636 4.264 -2.820 1.00 0.00 O ATOM 1027 CB LEU A 66 -3.183 1.488 -0.873 1.00 0.00 C ATOM 1028 CG LEU A 66 -4.203 1.107 0.197 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -5.013 -0.100 -0.271 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -3.469 0.749 1.489 1.00 0.00 C ATOM 0 H LEU A 66 -4.687 0.519 -2.452 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.433 3.184 -1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.796 0.590 -1.356 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.334 1.994 -0.415 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.874 1.948 0.373 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.740 -0.369 0.495 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.535 0.148 -1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.343 -0.942 -0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.194 0.476 2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.800 -0.092 1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.888 1.607 1.827 1.00 0.00 H new ATOM 1042 N GLU A 67 -2.007 2.258 -3.466 1.00 0.00 N ATOM 1043 CA GLU A 67 -0.940 2.800 -4.345 1.00 0.00 C ATOM 1044 C GLU A 67 -1.550 3.742 -5.368 1.00 0.00 C ATOM 1045 O GLU A 67 -0.884 4.593 -5.923 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.345 1.568 -5.026 1.00 0.00 C ATOM 1047 CG GLU A 67 0.429 1.990 -6.275 1.00 0.00 C ATOM 1048 CD GLU A 67 -0.471 1.855 -7.505 1.00 0.00 C ATOM 1049 OE1 GLU A 67 -1.665 2.070 -7.367 1.00 0.00 O ATOM 1050 OE2 GLU A 67 0.047 1.540 -8.562 1.00 0.00 O ATOM 0 H GLU A 67 -2.084 1.241 -3.460 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.186 3.368 -3.801 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.317 1.044 -4.336 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.139 0.872 -5.297 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.771 3.020 -6.173 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.317 1.369 -6.392 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.816 3.609 -5.608 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.466 4.511 -6.578 1.00 0.00 C ATOM 1059 C ASN A 68 -3.489 5.909 -5.991 1.00 0.00 C ATOM 1060 O ASN A 68 -3.148 6.875 -6.638 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.883 3.986 -6.713 1.00 0.00 C ATOM 1062 CG ASN A 68 -5.342 4.106 -8.168 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -5.768 5.160 -8.597 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -5.271 3.065 -8.952 1.00 0.00 N ATOM 0 H ASN A 68 -3.426 2.916 -5.175 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.954 4.547 -7.540 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.927 2.945 -6.392 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.553 4.549 -6.063 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -5.573 3.137 -9.924 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.914 2.180 -8.593 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.861 6.012 -4.747 1.00 0.00 N ATOM 1072 CA ILE A 69 -3.890 7.345 -4.090 1.00 0.00 C ATOM 1073 C ILE A 69 -2.483 7.879 -4.049 1.00 0.00 C ATOM 1074 O ILE A 69 -2.217 9.048 -4.249 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.415 7.079 -2.686 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -5.924 6.910 -2.753 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -4.076 8.262 -1.774 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.276 5.670 -3.572 1.00 0.00 C ATOM 0 H ILE A 69 -4.146 5.230 -4.157 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.511 8.076 -4.607 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.954 6.176 -2.285 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.333 6.819 -1.747 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.377 7.793 -3.203 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.454 8.067 -0.770 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.995 8.394 -1.736 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.538 9.168 -2.166 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.359 5.557 -3.614 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.883 5.778 -4.583 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.838 4.788 -3.104 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.586 6.996 -3.824 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.155 7.375 -3.799 1.00 0.00 C ATOM 1092 C LEU A 70 0.301 7.593 -5.231 1.00 0.00 C ATOM 1093 O LEU A 70 1.350 8.151 -5.492 1.00 0.00 O ATOM 1094 CB LEU A 70 0.562 6.201 -3.133 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.150 5.864 -1.817 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.718 4.930 -0.980 1.00 0.00 C ATOM 1097 CD2 LEU A 70 -0.414 7.152 -1.030 1.00 0.00 C ATOM 0 H LEU A 70 -1.774 6.008 -3.652 1.00 0.00 H new ATOM 0 HA LEU A 70 0.051 8.295 -3.252 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.561 5.335 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.605 6.455 -2.943 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.096 5.372 -2.042 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.205 4.695 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.902 4.010 -1.534 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.668 5.416 -0.759 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.920 6.910 -0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.533 7.646 -0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.043 7.817 -1.621 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.515 7.195 -6.166 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.173 7.417 -7.591 1.00 0.00 C ATOM 1111 C ASP A 71 -0.644 8.814 -7.976 1.00 0.00 C ATOM 1112 O ASP A 71 0.052 9.556 -8.638 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.929 6.340 -8.371 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.388 6.269 -9.801 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.787 6.539 -9.984 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -1.160 5.947 -10.690 1.00 0.00 O ATOM 0 H ASP A 71 -1.405 6.725 -6.001 1.00 0.00 H new ATOM 0 HA ASP A 71 0.895 7.352 -7.796 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.816 5.374 -7.880 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.995 6.567 -8.385 1.00 0.00 H new ATOM 1121 N LYS A 72 -1.808 9.202 -7.525 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.281 10.572 -7.829 1.00 0.00 C ATOM 1123 C LYS A 72 -1.448 11.522 -6.997 1.00 0.00 C ATOM 1124 O LYS A 72 -1.097 12.613 -7.400 1.00 0.00 O ATOM 1125 CB LYS A 72 -3.736 10.593 -7.395 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.594 10.024 -8.502 1.00 0.00 C ATOM 1127 CD LYS A 72 -4.651 8.521 -8.337 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.568 8.167 -7.155 1.00 0.00 C ATOM 1129 NZ LYS A 72 -6.624 7.269 -7.713 1.00 0.00 N ATOM 0 H LYS A 72 -2.442 8.631 -6.965 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.192 10.857 -8.877 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -3.864 10.010 -6.483 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.045 11.613 -7.167 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.597 10.448 -8.461 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.178 10.283 -9.476 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -5.024 8.058 -9.251 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -3.650 8.126 -8.165 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.010 7.669 -6.363 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.008 9.064 -6.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.319 7.047 -6.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.102 7.745 -8.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.187 6.388 -8.052 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.098 11.062 -5.841 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.240 11.856 -4.933 1.00 0.00 C ATOM 1145 C ALA A 73 1.061 12.164 -5.659 1.00 0.00 C ATOM 1146 O ALA A 73 1.586 13.258 -5.588 1.00 0.00 O ATOM 1147 CB ALA A 73 0.012 10.937 -3.741 1.00 0.00 C ATOM 0 H ALA A 73 -1.375 10.150 -5.477 1.00 0.00 H new ATOM 0 HA ALA A 73 -0.685 12.801 -4.621 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.643 11.448 -3.014 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -0.938 10.676 -3.276 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.511 10.029 -4.080 1.00 0.00 H new ATOM 1153 N ARG A 74 1.571 11.204 -6.383 1.00 0.00 N ATOM 1154 CA ARG A 74 2.822 11.444 -7.143 1.00 0.00 C ATOM 1155 C ARG A 74 2.465 11.957 -8.537 1.00 0.00 C ATOM 1156 O ARG A 74 3.303 12.453 -9.263 1.00 0.00 O ATOM 1157 CB ARG A 74 3.526 10.088 -7.218 1.00 0.00 C ATOM 1158 CG ARG A 74 2.745 9.157 -8.143 1.00 0.00 C ATOM 1159 CD ARG A 74 3.539 7.867 -8.362 1.00 0.00 C ATOM 1160 NE ARG A 74 4.391 8.135 -9.554 1.00 0.00 N ATOM 1161 CZ ARG A 74 5.263 7.246 -9.945 1.00 0.00 C ATOM 1162 NH1 ARG A 74 4.862 6.073 -10.351 1.00 0.00 N ATOM 1163 NH2 ARG A 74 6.537 7.530 -9.930 1.00 0.00 N ATOM 0 H ARG A 74 1.174 10.269 -6.478 1.00 0.00 H new ATOM 0 HA ARG A 74 3.466 12.188 -6.674 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.544 10.215 -7.588 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.601 9.650 -6.223 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.772 8.928 -7.708 1.00 0.00 H new ATOM 0 HG3 ARG A 74 2.559 9.648 -9.098 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.146 7.625 -7.490 1.00 0.00 H new ATOM 0 HD3 ARG A 74 2.875 7.020 -8.534 1.00 0.00 H new ATOM 0 HE ARG A 74 4.293 9.013 -10.064 1.00 0.00 H new ATOM 0 HH11 ARG A 74 3.867 5.850 -10.363 1.00 0.00 H new ATOM 0 HH12 ARG A 74 5.544 5.379 -10.657 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.851 8.447 -9.613 1.00 0.00 H new ATOM 0 HH22 ARG A 74 7.218 6.835 -10.236 1.00 0.00 H new ATOM 1177 N ASN A 75 1.213 11.861 -8.907 1.00 0.00 N ATOM 1178 CA ASN A 75 0.794 12.368 -10.247 1.00 0.00 C ATOM 1179 C ASN A 75 0.234 13.783 -10.100 1.00 0.00 C ATOM 1180 O ASN A 75 -0.169 14.406 -11.061 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.292 11.406 -10.729 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.536 11.621 -12.224 1.00 0.00 C ATOM 1183 OD1 ASN A 75 0.325 12.111 -12.928 1.00 0.00 O ATOM 1184 ND2 ASN A 75 -1.682 11.273 -12.742 1.00 0.00 N ATOM 0 H ASN A 75 0.467 11.456 -8.342 1.00 0.00 H new ATOM 0 HA ASN A 75 1.623 12.413 -10.954 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.011 10.376 -10.544 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.214 11.572 -10.171 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -1.855 11.412 -13.738 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.405 10.862 -12.151 1.00 0.00 H new ATOM 1191 N SER A 76 0.212 14.290 -8.890 1.00 0.00 N ATOM 1192 CA SER A 76 -0.308 15.666 -8.638 1.00 0.00 C ATOM 1193 C SER A 76 -1.836 15.683 -8.680 1.00 0.00 C ATOM 1194 O SER A 76 -2.442 16.717 -8.882 1.00 0.00 O ATOM 1195 CB SER A 76 0.272 16.542 -9.750 1.00 0.00 C ATOM 1196 OG SER A 76 0.461 17.862 -9.256 1.00 0.00 O ATOM 0 H SER A 76 0.537 13.799 -8.057 1.00 0.00 H new ATOM 0 HA SER A 76 -0.017 16.027 -7.652 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.221 16.131 -10.095 1.00 0.00 H new ATOM 0 HB3 SER A 76 -0.401 16.555 -10.607 1.00 0.00 H new ATOM 0 HG SER A 76 0.834 18.426 -9.965 1.00 0.00 H new ATOM 1202 N GLU A 77 -2.477 14.560 -8.483 1.00 0.00 N ATOM 1203 CA GLU A 77 -3.961 14.567 -8.508 1.00 0.00 C ATOM 1204 C GLU A 77 -4.502 14.638 -7.082 1.00 0.00 C ATOM 1205 O GLU A 77 -5.512 15.257 -6.816 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.352 13.269 -9.211 1.00 0.00 C ATOM 1207 CG GLU A 77 -3.987 13.372 -10.692 1.00 0.00 C ATOM 1208 CD GLU A 77 -4.701 14.576 -11.311 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -5.913 14.519 -11.441 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -4.023 15.534 -11.644 1.00 0.00 O ATOM 0 H GLU A 77 -2.041 13.654 -8.309 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.376 15.429 -9.031 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.836 12.424 -8.755 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -5.421 13.088 -9.099 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -2.908 13.478 -10.805 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.274 12.458 -11.213 1.00 0.00 H new ATOM 1217 N ILE A 78 -3.820 14.028 -6.164 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.268 14.073 -4.735 1.00 0.00 C ATOM 1219 C ILE A 78 -3.066 13.961 -3.798 1.00 0.00 C ATOM 1220 O ILE A 78 -1.959 14.325 -4.140 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.167 12.854 -4.557 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.361 11.607 -4.887 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.367 12.953 -5.500 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.861 10.936 -3.613 1.00 0.00 C ATOM 0 H ILE A 78 -2.967 13.495 -6.333 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.781 15.006 -4.503 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.529 12.806 -3.530 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.977 10.909 -5.454 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.515 11.872 -5.521 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.006 12.080 -5.369 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.935 13.855 -5.273 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.017 12.995 -6.531 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.287 10.046 -3.872 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.226 11.630 -3.061 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.712 10.652 -2.994 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.287 13.442 -2.623 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.186 13.263 -1.641 1.00 0.00 C ATOM 1238 C LYS A 79 -2.754 12.636 -0.371 1.00 0.00 C ATOM 1239 O LYS A 79 -3.805 12.027 -0.385 1.00 0.00 O ATOM 1240 CB LYS A 79 -1.625 14.668 -1.371 1.00 0.00 C ATOM 1241 CG LYS A 79 -2.532 15.443 -0.406 1.00 0.00 C ATOM 1242 CD LYS A 79 -3.249 16.549 -1.172 1.00 0.00 C ATOM 1243 CE LYS A 79 -4.588 16.018 -1.683 1.00 0.00 C ATOM 1244 NZ LYS A 79 -5.583 17.065 -1.321 1.00 0.00 N ATOM 0 H LYS A 79 -4.202 13.129 -2.298 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.397 12.605 -2.007 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -0.623 14.589 -0.950 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.535 15.215 -2.310 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.258 14.770 0.049 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -1.941 15.870 0.404 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -3.409 17.411 -0.525 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.635 16.887 -2.007 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.562 15.854 -2.760 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.835 15.062 -1.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -6.540 16.660 -1.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.387 17.413 -0.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.517 17.854 -1.995 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.077 12.779 0.725 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.586 12.197 1.988 1.00 0.00 C ATOM 1260 C ILE A 80 -3.380 13.244 2.749 1.00 0.00 C ATOM 1261 O ILE A 80 -2.866 13.988 3.561 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.341 11.799 2.733 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -0.826 10.499 2.139 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.651 11.608 4.219 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.403 10.719 0.686 1.00 0.00 C ATOM 0 H ILE A 80 -1.189 13.276 0.801 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.257 11.351 1.840 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.587 12.580 2.640 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.020 10.134 2.721 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.601 9.735 2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.742 11.320 4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.031 12.541 4.634 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.401 10.826 4.337 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.035 9.782 0.268 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.259 11.064 0.106 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.387 11.469 0.647 1.00 0.00 H new ATOM 1277 N THR A 81 -4.631 13.294 2.463 1.00 0.00 N ATOM 1278 CA THR A 81 -5.537 14.279 3.119 1.00 0.00 C ATOM 1279 C THR A 81 -6.045 13.737 4.456 1.00 0.00 C ATOM 1280 O THR A 81 -7.047 14.191 4.972 1.00 0.00 O ATOM 1281 CB THR A 81 -6.699 14.422 2.138 1.00 0.00 C ATOM 1282 OG1 THR A 81 -7.409 13.193 2.070 1.00 0.00 O ATOM 1283 CG2 THR A 81 -6.161 14.776 0.750 1.00 0.00 C ATOM 0 H THR A 81 -5.088 12.683 1.786 1.00 0.00 H new ATOM 0 HA THR A 81 -5.039 15.225 3.333 1.00 0.00 H new ATOM 0 HB THR A 81 -7.366 15.214 2.479 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.308 13.354 1.716 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.992 14.877 0.052 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.614 15.717 0.801 1.00 0.00 H new ATOM 0 HG23 THR A 81 -5.493 13.986 0.406 1.00 0.00 H new ATOM 1291 N SER A 82 -5.380 12.749 5.004 1.00 0.00 N ATOM 1292 CA SER A 82 -5.836 12.143 6.297 1.00 0.00 C ATOM 1293 C SER A 82 -7.043 11.234 6.045 1.00 0.00 C ATOM 1294 O SER A 82 -7.461 10.483 6.904 1.00 0.00 O ATOM 1295 CB SER A 82 -6.221 13.315 7.200 1.00 0.00 C ATOM 1296 OG SER A 82 -5.724 13.081 8.511 1.00 0.00 O ATOM 0 H SER A 82 -4.536 12.333 4.610 1.00 0.00 H new ATOM 0 HA SER A 82 -5.059 11.533 6.758 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.811 14.244 6.804 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.305 13.429 7.225 1.00 0.00 H new ATOM 0 HG SER A 82 -5.968 13.832 9.092 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.590 11.285 4.861 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.749 10.422 4.521 1.00 0.00 C ATOM 1304 C ASP A 83 -8.319 9.457 3.424 1.00 0.00 C ATOM 1305 O ASP A 83 -8.599 8.275 3.472 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.820 11.379 4.004 1.00 0.00 C ATOM 1307 CG ASP A 83 -10.935 11.514 5.044 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -10.955 10.719 5.968 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -11.751 12.409 4.896 1.00 0.00 O ATOM 0 H ASP A 83 -7.277 11.897 4.108 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.116 9.838 5.365 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.381 12.355 3.798 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.229 11.009 3.064 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.606 9.953 2.447 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.123 9.057 1.363 1.00 0.00 C ATOM 1316 C LEU A 84 -6.148 8.064 1.974 1.00 0.00 C ATOM 1317 O LEU A 84 -5.986 6.955 1.506 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.420 9.976 0.366 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.437 10.949 -0.228 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.771 11.772 -1.333 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.611 10.159 -0.816 1.00 0.00 C ATOM 0 H LEU A 84 -7.340 10.933 2.355 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.918 8.494 0.874 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.620 10.526 0.862 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.958 9.387 -0.426 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.801 11.618 0.552 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.496 12.466 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.934 12.332 -0.916 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.407 11.105 -2.115 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.339 10.851 -1.241 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.246 9.492 -1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.085 9.572 -0.029 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.515 8.455 3.043 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.567 7.536 3.723 1.00 0.00 C ATOM 1335 C LEU A 85 -5.357 6.686 4.725 1.00 0.00 C ATOM 1336 O LEU A 85 -5.091 5.515 4.912 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.537 8.462 4.405 1.00 0.00 C ATOM 1338 CG LEU A 85 -3.580 8.308 5.928 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -2.880 7.009 6.331 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -2.868 9.494 6.582 1.00 0.00 C ATOM 0 H LEU A 85 -5.614 9.374 3.475 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.058 6.841 3.056 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.536 8.229 4.041 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.741 9.498 4.135 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.618 8.279 6.259 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.911 6.900 7.415 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.387 6.163 5.867 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.842 7.037 5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.899 9.384 7.666 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.830 9.524 6.250 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.367 10.420 6.297 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.345 7.271 5.354 1.00 0.00 N ATOM 1353 CA ASP A 86 -7.173 6.501 6.326 1.00 0.00 C ATOM 1354 C ASP A 86 -7.825 5.323 5.607 1.00 0.00 C ATOM 1355 O ASP A 86 -7.765 4.197 6.060 1.00 0.00 O ATOM 1356 CB ASP A 86 -8.228 7.488 6.823 1.00 0.00 C ATOM 1357 CG ASP A 86 -9.344 6.726 7.542 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -9.134 6.345 8.682 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -10.388 6.538 6.941 1.00 0.00 O ATOM 0 H ASP A 86 -6.612 8.248 5.235 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.590 6.096 7.153 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -7.774 8.212 7.499 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.639 8.050 5.984 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.427 5.566 4.474 1.00 0.00 N ATOM 1365 CA LYS A 87 -9.048 4.444 3.724 1.00 0.00 C ATOM 1366 C LYS A 87 -7.931 3.553 3.202 1.00 0.00 C ATOM 1367 O LYS A 87 -8.073 2.352 3.087 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.821 5.095 2.576 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.981 5.918 3.141 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.784 5.064 4.123 1.00 0.00 C ATOM 1371 CE LYS A 87 -13.085 5.785 4.484 1.00 0.00 C ATOM 1372 NZ LYS A 87 -13.551 5.132 5.740 1.00 0.00 N ATOM 0 H LYS A 87 -8.514 6.485 4.041 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.714 3.831 4.331 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.158 5.735 1.994 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.200 4.329 1.899 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -10.599 6.806 3.644 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.625 6.262 2.331 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.005 4.093 3.680 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.198 4.878 5.023 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.917 6.852 4.632 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.825 5.686 3.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.440 5.573 6.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.709 4.119 5.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.830 5.248 6.480 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.801 4.137 2.918 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.652 3.329 2.442 1.00 0.00 C ATOM 1388 C ILE A 88 -5.191 2.445 3.603 1.00 0.00 C ATOM 1389 O ILE A 88 -5.026 1.248 3.469 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.594 4.374 2.033 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.515 4.430 0.518 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -3.202 4.046 2.592 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.123 5.844 0.091 1.00 0.00 C ATOM 0 H ILE A 88 -6.626 5.139 2.996 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.870 2.666 1.605 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.900 5.334 2.448 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.783 3.710 0.153 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.476 4.158 0.081 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.493 4.811 2.276 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.244 4.018 3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.879 3.075 2.217 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.064 5.893 -0.996 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.872 6.552 0.446 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.153 6.097 0.519 1.00 0.00 H new ATOM 1405 N PHE A 89 -5.011 3.034 4.750 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.589 2.244 5.937 1.00 0.00 C ATOM 1407 C PHE A 89 -5.693 1.266 6.312 1.00 0.00 C ATOM 1408 O PHE A 89 -5.467 0.267 6.966 1.00 0.00 O ATOM 1409 CB PHE A 89 -4.368 3.274 7.044 1.00 0.00 C ATOM 1410 CG PHE A 89 -3.558 2.652 8.155 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -2.260 2.193 7.904 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -4.107 2.529 9.438 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -1.510 1.612 8.933 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -3.358 1.949 10.468 1.00 0.00 C ATOM 1415 CZ PHE A 89 -2.059 1.490 10.215 1.00 0.00 C ATOM 0 H PHE A 89 -5.138 4.032 4.917 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.688 1.658 5.757 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.849 4.146 6.646 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.327 3.621 7.429 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.836 2.287 6.915 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -5.109 2.882 9.632 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -0.508 1.258 8.738 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.781 1.855 11.457 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.481 1.042 11.009 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.879 1.537 5.868 1.00 0.00 N ATOM 1426 CA ALA A 90 -8.011 0.619 6.153 1.00 0.00 C ATOM 1427 C ALA A 90 -7.913 -0.553 5.189 1.00 0.00 C ATOM 1428 O ALA A 90 -8.264 -1.673 5.507 1.00 0.00 O ATOM 1429 CB ALA A 90 -9.277 1.437 5.896 1.00 0.00 C ATOM 0 H ALA A 90 -7.118 2.360 5.315 1.00 0.00 H new ATOM 0 HA ALA A 90 -8.010 0.228 7.170 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.154 0.819 6.088 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.291 2.303 6.558 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.289 1.773 4.859 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.399 -0.301 4.018 1.00 0.00 N ATOM 1436 CA GLY A 91 -7.226 -1.394 3.032 1.00 0.00 C ATOM 1437 C GLY A 91 -6.083 -2.272 3.524 1.00 0.00 C ATOM 1438 O GLY A 91 -6.166 -3.485 3.531 1.00 0.00 O ATOM 0 H GLY A 91 -7.091 0.619 3.704 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.143 -1.975 2.938 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.002 -0.989 2.045 1.00 0.00 H new ATOM 1442 N VAL A 92 -5.020 -1.659 3.971 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.878 -2.445 4.503 1.00 0.00 C ATOM 1444 C VAL A 92 -4.340 -3.172 5.765 1.00 0.00 C ATOM 1445 O VAL A 92 -3.768 -4.163 6.176 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.805 -1.404 4.827 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.814 -1.976 5.844 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -2.056 -1.033 3.545 1.00 0.00 C ATOM 0 H VAL A 92 -4.896 -0.647 3.989 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.500 -3.195 3.809 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.280 -0.518 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.053 -1.229 6.070 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.344 -2.242 6.759 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.339 -2.865 5.429 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.291 -0.291 3.773 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.586 -1.923 3.128 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.758 -0.620 2.820 1.00 0.00 H new ATOM 1458 N ASP A 93 -5.393 -2.687 6.369 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.925 -3.344 7.594 1.00 0.00 C ATOM 1460 C ASP A 93 -6.655 -4.625 7.199 1.00 0.00 C ATOM 1461 O ASP A 93 -6.516 -5.654 7.830 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.899 -2.330 8.196 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.618 -2.181 9.692 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -7.048 -3.041 10.443 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -5.977 -1.211 10.062 1.00 0.00 O ATOM 0 H ASP A 93 -5.908 -1.861 6.064 1.00 0.00 H new ATOM 0 HA ASP A 93 -5.144 -3.617 8.303 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.793 -1.367 7.697 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.926 -2.659 8.039 1.00 0.00 H new ATOM 1470 N MET A 94 -7.414 -4.574 6.140 1.00 0.00 N ATOM 1471 CA MET A 94 -8.132 -5.791 5.683 1.00 0.00 C ATOM 1472 C MET A 94 -7.140 -6.695 4.958 1.00 0.00 C ATOM 1473 O MET A 94 -7.200 -7.905 5.044 1.00 0.00 O ATOM 1474 CB MET A 94 -9.214 -5.284 4.731 1.00 0.00 C ATOM 1475 CG MET A 94 -10.168 -4.363 5.493 1.00 0.00 C ATOM 1476 SD MET A 94 -11.831 -4.517 4.803 1.00 0.00 S ATOM 1477 CE MET A 94 -11.519 -3.606 3.272 1.00 0.00 C ATOM 0 H MET A 94 -7.567 -3.740 5.572 1.00 0.00 H new ATOM 0 HA MET A 94 -8.571 -6.367 6.498 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.759 -4.747 3.899 1.00 0.00 H new ATOM 0 HB3 MET A 94 -9.763 -6.124 4.306 1.00 0.00 H new ATOM 0 HG2 MET A 94 -10.176 -4.625 6.551 1.00 0.00 H new ATOM 0 HG3 MET A 94 -9.827 -3.330 5.423 1.00 0.00 H new ATOM 0 HE1 MET A 94 -12.084 -4.059 2.457 1.00 0.00 H new ATOM 0 HE2 MET A 94 -11.830 -2.569 3.396 1.00 0.00 H new ATOM 0 HE3 MET A 94 -10.455 -3.640 3.039 1.00 0.00 H new ATOM 1487 N ILE A 95 -6.207 -6.102 4.267 1.00 0.00 N ATOM 1488 CA ILE A 95 -5.177 -6.904 3.556 1.00 0.00 C ATOM 1489 C ILE A 95 -4.372 -7.694 4.593 1.00 0.00 C ATOM 1490 O ILE A 95 -3.989 -8.825 4.369 1.00 0.00 O ATOM 1491 CB ILE A 95 -4.318 -5.860 2.823 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -4.790 -5.745 1.371 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -2.842 -6.264 2.839 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -4.457 -4.352 0.832 1.00 0.00 C ATOM 0 H ILE A 95 -6.115 -5.091 4.165 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.582 -7.632 2.853 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.426 -4.902 3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.307 -6.508 0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -5.864 -5.922 1.312 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.253 -5.511 2.315 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -2.497 -6.341 3.870 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.723 -7.227 2.343 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.794 -4.272 -0.202 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.960 -3.598 1.437 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.380 -4.193 0.876 1.00 0.00 H new ATOM 1506 N THR A 96 -4.139 -7.110 5.738 1.00 0.00 N ATOM 1507 CA THR A 96 -3.391 -7.832 6.799 1.00 0.00 C ATOM 1508 C THR A 96 -4.295 -8.919 7.372 1.00 0.00 C ATOM 1509 O THR A 96 -3.893 -10.054 7.538 1.00 0.00 O ATOM 1510 CB THR A 96 -3.069 -6.777 7.857 1.00 0.00 C ATOM 1511 OG1 THR A 96 -1.980 -5.979 7.410 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.695 -7.465 9.170 1.00 0.00 C ATOM 0 H THR A 96 -4.435 -6.165 5.981 1.00 0.00 H new ATOM 0 HA THR A 96 -2.481 -8.309 6.436 1.00 0.00 H new ATOM 0 HB THR A 96 -3.942 -6.145 8.018 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.323 -5.202 6.921 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.466 -6.711 9.923 1.00 0.00 H new ATOM 0 HG22 THR A 96 -3.530 -8.077 9.511 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.822 -8.098 9.013 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.526 -8.585 7.651 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.460 -9.610 8.185 1.00 0.00 C ATOM 1522 C ARG A 97 -6.580 -10.746 7.168 1.00 0.00 C ATOM 1523 O ARG A 97 -6.743 -11.896 7.521 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.797 -8.888 8.365 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.765 -8.080 9.663 1.00 0.00 C ATOM 1526 CD ARG A 97 -8.693 -6.870 9.537 1.00 0.00 C ATOM 1527 NE ARG A 97 -9.687 -7.035 10.633 1.00 0.00 N ATOM 1528 CZ ARG A 97 -10.703 -7.840 10.477 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -11.411 -7.791 9.382 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -11.010 -8.692 11.418 1.00 0.00 N ATOM 0 H ARG A 97 -5.921 -7.652 7.532 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.124 -10.045 9.126 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.984 -8.229 7.517 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.613 -9.611 8.393 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.077 -8.705 10.500 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.747 -7.750 9.873 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.141 -5.936 9.641 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -9.180 -6.845 8.562 1.00 0.00 H new ATOM 0 HE ARG A 97 -9.574 -6.519 11.506 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.171 -7.124 8.649 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.205 -8.420 9.259 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.456 -8.728 12.274 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.804 -9.321 11.297 1.00 0.00 H new ATOM 1544 N MET A 98 -6.465 -10.430 5.905 1.00 0.00 N ATOM 1545 CA MET A 98 -6.533 -11.492 4.866 1.00 0.00 C ATOM 1546 C MET A 98 -5.266 -12.331 4.962 1.00 0.00 C ATOM 1547 O MET A 98 -5.283 -13.537 4.817 1.00 0.00 O ATOM 1548 CB MET A 98 -6.584 -10.746 3.532 1.00 0.00 C ATOM 1549 CG MET A 98 -7.982 -10.167 3.326 1.00 0.00 C ATOM 1550 SD MET A 98 -7.879 -8.703 2.265 1.00 0.00 S ATOM 1551 CE MET A 98 -8.936 -9.312 0.929 1.00 0.00 C ATOM 0 H MET A 98 -6.327 -9.483 5.551 1.00 0.00 H new ATOM 0 HA MET A 98 -7.392 -12.154 4.979 1.00 0.00 H new ATOM 0 HB2 MET A 98 -5.843 -9.947 3.521 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.335 -11.423 2.715 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.633 -10.914 2.871 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.423 -9.902 4.287 1.00 0.00 H new ATOM 0 HE1 MET A 98 -9.114 -8.511 0.212 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.444 -10.146 0.427 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.887 -9.647 1.342 1.00 0.00 H new ATOM 1561 N VAL A 99 -4.164 -11.686 5.230 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.880 -12.418 5.368 1.00 0.00 C ATOM 1563 C VAL A 99 -2.934 -13.298 6.617 1.00 0.00 C ATOM 1564 O VAL A 99 -2.358 -14.366 6.664 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.826 -11.320 5.515 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.564 -11.896 6.165 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.479 -10.765 4.132 1.00 0.00 C ATOM 0 H VAL A 99 -4.101 -10.676 5.360 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.663 -13.072 4.524 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.220 -10.522 6.144 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.184 -11.110 6.267 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.811 -12.293 7.150 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.166 -12.696 5.541 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.728 -9.982 4.232 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.086 -11.567 3.506 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.376 -10.351 3.671 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.639 -12.861 7.628 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.742 -13.680 8.867 1.00 0.00 C ATOM 1579 C ASP A 100 -4.553 -14.935 8.573 1.00 0.00 C ATOM 1580 O ASP A 100 -4.265 -16.007 9.069 1.00 0.00 O ATOM 1581 CB ASP A 100 -4.461 -12.789 9.880 1.00 0.00 C ATOM 1582 CG ASP A 100 -4.567 -13.520 11.220 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -3.715 -14.351 11.488 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -5.496 -13.235 11.957 1.00 0.00 O ATOM 0 H ASP A 100 -4.145 -11.976 7.647 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.771 -14.001 9.244 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.917 -11.853 10.007 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -5.455 -12.533 9.514 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.550 -14.818 7.744 1.00 0.00 N ATOM 1590 CA LYS A 101 -6.356 -16.007 7.390 1.00 0.00 C ATOM 1591 C LYS A 101 -5.654 -16.721 6.239 1.00 0.00 C ATOM 1592 O LYS A 101 -5.629 -17.930 6.160 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.735 -15.450 7.019 1.00 0.00 C ATOM 1594 CG LYS A 101 -8.070 -15.684 5.549 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.697 -14.429 5.001 1.00 0.00 C ATOM 1596 CE LYS A 101 -10.085 -14.776 4.475 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.910 -15.021 5.693 1.00 0.00 N ATOM 0 H LYS A 101 -5.839 -13.947 7.298 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.467 -16.743 8.187 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.495 -15.919 7.643 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.763 -14.381 7.232 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -7.169 -15.934 4.989 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -8.754 -16.527 5.445 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.765 -13.668 5.779 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.081 -14.015 4.203 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -10.495 -13.962 3.878 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -10.055 -15.658 3.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -10.966 -16.044 5.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.472 -14.548 6.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -11.867 -14.642 5.546 1.00 0.00 H new ATOM 1611 N ILE A 102 -5.056 -15.961 5.361 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.322 -16.578 4.232 1.00 0.00 C ATOM 1613 C ILE A 102 -3.186 -17.381 4.840 1.00 0.00 C ATOM 1614 O ILE A 102 -2.848 -18.464 4.407 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.795 -15.399 3.409 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.832 -15.007 2.356 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.488 -15.785 2.709 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.314 -13.809 1.561 1.00 0.00 C ATOM 0 H ILE A 102 -5.047 -14.941 5.381 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.921 -17.238 3.604 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.609 -14.558 4.077 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.024 -15.846 1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.779 -14.758 2.836 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -2.123 -14.939 2.127 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.743 -16.060 3.456 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -2.667 -16.631 2.046 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -5.050 -13.526 0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.144 -12.970 2.236 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.378 -14.075 1.070 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.622 -16.848 5.877 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.526 -17.556 6.577 1.00 0.00 C ATOM 1632 C VAL A 103 -2.126 -18.740 7.330 1.00 0.00 C ATOM 1633 O VAL A 103 -1.498 -19.763 7.518 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.958 -16.520 7.544 1.00 0.00 C ATOM 1635 CG1 VAL A 103 -0.155 -17.224 8.639 1.00 0.00 C ATOM 1636 CG2 VAL A 103 -0.046 -15.556 6.782 1.00 0.00 C ATOM 0 H VAL A 103 -2.875 -15.943 6.274 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.753 -17.943 5.913 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.777 -15.963 7.999 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.249 -16.482 9.328 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.805 -17.909 9.184 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.664 -17.784 8.187 1.00 0.00 H new ATOM 0 HG21 VAL A 103 0.359 -14.816 7.472 1.00 0.00 H new ATOM 0 HG22 VAL A 103 0.772 -16.113 6.326 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.619 -15.051 6.005 1.00 0.00 H new ATOM 1646 N SER A 104 -3.352 -18.597 7.756 1.00 0.00 N ATOM 1647 CA SER A 104 -4.030 -19.698 8.497 1.00 0.00 C ATOM 1648 C SER A 104 -4.620 -20.718 7.528 1.00 0.00 C ATOM 1649 O SER A 104 -4.678 -21.900 7.801 1.00 0.00 O ATOM 1650 CB SER A 104 -5.142 -19.010 9.281 1.00 0.00 C ATOM 1651 OG SER A 104 -5.578 -19.864 10.330 1.00 0.00 O ATOM 0 H SER A 104 -3.917 -17.758 7.621 1.00 0.00 H new ATOM 0 HA SER A 104 -3.340 -20.242 9.142 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.783 -18.066 9.691 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.976 -18.773 8.620 1.00 0.00 H new ATOM 0 HG SER A 104 -6.103 -20.601 9.955 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.062 -20.258 6.406 1.00 0.00 N ATOM 1658 CA GLU A 105 -5.666 -21.178 5.398 1.00 0.00 C ATOM 1659 C GLU A 105 -5.107 -20.881 4.005 1.00 0.00 C ATOM 1660 O GLU A 105 -4.893 -21.773 3.209 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.172 -20.891 5.434 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.627 -20.666 6.878 1.00 0.00 C ATOM 1663 CD GLU A 105 -7.462 -21.962 7.674 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -7.737 -23.013 7.119 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -7.065 -21.881 8.825 1.00 0.00 O ATOM 0 H GLU A 105 -5.035 -19.276 6.132 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.444 -22.222 5.619 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.397 -20.011 4.832 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.720 -21.726 4.997 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.040 -19.869 7.335 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.669 -20.346 6.896 1.00 0.00 H new ATOM 1672 N GLY A 106 -4.874 -19.632 3.703 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.336 -19.285 2.358 1.00 0.00 C ATOM 1674 C GLY A 106 -5.424 -18.603 1.524 1.00 0.00 C ATOM 1675 O GLY A 106 -5.355 -18.573 0.312 1.00 0.00 O ATOM 0 H GLY A 106 -5.032 -18.841 4.327 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.475 -18.624 2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -3.988 -20.186 1.852 1.00 0.00 H new ATOM 1679 N SER A 107 -6.429 -18.048 2.156 1.00 0.00 N ATOM 1680 CA SER A 107 -7.505 -17.369 1.372 1.00 0.00 C ATOM 1681 C SER A 107 -7.668 -15.936 1.840 1.00 0.00 C ATOM 1682 O SER A 107 -7.838 -15.681 3.004 1.00 0.00 O ATOM 1683 CB SER A 107 -8.777 -18.163 1.647 1.00 0.00 C ATOM 1684 OG SER A 107 -8.829 -18.514 3.024 1.00 0.00 O ATOM 0 H SER A 107 -6.550 -18.036 3.169 1.00 0.00 H new ATOM 0 HA SER A 107 -7.272 -17.337 0.308 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.653 -17.572 1.378 1.00 0.00 H new ATOM 0 HB3 SER A 107 -8.798 -19.062 1.031 1.00 0.00 H new ATOM 0 HG SER A 107 -8.533 -17.754 3.567 1.00 0.00 H new ATOM 1690 N ASP A 108 -7.637 -15.005 0.936 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.817 -13.580 1.327 1.00 0.00 C ATOM 1692 C ASP A 108 -9.305 -13.237 1.259 1.00 0.00 C ATOM 1693 O ASP A 108 -9.697 -12.089 1.320 1.00 0.00 O ATOM 1694 CB ASP A 108 -7.024 -12.779 0.289 1.00 0.00 C ATOM 1695 CG ASP A 108 -7.824 -12.673 -1.013 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -7.995 -13.691 -1.663 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -8.254 -11.578 -1.332 1.00 0.00 O ATOM 0 H ASP A 108 -7.494 -15.167 -0.061 1.00 0.00 H new ATOM 0 HA ASP A 108 -7.473 -13.364 2.338 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.807 -11.783 0.674 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.066 -13.263 0.099 1.00 0.00 H new ATOM 1702 N ASP A 109 -10.133 -14.236 1.110 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.600 -13.981 1.011 1.00 0.00 C ATOM 1704 C ASP A 109 -12.187 -13.559 2.365 1.00 0.00 C ATOM 1705 O ASP A 109 -12.955 -14.283 2.966 1.00 0.00 O ATOM 1706 CB ASP A 109 -12.202 -15.315 0.566 1.00 0.00 C ATOM 1707 CG ASP A 109 -12.737 -15.184 -0.862 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -12.980 -14.065 -1.281 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -12.896 -16.206 -1.510 1.00 0.00 O ATOM 0 H ASP A 109 -9.858 -15.217 1.053 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.819 -13.170 0.317 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.447 -16.100 0.612 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -13.006 -15.606 1.242 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.855 -12.386 2.842 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.427 -11.932 4.146 1.00 0.00 C ATOM 1716 C ILE A 110 -13.666 -11.071 3.895 1.00 0.00 C ATOM 1717 O ILE A 110 -13.997 -10.201 4.676 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.342 -11.092 4.824 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -11.005 -9.883 3.949 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -10.083 -11.932 5.050 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -10.383 -8.788 4.819 1.00 0.00 C ATOM 0 H ILE A 110 -11.219 -11.729 2.390 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.722 -12.778 4.767 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.714 -10.750 5.790 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.313 -10.173 3.159 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.906 -9.509 3.462 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.320 -11.321 5.533 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.323 -12.783 5.687 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.708 -12.290 4.091 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.141 -7.924 4.199 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -11.091 -8.492 5.593 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.473 -9.166 5.285 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.346 -11.295 2.805 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.552 -10.474 2.505 1.00 0.00 C ATOM 1735 C GLY A 111 -15.108 -9.068 2.102 1.00 0.00 C ATOM 1736 O GLY A 111 -15.907 -8.158 1.987 1.00 0.00 O ATOM 0 H GLY A 111 -14.120 -12.008 2.112 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.129 -10.932 1.701 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.203 -10.428 3.378 1.00 0.00 H new ATOM 1740 N GLU A 112 -13.833 -8.882 1.889 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.322 -7.540 1.497 1.00 0.00 C ATOM 1742 C GLU A 112 -14.090 -6.994 0.291 1.00 0.00 C ATOM 1743 O GLU A 112 -14.448 -7.721 -0.614 1.00 0.00 O ATOM 1744 CB GLU A 112 -11.860 -7.777 1.122 1.00 0.00 C ATOM 1745 CG GLU A 112 -10.954 -7.307 2.260 1.00 0.00 C ATOM 1746 CD GLU A 112 -10.085 -6.146 1.773 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -10.572 -5.363 0.974 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -8.948 -6.060 2.207 1.00 0.00 O ATOM 0 H GLU A 112 -13.121 -9.607 1.971 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.438 -6.811 2.299 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.692 -8.836 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.618 -7.239 0.205 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -11.556 -6.992 3.112 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.324 -8.129 2.601 1.00 0.00 H new ATOM 1755 N ASN A 113 -14.327 -5.712 0.269 1.00 0.00 N ATOM 1756 CA ASN A 113 -15.050 -5.096 -0.880 1.00 0.00 C ATOM 1757 C ASN A 113 -14.072 -4.243 -1.684 1.00 0.00 C ATOM 1758 O ASN A 113 -14.066 -3.041 -1.584 1.00 0.00 O ATOM 1759 CB ASN A 113 -16.136 -4.226 -0.244 1.00 0.00 C ATOM 1760 CG ASN A 113 -17.508 -4.649 -0.774 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -17.772 -4.557 -1.956 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -18.401 -5.112 0.059 1.00 0.00 N ATOM 0 H ASN A 113 -14.049 -5.060 1.002 1.00 0.00 H new ATOM 0 HA ASN A 113 -15.479 -5.832 -1.560 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -16.107 -4.326 0.841 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.955 -3.176 -0.472 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -19.319 -5.396 -0.283 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -18.180 -5.190 1.052 1.00 0.00 H new ATOM 1769 N ILE A 114 -13.228 -4.857 -2.462 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.231 -4.072 -3.247 1.00 0.00 C ATOM 1771 C ILE A 114 -12.916 -3.155 -4.255 1.00 0.00 C ATOM 1772 O ILE A 114 -12.879 -1.947 -4.124 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.379 -5.117 -3.965 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.964 -6.222 -2.983 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -10.130 -4.444 -4.534 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.702 -5.628 -1.596 1.00 0.00 C ATOM 0 H ILE A 114 -13.183 -5.868 -2.590 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.636 -3.424 -2.604 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.960 -5.561 -4.774 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -11.748 -6.976 -2.921 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.067 -6.724 -3.347 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.519 -5.186 -5.047 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.425 -3.666 -5.239 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.555 -3.999 -3.722 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.409 -6.422 -0.910 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.902 -4.891 -1.661 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.609 -5.148 -1.229 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.534 -3.706 -5.263 1.00 0.00 N ATOM 1789 CA ASP A 115 -14.210 -2.841 -6.269 1.00 0.00 C ATOM 1790 C ASP A 115 -14.981 -1.739 -5.557 1.00 0.00 C ATOM 1791 O ASP A 115 -15.209 -0.669 -6.086 1.00 0.00 O ATOM 1792 CB ASP A 115 -15.160 -3.767 -7.028 1.00 0.00 C ATOM 1793 CG ASP A 115 -15.370 -3.230 -8.445 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -15.835 -2.109 -8.570 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -15.063 -3.950 -9.381 1.00 0.00 O ATOM 0 H ASP A 115 -13.600 -4.710 -5.433 1.00 0.00 H new ATOM 0 HA ASP A 115 -13.505 -2.357 -6.945 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -14.748 -4.776 -7.067 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -16.115 -3.832 -6.507 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.378 -2.005 -4.354 1.00 0.00 N ATOM 1801 CA VAL A 116 -16.137 -0.997 -3.568 1.00 0.00 C ATOM 1802 C VAL A 116 -15.195 -0.124 -2.752 1.00 0.00 C ATOM 1803 O VAL A 116 -15.244 1.086 -2.804 1.00 0.00 O ATOM 1804 CB VAL A 116 -17.042 -1.814 -2.649 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.618 -0.906 -1.561 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -18.186 -2.419 -3.466 1.00 0.00 C ATOM 0 H VAL A 116 -15.209 -2.888 -3.872 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.703 -0.323 -4.211 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.463 -2.613 -2.186 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.264 -1.489 -0.905 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -16.804 -0.474 -0.979 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.197 -0.106 -2.023 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.832 -3.002 -2.810 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.765 -1.620 -3.929 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.777 -3.066 -4.242 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.343 -0.733 -1.996 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.391 0.060 -1.165 1.00 0.00 C ATOM 1818 C PHE A 117 -12.384 0.766 -2.071 1.00 0.00 C ATOM 1819 O PHE A 117 -11.714 1.694 -1.667 1.00 0.00 O ATOM 1820 CB PHE A 117 -12.692 -0.954 -0.255 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.406 -0.317 1.084 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -13.456 -0.065 1.978 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -11.094 0.022 1.434 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -13.191 0.524 3.219 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -10.830 0.611 2.676 1.00 0.00 C ATOM 1826 CZ PHE A 117 -11.879 0.863 3.569 1.00 0.00 C ATOM 0 H PHE A 117 -14.257 -1.746 -1.911 1.00 0.00 H new ATOM 0 HA PHE A 117 -13.894 0.830 -0.580 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.321 -1.835 -0.124 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -11.763 -1.291 -0.715 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -14.469 -0.325 1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.285 -0.171 0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -14.000 0.717 3.908 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.817 0.871 2.946 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.676 1.319 4.527 1.00 0.00 H new ATOM 1836 N SER A 118 -12.300 0.356 -3.306 1.00 0.00 N ATOM 1837 CA SER A 118 -11.376 1.013 -4.248 1.00 0.00 C ATOM 1838 C SER A 118 -12.142 2.103 -4.954 1.00 0.00 C ATOM 1839 O SER A 118 -11.625 3.154 -5.246 1.00 0.00 O ATOM 1840 CB SER A 118 -10.942 -0.077 -5.228 1.00 0.00 C ATOM 1841 OG SER A 118 -10.356 0.527 -6.374 1.00 0.00 O ATOM 0 H SER A 118 -12.841 -0.414 -3.699 1.00 0.00 H new ATOM 0 HA SER A 118 -10.505 1.459 -3.767 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.227 -0.748 -4.751 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.800 -0.682 -5.520 1.00 0.00 H new ATOM 0 HG SER A 118 -9.381 0.529 -6.280 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.394 1.848 -5.190 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.258 2.858 -5.854 1.00 0.00 C ATOM 1849 C ASP A 119 -14.747 3.831 -4.801 1.00 0.00 C ATOM 1850 O ASP A 119 -14.956 5.000 -5.051 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.423 2.070 -6.458 1.00 0.00 C ATOM 1852 CG ASP A 119 -16.463 3.043 -7.017 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -17.131 3.685 -6.224 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -16.573 3.127 -8.229 1.00 0.00 O ATOM 0 H ASP A 119 -13.861 0.974 -4.949 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.740 3.428 -6.625 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.061 1.414 -7.250 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.877 1.433 -5.699 1.00 0.00 H new ATOM 1859 N THR A 120 -14.891 3.343 -3.613 1.00 0.00 N ATOM 1860 CA THR A 120 -15.326 4.209 -2.491 1.00 0.00 C ATOM 1861 C THR A 120 -14.220 5.214 -2.226 1.00 0.00 C ATOM 1862 O THR A 120 -14.447 6.388 -2.009 1.00 0.00 O ATOM 1863 CB THR A 120 -15.512 3.253 -1.309 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.790 2.639 -1.397 1.00 0.00 O ATOM 1865 CG2 THR A 120 -15.403 4.023 0.005 1.00 0.00 C ATOM 0 H THR A 120 -14.724 2.368 -3.364 1.00 0.00 H new ATOM 0 HA THR A 120 -16.243 4.765 -2.684 1.00 0.00 H new ATOM 0 HB THR A 120 -14.736 2.488 -1.339 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.731 1.839 -1.961 1.00 0.00 H new ATOM 0 HG21 THR A 120 -15.536 3.337 0.841 1.00 0.00 H new ATOM 0 HG22 THR A 120 -14.421 4.490 0.072 1.00 0.00 H new ATOM 0 HG23 THR A 120 -16.174 4.793 0.041 1.00 0.00 H new ATOM 1873 N ILE A 121 -13.020 4.740 -2.285 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.840 5.618 -2.087 1.00 0.00 C ATOM 1875 C ILE A 121 -11.669 6.482 -3.338 1.00 0.00 C ATOM 1876 O ILE A 121 -11.420 7.669 -3.263 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.676 4.630 -1.896 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -10.150 4.750 -0.469 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.539 4.899 -2.888 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -8.845 3.961 -0.332 1.00 0.00 C ATOM 0 H ILE A 121 -12.797 3.761 -2.466 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.915 6.302 -1.242 1.00 0.00 H new ATOM 0 HB ILE A 121 -11.047 3.622 -2.080 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -9.981 5.798 -0.221 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -10.891 4.371 0.235 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.735 4.182 -2.723 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.913 4.797 -3.907 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -9.159 5.910 -2.741 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.472 4.049 0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.028 2.911 -0.562 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -8.104 4.360 -1.025 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.819 5.883 -4.487 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.691 6.636 -5.746 1.00 0.00 C ATOM 1894 C LYS A 122 -12.755 7.722 -5.784 1.00 0.00 C ATOM 1895 O LYS A 122 -12.533 8.818 -6.262 1.00 0.00 O ATOM 1896 CB LYS A 122 -11.937 5.587 -6.825 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.641 5.384 -7.600 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.204 3.921 -7.528 1.00 0.00 C ATOM 1899 CE LYS A 122 -9.041 3.788 -6.538 1.00 0.00 C ATOM 1900 NZ LYS A 122 -8.100 2.826 -7.178 1.00 0.00 N ATOM 0 H LYS A 122 -12.027 4.891 -4.599 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.727 7.129 -5.870 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.261 4.649 -6.375 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.733 5.911 -7.495 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.781 5.678 -8.640 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.860 6.025 -7.190 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.039 3.295 -7.212 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -9.899 3.572 -8.514 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.562 4.751 -6.360 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.385 3.420 -5.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.231 2.760 -6.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.548 1.889 -7.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.863 3.157 -8.135 1.00 0.00 H new ATOM 1914 N SER A 123 -13.909 7.427 -5.260 1.00 0.00 N ATOM 1915 CA SER A 123 -14.992 8.438 -5.239 1.00 0.00 C ATOM 1916 C SER A 123 -14.788 9.376 -4.059 1.00 0.00 C ATOM 1917 O SER A 123 -15.385 10.430 -3.970 1.00 0.00 O ATOM 1918 CB SER A 123 -16.274 7.643 -5.063 1.00 0.00 C ATOM 1919 OG SER A 123 -16.866 7.414 -6.336 1.00 0.00 O ATOM 0 H SER A 123 -14.147 6.526 -4.845 1.00 0.00 H new ATOM 0 HA SER A 123 -15.014 9.045 -6.144 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.062 6.693 -4.572 1.00 0.00 H new ATOM 0 HB3 SER A 123 -16.966 8.186 -4.420 1.00 0.00 H new ATOM 0 HG SER A 123 -17.693 6.900 -6.225 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.937 8.994 -3.157 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.668 9.857 -1.974 1.00 0.00 C ATOM 1927 C PHE A 124 -12.718 10.985 -2.365 1.00 0.00 C ATOM 1928 O PHE A 124 -12.332 11.803 -1.554 1.00 0.00 O ATOM 1929 CB PHE A 124 -13.007 8.935 -0.955 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.421 9.345 0.439 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -12.729 10.364 1.103 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -14.498 8.707 1.065 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -13.113 10.745 2.395 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -14.883 9.087 2.356 1.00 0.00 C ATOM 1935 CZ PHE A 124 -14.191 10.107 3.022 1.00 0.00 C ATOM 0 H PHE A 124 -13.413 8.119 -3.185 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.573 10.317 -1.578 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -13.297 7.901 -1.143 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.923 8.985 -1.053 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -11.899 10.857 0.619 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -15.032 7.921 0.552 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -12.578 11.531 2.908 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.714 8.594 2.839 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.488 10.401 4.018 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.339 11.025 -3.607 1.00 0.00 N ATOM 1946 CA ALA A 125 -11.406 12.092 -4.072 1.00 0.00 C ATOM 1947 C ALA A 125 -12.146 13.097 -4.958 1.00 0.00 C ATOM 1948 O ALA A 125 -11.830 14.271 -4.980 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.337 11.355 -4.879 1.00 0.00 C ATOM 0 H ALA A 125 -12.634 10.364 -4.326 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.979 12.656 -3.243 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.609 12.072 -5.258 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -9.834 10.630 -4.239 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.806 10.837 -5.716 1.00 0.00 H new ATOM 1955 N SER A 126 -13.125 12.646 -5.692 1.00 0.00 N ATOM 1956 CA SER A 126 -13.882 13.573 -6.579 1.00 0.00 C ATOM 1957 C SER A 126 -14.275 14.841 -5.816 1.00 0.00 C ATOM 1958 O SER A 126 -15.180 14.834 -5.006 1.00 0.00 O ATOM 1959 CB SER A 126 -15.126 12.793 -6.995 1.00 0.00 C ATOM 1960 OG SER A 126 -14.799 11.415 -7.113 1.00 0.00 O ATOM 0 H SER A 126 -13.434 11.674 -5.716 1.00 0.00 H new ATOM 0 HA SER A 126 -13.292 13.892 -7.438 1.00 0.00 H new ATOM 0 HB2 SER A 126 -15.918 12.929 -6.258 1.00 0.00 H new ATOM 0 HB3 SER A 126 -15.506 13.171 -7.944 1.00 0.00 H new ATOM 0 HG SER A 126 -15.597 10.911 -7.378 1.00 0.00 H new ATOM 1966 N SER A 127 -13.605 15.931 -6.072 1.00 0.00 N ATOM 1967 CA SER A 127 -13.943 17.200 -5.366 1.00 0.00 C ATOM 1968 C SER A 127 -14.857 18.060 -6.243 1.00 0.00 C ATOM 1969 O SER A 127 -14.486 18.473 -7.324 1.00 0.00 O ATOM 1970 CB SER A 127 -12.603 17.898 -5.141 1.00 0.00 C ATOM 1971 OG SER A 127 -11.857 17.176 -4.171 1.00 0.00 O ATOM 0 H SER A 127 -12.837 15.998 -6.740 1.00 0.00 H new ATOM 0 HA SER A 127 -14.471 17.025 -4.429 1.00 0.00 H new ATOM 0 HB2 SER A 127 -12.047 17.954 -6.077 1.00 0.00 H new ATOM 0 HB3 SER A 127 -12.765 18.922 -4.804 1.00 0.00 H new ATOM 0 HG SER A 127 -11.742 16.250 -4.470 1.00 0.00 H new ATOM 1977 N GLY A 128 -16.052 18.328 -5.790 1.00 0.00 N ATOM 1978 CA GLY A 128 -16.985 19.157 -6.602 1.00 0.00 C ATOM 1979 C GLY A 128 -17.303 20.457 -5.861 1.00 0.00 C ATOM 1980 O GLY A 128 -16.570 21.422 -5.940 1.00 0.00 O ATOM 0 H GLY A 128 -16.421 18.009 -4.894 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -16.538 19.380 -7.571 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -17.904 18.603 -6.795 1.00 0.00 H new ATOM 1984 N LYS A 129 -18.396 20.493 -5.149 1.00 0.00 N ATOM 1985 CA LYS A 129 -18.764 21.737 -4.412 1.00 0.00 C ATOM 1986 C LYS A 129 -18.871 21.458 -2.911 1.00 0.00 C ATOM 1987 O LYS A 129 -19.035 20.332 -2.488 1.00 0.00 O ATOM 1988 CB LYS A 129 -20.126 22.145 -4.982 1.00 0.00 C ATOM 1989 CG LYS A 129 -20.112 21.985 -6.505 1.00 0.00 C ATOM 1990 CD LYS A 129 -21.354 22.644 -7.105 1.00 0.00 C ATOM 1991 CE LYS A 129 -21.041 23.125 -8.524 1.00 0.00 C ATOM 1992 NZ LYS A 129 -21.729 24.439 -8.647 1.00 0.00 N ATOM 0 H LYS A 129 -19.050 19.717 -5.045 1.00 0.00 H new ATOM 0 HA LYS A 129 -18.018 22.522 -4.532 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -20.913 21.528 -4.548 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -20.348 23.179 -4.716 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -19.212 22.439 -6.919 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -20.086 20.928 -6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -22.182 21.935 -7.124 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -21.668 23.484 -6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -19.967 23.226 -8.678 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -21.405 22.418 -9.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -21.560 24.832 -9.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -22.751 24.311 -8.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -21.357 25.094 -7.930 1.00 0.00 H new ATOM 2006 N GLU A 130 -18.777 22.478 -2.102 1.00 0.00 N ATOM 2007 CA GLU A 130 -18.870 22.273 -0.629 1.00 0.00 C ATOM 2008 C GLU A 130 -20.219 21.654 -0.258 1.00 0.00 C ATOM 2009 O GLU A 130 -21.263 22.154 -0.623 1.00 0.00 O ATOM 2010 CB GLU A 130 -18.723 23.673 -0.019 1.00 0.00 C ATOM 2011 CG GLU A 130 -20.048 24.435 -0.121 1.00 0.00 C ATOM 2012 CD GLU A 130 -20.464 24.554 -1.588 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -19.619 24.902 -2.397 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -21.621 24.297 -1.878 1.00 0.00 O ATOM 0 H GLU A 130 -18.640 23.444 -2.398 1.00 0.00 H new ATOM 0 HA GLU A 130 -18.105 21.590 -0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -18.420 23.593 1.025 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -17.938 24.223 -0.537 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -20.821 23.916 0.445 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -19.943 25.427 0.319 1.00 0.00 H new ATOM 2021 N LYS A 131 -20.193 20.566 0.469 1.00 0.00 N ATOM 2022 CA LYS A 131 -21.461 19.893 0.883 1.00 0.00 C ATOM 2023 C LYS A 131 -22.518 19.979 -0.222 1.00 0.00 C ATOM 2024 O LYS A 131 -23.693 20.138 0.044 1.00 0.00 O ATOM 2025 CB LYS A 131 -21.913 20.647 2.137 1.00 0.00 C ATOM 2026 CG LYS A 131 -22.451 22.035 1.766 1.00 0.00 C ATOM 2027 CD LYS A 131 -23.606 22.399 2.700 1.00 0.00 C ATOM 2028 CE LYS A 131 -23.153 22.273 4.158 1.00 0.00 C ATOM 2029 NZ LYS A 131 -24.349 21.768 4.886 1.00 0.00 N ATOM 0 H LYS A 131 -19.340 20.112 0.796 1.00 0.00 H new ATOM 0 HA LYS A 131 -21.316 18.830 1.074 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -22.686 20.077 2.652 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -21.077 20.748 2.829 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -21.657 22.778 1.845 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.791 22.040 0.730 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -23.941 23.417 2.500 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -24.456 21.742 2.515 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -22.313 21.585 4.253 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -22.825 23.234 4.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -24.120 21.655 5.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -25.130 22.447 4.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -24.634 20.849 4.491 1.00 0.00 H new ATOM 2043 N LEU A 132 -22.113 19.875 -1.456 1.00 0.00 N ATOM 2044 CA LEU A 132 -23.101 19.950 -2.570 1.00 0.00 C ATOM 2045 C LEU A 132 -23.732 21.344 -2.625 1.00 0.00 C ATOM 2046 O LEU A 132 -23.363 22.234 -1.885 1.00 0.00 O ATOM 2047 CB LEU A 132 -24.159 18.899 -2.229 1.00 0.00 C ATOM 2048 CG LEU A 132 -24.461 18.059 -3.469 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -24.142 16.590 -3.183 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -25.942 18.198 -3.829 1.00 0.00 C ATOM 0 H LEU A 132 -21.143 19.742 -1.742 1.00 0.00 H new ATOM 0 HA LEU A 132 -22.642 19.770 -3.542 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -23.804 18.259 -1.421 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -25.069 19.385 -1.875 1.00 0.00 H new ATOM 0 HG LEU A 132 -23.849 18.407 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -24.358 15.992 -4.068 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -23.088 16.490 -2.926 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -24.753 16.240 -2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -26.159 17.599 -4.714 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -26.553 17.850 -2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -26.170 19.244 -4.034 1.00 0.00 H new ATOM 2062 N GLU A 133 -24.683 21.540 -3.497 1.00 0.00 N ATOM 2063 CA GLU A 133 -25.338 22.875 -3.600 1.00 0.00 C ATOM 2064 C GLU A 133 -26.452 22.999 -2.556 1.00 0.00 C ATOM 2065 O GLU A 133 -26.215 22.632 -1.418 1.00 0.00 O ATOM 2066 CB GLU A 133 -25.921 22.925 -5.013 1.00 0.00 C ATOM 2067 CG GLU A 133 -25.553 24.257 -5.670 1.00 0.00 C ATOM 2068 CD GLU A 133 -26.671 24.684 -6.623 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -27.776 24.190 -6.466 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -26.404 25.496 -7.492 1.00 0.00 O ATOM 0 H GLU A 133 -25.035 20.833 -4.143 1.00 0.00 H new ATOM 0 HA GLU A 133 -24.639 23.692 -3.419 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -25.536 22.096 -5.606 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -27.005 22.813 -4.975 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -25.400 25.020 -4.907 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.614 24.158 -6.215 1.00 0.00 H new TER 2077 GLU A 133