USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1187 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 LYS NZ :NH3+ -126:sc= 0.42 (180deg=0) USER MOD Set 1.2: A 110 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 92 TYR OH : rot 180:sc= -0.275 USER MOD Set 2.2: A 118 ASN : amide:sc= -3.55 K(o=-3.8,f=-6.9!) USER MOD Set 3.1: A 57 LYS NZ :NH3+ -114:sc= 0.014 (180deg=-0.0999) USER MOD Set 3.2: A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 35 THR OG1 : rot 180:sc= -0.739! USER MOD Set 4.2: A 36 SER OG : rot -63:sc= 0.117 USER MOD Set 5.1: A 21 CYS SG : rot -50:sc= -3.58 USER MOD Set 5.2: A 23 GLN : amide:sc= -0.864 K(o=-4.4,f=-5.2!) USER MOD Set 6.1: A 17 THR OG1 : rot -140:sc= -0.15 USER MOD Set 6.2: A 47 HIS :FLIP no HD1:sc= -1.27 F(o=-3.9!,f=-2.5) USER MOD Set 6.3: A 51 MET CE :methyl -151:sc= -1.11! (180deg=-3.66!) USER MOD Single : A 1 MET CE :methyl 150:sc= -0.278 (180deg=-1.31!) USER MOD Single : A 1 MET N :NH3+ -111:sc= 0.0584 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -116:sc= 0 (180deg=-0.0817) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 7 SER OG : rot 113:sc= -1.49 USER MOD Single : A 8 TYR OH : rot 1:sc= -0.31 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -2.67 X(o=-2.7,f=-2.7!) USER MOD Single : A 19 SER OG : rot -168:sc= -2.46 USER MOD Single : A 20 SER OG : rot 16:sc= -0.237 USER MOD Single : A 26 GLN : amide:sc= -0.489 X(o=-0.49,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc=-0.00177 X(o=-0.0018,f=0) USER MOD Single : A 30 ASN : amide:sc= -0.0516 K(o=-0.052,f=-0.59) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -27:sc= 0.331 USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 40 GLN : amide:sc= 0.141 K(o=0.14,f=-0.57) USER MOD Single : A 42 THR OG1 : rot 180:sc= -2.19! USER MOD Single : A 48 ASN : amide:sc= -0.369 K(o=-0.37,f=-1.9!) USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.042) USER MOD Single : A 64 ASN : amide:sc= -0.391 K(o=-0.39,f=-3!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl 177:sc= -5.58! (180deg=-5.72!) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.778 X(o=-0.78,f=-0.4) USER MOD Single : A 79 CYS SG : rot 91:sc= 0.461 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot -160:sc= -0.467 USER MOD Single : A 83 THR OG1 : rot 102:sc= -3.69! USER MOD Single : A 86 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-3.5!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 10:sc= 0.516 USER MOD Single : A 94 CYS SG : rot 51:sc= -4.25 USER MOD Single : A 96 THR OG1 : rot 109:sc= -0.545 USER MOD Single : A 102 LYS NZ :NH3+ -165:sc= 0 (180deg=-5.8e-05) USER MOD Single : A 113 GLN : amide:sc= -1.49 X(o=-1.5,f=-1.1) USER MOD Single : A 115 TYR OH : rot 165:sc= -2.55 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.457 USER MOD Single : A 121 ASN :FLIP amide:sc= -0.366 F(o=-1.3,f=-0.37) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 HIS :FLIP no HD1:sc= -8.91! C(o=-9.8!,f=-8.9!) USER MOD Single : A 130 GLN : amide:sc= -0.147 K(o=-0.15,f=-1.7!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 HIS :FLIP no HD1:sc= -0.432 F(o=-1.7,f=-0.43) USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.0931 X(o=-0.093,f=0) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0.0279 USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.910 -6.701 -15.455 1.00 0.00 N ATOM 2 CA MET A 1 14.449 -6.513 -15.251 1.00 0.00 C ATOM 3 C MET A 1 14.121 -6.287 -13.780 1.00 0.00 C ATOM 4 O MET A 1 14.930 -6.581 -12.901 1.00 0.00 O ATOM 5 CB MET A 1 13.722 -7.757 -15.769 1.00 0.00 C ATOM 6 CG MET A 1 13.707 -7.864 -17.286 1.00 0.00 C ATOM 7 SD MET A 1 12.323 -8.843 -17.899 1.00 0.00 S ATOM 8 CE MET A 1 10.937 -7.862 -17.333 1.00 0.00 C ATOM 0 H1 MET A 1 16.298 -5.881 -15.964 1.00 0.00 H new ATOM 0 H2 MET A 1 16.381 -6.790 -14.532 1.00 0.00 H new ATOM 0 H3 MET A 1 16.075 -7.564 -16.012 1.00 0.00 H new ATOM 0 HA MET A 1 14.122 -5.629 -15.799 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.199 -8.645 -15.355 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.695 -7.747 -15.403 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.658 -6.864 -17.716 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.642 -8.312 -17.624 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.100 -7.984 -18.021 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.640 -8.192 -16.338 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.226 -6.812 -17.296 1.00 0.00 H new ATOM 20 N LYS A 2 12.929 -5.761 -13.519 1.00 0.00 N ATOM 21 CA LYS A 2 12.495 -5.494 -12.153 1.00 0.00 C ATOM 22 C LYS A 2 11.058 -5.962 -11.936 1.00 0.00 C ATOM 23 O LYS A 2 10.174 -5.674 -12.742 1.00 0.00 O ATOM 24 CB LYS A 2 12.613 -4.000 -11.840 1.00 0.00 C ATOM 25 CG LYS A 2 13.232 -3.709 -10.484 1.00 0.00 C ATOM 26 CD LYS A 2 12.398 -4.288 -9.354 1.00 0.00 C ATOM 27 CE LYS A 2 12.370 -3.362 -8.149 1.00 0.00 C ATOM 28 NZ LYS A 2 13.478 -3.656 -7.199 1.00 0.00 N ATOM 0 H LYS A 2 12.247 -5.511 -14.235 1.00 0.00 H new ATOM 0 HA LYS A 2 13.144 -6.051 -11.477 1.00 0.00 H new ATOM 0 HB2 LYS A 2 13.213 -3.522 -12.614 1.00 0.00 H new ATOM 0 HB3 LYS A 2 11.621 -3.549 -11.881 1.00 0.00 H new ATOM 0 HG2 LYS A 2 14.238 -4.126 -10.445 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.328 -2.631 -10.351 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.380 -4.462 -9.704 1.00 0.00 H new ATOM 0 HD3 LYS A 2 12.804 -5.256 -9.060 1.00 0.00 H new ATOM 0 HE2 LYS A 2 12.444 -2.327 -8.484 1.00 0.00 H new ATOM 0 HE3 LYS A 2 11.414 -3.463 -7.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 13.082 -3.980 -6.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 14.088 -4.399 -7.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 14.039 -2.795 -7.043 1.00 0.00 H new ATOM 42 N ARG A 3 10.833 -6.682 -10.842 1.00 0.00 N ATOM 43 CA ARG A 3 9.505 -7.189 -10.517 1.00 0.00 C ATOM 44 C ARG A 3 9.082 -6.752 -9.118 1.00 0.00 C ATOM 45 O ARG A 3 9.700 -5.869 -8.522 1.00 0.00 O ATOM 46 CB ARG A 3 9.480 -8.716 -10.622 1.00 0.00 C ATOM 47 CG ARG A 3 8.285 -9.253 -11.393 1.00 0.00 C ATOM 48 CD ARG A 3 8.652 -9.597 -12.828 1.00 0.00 C ATOM 49 NE ARG A 3 8.293 -10.973 -13.171 1.00 0.00 N ATOM 50 CZ ARG A 3 8.897 -12.044 -12.661 1.00 0.00 C ATOM 51 NH1 ARG A 3 9.888 -11.905 -11.790 1.00 0.00 N ATOM 52 NH2 ARG A 3 8.507 -13.258 -13.025 1.00 0.00 N ATOM 0 H ARG A 3 11.555 -6.928 -10.164 1.00 0.00 H new ATOM 0 HA ARG A 3 8.798 -6.773 -11.234 1.00 0.00 H new ATOM 0 HB2 ARG A 3 10.396 -9.054 -11.107 1.00 0.00 H new ATOM 0 HB3 ARG A 3 9.475 -9.141 -9.618 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.898 -10.141 -10.893 1.00 0.00 H new ATOM 0 HG3 ARG A 3 7.486 -8.512 -11.389 1.00 0.00 H new ATOM 0 HD2 ARG A 3 8.145 -8.910 -13.506 1.00 0.00 H new ATOM 0 HD3 ARG A 3 9.723 -9.455 -12.972 1.00 0.00 H new ATOM 0 HE ARG A 3 7.537 -11.120 -13.839 1.00 0.00 H new ATOM 0 HH11 ARG A 3 10.191 -10.973 -11.507 1.00 0.00 H new ATOM 0 HH12 ARG A 3 10.346 -12.730 -11.403 1.00 0.00 H new ATOM 0 HH21 ARG A 3 7.746 -13.370 -13.695 1.00 0.00 H new ATOM 0 HH22 ARG A 3 8.968 -14.080 -12.636 1.00 0.00 H new ATOM 66 N PHE A 4 8.027 -7.371 -8.598 1.00 0.00 N ATOM 67 CA PHE A 4 7.526 -7.043 -7.270 1.00 0.00 C ATOM 68 C PHE A 4 6.629 -8.154 -6.732 1.00 0.00 C ATOM 69 O PHE A 4 6.373 -9.143 -7.418 1.00 0.00 O ATOM 70 CB PHE A 4 6.758 -5.723 -7.306 1.00 0.00 C ATOM 71 CG PHE A 4 7.641 -4.514 -7.188 1.00 0.00 C ATOM 72 CD1 PHE A 4 7.475 -3.432 -8.037 1.00 0.00 C ATOM 73 CD2 PHE A 4 8.637 -4.462 -6.229 1.00 0.00 C ATOM 74 CE1 PHE A 4 8.287 -2.319 -7.929 1.00 0.00 C ATOM 75 CE2 PHE A 4 9.453 -3.353 -6.116 1.00 0.00 C ATOM 76 CZ PHE A 4 9.277 -2.280 -6.967 1.00 0.00 C ATOM 0 H PHE A 4 7.503 -8.103 -9.077 1.00 0.00 H new ATOM 0 HA PHE A 4 8.382 -6.941 -6.602 1.00 0.00 H new ATOM 0 HB2 PHE A 4 6.196 -5.664 -8.238 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.030 -5.713 -6.494 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.703 -3.459 -8.791 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.778 -5.299 -5.561 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.148 -1.481 -8.596 1.00 0.00 H new ATOM 0 HE2 PHE A 4 10.227 -3.325 -5.363 1.00 0.00 H new ATOM 0 HZ PHE A 4 9.913 -1.411 -6.880 1.00 0.00 H new ATOM 86 N ASN A 5 6.154 -7.984 -5.502 1.00 0.00 N ATOM 87 CA ASN A 5 5.288 -8.975 -4.875 1.00 0.00 C ATOM 88 C ASN A 5 4.796 -8.498 -3.513 1.00 0.00 C ATOM 89 O ASN A 5 5.517 -8.584 -2.519 1.00 0.00 O ATOM 90 CB ASN A 5 6.028 -10.306 -4.724 1.00 0.00 C ATOM 91 CG ASN A 5 5.122 -11.499 -4.955 1.00 0.00 C ATOM 92 OD1 ASN A 5 4.094 -11.650 -4.294 1.00 0.00 O ATOM 93 ND2 ASN A 5 5.500 -12.355 -5.898 1.00 0.00 N ATOM 0 H ASN A 5 6.354 -7.170 -4.921 1.00 0.00 H new ATOM 0 HA ASN A 5 4.421 -9.116 -5.520 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.857 -10.340 -5.431 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.459 -10.368 -3.725 1.00 0.00 H new ATOM 0 HD21 ASN A 5 4.930 -13.177 -6.099 1.00 0.00 H new ATOM 0 HD22 ASN A 5 6.360 -12.190 -6.421 1.00 0.00 H new ATOM 100 N VAL A 6 3.560 -8.006 -3.470 1.00 0.00 N ATOM 101 CA VAL A 6 2.979 -7.531 -2.221 1.00 0.00 C ATOM 102 C VAL A 6 2.897 -8.669 -1.206 1.00 0.00 C ATOM 103 O VAL A 6 2.250 -9.687 -1.452 1.00 0.00 O ATOM 104 CB VAL A 6 1.579 -6.914 -2.439 1.00 0.00 C ATOM 105 CG1 VAL A 6 0.816 -6.813 -1.130 1.00 0.00 C ATOM 106 CG2 VAL A 6 1.694 -5.544 -3.085 1.00 0.00 C ATOM 0 H VAL A 6 2.946 -7.927 -4.281 1.00 0.00 H new ATOM 0 HA VAL A 6 3.632 -6.749 -1.833 1.00 0.00 H new ATOM 0 HB VAL A 6 1.025 -7.573 -3.108 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -0.165 -6.375 -1.314 1.00 0.00 H new ATOM 0 HG12 VAL A 6 0.695 -7.808 -0.702 1.00 0.00 H new ATOM 0 HG13 VAL A 6 1.370 -6.183 -0.434 1.00 0.00 H new ATOM 0 HG21 VAL A 6 0.698 -5.126 -3.231 1.00 0.00 H new ATOM 0 HG22 VAL A 6 2.274 -4.885 -2.439 1.00 0.00 H new ATOM 0 HG23 VAL A 6 2.193 -5.637 -4.050 1.00 0.00 H new ATOM 116 N SER A 7 3.567 -8.490 -0.074 1.00 0.00 N ATOM 117 CA SER A 7 3.588 -9.503 0.975 1.00 0.00 C ATOM 118 C SER A 7 2.180 -9.881 1.423 1.00 0.00 C ATOM 119 O SER A 7 1.816 -11.057 1.414 1.00 0.00 O ATOM 120 CB SER A 7 4.405 -9.011 2.173 1.00 0.00 C ATOM 121 OG SER A 7 4.806 -7.662 2.002 1.00 0.00 O ATOM 0 H SER A 7 4.105 -7.650 0.142 1.00 0.00 H new ATOM 0 HA SER A 7 4.057 -10.395 0.560 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.813 -9.104 3.083 1.00 0.00 H new ATOM 0 HB3 SER A 7 5.285 -9.641 2.300 1.00 0.00 H new ATOM 0 HG SER A 7 4.350 -7.099 2.662 1.00 0.00 H new ATOM 127 N TYR A 8 1.395 -8.888 1.823 1.00 0.00 N ATOM 128 CA TYR A 8 0.037 -9.143 2.283 1.00 0.00 C ATOM 129 C TYR A 8 -0.925 -8.052 1.839 1.00 0.00 C ATOM 130 O TYR A 8 -0.624 -6.866 1.944 1.00 0.00 O ATOM 131 CB TYR A 8 0.009 -9.263 3.801 1.00 0.00 C ATOM 132 CG TYR A 8 1.194 -10.001 4.389 1.00 0.00 C ATOM 133 CD1 TYR A 8 2.247 -9.309 4.972 1.00 0.00 C ATOM 134 CD2 TYR A 8 1.258 -11.389 4.361 1.00 0.00 C ATOM 135 CE1 TYR A 8 3.330 -9.979 5.511 1.00 0.00 C ATOM 136 CE2 TYR A 8 2.336 -12.066 4.898 1.00 0.00 C ATOM 137 CZ TYR A 8 3.370 -11.355 5.471 1.00 0.00 C ATOM 138 OH TYR A 8 4.445 -12.026 6.007 1.00 0.00 O ATOM 0 H TYR A 8 1.673 -7.907 1.838 1.00 0.00 H new ATOM 0 HA TYR A 8 -0.288 -10.082 1.834 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -0.032 -8.263 4.232 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -0.907 -9.775 4.097 1.00 0.00 H new ATOM 0 HD1 TYR A 8 2.220 -8.230 5.005 1.00 0.00 H new ATOM 0 HD2 TYR A 8 0.451 -11.948 3.912 1.00 0.00 H new ATOM 0 HE1 TYR A 8 4.141 -9.426 5.961 1.00 0.00 H new ATOM 0 HE2 TYR A 8 2.369 -13.145 4.869 1.00 0.00 H new ATOM 0 HH TYR A 8 5.077 -11.381 6.386 1.00 0.00 H new ATOM 148 N VAL A 9 -2.091 -8.463 1.354 1.00 0.00 N ATOM 149 CA VAL A 9 -3.107 -7.507 0.909 1.00 0.00 C ATOM 150 C VAL A 9 -4.462 -7.827 1.533 1.00 0.00 C ATOM 151 O VAL A 9 -5.223 -8.634 1.002 1.00 0.00 O ATOM 152 CB VAL A 9 -3.267 -7.469 -0.629 1.00 0.00 C ATOM 153 CG1 VAL A 9 -3.672 -6.074 -1.082 1.00 0.00 C ATOM 154 CG2 VAL A 9 -1.991 -7.911 -1.338 1.00 0.00 C ATOM 0 H VAL A 9 -2.358 -9.443 1.258 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.759 -6.528 1.238 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.054 -8.173 -0.900 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.781 -6.061 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.620 -5.802 -0.618 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.905 -5.358 -0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.142 -7.871 -2.417 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.172 -7.247 -1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.746 -8.931 -1.043 1.00 0.00 H new ATOM 164 N GLU A 10 -4.757 -7.196 2.669 1.00 0.00 N ATOM 165 CA GLU A 10 -6.018 -7.424 3.362 1.00 0.00 C ATOM 166 C GLU A 10 -6.970 -6.244 3.197 1.00 0.00 C ATOM 167 O GLU A 10 -6.656 -5.121 3.594 1.00 0.00 O ATOM 168 CB GLU A 10 -5.765 -7.686 4.848 1.00 0.00 C ATOM 169 CG GLU A 10 -6.196 -9.071 5.307 1.00 0.00 C ATOM 170 CD GLU A 10 -5.664 -9.422 6.681 1.00 0.00 C ATOM 171 OE1 GLU A 10 -5.235 -8.503 7.408 1.00 0.00 O ATOM 172 OE2 GLU A 10 -5.677 -10.622 7.033 1.00 0.00 O ATOM 0 H GLU A 10 -4.139 -6.525 3.126 1.00 0.00 H new ATOM 0 HA GLU A 10 -6.488 -8.300 2.915 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.702 -7.559 5.054 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.296 -6.937 5.435 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -7.285 -9.123 5.319 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.849 -9.812 4.587 1.00 0.00 H new ATOM 179 N VAL A 11 -8.140 -6.511 2.626 1.00 0.00 N ATOM 180 CA VAL A 11 -9.147 -5.474 2.431 1.00 0.00 C ATOM 181 C VAL A 11 -9.987 -5.330 3.692 1.00 0.00 C ATOM 182 O VAL A 11 -10.015 -6.232 4.527 1.00 0.00 O ATOM 183 CB VAL A 11 -10.065 -5.789 1.234 1.00 0.00 C ATOM 184 CG1 VAL A 11 -10.990 -4.619 0.940 1.00 0.00 C ATOM 185 CG2 VAL A 11 -9.236 -6.134 0.008 1.00 0.00 C ATOM 0 H VAL A 11 -8.414 -7.435 2.291 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.627 -4.540 2.220 1.00 0.00 H new ATOM 0 HB VAL A 11 -10.680 -6.651 1.492 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.628 -4.864 0.091 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.610 -4.417 1.814 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -10.396 -3.736 0.704 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.899 -6.354 -0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.596 -5.290 -0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -8.618 -7.006 0.220 1.00 0.00 H new ATOM 195 N ILE A 12 -10.652 -4.193 3.842 1.00 0.00 N ATOM 196 CA ILE A 12 -11.467 -3.947 5.024 1.00 0.00 C ATOM 197 C ILE A 12 -12.790 -3.276 4.677 1.00 0.00 C ATOM 198 O ILE A 12 -12.813 -2.159 4.175 1.00 0.00 O ATOM 199 CB ILE A 12 -10.706 -3.056 6.022 1.00 0.00 C ATOM 200 CG1 ILE A 12 -9.487 -3.798 6.576 1.00 0.00 C ATOM 201 CG2 ILE A 12 -11.616 -2.602 7.151 1.00 0.00 C ATOM 202 CD1 ILE A 12 -8.201 -3.018 6.450 1.00 0.00 C ATOM 0 H ILE A 12 -10.644 -3.430 3.165 1.00 0.00 H new ATOM 0 HA ILE A 12 -11.679 -4.919 5.470 1.00 0.00 H new ATOM 0 HB ILE A 12 -10.361 -2.168 5.492 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -9.660 -4.032 7.627 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -9.380 -4.748 6.052 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -11.053 -1.974 7.842 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -12.450 -2.033 6.740 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -11.999 -3.473 7.682 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -7.379 -3.603 6.862 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -8.005 -2.807 5.399 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -8.289 -2.080 6.998 1.00 0.00 H new ATOM 214 N LYS A 13 -13.890 -3.958 4.960 1.00 0.00 N ATOM 215 CA LYS A 13 -15.211 -3.402 4.682 1.00 0.00 C ATOM 216 C LYS A 13 -15.912 -2.954 5.966 1.00 0.00 C ATOM 217 O LYS A 13 -16.338 -3.779 6.774 1.00 0.00 O ATOM 218 CB LYS A 13 -16.083 -4.419 3.943 1.00 0.00 C ATOM 219 CG LYS A 13 -16.698 -3.872 2.663 1.00 0.00 C ATOM 220 CD LYS A 13 -17.580 -4.904 1.982 1.00 0.00 C ATOM 221 CE LYS A 13 -18.839 -4.271 1.410 1.00 0.00 C ATOM 222 NZ LYS A 13 -19.963 -4.285 2.386 1.00 0.00 N ATOM 0 H LYS A 13 -13.898 -4.888 5.378 1.00 0.00 H new ATOM 0 HA LYS A 13 -15.068 -2.528 4.047 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.481 -5.295 3.702 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -16.881 -4.753 4.607 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -17.287 -2.984 2.892 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.906 -3.563 1.981 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.021 -5.391 1.183 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.854 -5.679 2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -18.627 -3.243 1.116 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -19.136 -4.806 0.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -20.801 -3.844 1.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -20.184 -5.267 2.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.690 -3.753 3.237 1.00 0.00 H new ATOM 236 N ASN A 14 -16.038 -1.640 6.136 1.00 0.00 N ATOM 237 CA ASN A 14 -16.703 -1.071 7.306 1.00 0.00 C ATOM 238 C ASN A 14 -15.991 -1.456 8.601 1.00 0.00 C ATOM 239 O ASN A 14 -16.637 -1.707 9.619 1.00 0.00 O ATOM 240 CB ASN A 14 -18.160 -1.538 7.355 1.00 0.00 C ATOM 241 CG ASN A 14 -19.129 -0.392 7.568 1.00 0.00 C ATOM 242 OD1 ASN A 14 -18.894 0.490 8.395 1.00 0.00 O ATOM 243 ND2 ASN A 14 -20.226 -0.400 6.820 1.00 0.00 N ATOM 0 H ASN A 14 -15.687 -0.947 5.475 1.00 0.00 H new ATOM 0 HA ASN A 14 -16.668 0.015 7.215 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -18.406 -2.049 6.424 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -18.279 -2.264 8.159 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -20.916 0.345 6.918 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -20.379 -1.151 6.147 1.00 0.00 H new ATOM 250 N GLY A 15 -14.664 -1.508 8.559 1.00 0.00 N ATOM 251 CA GLY A 15 -13.909 -1.871 9.741 1.00 0.00 C ATOM 252 C GLY A 15 -13.918 -3.364 9.966 1.00 0.00 C ATOM 253 O GLY A 15 -13.782 -3.835 11.096 1.00 0.00 O ATOM 0 H GLY A 15 -14.102 -1.306 7.732 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -12.881 -1.524 9.638 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -14.330 -1.368 10.612 1.00 0.00 H new ATOM 257 N GLU A 16 -14.080 -4.111 8.880 1.00 0.00 N ATOM 258 CA GLU A 16 -14.105 -5.560 8.948 1.00 0.00 C ATOM 259 C GLU A 16 -13.483 -6.157 7.696 1.00 0.00 C ATOM 260 O GLU A 16 -13.970 -5.950 6.586 1.00 0.00 O ATOM 261 CB GLU A 16 -15.538 -6.066 9.116 1.00 0.00 C ATOM 262 CG GLU A 16 -16.025 -6.046 10.555 1.00 0.00 C ATOM 263 CD GLU A 16 -17.259 -6.900 10.766 1.00 0.00 C ATOM 264 OE1 GLU A 16 -17.131 -8.142 10.755 1.00 0.00 O ATOM 265 OE2 GLU A 16 -18.356 -6.328 10.940 1.00 0.00 O ATOM 0 H GLU A 16 -14.196 -3.732 7.940 1.00 0.00 H new ATOM 0 HA GLU A 16 -13.523 -5.873 9.815 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -16.204 -5.455 8.507 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -15.602 -7.085 8.734 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -15.228 -6.399 11.209 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -16.245 -5.019 10.846 1.00 0.00 H new ATOM 272 N THR A 17 -12.394 -6.884 7.884 1.00 0.00 N ATOM 273 CA THR A 17 -11.682 -7.502 6.775 1.00 0.00 C ATOM 274 C THR A 17 -12.623 -8.246 5.830 1.00 0.00 C ATOM 275 O THR A 17 -13.395 -9.106 6.253 1.00 0.00 O ATOM 276 CB THR A 17 -10.615 -8.460 7.303 1.00 0.00 C ATOM 277 OG1 THR A 17 -10.155 -8.045 8.576 1.00 0.00 O ATOM 278 CG2 THR A 17 -9.412 -8.576 6.394 1.00 0.00 C ATOM 0 H THR A 17 -11.981 -7.062 8.799 1.00 0.00 H new ATOM 0 HA THR A 17 -11.209 -6.701 6.207 1.00 0.00 H new ATOM 0 HB THR A 17 -11.102 -9.433 7.358 1.00 0.00 H new ATOM 0 HG1 THR A 17 -9.185 -8.176 8.632 1.00 0.00 H new ATOM 0 HG21 THR A 17 -8.694 -9.271 6.828 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.728 -8.943 5.418 1.00 0.00 H new ATOM 0 HG23 THR A 17 -8.946 -7.597 6.280 1.00 0.00 H new ATOM 286 N ILE A 18 -12.533 -7.920 4.542 1.00 0.00 N ATOM 287 CA ILE A 18 -13.353 -8.568 3.520 1.00 0.00 C ATOM 288 C ILE A 18 -12.512 -9.550 2.729 1.00 0.00 C ATOM 289 O ILE A 18 -12.925 -10.680 2.460 1.00 0.00 O ATOM 290 CB ILE A 18 -13.972 -7.560 2.518 1.00 0.00 C ATOM 291 CG1 ILE A 18 -13.390 -6.159 2.706 1.00 0.00 C ATOM 292 CG2 ILE A 18 -15.484 -7.536 2.649 1.00 0.00 C ATOM 293 CD1 ILE A 18 -13.968 -5.129 1.757 1.00 0.00 C ATOM 0 H ILE A 18 -11.898 -7.208 4.180 1.00 0.00 H new ATOM 0 HA ILE A 18 -14.162 -9.071 4.050 1.00 0.00 H new ATOM 0 HB ILE A 18 -13.718 -7.892 1.511 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -13.568 -5.836 3.732 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -12.310 -6.202 2.568 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -15.900 -6.822 1.937 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -15.883 -8.529 2.442 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -15.757 -7.239 3.662 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -13.508 -4.159 1.949 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -13.767 -5.429 0.728 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -15.045 -5.057 1.910 1.00 0.00 H new ATOM 305 N SER A 19 -11.326 -9.096 2.349 1.00 0.00 N ATOM 306 CA SER A 19 -10.403 -9.915 1.570 1.00 0.00 C ATOM 307 C SER A 19 -9.042 -10.018 2.249 1.00 0.00 C ATOM 308 O SER A 19 -8.804 -9.393 3.283 1.00 0.00 O ATOM 309 CB SER A 19 -10.244 -9.335 0.165 1.00 0.00 C ATOM 310 OG SER A 19 -11.043 -8.179 -0.002 1.00 0.00 O ATOM 0 H SER A 19 -10.978 -8.162 2.567 1.00 0.00 H new ATOM 0 HA SER A 19 -10.822 -10.919 1.501 1.00 0.00 H new ATOM 0 HB2 SER A 19 -9.198 -9.087 -0.013 1.00 0.00 H new ATOM 0 HB3 SER A 19 -10.524 -10.085 -0.575 1.00 0.00 H new ATOM 0 HG SER A 19 -11.074 -7.937 -0.951 1.00 0.00 H new ATOM 316 N SER A 20 -8.152 -10.814 1.662 1.00 0.00 N ATOM 317 CA SER A 20 -6.816 -11.003 2.215 1.00 0.00 C ATOM 318 C SER A 20 -5.911 -11.760 1.246 1.00 0.00 C ATOM 319 O SER A 20 -6.254 -12.843 0.772 1.00 0.00 O ATOM 320 CB SER A 20 -6.898 -11.759 3.543 1.00 0.00 C ATOM 321 OG SER A 20 -7.242 -13.118 3.336 1.00 0.00 O ATOM 0 H SER A 20 -8.332 -11.337 0.805 1.00 0.00 H new ATOM 0 HA SER A 20 -6.384 -10.017 2.383 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.940 -11.698 4.060 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.639 -11.287 4.188 1.00 0.00 H new ATOM 0 HG SER A 20 -7.107 -13.350 2.393 1.00 0.00 H new ATOM 327 N CYS A 21 -4.744 -11.185 0.973 1.00 0.00 N ATOM 328 CA CYS A 21 -3.769 -11.802 0.080 1.00 0.00 C ATOM 329 C CYS A 21 -2.455 -12.014 0.823 1.00 0.00 C ATOM 330 O CYS A 21 -1.462 -11.339 0.555 1.00 0.00 O ATOM 331 CB CYS A 21 -3.541 -10.922 -1.152 1.00 0.00 C ATOM 332 SG CYS A 21 -2.190 -11.467 -2.227 1.00 0.00 S ATOM 0 H CYS A 21 -4.449 -10.288 1.360 1.00 0.00 H new ATOM 0 HA CYS A 21 -4.154 -12.766 -0.251 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -4.461 -10.890 -1.735 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -3.337 -9.903 -0.822 1.00 0.00 H new ATOM 0 HG CYS A 21 -1.124 -11.677 -1.512 1.00 0.00 H new ATOM 338 N PHE A 22 -2.466 -12.942 1.768 1.00 0.00 N ATOM 339 CA PHE A 22 -1.284 -13.231 2.567 1.00 0.00 C ATOM 340 C PHE A 22 -0.669 -14.555 2.149 1.00 0.00 C ATOM 341 O PHE A 22 -1.117 -15.622 2.569 1.00 0.00 O ATOM 342 CB PHE A 22 -1.649 -13.243 4.056 1.00 0.00 C ATOM 343 CG PHE A 22 -2.065 -11.890 4.561 1.00 0.00 C ATOM 344 CD1 PHE A 22 -3.016 -11.148 3.880 1.00 0.00 C ATOM 345 CD2 PHE A 22 -1.488 -11.347 5.702 1.00 0.00 C ATOM 346 CE1 PHE A 22 -3.384 -9.894 4.316 1.00 0.00 C ATOM 347 CE2 PHE A 22 -1.862 -10.089 6.145 1.00 0.00 C ATOM 348 CZ PHE A 22 -2.808 -9.366 5.447 1.00 0.00 C ATOM 0 H PHE A 22 -3.281 -13.509 2.001 1.00 0.00 H new ATOM 0 HA PHE A 22 -0.544 -12.449 2.398 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -2.459 -13.953 4.222 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -0.794 -13.595 4.633 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -3.476 -11.559 2.994 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -0.744 -11.909 6.247 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -4.124 -9.327 3.770 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -1.414 -9.674 7.036 1.00 0.00 H new ATOM 0 HZ PHE A 22 -3.096 -8.383 5.790 1.00 0.00 H new ATOM 358 N GLN A 23 0.355 -14.480 1.305 1.00 0.00 N ATOM 359 CA GLN A 23 1.021 -15.685 0.818 1.00 0.00 C ATOM 360 C GLN A 23 2.456 -15.776 1.327 1.00 0.00 C ATOM 361 O GLN A 23 3.147 -14.766 1.449 1.00 0.00 O ATOM 362 CB GLN A 23 1.010 -15.711 -0.712 1.00 0.00 C ATOM 363 CG GLN A 23 -0.354 -15.425 -1.318 1.00 0.00 C ATOM 364 CD GLN A 23 -0.269 -14.553 -2.556 1.00 0.00 C ATOM 365 OE1 GLN A 23 0.803 -14.073 -2.920 1.00 0.00 O ATOM 366 NE2 GLN A 23 -1.407 -14.342 -3.210 1.00 0.00 N ATOM 0 H GLN A 23 0.740 -13.606 0.946 1.00 0.00 H new ATOM 0 HA GLN A 23 0.472 -16.545 1.200 1.00 0.00 H new ATOM 0 HB2 GLN A 23 1.724 -14.977 -1.084 1.00 0.00 H new ATOM 0 HB3 GLN A 23 1.351 -16.689 -1.052 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -0.839 -16.367 -1.574 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -0.983 -14.935 -0.575 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -2.274 -14.760 -2.873 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -1.413 -13.762 -4.049 1.00 0.00 H new ATOM 375 N PRO A 24 2.927 -17.002 1.622 1.00 0.00 N ATOM 376 CA PRO A 24 4.286 -17.231 2.105 1.00 0.00 C ATOM 377 C PRO A 24 5.283 -17.307 0.956 1.00 0.00 C ATOM 378 O PRO A 24 4.980 -17.863 -0.100 1.00 0.00 O ATOM 379 CB PRO A 24 4.172 -18.579 2.806 1.00 0.00 C ATOM 380 CG PRO A 24 3.120 -19.311 2.044 1.00 0.00 C ATOM 381 CD PRO A 24 2.175 -18.267 1.498 1.00 0.00 C ATOM 0 HA PRO A 24 4.648 -16.429 2.749 1.00 0.00 H new ATOM 0 HB2 PRO A 24 5.120 -19.116 2.789 1.00 0.00 H new ATOM 0 HB3 PRO A 24 3.892 -18.459 3.853 1.00 0.00 H new ATOM 0 HG2 PRO A 24 3.562 -19.894 1.236 1.00 0.00 H new ATOM 0 HG3 PRO A 24 2.591 -20.012 2.690 1.00 0.00 H new ATOM 0 HD2 PRO A 24 1.909 -18.473 0.461 1.00 0.00 H new ATOM 0 HD3 PRO A 24 1.245 -18.235 2.065 1.00 0.00 H new ATOM 389 N PHE A 25 6.465 -16.738 1.156 1.00 0.00 N ATOM 390 CA PHE A 25 7.492 -16.738 0.119 1.00 0.00 C ATOM 391 C PHE A 25 8.755 -16.028 0.597 1.00 0.00 C ATOM 392 O PHE A 25 8.727 -14.836 0.901 1.00 0.00 O ATOM 393 CB PHE A 25 6.961 -16.033 -1.132 1.00 0.00 C ATOM 394 CG PHE A 25 6.560 -14.614 -0.869 1.00 0.00 C ATOM 395 CD1 PHE A 25 7.436 -13.580 -1.132 1.00 0.00 C ATOM 396 CD2 PHE A 25 5.313 -14.316 -0.343 1.00 0.00 C ATOM 397 CE1 PHE A 25 7.083 -12.273 -0.877 1.00 0.00 C ATOM 398 CE2 PHE A 25 4.949 -13.008 -0.087 1.00 0.00 C ATOM 399 CZ PHE A 25 5.841 -11.983 -0.354 1.00 0.00 C ATOM 0 H PHE A 25 6.737 -16.272 2.022 1.00 0.00 H new ATOM 0 HA PHE A 25 7.741 -17.774 -0.112 1.00 0.00 H new ATOM 0 HB2 PHE A 25 7.727 -16.052 -1.908 1.00 0.00 H new ATOM 0 HB3 PHE A 25 6.103 -16.583 -1.518 1.00 0.00 H new ATOM 0 HD1 PHE A 25 8.411 -13.798 -1.543 1.00 0.00 H new ATOM 0 HD2 PHE A 25 4.618 -15.115 -0.131 1.00 0.00 H new ATOM 0 HE1 PHE A 25 7.780 -11.475 -1.087 1.00 0.00 H new ATOM 0 HE2 PHE A 25 3.973 -12.786 0.319 1.00 0.00 H new ATOM 0 HZ PHE A 25 5.564 -10.959 -0.153 1.00 0.00 H new ATOM 409 N GLN A 26 9.862 -16.759 0.657 1.00 0.00 N ATOM 410 CA GLN A 26 11.120 -16.180 1.090 1.00 0.00 C ATOM 411 C GLN A 26 11.698 -15.278 0.006 1.00 0.00 C ATOM 412 O GLN A 26 12.734 -15.583 -0.586 1.00 0.00 O ATOM 413 CB GLN A 26 12.119 -17.285 1.443 1.00 0.00 C ATOM 414 CG GLN A 26 11.498 -18.454 2.191 1.00 0.00 C ATOM 415 CD GLN A 26 12.537 -19.430 2.712 1.00 0.00 C ATOM 416 OE1 GLN A 26 12.990 -20.316 1.987 1.00 0.00 O ATOM 417 NE2 GLN A 26 12.917 -19.273 3.974 1.00 0.00 N ATOM 0 H GLN A 26 9.910 -17.748 0.412 1.00 0.00 H new ATOM 0 HA GLN A 26 10.932 -15.577 1.978 1.00 0.00 H new ATOM 0 HB2 GLN A 26 12.578 -17.654 0.526 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.918 -16.860 2.050 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.910 -18.075 3.026 1.00 0.00 H new ATOM 0 HG3 GLN A 26 10.810 -18.980 1.529 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.515 -18.525 4.538 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.611 -19.901 4.379 1.00 0.00 H new ATOM 426 N LYS A 27 11.020 -14.166 -0.250 1.00 0.00 N ATOM 427 CA LYS A 27 11.460 -13.215 -1.264 1.00 0.00 C ATOM 428 C LYS A 27 12.891 -12.757 -0.999 1.00 0.00 C ATOM 429 O LYS A 27 13.119 -11.777 -0.291 1.00 0.00 O ATOM 430 CB LYS A 27 10.529 -12.006 -1.297 1.00 0.00 C ATOM 431 CG LYS A 27 10.448 -11.337 -2.660 1.00 0.00 C ATOM 432 CD LYS A 27 9.690 -12.196 -3.662 1.00 0.00 C ATOM 433 CE LYS A 27 10.634 -12.888 -4.631 1.00 0.00 C ATOM 434 NZ LYS A 27 9.953 -13.251 -5.905 1.00 0.00 N ATOM 0 H LYS A 27 10.161 -13.900 0.232 1.00 0.00 H new ATOM 0 HA LYS A 27 11.430 -13.717 -2.231 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.530 -12.319 -0.995 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.869 -11.276 -0.563 1.00 0.00 H new ATOM 0 HG2 LYS A 27 9.955 -10.370 -2.562 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.454 -11.145 -3.032 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.101 -12.943 -3.130 1.00 0.00 H new ATOM 0 HD3 LYS A 27 8.988 -11.574 -4.218 1.00 0.00 H new ATOM 0 HE2 LYS A 27 11.479 -12.234 -4.845 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.037 -13.787 -4.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 10.630 -13.721 -6.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 9.162 -13.896 -5.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 9.590 -12.390 -6.362 1.00 0.00 H new ATOM 448 N ASN A 28 13.854 -13.472 -1.573 1.00 0.00 N ATOM 449 CA ASN A 28 15.261 -13.138 -1.397 1.00 0.00 C ATOM 450 C ASN A 28 15.871 -12.644 -2.705 1.00 0.00 C ATOM 451 O ASN A 28 16.383 -13.432 -3.501 1.00 0.00 O ATOM 452 CB ASN A 28 16.037 -14.354 -0.884 1.00 0.00 C ATOM 453 CG ASN A 28 16.962 -14.006 0.266 1.00 0.00 C ATOM 454 OD1 ASN A 28 18.185 -14.071 0.136 1.00 0.00 O ATOM 455 ND2 ASN A 28 16.382 -13.634 1.402 1.00 0.00 N ATOM 0 H ASN A 28 13.684 -14.286 -2.164 1.00 0.00 H new ATOM 0 HA ASN A 28 15.329 -12.337 -0.661 1.00 0.00 H new ATOM 0 HB2 ASN A 28 15.333 -15.121 -0.561 1.00 0.00 H new ATOM 0 HB3 ASN A 28 16.621 -14.780 -1.700 1.00 0.00 H new ATOM 0 HD21 ASN A 28 16.954 -13.388 2.210 1.00 0.00 H new ATOM 0 HD22 ASN A 28 15.365 -13.594 1.466 1.00 0.00 H new ATOM 462 N GLU A 29 15.812 -11.333 -2.923 1.00 0.00 N ATOM 463 CA GLU A 29 16.357 -10.736 -4.135 1.00 0.00 C ATOM 464 C GLU A 29 16.243 -9.213 -4.089 1.00 0.00 C ATOM 465 O GLU A 29 16.020 -8.630 -3.027 1.00 0.00 O ATOM 466 CB GLU A 29 15.631 -11.282 -5.368 1.00 0.00 C ATOM 467 CG GLU A 29 16.567 -11.673 -6.499 1.00 0.00 C ATOM 468 CD GLU A 29 15.949 -11.457 -7.868 1.00 0.00 C ATOM 469 OE1 GLU A 29 14.722 -11.641 -8.000 1.00 0.00 O ATOM 470 OE2 GLU A 29 16.694 -11.102 -8.806 1.00 0.00 O ATOM 0 H GLU A 29 15.392 -10.666 -2.276 1.00 0.00 H new ATOM 0 HA GLU A 29 17.413 -11.000 -4.200 1.00 0.00 H new ATOM 0 HB2 GLU A 29 15.042 -12.152 -5.077 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.931 -10.529 -5.730 1.00 0.00 H new ATOM 0 HG2 GLU A 29 17.486 -11.091 -6.423 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.844 -12.722 -6.391 1.00 0.00 H new ATOM 477 N ASN A 30 16.400 -8.575 -5.245 1.00 0.00 N ATOM 478 CA ASN A 30 16.315 -7.120 -5.337 1.00 0.00 C ATOM 479 C ASN A 30 15.007 -6.603 -4.745 1.00 0.00 C ATOM 480 O ASN A 30 14.927 -5.457 -4.299 1.00 0.00 O ATOM 481 CB ASN A 30 16.438 -6.675 -6.795 1.00 0.00 C ATOM 482 CG ASN A 30 17.880 -6.523 -7.235 1.00 0.00 C ATOM 483 OD1 ASN A 30 18.713 -5.986 -6.503 1.00 0.00 O ATOM 484 ND2 ASN A 30 18.187 -6.998 -8.436 1.00 0.00 N ATOM 0 H ASN A 30 16.587 -9.043 -6.132 1.00 0.00 H new ATOM 0 HA ASN A 30 17.139 -6.700 -4.761 1.00 0.00 H new ATOM 0 HB2 ASN A 30 15.940 -7.402 -7.437 1.00 0.00 H new ATOM 0 HB3 ASN A 30 15.919 -5.726 -6.927 1.00 0.00 H new ATOM 0 HD21 ASN A 30 19.143 -6.925 -8.784 1.00 0.00 H new ATOM 0 HD22 ASN A 30 17.467 -7.436 -9.011 1.00 0.00 H new ATOM 491 N TYR A 31 13.983 -7.450 -4.744 1.00 0.00 N ATOM 492 CA TYR A 31 12.679 -7.074 -4.210 1.00 0.00 C ATOM 493 C TYR A 31 12.106 -8.187 -3.336 1.00 0.00 C ATOM 494 O TYR A 31 11.453 -9.103 -3.836 1.00 0.00 O ATOM 495 CB TYR A 31 11.711 -6.759 -5.350 1.00 0.00 C ATOM 496 CG TYR A 31 11.561 -7.892 -6.343 1.00 0.00 C ATOM 497 CD1 TYR A 31 10.424 -8.688 -6.352 1.00 0.00 C ATOM 498 CD2 TYR A 31 12.560 -8.163 -7.270 1.00 0.00 C ATOM 499 CE1 TYR A 31 10.286 -9.724 -7.255 1.00 0.00 C ATOM 500 CE2 TYR A 31 12.427 -9.197 -8.176 1.00 0.00 C ATOM 501 CZ TYR A 31 11.289 -9.975 -8.165 1.00 0.00 C ATOM 502 OH TYR A 31 11.155 -11.006 -9.066 1.00 0.00 O ATOM 0 H TYR A 31 14.031 -8.402 -5.107 1.00 0.00 H new ATOM 0 HA TYR A 31 12.810 -6.184 -3.595 1.00 0.00 H new ATOM 0 HB2 TYR A 31 10.733 -6.521 -4.931 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.058 -5.869 -5.875 1.00 0.00 H new ATOM 0 HD1 TYR A 31 9.634 -8.494 -5.641 1.00 0.00 H new ATOM 0 HD2 TYR A 31 13.453 -7.556 -7.282 1.00 0.00 H new ATOM 0 HE1 TYR A 31 9.395 -10.335 -7.248 1.00 0.00 H new ATOM 0 HE2 TYR A 31 13.212 -9.395 -8.891 1.00 0.00 H new ATOM 0 HH TYR A 31 11.950 -11.047 -9.637 1.00 0.00 H new ATOM 512 N GLY A 32 12.352 -8.102 -2.032 1.00 0.00 N ATOM 513 CA GLY A 32 11.849 -9.111 -1.117 1.00 0.00 C ATOM 514 C GLY A 32 12.291 -8.876 0.314 1.00 0.00 C ATOM 515 O GLY A 32 13.177 -8.058 0.569 1.00 0.00 O ATOM 0 H GLY A 32 12.889 -7.354 -1.593 1.00 0.00 H new ATOM 0 HA2 GLY A 32 10.760 -9.123 -1.159 1.00 0.00 H new ATOM 0 HA3 GLY A 32 12.192 -10.093 -1.442 1.00 0.00 H new ATOM 519 N THR A 33 11.677 -9.594 1.251 1.00 0.00 N ATOM 520 CA THR A 33 12.018 -9.454 2.662 1.00 0.00 C ATOM 521 C THR A 33 11.613 -10.686 3.466 1.00 0.00 C ATOM 522 O THR A 33 12.365 -11.156 4.320 1.00 0.00 O ATOM 523 CB THR A 33 11.351 -8.209 3.247 1.00 0.00 C ATOM 524 OG1 THR A 33 11.587 -7.080 2.424 1.00 0.00 O ATOM 525 CG2 THR A 33 11.836 -7.870 4.639 1.00 0.00 C ATOM 0 H THR A 33 10.943 -10.276 1.059 1.00 0.00 H new ATOM 0 HA THR A 33 13.101 -9.351 2.729 1.00 0.00 H new ATOM 0 HB THR A 33 10.288 -8.447 3.297 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.424 -7.204 1.930 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.323 -6.977 4.995 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.625 -8.702 5.311 1.00 0.00 H new ATOM 0 HG23 THR A 33 12.910 -7.687 4.615 1.00 0.00 H new ATOM 533 N ILE A 34 10.418 -11.203 3.198 1.00 0.00 N ATOM 534 CA ILE A 34 9.921 -12.378 3.911 1.00 0.00 C ATOM 535 C ILE A 34 10.757 -13.616 3.625 1.00 0.00 C ATOM 536 O ILE A 34 11.335 -13.748 2.547 1.00 0.00 O ATOM 537 CB ILE A 34 8.466 -12.699 3.537 1.00 0.00 C ATOM 538 CG1 ILE A 34 7.595 -11.451 3.646 1.00 0.00 C ATOM 539 CG2 ILE A 34 7.931 -13.810 4.431 1.00 0.00 C ATOM 540 CD1 ILE A 34 6.117 -11.746 3.568 1.00 0.00 C ATOM 0 H ILE A 34 9.778 -10.831 2.497 1.00 0.00 H new ATOM 0 HA ILE A 34 9.987 -12.126 4.969 1.00 0.00 H new ATOM 0 HB ILE A 34 8.437 -13.040 2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.809 -10.948 4.589 1.00 0.00 H new ATOM 0 HG13 ILE A 34 7.863 -10.759 2.848 1.00 0.00 H new ATOM 0 HG21 ILE A 34 6.899 -14.031 4.159 1.00 0.00 H new ATOM 0 HG22 ILE A 34 8.540 -14.705 4.303 1.00 0.00 H new ATOM 0 HG23 ILE A 34 7.971 -13.490 5.472 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.555 -10.816 3.652 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.891 -12.222 2.614 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.836 -12.414 4.382 1.00 0.00 H new ATOM 552 N THR A 35 10.784 -14.533 4.594 1.00 0.00 N ATOM 553 CA THR A 35 11.511 -15.795 4.459 1.00 0.00 C ATOM 554 C THR A 35 11.089 -16.776 5.549 1.00 0.00 C ATOM 555 O THR A 35 10.421 -17.772 5.275 1.00 0.00 O ATOM 556 CB THR A 35 13.040 -15.600 4.475 1.00 0.00 C ATOM 557 OG1 THR A 35 13.599 -15.971 5.726 1.00 0.00 O ATOM 558 CG2 THR A 35 13.505 -14.189 4.165 1.00 0.00 C ATOM 0 H THR A 35 10.306 -14.422 5.488 1.00 0.00 H new ATOM 0 HA THR A 35 11.251 -16.208 3.485 1.00 0.00 H new ATOM 0 HB THR A 35 13.390 -16.251 3.674 1.00 0.00 H new ATOM 0 HG1 THR A 35 14.570 -15.837 5.703 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.594 -14.149 4.199 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.163 -13.903 3.170 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.093 -13.500 4.902 1.00 0.00 H new ATOM 566 N SER A 36 11.483 -16.489 6.783 1.00 0.00 N ATOM 567 CA SER A 36 11.145 -17.350 7.911 1.00 0.00 C ATOM 568 C SER A 36 10.859 -16.528 9.161 1.00 0.00 C ATOM 569 O SER A 36 9.871 -16.761 9.858 1.00 0.00 O ATOM 570 CB SER A 36 12.281 -18.336 8.185 1.00 0.00 C ATOM 571 OG SER A 36 13.512 -17.659 8.370 1.00 0.00 O ATOM 0 H SER A 36 12.036 -15.668 7.029 1.00 0.00 H new ATOM 0 HA SER A 36 10.244 -17.905 7.651 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.049 -18.925 9.073 1.00 0.00 H new ATOM 0 HB3 SER A 36 12.368 -19.035 7.353 1.00 0.00 H new ATOM 0 HG SER A 36 13.754 -17.189 7.545 1.00 0.00 H new ATOM 577 N ALA A 37 11.730 -15.569 9.441 1.00 0.00 N ATOM 578 CA ALA A 37 11.576 -14.710 10.610 1.00 0.00 C ATOM 579 C ALA A 37 10.334 -13.832 10.489 1.00 0.00 C ATOM 580 O ALA A 37 9.712 -13.479 11.492 1.00 0.00 O ATOM 581 CB ALA A 37 12.816 -13.850 10.799 1.00 0.00 C ATOM 0 H ALA A 37 12.553 -15.365 8.874 1.00 0.00 H new ATOM 0 HA ALA A 37 11.452 -15.348 11.485 1.00 0.00 H new ATOM 0 HB1 ALA A 37 12.688 -13.214 11.675 1.00 0.00 H new ATOM 0 HB2 ALA A 37 13.686 -14.492 10.941 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.965 -13.227 9.917 1.00 0.00 H new ATOM 587 N ASN A 38 9.979 -13.482 9.258 1.00 0.00 N ATOM 588 CA ASN A 38 8.810 -12.644 9.011 1.00 0.00 C ATOM 589 C ASN A 38 7.753 -13.402 8.216 1.00 0.00 C ATOM 590 O ASN A 38 6.993 -12.809 7.452 1.00 0.00 O ATOM 591 CB ASN A 38 9.217 -11.375 8.260 1.00 0.00 C ATOM 592 CG ASN A 38 10.274 -10.580 9.005 1.00 0.00 C ATOM 593 OD1 ASN A 38 10.239 -10.474 10.230 1.00 0.00 O ATOM 594 ND2 ASN A 38 11.219 -10.014 8.263 1.00 0.00 N ATOM 0 H ASN A 38 10.482 -13.764 8.417 1.00 0.00 H new ATOM 0 HA ASN A 38 8.383 -12.367 9.975 1.00 0.00 H new ATOM 0 HB2 ASN A 38 9.596 -11.644 7.274 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.338 -10.750 8.104 1.00 0.00 H new ATOM 0 HD21 ASN A 38 11.955 -9.465 8.707 1.00 0.00 H new ATOM 0 HD22 ASN A 38 11.209 -10.129 7.250 1.00 0.00 H new ATOM 601 N GLU A 39 7.704 -14.715 8.411 1.00 0.00 N ATOM 602 CA GLU A 39 6.731 -15.552 7.722 1.00 0.00 C ATOM 603 C GLU A 39 5.932 -16.386 8.718 1.00 0.00 C ATOM 604 O GLU A 39 5.416 -17.454 8.386 1.00 0.00 O ATOM 605 CB GLU A 39 7.429 -16.457 6.703 1.00 0.00 C ATOM 606 CG GLU A 39 6.473 -17.318 5.896 1.00 0.00 C ATOM 607 CD GLU A 39 6.681 -18.802 6.134 1.00 0.00 C ATOM 608 OE1 GLU A 39 7.779 -19.306 5.823 1.00 0.00 O ATOM 609 OE2 GLU A 39 5.743 -19.459 6.634 1.00 0.00 O ATOM 0 H GLU A 39 8.327 -15.222 9.040 1.00 0.00 H new ATOM 0 HA GLU A 39 6.038 -14.901 7.190 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.012 -15.839 6.020 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.133 -17.104 7.227 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.447 -17.053 6.152 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.603 -17.102 4.835 1.00 0.00 H new ATOM 616 N GLN A 40 5.825 -15.876 9.938 1.00 0.00 N ATOM 617 CA GLN A 40 5.078 -16.547 10.997 1.00 0.00 C ATOM 618 C GLN A 40 3.827 -15.748 11.340 1.00 0.00 C ATOM 619 O GLN A 40 2.789 -16.309 11.698 1.00 0.00 O ATOM 620 CB GLN A 40 5.953 -16.715 12.240 1.00 0.00 C ATOM 621 CG GLN A 40 7.360 -17.199 11.932 1.00 0.00 C ATOM 622 CD GLN A 40 8.231 -17.282 13.169 1.00 0.00 C ATOM 623 OE1 GLN A 40 7.732 -17.409 14.288 1.00 0.00 O ATOM 624 NE2 GLN A 40 9.543 -17.209 12.975 1.00 0.00 N ATOM 0 H GLN A 40 6.249 -14.993 10.221 1.00 0.00 H new ATOM 0 HA GLN A 40 4.781 -17.535 10.644 1.00 0.00 H new ATOM 0 HB2 GLN A 40 6.012 -15.761 12.764 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.475 -17.422 12.918 1.00 0.00 H new ATOM 0 HG2 GLN A 40 7.308 -18.181 11.462 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.822 -16.525 11.211 1.00 0.00 H new ATOM 0 HE21 GLN A 40 9.914 -17.104 12.031 1.00 0.00 H new ATOM 0 HE22 GLN A 40 10.180 -17.258 13.770 1.00 0.00 H new ATOM 633 N ILE A 41 3.936 -14.430 11.210 1.00 0.00 N ATOM 634 CA ILE A 41 2.828 -13.523 11.482 1.00 0.00 C ATOM 635 C ILE A 41 1.598 -13.915 10.664 1.00 0.00 C ATOM 636 O ILE A 41 1.645 -13.934 9.433 1.00 0.00 O ATOM 637 CB ILE A 41 3.230 -12.078 11.147 1.00 0.00 C ATOM 638 CG1 ILE A 41 4.547 -11.710 11.852 1.00 0.00 C ATOM 639 CG2 ILE A 41 2.112 -11.108 11.506 1.00 0.00 C ATOM 640 CD1 ILE A 41 4.386 -10.819 13.067 1.00 0.00 C ATOM 0 H ILE A 41 4.793 -13.962 10.914 1.00 0.00 H new ATOM 0 HA ILE A 41 2.583 -13.592 12.542 1.00 0.00 H new ATOM 0 HB ILE A 41 3.395 -12.002 10.072 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.050 -12.628 12.155 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.200 -11.211 11.136 1.00 0.00 H new ATOM 0 HG21 ILE A 41 2.419 -10.092 11.260 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.215 -11.362 10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.901 -11.175 12.573 1.00 0.00 H new ATOM 0 HD11 ILE A 41 5.365 -10.612 13.499 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.914 -9.882 12.771 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.762 -11.321 13.806 1.00 0.00 H new ATOM 652 N THR A 42 0.501 -14.229 11.348 1.00 0.00 N ATOM 653 CA THR A 42 -0.729 -14.620 10.672 1.00 0.00 C ATOM 654 C THR A 42 -1.508 -13.391 10.233 1.00 0.00 C ATOM 655 O THR A 42 -1.432 -12.341 10.871 1.00 0.00 O ATOM 656 CB THR A 42 -1.601 -15.486 11.592 1.00 0.00 C ATOM 657 OG1 THR A 42 -2.755 -15.949 10.916 1.00 0.00 O ATOM 658 CG2 THR A 42 -2.063 -14.773 12.840 1.00 0.00 C ATOM 0 H THR A 42 0.440 -14.220 12.366 1.00 0.00 H new ATOM 0 HA THR A 42 -0.460 -15.203 9.791 1.00 0.00 H new ATOM 0 HB THR A 42 -0.955 -16.314 11.884 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.292 -16.499 11.524 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.674 -15.448 13.440 1.00 0.00 H new ATOM 0 HG22 THR A 42 -1.196 -14.456 13.420 1.00 0.00 H new ATOM 0 HG23 THR A 42 -2.653 -13.900 12.563 1.00 0.00 H new ATOM 666 N PRO A 43 -2.284 -13.503 9.141 1.00 0.00 N ATOM 667 CA PRO A 43 -3.088 -12.390 8.636 1.00 0.00 C ATOM 668 C PRO A 43 -3.826 -11.668 9.761 1.00 0.00 C ATOM 669 O PRO A 43 -4.176 -10.500 9.633 1.00 0.00 O ATOM 670 CB PRO A 43 -4.076 -13.078 7.695 1.00 0.00 C ATOM 671 CG PRO A 43 -3.346 -14.282 7.201 1.00 0.00 C ATOM 672 CD PRO A 43 -2.446 -14.722 8.322 1.00 0.00 C ATOM 0 HA PRO A 43 -2.485 -11.622 8.151 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -4.992 -13.356 8.216 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.363 -12.423 6.873 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -4.043 -15.074 6.929 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -2.767 -14.046 6.308 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -2.891 -15.534 8.897 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -1.488 -15.083 7.948 1.00 0.00 H new ATOM 680 N VAL A 44 -4.038 -12.382 10.864 1.00 0.00 N ATOM 681 CA VAL A 44 -4.712 -11.841 12.035 1.00 0.00 C ATOM 682 C VAL A 44 -3.881 -10.750 12.692 1.00 0.00 C ATOM 683 O VAL A 44 -4.404 -9.692 13.022 1.00 0.00 O ATOM 684 CB VAL A 44 -4.976 -12.956 13.048 1.00 0.00 C ATOM 685 CG1 VAL A 44 -5.341 -12.409 14.417 1.00 0.00 C ATOM 686 CG2 VAL A 44 -6.043 -13.911 12.537 1.00 0.00 C ATOM 0 H VAL A 44 -3.746 -13.354 10.968 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.657 -11.408 11.708 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.046 -13.513 13.165 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.520 -13.236 15.104 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.523 -11.795 14.794 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.243 -11.802 14.338 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.213 -14.695 13.275 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.971 -13.364 12.369 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.711 -14.360 11.601 1.00 0.00 H new ATOM 696 N ILE A 45 -2.585 -10.998 12.882 1.00 0.00 N ATOM 697 CA ILE A 45 -1.724 -9.994 13.494 1.00 0.00 C ATOM 698 C ILE A 45 -1.768 -8.724 12.663 1.00 0.00 C ATOM 699 O ILE A 45 -1.716 -7.612 13.189 1.00 0.00 O ATOM 700 CB ILE A 45 -0.272 -10.490 13.633 1.00 0.00 C ATOM 701 CG1 ILE A 45 -0.170 -11.507 14.769 1.00 0.00 C ATOM 702 CG2 ILE A 45 0.688 -9.331 13.869 1.00 0.00 C ATOM 703 CD1 ILE A 45 -0.106 -12.933 14.289 1.00 0.00 C ATOM 0 H ILE A 45 -2.118 -11.868 12.626 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.094 -9.794 14.500 1.00 0.00 H new ATOM 0 HB ILE A 45 0.012 -10.973 12.698 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.718 -11.291 15.362 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.030 -11.391 15.429 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.704 -9.714 13.963 1.00 0.00 H new ATOM 0 HG22 ILE A 45 0.637 -8.639 13.028 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.411 -8.810 14.785 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.035 -13.603 15.146 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.006 -13.166 13.720 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.769 -13.064 13.653 1.00 0.00 H new ATOM 715 N PHE A 46 -1.902 -8.908 11.357 1.00 0.00 N ATOM 716 CA PHE A 46 -1.998 -7.796 10.435 1.00 0.00 C ATOM 717 C PHE A 46 -3.420 -7.255 10.442 1.00 0.00 C ATOM 718 O PHE A 46 -3.635 -6.045 10.439 1.00 0.00 O ATOM 719 CB PHE A 46 -1.622 -8.236 9.023 1.00 0.00 C ATOM 720 CG PHE A 46 -0.238 -8.805 8.911 1.00 0.00 C ATOM 721 CD1 PHE A 46 0.865 -7.972 8.872 1.00 0.00 C ATOM 722 CD2 PHE A 46 -0.043 -10.174 8.828 1.00 0.00 C ATOM 723 CE1 PHE A 46 2.135 -8.491 8.751 1.00 0.00 C ATOM 724 CE2 PHE A 46 1.226 -10.702 8.707 1.00 0.00 C ATOM 725 CZ PHE A 46 2.317 -9.859 8.667 1.00 0.00 C ATOM 0 H PHE A 46 -1.946 -9.826 10.914 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.306 -7.016 10.751 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.340 -8.982 8.683 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.708 -7.382 8.352 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.729 -6.903 8.937 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.895 -10.837 8.858 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.988 -7.830 8.722 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.365 -11.771 8.644 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.312 -10.267 8.570 1.00 0.00 H new ATOM 735 N HIS A 47 -4.390 -8.169 10.468 1.00 0.00 N ATOM 736 CA HIS A 47 -5.795 -7.782 10.487 1.00 0.00 C ATOM 737 C HIS A 47 -6.111 -7.038 11.777 1.00 0.00 C ATOM 738 O HIS A 47 -6.994 -6.187 11.815 1.00 0.00 O ATOM 739 CB HIS A 47 -6.695 -9.023 10.311 1.00 0.00 C ATOM 740 CG HIS A 47 -7.716 -9.232 11.394 1.00 0.00 C ATOM 741 ND1 HIS A 47 -7.585 -9.270 12.739 1.00 0.00 N flip ATOM 742 CD2 HIS A 47 -9.053 -9.449 11.135 1.00 0.00 C flip ATOM 743 CE1 HIS A 47 -8.831 -9.507 13.264 1.00 0.00 C flip ATOM 744 NE2 HIS A 47 -9.700 -9.611 12.275 1.00 0.00 N flip ATOM 0 H HIS A 47 -4.227 -9.176 10.476 1.00 0.00 H new ATOM 0 HA HIS A 47 -5.995 -7.109 9.653 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -7.213 -8.943 9.356 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -6.060 -9.907 10.257 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -9.501 -9.481 10.153 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -9.063 -9.594 14.315 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -10.700 -9.786 12.375 1.00 0.00 H new ATOM 753 N ASN A 48 -5.361 -7.351 12.827 1.00 0.00 N ATOM 754 CA ASN A 48 -5.540 -6.707 14.116 1.00 0.00 C ATOM 755 C ASN A 48 -4.670 -5.466 14.172 1.00 0.00 C ATOM 756 O ASN A 48 -5.009 -4.485 14.826 1.00 0.00 O ATOM 757 CB ASN A 48 -5.191 -7.660 15.260 1.00 0.00 C ATOM 758 CG ASN A 48 -6.424 -8.258 15.910 1.00 0.00 C ATOM 759 OD1 ASN A 48 -7.493 -7.648 15.916 1.00 0.00 O ATOM 760 ND2 ASN A 48 -6.281 -9.456 16.462 1.00 0.00 N ATOM 0 H ASN A 48 -4.620 -8.051 12.807 1.00 0.00 H new ATOM 0 HA ASN A 48 -6.587 -6.426 14.232 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -4.558 -8.462 14.881 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -4.611 -7.124 16.011 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -7.076 -9.907 16.914 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -5.376 -9.926 16.434 1.00 0.00 H new ATOM 767 N LEU A 49 -3.564 -5.502 13.434 1.00 0.00 N ATOM 768 CA LEU A 49 -2.674 -4.361 13.344 1.00 0.00 C ATOM 769 C LEU A 49 -3.462 -3.232 12.720 1.00 0.00 C ATOM 770 O LEU A 49 -3.704 -2.195 13.327 1.00 0.00 O ATOM 771 CB LEU A 49 -1.477 -4.700 12.459 1.00 0.00 C ATOM 772 CG LEU A 49 -0.169 -4.953 13.193 1.00 0.00 C ATOM 773 CD1 LEU A 49 0.988 -4.964 12.209 1.00 0.00 C ATOM 774 CD2 LEU A 49 0.044 -3.896 14.260 1.00 0.00 C ATOM 0 H LEU A 49 -3.267 -6.313 12.891 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.302 -4.083 14.330 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.721 -5.585 11.872 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.325 -3.882 11.754 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.217 -5.927 13.679 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.920 -5.146 12.745 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.832 -5.753 11.473 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.043 -4.001 11.702 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.983 -4.087 14.779 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.081 -2.911 13.794 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.779 -3.929 14.974 1.00 0.00 H new ATOM 786 N ILE A 50 -3.899 -3.504 11.506 1.00 0.00 N ATOM 787 CA ILE A 50 -4.728 -2.585 10.740 1.00 0.00 C ATOM 788 C ILE A 50 -5.905 -2.125 11.590 1.00 0.00 C ATOM 789 O ILE A 50 -6.064 -0.944 11.895 1.00 0.00 O ATOM 790 CB ILE A 50 -5.309 -3.294 9.498 1.00 0.00 C ATOM 791 CG1 ILE A 50 -4.225 -3.984 8.686 1.00 0.00 C ATOM 792 CG2 ILE A 50 -6.099 -2.330 8.626 1.00 0.00 C ATOM 793 CD1 ILE A 50 -4.707 -5.289 8.088 1.00 0.00 C ATOM 0 H ILE A 50 -3.689 -4.374 11.017 1.00 0.00 H new ATOM 0 HA ILE A 50 -4.107 -1.741 10.440 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.993 -4.061 9.861 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.893 -3.320 7.888 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.361 -4.174 9.323 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.494 -2.862 7.761 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.924 -1.911 9.202 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.446 -1.525 8.290 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.900 -5.747 7.516 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.014 -5.964 8.887 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.554 -5.097 7.430 1.00 0.00 H new ATOM 805 N MET A 51 -6.727 -3.100 11.942 1.00 0.00 N ATOM 806 CA MET A 51 -7.926 -2.900 12.737 1.00 0.00 C ATOM 807 C MET A 51 -7.666 -2.118 14.030 1.00 0.00 C ATOM 808 O MET A 51 -8.473 -1.275 14.423 1.00 0.00 O ATOM 809 CB MET A 51 -8.514 -4.278 13.056 1.00 0.00 C ATOM 810 CG MET A 51 -9.975 -4.245 13.476 1.00 0.00 C ATOM 811 SD MET A 51 -10.979 -5.485 12.629 1.00 0.00 S ATOM 812 CE MET A 51 -10.247 -5.471 10.993 1.00 0.00 C ATOM 0 H MET A 51 -6.575 -4.073 11.677 1.00 0.00 H new ATOM 0 HA MET A 51 -8.626 -2.296 12.160 1.00 0.00 H new ATOM 0 HB2 MET A 51 -8.413 -4.917 12.178 1.00 0.00 H new ATOM 0 HB3 MET A 51 -7.928 -4.736 13.853 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.042 -4.404 14.552 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.383 -3.255 13.274 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.001 -5.744 10.255 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.867 -4.473 10.773 1.00 0.00 H new ATOM 0 HE3 MET A 51 -9.427 -6.188 10.955 1.00 0.00 H new ATOM 822 N ASP A 52 -6.566 -2.425 14.708 1.00 0.00 N ATOM 823 CA ASP A 52 -6.236 -1.774 15.978 1.00 0.00 C ATOM 824 C ASP A 52 -5.372 -0.516 15.821 1.00 0.00 C ATOM 825 O ASP A 52 -5.340 0.325 16.717 1.00 0.00 O ATOM 826 CB ASP A 52 -5.528 -2.763 16.906 1.00 0.00 C ATOM 827 CG ASP A 52 -6.354 -4.011 17.160 1.00 0.00 C ATOM 828 OD1 ASP A 52 -7.062 -4.454 16.231 1.00 0.00 O ATOM 829 OD2 ASP A 52 -6.289 -4.545 18.286 1.00 0.00 O ATOM 0 H ASP A 52 -5.885 -3.120 14.402 1.00 0.00 H new ATOM 0 HA ASP A 52 -7.185 -1.453 16.408 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -4.571 -3.047 16.468 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.311 -2.274 17.856 1.00 0.00 H new ATOM 834 N MET A 53 -4.653 -0.400 14.709 1.00 0.00 N ATOM 835 CA MET A 53 -3.775 0.754 14.497 1.00 0.00 C ATOM 836 C MET A 53 -4.205 1.594 13.301 1.00 0.00 C ATOM 837 O MET A 53 -4.499 2.781 13.440 1.00 0.00 O ATOM 838 CB MET A 53 -2.332 0.287 14.297 1.00 0.00 C ATOM 839 CG MET A 53 -1.651 -0.174 15.574 1.00 0.00 C ATOM 840 SD MET A 53 -1.632 1.096 16.854 1.00 0.00 S ATOM 841 CE MET A 53 0.034 1.726 16.680 1.00 0.00 C ATOM 0 H MET A 53 -4.657 -1.079 13.948 1.00 0.00 H new ATOM 0 HA MET A 53 -3.846 1.379 15.387 1.00 0.00 H new ATOM 0 HB2 MET A 53 -2.322 -0.530 13.576 1.00 0.00 H new ATOM 0 HB3 MET A 53 -1.754 1.102 13.863 1.00 0.00 H new ATOM 0 HG2 MET A 53 -2.162 -1.059 15.954 1.00 0.00 H new ATOM 0 HG3 MET A 53 -0.627 -0.470 15.347 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.200 2.521 17.407 1.00 0.00 H new ATOM 0 HE2 MET A 53 0.748 0.921 16.854 1.00 0.00 H new ATOM 0 HE3 MET A 53 0.171 2.120 15.673 1.00 0.00 H new ATOM 851 N VAL A 54 -4.226 0.981 12.128 1.00 0.00 N ATOM 852 CA VAL A 54 -4.601 1.679 10.905 1.00 0.00 C ATOM 853 C VAL A 54 -6.032 2.209 10.966 1.00 0.00 C ATOM 854 O VAL A 54 -6.263 3.411 10.850 1.00 0.00 O ATOM 855 CB VAL A 54 -4.459 0.758 9.677 1.00 0.00 C ATOM 856 CG1 VAL A 54 -4.972 1.444 8.422 1.00 0.00 C ATOM 857 CG2 VAL A 54 -3.012 0.319 9.497 1.00 0.00 C ATOM 0 H VAL A 54 -3.987 -0.002 11.995 1.00 0.00 H new ATOM 0 HA VAL A 54 -3.920 2.525 10.809 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.067 -0.130 9.849 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.861 0.774 7.570 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.025 1.697 8.550 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.399 2.354 8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.935 -0.330 8.625 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.381 1.196 9.354 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.683 -0.224 10.383 1.00 0.00 H new ATOM 867 N LEU A 55 -6.987 1.300 11.120 1.00 0.00 N ATOM 868 CA LEU A 55 -8.400 1.666 11.164 1.00 0.00 C ATOM 869 C LEU A 55 -8.660 2.872 12.062 1.00 0.00 C ATOM 870 O LEU A 55 -9.234 3.866 11.614 1.00 0.00 O ATOM 871 CB LEU A 55 -9.245 0.472 11.595 1.00 0.00 C ATOM 872 CG LEU A 55 -9.616 -0.476 10.460 1.00 0.00 C ATOM 873 CD1 LEU A 55 -10.800 0.057 9.675 1.00 0.00 C ATOM 874 CD2 LEU A 55 -8.429 -0.705 9.539 1.00 0.00 C ATOM 0 H LEU A 55 -6.809 0.300 11.217 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.692 1.958 10.155 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -8.701 -0.087 12.357 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.160 0.838 12.061 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.900 -1.432 10.900 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.045 -0.637 8.871 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.659 0.162 10.338 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.548 1.029 9.251 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.717 -1.384 8.737 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.111 0.246 9.112 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.607 -1.141 10.107 1.00 0.00 H new ATOM 886 N PRO A 56 -8.236 2.825 13.337 1.00 0.00 N ATOM 887 CA PRO A 56 -8.429 3.939 14.266 1.00 0.00 C ATOM 888 C PRO A 56 -7.620 5.176 13.871 1.00 0.00 C ATOM 889 O PRO A 56 -7.632 6.181 14.582 1.00 0.00 O ATOM 890 CB PRO A 56 -7.935 3.391 15.613 1.00 0.00 C ATOM 891 CG PRO A 56 -7.839 1.915 15.429 1.00 0.00 C ATOM 892 CD PRO A 56 -7.537 1.701 13.976 1.00 0.00 C ATOM 0 HA PRO A 56 -9.468 4.267 14.283 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -6.968 3.817 15.880 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.627 3.642 16.417 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -7.054 1.493 16.057 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -8.771 1.425 15.711 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -6.466 1.723 13.777 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.907 0.739 13.622 1.00 0.00 H new ATOM 900 N LYS A 57 -6.923 5.108 12.735 1.00 0.00 N ATOM 901 CA LYS A 57 -6.126 6.235 12.266 1.00 0.00 C ATOM 902 C LYS A 57 -6.107 6.270 10.743 1.00 0.00 C ATOM 903 O LYS A 57 -5.181 6.805 10.133 1.00 0.00 O ATOM 904 CB LYS A 57 -4.699 6.145 12.813 1.00 0.00 C ATOM 905 CG LYS A 57 -4.288 7.352 13.640 1.00 0.00 C ATOM 906 CD LYS A 57 -4.177 8.602 12.782 1.00 0.00 C ATOM 907 CE LYS A 57 -2.940 8.565 11.900 1.00 0.00 C ATOM 908 NZ LYS A 57 -1.691 8.763 12.686 1.00 0.00 N ATOM 0 H LYS A 57 -6.896 4.288 12.129 1.00 0.00 H new ATOM 0 HA LYS A 57 -6.579 7.157 12.631 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.609 5.248 13.425 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.006 6.033 11.980 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -5.018 7.517 14.433 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -3.331 7.155 14.123 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.066 8.697 12.159 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -4.141 9.483 13.423 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.894 7.608 11.380 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.015 9.340 11.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -1.247 9.662 12.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.919 8.786 13.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -1.034 7.980 12.496 1.00 0.00 H new ATOM 922 N VAL A 58 -7.137 5.690 10.141 1.00 0.00 N ATOM 923 CA VAL A 58 -7.253 5.642 8.695 1.00 0.00 C ATOM 924 C VAL A 58 -7.919 6.901 8.164 1.00 0.00 C ATOM 925 O VAL A 58 -8.469 7.697 8.926 1.00 0.00 O ATOM 926 CB VAL A 58 -8.070 4.413 8.247 1.00 0.00 C ATOM 927 CG1 VAL A 58 -9.555 4.633 8.501 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.828 4.104 6.777 1.00 0.00 C ATOM 0 H VAL A 58 -7.908 5.244 10.639 1.00 0.00 H new ATOM 0 HA VAL A 58 -6.244 5.569 8.290 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.738 3.558 8.836 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.113 3.754 8.178 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -9.722 4.798 9.566 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.895 5.505 7.942 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.416 3.233 6.487 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -8.125 4.960 6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.770 3.897 6.618 1.00 0.00 H new ATOM 938 N VAL A 59 -7.876 7.066 6.855 1.00 0.00 N ATOM 939 CA VAL A 59 -8.485 8.214 6.214 1.00 0.00 C ATOM 940 C VAL A 59 -9.243 7.785 4.971 1.00 0.00 C ATOM 941 O VAL A 59 -8.845 6.841 4.291 1.00 0.00 O ATOM 942 CB VAL A 59 -7.438 9.261 5.804 1.00 0.00 C ATOM 943 CG1 VAL A 59 -7.171 10.233 6.943 1.00 0.00 C ATOM 944 CG2 VAL A 59 -6.151 8.593 5.343 1.00 0.00 C ATOM 0 H VAL A 59 -7.423 6.415 6.213 1.00 0.00 H new ATOM 0 HA VAL A 59 -9.165 8.658 6.941 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.839 9.828 4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.427 10.965 6.630 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -8.096 10.746 7.208 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.799 9.685 7.809 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.427 9.356 5.058 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -5.743 7.990 6.154 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -6.360 7.953 4.485 1.00 0.00 H new ATOM 954 N PRO A 60 -10.335 8.485 4.636 1.00 0.00 N ATOM 955 CA PRO A 60 -11.121 8.172 3.450 1.00 0.00 C ATOM 956 C PRO A 60 -10.485 8.740 2.188 1.00 0.00 C ATOM 957 O PRO A 60 -11.165 9.026 1.203 1.00 0.00 O ATOM 958 CB PRO A 60 -12.459 8.839 3.745 1.00 0.00 C ATOM 959 CG PRO A 60 -12.111 10.021 4.587 1.00 0.00 C ATOM 960 CD PRO A 60 -10.878 9.644 5.371 1.00 0.00 C ATOM 0 HA PRO A 60 -11.204 7.101 3.263 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -12.963 9.141 2.827 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.132 8.162 4.271 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -11.923 10.897 3.966 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -12.933 10.275 5.256 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -10.162 10.465 5.409 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -11.122 9.386 6.401 1.00 0.00 H new ATOM 968 N ILE A 61 -9.163 8.887 2.241 1.00 0.00 N ATOM 969 CA ILE A 61 -8.364 9.406 1.136 1.00 0.00 C ATOM 970 C ILE A 61 -9.072 10.512 0.358 1.00 0.00 C ATOM 971 O ILE A 61 -9.936 10.245 -0.477 1.00 0.00 O ATOM 972 CB ILE A 61 -7.962 8.289 0.169 1.00 0.00 C ATOM 973 CG1 ILE A 61 -7.403 7.102 0.961 1.00 0.00 C ATOM 974 CG2 ILE A 61 -6.945 8.811 -0.839 1.00 0.00 C ATOM 975 CD1 ILE A 61 -6.628 6.109 0.128 1.00 0.00 C ATOM 0 H ILE A 61 -8.611 8.646 3.064 1.00 0.00 H new ATOM 0 HA ILE A 61 -7.472 9.835 1.593 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.838 7.951 -0.385 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.754 7.480 1.751 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -8.229 6.584 1.448 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.665 8.009 -1.522 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.383 9.634 -1.405 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -6.059 9.164 -0.312 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.268 5.302 0.766 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -7.277 5.699 -0.646 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.779 6.609 -0.338 1.00 0.00 H new ATOM 987 N LYS A 62 -8.686 11.754 0.625 1.00 0.00 N ATOM 988 CA LYS A 62 -9.273 12.900 -0.059 1.00 0.00 C ATOM 989 C LYS A 62 -8.607 13.113 -1.414 1.00 0.00 C ATOM 990 O LYS A 62 -9.258 13.054 -2.457 1.00 0.00 O ATOM 991 CB LYS A 62 -9.134 14.159 0.797 1.00 0.00 C ATOM 992 CG LYS A 62 -10.312 14.393 1.728 1.00 0.00 C ATOM 993 CD LYS A 62 -10.119 13.685 3.059 1.00 0.00 C ATOM 994 CE LYS A 62 -9.591 14.632 4.124 1.00 0.00 C ATOM 995 NZ LYS A 62 -8.101 14.684 4.134 1.00 0.00 N ATOM 0 H LYS A 62 -7.969 11.993 1.310 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.332 12.698 -0.219 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.222 14.087 1.389 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.021 15.023 0.142 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.436 15.462 1.898 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.227 14.037 1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.068 13.260 3.387 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -9.424 12.854 2.933 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -9.988 15.632 3.949 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.950 14.313 5.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -7.779 15.260 4.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -7.721 13.720 4.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -7.762 15.108 3.247 1.00 0.00 H new ATOM 1009 N GLY A 63 -7.306 13.358 -1.382 1.00 0.00 N ATOM 1010 CA GLY A 63 -6.557 13.576 -2.607 1.00 0.00 C ATOM 1011 C GLY A 63 -5.429 12.577 -2.790 1.00 0.00 C ATOM 1012 O GLY A 63 -4.979 12.338 -3.910 1.00 0.00 O ATOM 0 H GLY A 63 -6.752 13.410 -0.527 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.235 13.513 -3.458 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.146 14.585 -2.602 1.00 0.00 H new ATOM 1016 N ASN A 64 -4.968 11.993 -1.686 1.00 0.00 N ATOM 1017 CA ASN A 64 -3.886 11.017 -1.732 1.00 0.00 C ATOM 1018 C ASN A 64 -4.392 9.667 -2.237 1.00 0.00 C ATOM 1019 O ASN A 64 -5.416 9.596 -2.917 1.00 0.00 O ATOM 1020 CB ASN A 64 -3.258 10.864 -0.341 1.00 0.00 C ATOM 1021 CG ASN A 64 -1.743 10.849 -0.390 1.00 0.00 C ATOM 1022 OD1 ASN A 64 -1.140 11.183 -1.410 1.00 0.00 O ATOM 1023 ND2 ASN A 64 -1.120 10.458 0.715 1.00 0.00 N ATOM 0 H ASN A 64 -5.328 12.180 -0.750 1.00 0.00 H new ATOM 0 HA ASN A 64 -3.127 11.376 -2.427 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.590 11.683 0.297 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.613 9.940 0.116 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -0.101 10.426 0.742 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.660 10.190 1.537 1.00 0.00 H new ATOM 1030 N LYS A 65 -3.672 8.595 -1.907 1.00 0.00 N ATOM 1031 CA LYS A 65 -4.057 7.252 -2.332 1.00 0.00 C ATOM 1032 C LYS A 65 -3.041 6.215 -1.861 1.00 0.00 C ATOM 1033 O LYS A 65 -1.871 6.262 -2.247 1.00 0.00 O ATOM 1034 CB LYS A 65 -4.193 7.196 -3.857 1.00 0.00 C ATOM 1035 CG LYS A 65 -5.634 7.103 -4.334 1.00 0.00 C ATOM 1036 CD LYS A 65 -6.104 5.660 -4.403 1.00 0.00 C ATOM 1037 CE LYS A 65 -7.614 5.559 -4.248 1.00 0.00 C ATOM 1038 NZ LYS A 65 -8.104 4.166 -4.448 1.00 0.00 N ATOM 0 H LYS A 65 -2.820 8.632 -1.347 1.00 0.00 H new ATOM 0 HA LYS A 65 -5.020 7.019 -1.878 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -3.733 8.085 -4.288 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.638 6.336 -4.232 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.279 7.665 -3.659 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -5.723 7.564 -5.318 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.805 5.224 -5.356 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.617 5.079 -3.620 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.900 5.905 -3.255 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.097 6.220 -4.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.848 4.161 -5.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.315 3.561 -4.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.492 3.803 -3.554 1.00 0.00 H new ATOM 1052 N VAL A 66 -3.491 5.275 -1.032 1.00 0.00 N ATOM 1053 CA VAL A 66 -2.611 4.227 -0.527 1.00 0.00 C ATOM 1054 C VAL A 66 -1.469 4.823 0.296 1.00 0.00 C ATOM 1055 O VAL A 66 -0.310 4.797 -0.122 1.00 0.00 O ATOM 1056 CB VAL A 66 -2.009 3.418 -1.685 1.00 0.00 C ATOM 1057 CG1 VAL A 66 -1.281 2.184 -1.169 1.00 0.00 C ATOM 1058 CG2 VAL A 66 -3.087 3.037 -2.688 1.00 0.00 C ATOM 0 H VAL A 66 -4.453 5.219 -0.698 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.213 3.574 0.104 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.277 4.045 -2.194 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.864 1.629 -2.010 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.476 2.489 -0.501 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.981 1.549 -0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.641 2.464 -3.501 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.847 2.433 -2.193 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.546 3.940 -3.090 1.00 0.00 H new ATOM 1068 N THR A 67 -1.795 5.369 1.464 1.00 0.00 N ATOM 1069 CA THR A 67 -0.786 5.976 2.327 1.00 0.00 C ATOM 1070 C THR A 67 -0.364 5.022 3.440 1.00 0.00 C ATOM 1071 O THR A 67 -1.146 4.182 3.881 1.00 0.00 O ATOM 1072 CB THR A 67 -1.310 7.287 2.922 1.00 0.00 C ATOM 1073 OG1 THR A 67 -0.237 8.091 3.383 1.00 0.00 O ATOM 1074 CG2 THR A 67 -2.264 7.093 4.084 1.00 0.00 C ATOM 0 H THR A 67 -2.745 5.404 1.834 1.00 0.00 H new ATOM 0 HA THR A 67 0.091 6.191 1.716 1.00 0.00 H new ATOM 0 HB THR A 67 -1.853 7.769 2.109 1.00 0.00 H new ATOM 0 HG1 THR A 67 -0.590 8.925 3.758 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.592 8.065 4.452 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.130 6.520 3.752 1.00 0.00 H new ATOM 0 HG23 THR A 67 -1.757 6.554 4.885 1.00 0.00 H new ATOM 1082 N LYS A 68 0.876 5.169 3.897 1.00 0.00 N ATOM 1083 CA LYS A 68 1.400 4.328 4.966 1.00 0.00 C ATOM 1084 C LYS A 68 1.041 4.910 6.327 1.00 0.00 C ATOM 1085 O LYS A 68 1.065 6.124 6.520 1.00 0.00 O ATOM 1086 CB LYS A 68 2.918 4.189 4.843 1.00 0.00 C ATOM 1087 CG LYS A 68 3.435 2.813 5.230 1.00 0.00 C ATOM 1088 CD LYS A 68 4.930 2.836 5.507 1.00 0.00 C ATOM 1089 CE LYS A 68 5.719 3.277 4.283 1.00 0.00 C ATOM 1090 NZ LYS A 68 7.072 3.785 4.646 1.00 0.00 N ATOM 0 H LYS A 68 1.535 5.862 3.544 1.00 0.00 H new ATOM 0 HA LYS A 68 0.948 3.340 4.875 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.212 4.403 3.816 1.00 0.00 H new ATOM 0 HB3 LYS A 68 3.396 4.938 5.474 1.00 0.00 H new ATOM 0 HG2 LYS A 68 2.906 2.460 6.115 1.00 0.00 H new ATOM 0 HG3 LYS A 68 3.223 2.105 4.429 1.00 0.00 H new ATOM 0 HD2 LYS A 68 5.137 3.512 6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 68 5.259 1.843 5.815 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.819 2.438 3.594 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.168 4.057 3.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.577 4.075 3.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 6.977 4.602 5.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 7.608 3.033 5.125 1.00 0.00 H new ATOM 1104 N MET A 69 0.710 4.036 7.271 1.00 0.00 N ATOM 1105 CA MET A 69 0.348 4.467 8.616 1.00 0.00 C ATOM 1106 C MET A 69 1.449 5.328 9.228 1.00 0.00 C ATOM 1107 O MET A 69 1.180 6.214 10.040 1.00 0.00 O ATOM 1108 CB MET A 69 0.075 3.253 9.507 1.00 0.00 C ATOM 1109 CG MET A 69 -1.339 3.223 10.059 1.00 0.00 C ATOM 1110 SD MET A 69 -1.397 2.866 11.822 1.00 0.00 S ATOM 1111 CE MET A 69 -2.305 4.293 12.402 1.00 0.00 C ATOM 0 H MET A 69 0.685 3.026 7.130 1.00 0.00 H new ATOM 0 HA MET A 69 -0.559 5.068 8.546 1.00 0.00 H new ATOM 0 HB2 MET A 69 0.254 2.343 8.935 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.782 3.253 10.336 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.817 4.185 9.873 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.917 2.471 9.522 1.00 0.00 H new ATOM 0 HE1 MET A 69 -2.477 4.204 13.475 1.00 0.00 H new ATOM 0 HE2 MET A 69 -1.730 5.197 12.200 1.00 0.00 H new ATOM 0 HE3 MET A 69 -3.263 4.350 11.885 1.00 0.00 H new ATOM 1121 N SER A 70 2.686 5.062 8.830 1.00 0.00 N ATOM 1122 CA SER A 70 3.831 5.809 9.335 1.00 0.00 C ATOM 1123 C SER A 70 3.963 5.654 10.844 1.00 0.00 C ATOM 1124 O SER A 70 4.514 6.519 11.524 1.00 0.00 O ATOM 1125 CB SER A 70 3.706 7.290 8.969 1.00 0.00 C ATOM 1126 OG SER A 70 4.356 7.568 7.741 1.00 0.00 O ATOM 0 H SER A 70 2.923 4.333 8.157 1.00 0.00 H new ATOM 0 HA SER A 70 4.729 5.403 8.869 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.653 7.562 8.897 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.140 7.901 9.760 1.00 0.00 H new ATOM 0 HG SER A 70 4.260 8.520 7.528 1.00 0.00 H new ATOM 1132 N MET A 71 3.455 4.541 11.359 1.00 0.00 N ATOM 1133 CA MET A 71 3.520 4.261 12.792 1.00 0.00 C ATOM 1134 C MET A 71 4.373 3.026 13.075 1.00 0.00 C ATOM 1135 O MET A 71 4.579 2.659 14.231 1.00 0.00 O ATOM 1136 CB MET A 71 2.116 4.056 13.369 1.00 0.00 C ATOM 1137 CG MET A 71 1.045 4.907 12.705 1.00 0.00 C ATOM 1138 SD MET A 71 1.327 6.674 12.922 1.00 0.00 S ATOM 1139 CE MET A 71 0.495 6.960 14.483 1.00 0.00 C ATOM 0 H MET A 71 2.994 3.817 10.808 1.00 0.00 H new ATOM 0 HA MET A 71 3.982 5.123 13.273 1.00 0.00 H new ATOM 0 HB2 MET A 71 1.844 3.005 13.271 1.00 0.00 H new ATOM 0 HB3 MET A 71 2.136 4.282 14.435 1.00 0.00 H new ATOM 0 HG2 MET A 71 1.012 4.677 11.640 1.00 0.00 H new ATOM 0 HG3 MET A 71 0.071 4.645 13.118 1.00 0.00 H new ATOM 0 HE1 MET A 71 0.581 8.012 14.754 1.00 0.00 H new ATOM 0 HE2 MET A 71 -0.558 6.695 14.388 1.00 0.00 H new ATOM 0 HE3 MET A 71 0.955 6.347 15.258 1.00 0.00 H new ATOM 1149 N ASN A 72 4.862 2.381 12.017 1.00 0.00 N ATOM 1150 CA ASN A 72 5.682 1.184 12.163 1.00 0.00 C ATOM 1151 C ASN A 72 4.934 0.113 12.950 1.00 0.00 C ATOM 1152 O ASN A 72 5.389 -0.337 14.004 1.00 0.00 O ATOM 1153 CB ASN A 72 7.004 1.520 12.857 1.00 0.00 C ATOM 1154 CG ASN A 72 7.914 0.313 12.987 1.00 0.00 C ATOM 1155 OD1 ASN A 72 8.481 0.062 14.052 1.00 0.00 O ATOM 1156 ND2 ASN A 72 8.061 -0.441 11.903 1.00 0.00 N ATOM 0 H ASN A 72 4.704 2.668 11.051 1.00 0.00 H new ATOM 0 HA ASN A 72 5.898 0.797 11.167 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.518 2.300 12.295 1.00 0.00 H new ATOM 0 HB3 ASN A 72 6.798 1.924 13.848 1.00 0.00 H new ATOM 0 HD21 ASN A 72 8.662 -1.264 11.932 1.00 0.00 H new ATOM 0 HD22 ASN A 72 7.573 -0.196 11.042 1.00 0.00 H new ATOM 1163 N LEU A 73 3.780 -0.290 12.429 1.00 0.00 N ATOM 1164 CA LEU A 73 2.957 -1.305 13.074 1.00 0.00 C ATOM 1165 C LEU A 73 3.742 -2.597 13.257 1.00 0.00 C ATOM 1166 O LEU A 73 3.842 -3.129 14.363 1.00 0.00 O ATOM 1167 CB LEU A 73 1.696 -1.569 12.247 1.00 0.00 C ATOM 1168 CG LEU A 73 0.649 -0.453 12.285 1.00 0.00 C ATOM 1169 CD1 LEU A 73 1.078 0.716 11.416 1.00 0.00 C ATOM 1170 CD2 LEU A 73 -0.704 -0.977 11.833 1.00 0.00 C ATOM 0 H LEU A 73 3.393 0.073 11.558 1.00 0.00 H new ATOM 0 HA LEU A 73 2.665 -0.935 14.057 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.989 -1.736 11.210 1.00 0.00 H new ATOM 0 HB3 LEU A 73 1.235 -2.491 12.601 1.00 0.00 H new ATOM 0 HG LEU A 73 0.561 -0.103 13.314 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.320 1.498 11.457 1.00 0.00 H new ATOM 0 HD12 LEU A 73 2.027 1.111 11.780 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.196 0.380 10.386 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.436 -0.170 11.866 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.626 -1.354 10.813 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -1.022 -1.783 12.495 1.00 0.00 H new ATOM 1182 N ILE A 74 4.297 -3.092 12.161 1.00 0.00 N ATOM 1183 CA ILE A 74 5.079 -4.322 12.185 1.00 0.00 C ATOM 1184 C ILE A 74 6.419 -4.127 11.483 1.00 0.00 C ATOM 1185 O ILE A 74 6.575 -3.230 10.656 1.00 0.00 O ATOM 1186 CB ILE A 74 4.301 -5.488 11.524 1.00 0.00 C ATOM 1187 CG1 ILE A 74 3.779 -6.452 12.595 1.00 0.00 C ATOM 1188 CG2 ILE A 74 5.158 -6.240 10.512 1.00 0.00 C ATOM 1189 CD1 ILE A 74 3.134 -7.700 12.027 1.00 0.00 C ATOM 0 H ILE A 74 4.221 -2.660 11.240 1.00 0.00 H new ATOM 0 HA ILE A 74 5.264 -4.575 13.229 1.00 0.00 H new ATOM 0 HB ILE A 74 3.457 -5.057 10.986 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.605 -6.743 13.243 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.053 -5.930 13.219 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.575 -7.049 10.072 1.00 0.00 H new ATOM 0 HG22 ILE A 74 5.479 -5.555 9.727 1.00 0.00 H new ATOM 0 HG23 ILE A 74 6.033 -6.654 11.013 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.789 -8.335 12.843 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.286 -7.419 11.402 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.863 -8.245 11.427 1.00 0.00 H new ATOM 1201 N ASP A 75 7.377 -4.986 11.813 1.00 0.00 N ATOM 1202 CA ASP A 75 8.696 -4.924 11.207 1.00 0.00 C ATOM 1203 C ASP A 75 8.843 -6.012 10.155 1.00 0.00 C ATOM 1204 O ASP A 75 8.402 -7.144 10.351 1.00 0.00 O ATOM 1205 CB ASP A 75 9.779 -5.077 12.273 1.00 0.00 C ATOM 1206 CG ASP A 75 11.097 -4.457 11.850 1.00 0.00 C ATOM 1207 OD1 ASP A 75 12.144 -4.854 12.407 1.00 0.00 O ATOM 1208 OD2 ASP A 75 11.085 -3.578 10.965 1.00 0.00 O ATOM 0 H ASP A 75 7.262 -5.733 12.498 1.00 0.00 H new ATOM 0 HA ASP A 75 8.812 -3.952 10.728 1.00 0.00 H new ATOM 0 HB2 ASP A 75 9.442 -4.611 13.199 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.930 -6.136 12.485 1.00 0.00 H new ATOM 1213 N GLY A 76 9.455 -5.660 9.036 1.00 0.00 N ATOM 1214 CA GLY A 76 9.641 -6.615 7.961 1.00 0.00 C ATOM 1215 C GLY A 76 8.828 -6.268 6.730 1.00 0.00 C ATOM 1216 O GLY A 76 9.232 -6.568 5.608 1.00 0.00 O ATOM 0 H GLY A 76 9.828 -4.729 8.851 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.697 -6.657 7.695 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.360 -7.609 8.310 1.00 0.00 H new ATOM 1220 N PHE A 77 7.677 -5.630 6.937 1.00 0.00 N ATOM 1221 CA PHE A 77 6.816 -5.244 5.823 1.00 0.00 C ATOM 1222 C PHE A 77 6.306 -3.813 6.001 1.00 0.00 C ATOM 1223 O PHE A 77 6.408 -3.239 7.085 1.00 0.00 O ATOM 1224 CB PHE A 77 5.629 -6.210 5.684 1.00 0.00 C ATOM 1225 CG PHE A 77 5.754 -7.467 6.496 1.00 0.00 C ATOM 1226 CD1 PHE A 77 5.156 -7.562 7.738 1.00 0.00 C ATOM 1227 CD2 PHE A 77 6.461 -8.557 6.012 1.00 0.00 C ATOM 1228 CE1 PHE A 77 5.258 -8.720 8.486 1.00 0.00 C ATOM 1229 CE2 PHE A 77 6.566 -9.716 6.757 1.00 0.00 C ATOM 1230 CZ PHE A 77 5.964 -9.796 7.998 1.00 0.00 C ATOM 0 H PHE A 77 7.322 -5.372 7.858 1.00 0.00 H new ATOM 0 HA PHE A 77 7.412 -5.293 4.912 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.717 -5.691 5.979 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.517 -6.480 4.634 1.00 0.00 H new ATOM 0 HD1 PHE A 77 4.602 -6.721 8.129 1.00 0.00 H new ATOM 0 HD2 PHE A 77 6.934 -8.500 5.043 1.00 0.00 H new ATOM 0 HE1 PHE A 77 4.783 -8.780 9.454 1.00 0.00 H new ATOM 0 HE2 PHE A 77 7.119 -10.559 6.369 1.00 0.00 H new ATOM 0 HZ PHE A 77 6.047 -10.700 8.583 1.00 0.00 H new ATOM 1240 N ASP A 78 5.759 -3.246 4.928 1.00 0.00 N ATOM 1241 CA ASP A 78 5.233 -1.883 4.959 1.00 0.00 C ATOM 1242 C ASP A 78 3.705 -1.890 4.997 1.00 0.00 C ATOM 1243 O ASP A 78 3.060 -2.516 4.156 1.00 0.00 O ATOM 1244 CB ASP A 78 5.720 -1.100 3.740 1.00 0.00 C ATOM 1245 CG ASP A 78 6.986 -0.315 4.025 1.00 0.00 C ATOM 1246 OD1 ASP A 78 7.283 0.630 3.263 1.00 0.00 O ATOM 1247 OD2 ASP A 78 7.683 -0.646 5.007 1.00 0.00 O ATOM 0 H ASP A 78 5.668 -3.710 4.024 1.00 0.00 H new ATOM 0 HA ASP A 78 5.599 -1.398 5.864 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.902 -1.791 2.917 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.937 -0.415 3.415 1.00 0.00 H new ATOM 1252 N CYS A 79 3.135 -1.198 5.984 1.00 0.00 N ATOM 1253 CA CYS A 79 1.681 -1.136 6.146 1.00 0.00 C ATOM 1254 C CYS A 79 1.074 0.085 5.453 1.00 0.00 C ATOM 1255 O CYS A 79 1.184 1.211 5.941 1.00 0.00 O ATOM 1256 CB CYS A 79 1.322 -1.111 7.631 1.00 0.00 C ATOM 1257 SG CYS A 79 -0.442 -1.328 7.968 1.00 0.00 S ATOM 0 H CYS A 79 3.658 -0.672 6.684 1.00 0.00 H new ATOM 0 HA CYS A 79 1.265 -2.027 5.675 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.878 -1.897 8.141 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.648 -0.162 8.057 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.702 -2.592 8.123 1.00 0.00 H new ATOM 1263 N PHE A 80 0.412 -0.155 4.324 1.00 0.00 N ATOM 1264 CA PHE A 80 -0.237 0.913 3.565 1.00 0.00 C ATOM 1265 C PHE A 80 -1.751 0.704 3.532 1.00 0.00 C ATOM 1266 O PHE A 80 -2.222 -0.415 3.338 1.00 0.00 O ATOM 1267 CB PHE A 80 0.304 0.949 2.135 1.00 0.00 C ATOM 1268 CG PHE A 80 1.602 1.689 1.990 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.810 1.046 2.219 1.00 0.00 C ATOM 1270 CD2 PHE A 80 1.617 3.024 1.623 1.00 0.00 C ATOM 1271 CE1 PHE A 80 4.006 1.723 2.081 1.00 0.00 C ATOM 1272 CE2 PHE A 80 2.810 3.707 1.484 1.00 0.00 C ATOM 1273 CZ PHE A 80 4.007 3.055 1.714 1.00 0.00 C ATOM 0 H PHE A 80 0.310 -1.083 3.913 1.00 0.00 H new ATOM 0 HA PHE A 80 -0.020 1.861 4.057 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.440 -0.074 1.783 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.441 1.412 1.488 1.00 0.00 H new ATOM 0 HD1 PHE A 80 2.815 0.005 2.508 1.00 0.00 H new ATOM 0 HD2 PHE A 80 0.684 3.538 1.443 1.00 0.00 H new ATOM 0 HE1 PHE A 80 4.940 1.211 2.260 1.00 0.00 H new ATOM 0 HE2 PHE A 80 2.807 4.748 1.196 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.941 3.586 1.607 1.00 0.00 H new ATOM 1283 N TYR A 81 -2.512 1.784 3.716 1.00 0.00 N ATOM 1284 CA TYR A 81 -3.970 1.691 3.693 1.00 0.00 C ATOM 1285 C TYR A 81 -4.572 2.648 2.673 1.00 0.00 C ATOM 1286 O TYR A 81 -4.124 3.785 2.526 1.00 0.00 O ATOM 1287 CB TYR A 81 -4.566 1.959 5.079 1.00 0.00 C ATOM 1288 CG TYR A 81 -4.205 3.304 5.674 1.00 0.00 C ATOM 1289 CD1 TYR A 81 -4.693 4.492 5.133 1.00 0.00 C ATOM 1290 CD2 TYR A 81 -3.377 3.385 6.788 1.00 0.00 C ATOM 1291 CE1 TYR A 81 -4.362 5.712 5.688 1.00 0.00 C ATOM 1292 CE2 TYR A 81 -3.046 4.604 7.345 1.00 0.00 C ATOM 1293 CZ TYR A 81 -3.540 5.763 6.791 1.00 0.00 C ATOM 1294 OH TYR A 81 -3.210 6.980 7.344 1.00 0.00 O ATOM 0 H TYR A 81 -2.147 2.722 3.881 1.00 0.00 H new ATOM 0 HA TYR A 81 -4.221 0.672 3.399 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -5.652 1.886 5.013 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -4.234 1.175 5.760 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -5.339 4.458 4.268 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -2.986 2.478 7.225 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -4.747 6.625 5.258 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.403 4.648 8.211 1.00 0.00 H new ATOM 0 HH TYR A 81 -2.624 6.840 8.117 1.00 0.00 H new ATOM 1304 N SER A 82 -5.595 2.171 1.971 1.00 0.00 N ATOM 1305 CA SER A 82 -6.276 2.969 0.960 1.00 0.00 C ATOM 1306 C SER A 82 -7.777 2.708 0.995 1.00 0.00 C ATOM 1307 O SER A 82 -8.218 1.582 0.776 1.00 0.00 O ATOM 1308 CB SER A 82 -5.732 2.643 -0.431 1.00 0.00 C ATOM 1309 OG SER A 82 -5.936 3.724 -1.322 1.00 0.00 O ATOM 0 H SER A 82 -5.972 1.230 2.086 1.00 0.00 H new ATOM 0 HA SER A 82 -6.093 4.021 1.178 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.668 2.417 -0.365 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.224 1.751 -0.818 1.00 0.00 H new ATOM 0 HG SER A 82 -5.883 3.401 -2.246 1.00 0.00 H new ATOM 1315 N THR A 83 -8.564 3.742 1.274 1.00 0.00 N ATOM 1316 CA THR A 83 -10.012 3.588 1.329 1.00 0.00 C ATOM 1317 C THR A 83 -10.618 3.634 -0.068 1.00 0.00 C ATOM 1318 O THR A 83 -10.083 4.280 -0.969 1.00 0.00 O ATOM 1319 CB THR A 83 -10.647 4.660 2.211 1.00 0.00 C ATOM 1320 OG1 THR A 83 -10.343 5.955 1.727 1.00 0.00 O ATOM 1321 CG2 THR A 83 -10.205 4.591 3.654 1.00 0.00 C ATOM 0 H THR A 83 -8.227 4.686 1.464 1.00 0.00 H new ATOM 0 HA THR A 83 -10.221 2.612 1.768 1.00 0.00 H new ATOM 0 HB THR A 83 -11.719 4.466 2.170 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.117 6.314 1.244 1.00 0.00 H new ATOM 0 HG21 THR A 83 -10.695 5.381 4.223 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.477 3.622 4.072 1.00 0.00 H new ATOM 0 HG23 THR A 83 -9.124 4.720 3.710 1.00 0.00 H new ATOM 1329 N ASP A 84 -11.740 2.937 -0.243 1.00 0.00 N ATOM 1330 CA ASP A 84 -12.426 2.888 -1.532 1.00 0.00 C ATOM 1331 C ASP A 84 -12.553 4.281 -2.142 1.00 0.00 C ATOM 1332 O ASP A 84 -12.668 5.277 -1.428 1.00 0.00 O ATOM 1333 CB ASP A 84 -13.812 2.260 -1.372 1.00 0.00 C ATOM 1334 CG ASP A 84 -14.355 1.710 -2.677 1.00 0.00 C ATOM 1335 OD1 ASP A 84 -15.022 0.656 -2.644 1.00 0.00 O ATOM 1336 OD2 ASP A 84 -14.113 2.335 -3.731 1.00 0.00 O ATOM 0 H ASP A 84 -12.194 2.397 0.494 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.830 2.273 -2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -13.761 1.457 -0.637 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -14.503 3.007 -0.981 1.00 0.00 H new ATOM 1341 N ASP A 85 -12.525 4.337 -3.467 1.00 0.00 N ATOM 1342 CA ASP A 85 -12.631 5.604 -4.184 1.00 0.00 C ATOM 1343 C ASP A 85 -14.042 6.186 -4.098 1.00 0.00 C ATOM 1344 O ASP A 85 -14.275 7.319 -4.518 1.00 0.00 O ATOM 1345 CB ASP A 85 -12.233 5.416 -5.649 1.00 0.00 C ATOM 1346 CG ASP A 85 -10.786 5.790 -5.907 1.00 0.00 C ATOM 1347 OD1 ASP A 85 -10.080 5.003 -6.570 1.00 0.00 O ATOM 1348 OD2 ASP A 85 -10.363 6.871 -5.450 1.00 0.00 O ATOM 0 H ASP A 85 -12.430 3.519 -4.069 1.00 0.00 H new ATOM 0 HA ASP A 85 -11.949 6.309 -3.710 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -12.394 4.377 -5.936 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -12.881 6.025 -6.280 1.00 0.00 H new ATOM 1353 N HIS A 86 -14.983 5.410 -3.562 1.00 0.00 N ATOM 1354 CA HIS A 86 -16.364 5.873 -3.444 1.00 0.00 C ATOM 1355 C HIS A 86 -17.120 5.117 -2.350 1.00 0.00 C ATOM 1356 O HIS A 86 -18.348 5.048 -2.374 1.00 0.00 O ATOM 1357 CB HIS A 86 -17.088 5.705 -4.780 1.00 0.00 C ATOM 1358 CG HIS A 86 -17.212 4.278 -5.215 1.00 0.00 C ATOM 1359 ND1 HIS A 86 -16.685 3.224 -4.498 1.00 0.00 N ATOM 1360 CD2 HIS A 86 -17.812 3.729 -6.298 1.00 0.00 C ATOM 1361 CE1 HIS A 86 -16.952 2.091 -5.120 1.00 0.00 C ATOM 1362 NE2 HIS A 86 -17.635 2.369 -6.216 1.00 0.00 N ATOM 0 H HIS A 86 -14.817 4.468 -3.206 1.00 0.00 H new ATOM 0 HA HIS A 86 -16.338 6.928 -3.170 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -18.084 6.141 -4.702 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -16.554 6.266 -5.547 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -18.333 4.261 -7.080 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -16.662 1.105 -4.789 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -17.976 1.685 -6.892 1.00 0.00 H new ATOM 1371 N ASP A 87 -16.388 4.550 -1.397 1.00 0.00 N ATOM 1372 CA ASP A 87 -17.007 3.804 -0.309 1.00 0.00 C ATOM 1373 C ASP A 87 -16.097 3.751 0.915 1.00 0.00 C ATOM 1374 O ASP A 87 -15.304 2.822 1.070 1.00 0.00 O ATOM 1375 CB ASP A 87 -17.347 2.384 -0.767 1.00 0.00 C ATOM 1376 CG ASP A 87 -18.681 1.907 -0.226 1.00 0.00 C ATOM 1377 OD1 ASP A 87 -18.774 0.724 0.167 1.00 0.00 O ATOM 1378 OD2 ASP A 87 -19.633 2.716 -0.193 1.00 0.00 O ATOM 0 H ASP A 87 -15.370 4.593 -1.356 1.00 0.00 H new ATOM 0 HA ASP A 87 -17.924 4.322 -0.029 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -17.367 2.351 -1.856 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -16.561 1.702 -0.442 1.00 0.00 H new ATOM 1383 N PRO A 88 -16.206 4.749 1.811 1.00 0.00 N ATOM 1384 CA PRO A 88 -15.392 4.809 3.031 1.00 0.00 C ATOM 1385 C PRO A 88 -15.527 3.543 3.876 1.00 0.00 C ATOM 1386 O PRO A 88 -14.672 3.253 4.713 1.00 0.00 O ATOM 1387 CB PRO A 88 -15.957 6.016 3.782 1.00 0.00 C ATOM 1388 CG PRO A 88 -16.602 6.853 2.733 1.00 0.00 C ATOM 1389 CD PRO A 88 -17.132 5.892 1.708 1.00 0.00 C ATOM 0 HA PRO A 88 -14.329 4.893 2.807 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -16.677 5.708 4.540 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.169 6.566 4.296 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.406 7.457 3.155 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.885 7.543 2.288 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -18.160 5.599 1.923 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -17.127 6.326 0.708 1.00 0.00 H new ATOM 1397 N LYS A 89 -16.598 2.786 3.645 1.00 0.00 N ATOM 1398 CA LYS A 89 -16.837 1.549 4.377 1.00 0.00 C ATOM 1399 C LYS A 89 -16.264 0.359 3.612 1.00 0.00 C ATOM 1400 O LYS A 89 -16.799 -0.749 3.670 1.00 0.00 O ATOM 1401 CB LYS A 89 -18.334 1.352 4.616 1.00 0.00 C ATOM 1402 CG LYS A 89 -18.909 2.289 5.668 1.00 0.00 C ATOM 1403 CD LYS A 89 -20.411 2.457 5.506 1.00 0.00 C ATOM 1404 CE LYS A 89 -21.063 2.927 6.797 1.00 0.00 C ATOM 1405 NZ LYS A 89 -21.935 4.114 6.578 1.00 0.00 N ATOM 0 H LYS A 89 -17.314 3.011 2.954 1.00 0.00 H new ATOM 0 HA LYS A 89 -16.336 1.617 5.343 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -18.867 1.502 3.677 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -18.512 0.321 4.922 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -18.691 1.899 6.662 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -18.423 3.262 5.594 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -20.614 3.176 4.712 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -20.853 1.509 5.198 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.654 2.116 7.222 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.290 3.173 7.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -22.361 4.403 7.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -21.366 4.897 6.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -22.688 3.872 5.903 1.00 0.00 H new ATOM 1419 N THR A 90 -15.168 0.602 2.903 1.00 0.00 N ATOM 1420 CA THR A 90 -14.497 -0.431 2.125 1.00 0.00 C ATOM 1421 C THR A 90 -13.041 -0.050 1.922 1.00 0.00 C ATOM 1422 O THR A 90 -12.620 0.309 0.824 1.00 0.00 O ATOM 1423 CB THR A 90 -15.199 -0.626 0.776 1.00 0.00 C ATOM 1424 OG1 THR A 90 -16.472 -1.222 0.957 1.00 0.00 O ATOM 1425 CG2 THR A 90 -14.424 -1.492 -0.194 1.00 0.00 C ATOM 0 H THR A 90 -14.721 1.517 2.852 1.00 0.00 H new ATOM 0 HA THR A 90 -14.543 -1.375 2.668 1.00 0.00 H new ATOM 0 HB THR A 90 -15.282 0.375 0.352 1.00 0.00 H new ATOM 0 HG1 THR A 90 -16.692 -1.239 1.912 1.00 0.00 H new ATOM 0 HG21 THR A 90 -14.983 -1.585 -1.125 1.00 0.00 H new ATOM 0 HG22 THR A 90 -13.455 -1.035 -0.396 1.00 0.00 H new ATOM 0 HG23 THR A 90 -14.275 -2.481 0.240 1.00 0.00 H new ATOM 1433 N VAL A 91 -12.282 -0.123 3.003 1.00 0.00 N ATOM 1434 CA VAL A 91 -10.873 0.220 2.975 1.00 0.00 C ATOM 1435 C VAL A 91 -10.065 -0.830 2.221 1.00 0.00 C ATOM 1436 O VAL A 91 -10.605 -1.830 1.753 1.00 0.00 O ATOM 1437 CB VAL A 91 -10.297 0.395 4.400 1.00 0.00 C ATOM 1438 CG1 VAL A 91 -9.204 1.454 4.408 1.00 0.00 C ATOM 1439 CG2 VAL A 91 -11.398 0.754 5.388 1.00 0.00 C ATOM 0 H VAL A 91 -12.623 -0.420 3.917 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.792 1.173 2.452 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.859 -0.554 4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.811 1.563 5.419 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.400 1.152 3.736 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -9.617 2.406 4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -10.969 0.872 6.383 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -11.870 1.688 5.083 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -12.144 -0.041 5.406 1.00 0.00 H new ATOM 1449 N TYR A 92 -8.765 -0.588 2.109 1.00 0.00 N ATOM 1450 CA TYR A 92 -7.862 -1.498 1.414 1.00 0.00 C ATOM 1451 C TYR A 92 -6.451 -1.369 1.974 1.00 0.00 C ATOM 1452 O TYR A 92 -5.712 -0.453 1.613 1.00 0.00 O ATOM 1453 CB TYR A 92 -7.843 -1.205 -0.091 1.00 0.00 C ATOM 1454 CG TYR A 92 -9.188 -1.338 -0.772 1.00 0.00 C ATOM 1455 CD1 TYR A 92 -9.565 -2.532 -1.377 1.00 0.00 C ATOM 1456 CD2 TYR A 92 -10.076 -0.271 -0.820 1.00 0.00 C ATOM 1457 CE1 TYR A 92 -10.788 -2.656 -2.008 1.00 0.00 C ATOM 1458 CE2 TYR A 92 -11.301 -0.389 -1.447 1.00 0.00 C ATOM 1459 CZ TYR A 92 -11.652 -1.584 -2.040 1.00 0.00 C ATOM 1460 OH TYR A 92 -12.871 -1.705 -2.667 1.00 0.00 O ATOM 0 H TYR A 92 -8.309 0.239 2.494 1.00 0.00 H new ATOM 0 HA TYR A 92 -8.223 -2.515 1.569 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -7.469 -0.193 -0.247 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -7.138 -1.883 -0.572 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -8.891 -3.376 -1.353 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -9.804 0.667 -0.359 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -11.065 -3.590 -2.474 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -11.981 0.450 -1.473 1.00 0.00 H new ATOM 0 HH TYR A 92 -13.360 -0.858 -2.598 1.00 0.00 H new ATOM 1470 N VAL A 93 -6.084 -2.281 2.867 1.00 0.00 N ATOM 1471 CA VAL A 93 -4.766 -2.255 3.483 1.00 0.00 C ATOM 1472 C VAL A 93 -3.869 -3.356 2.924 1.00 0.00 C ATOM 1473 O VAL A 93 -4.259 -4.522 2.866 1.00 0.00 O ATOM 1474 CB VAL A 93 -4.879 -2.385 5.018 1.00 0.00 C ATOM 1475 CG1 VAL A 93 -3.527 -2.667 5.660 1.00 0.00 C ATOM 1476 CG2 VAL A 93 -5.496 -1.119 5.597 1.00 0.00 C ATOM 0 H VAL A 93 -6.681 -3.046 3.179 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.310 -1.294 3.245 1.00 0.00 H new ATOM 0 HB VAL A 93 -5.525 -3.234 5.241 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.648 -2.752 6.740 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -3.124 -3.600 5.266 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.840 -1.851 5.435 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -5.574 -1.215 6.680 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.867 -0.263 5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.489 -0.972 5.173 1.00 0.00 H new ATOM 1486 N CYS A 94 -2.667 -2.968 2.506 1.00 0.00 N ATOM 1487 CA CYS A 94 -1.710 -3.911 1.942 1.00 0.00 C ATOM 1488 C CYS A 94 -0.353 -3.801 2.629 1.00 0.00 C ATOM 1489 O CYS A 94 0.308 -2.766 2.564 1.00 0.00 O ATOM 1490 CB CYS A 94 -1.550 -3.665 0.441 1.00 0.00 C ATOM 1491 SG CYS A 94 -0.933 -2.017 0.028 1.00 0.00 S ATOM 0 H CYS A 94 -2.334 -2.005 2.548 1.00 0.00 H new ATOM 0 HA CYS A 94 -2.096 -4.917 2.106 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -0.868 -4.410 0.032 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.514 -3.814 -0.046 1.00 0.00 H new ATOM 0 HG CYS A 94 0.140 -1.769 0.719 1.00 0.00 H new ATOM 1497 N PHE A 95 0.063 -4.885 3.275 1.00 0.00 N ATOM 1498 CA PHE A 95 1.349 -4.925 3.957 1.00 0.00 C ATOM 1499 C PHE A 95 2.444 -5.314 2.971 1.00 0.00 C ATOM 1500 O PHE A 95 2.883 -6.462 2.945 1.00 0.00 O ATOM 1501 CB PHE A 95 1.322 -5.933 5.106 1.00 0.00 C ATOM 1502 CG PHE A 95 0.837 -5.371 6.410 1.00 0.00 C ATOM 1503 CD1 PHE A 95 -0.503 -5.435 6.749 1.00 0.00 C ATOM 1504 CD2 PHE A 95 1.725 -4.794 7.302 1.00 0.00 C ATOM 1505 CE1 PHE A 95 -0.951 -4.934 7.954 1.00 0.00 C ATOM 1506 CE2 PHE A 95 1.283 -4.290 8.509 1.00 0.00 C ATOM 1507 CZ PHE A 95 -0.056 -4.359 8.835 1.00 0.00 C ATOM 0 H PHE A 95 -0.474 -5.749 3.340 1.00 0.00 H new ATOM 0 HA PHE A 95 1.553 -3.934 4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.683 -6.770 4.824 1.00 0.00 H new ATOM 0 HB3 PHE A 95 2.326 -6.332 5.247 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.206 -5.882 6.062 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.774 -4.738 7.051 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -1.999 -4.991 8.208 1.00 0.00 H new ATOM 0 HE2 PHE A 95 1.985 -3.842 9.197 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.404 -3.964 9.778 1.00 0.00 H new ATOM 1517 N THR A 96 2.875 -4.361 2.154 1.00 0.00 N ATOM 1518 CA THR A 96 3.911 -4.634 1.164 1.00 0.00 C ATOM 1519 C THR A 96 5.230 -4.967 1.847 1.00 0.00 C ATOM 1520 O THR A 96 5.286 -5.119 3.063 1.00 0.00 O ATOM 1521 CB THR A 96 4.093 -3.444 0.218 1.00 0.00 C ATOM 1522 OG1 THR A 96 3.438 -2.293 0.723 1.00 0.00 O ATOM 1523 CG2 THR A 96 3.558 -3.711 -1.171 1.00 0.00 C ATOM 0 H THR A 96 2.528 -3.402 2.156 1.00 0.00 H new ATOM 0 HA THR A 96 3.593 -5.495 0.576 1.00 0.00 H new ATOM 0 HB THR A 96 5.169 -3.281 0.154 1.00 0.00 H new ATOM 0 HG1 THR A 96 4.106 -1.647 1.034 1.00 0.00 H new ATOM 0 HG21 THR A 96 3.715 -2.832 -1.796 1.00 0.00 H new ATOM 0 HG22 THR A 96 4.081 -4.563 -1.605 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.492 -3.930 -1.114 1.00 0.00 H new ATOM 1531 N LEU A 97 6.288 -5.079 1.056 1.00 0.00 N ATOM 1532 CA LEU A 97 7.603 -5.389 1.593 1.00 0.00 C ATOM 1533 C LEU A 97 8.460 -4.131 1.663 1.00 0.00 C ATOM 1534 O LEU A 97 8.558 -3.384 0.690 1.00 0.00 O ATOM 1535 CB LEU A 97 8.279 -6.456 0.737 1.00 0.00 C ATOM 1536 CG LEU A 97 7.701 -7.860 0.912 1.00 0.00 C ATOM 1537 CD1 LEU A 97 8.286 -8.810 -0.112 1.00 0.00 C ATOM 1538 CD2 LEU A 97 7.955 -8.375 2.322 1.00 0.00 C ATOM 0 H LEU A 97 6.261 -4.960 0.043 1.00 0.00 H new ATOM 0 HA LEU A 97 7.487 -5.777 2.605 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.197 -6.170 -0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.342 -6.480 0.979 1.00 0.00 H new ATOM 0 HG LEU A 97 6.624 -7.806 0.755 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.862 -9.804 0.030 1.00 0.00 H new ATOM 0 HD12 LEU A 97 8.050 -8.454 -1.115 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.368 -8.857 0.011 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.535 -9.376 2.425 1.00 0.00 H new ATOM 0 HD22 LEU A 97 9.028 -8.411 2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.483 -7.708 3.043 1.00 0.00 H new ATOM 1550 N VAL A 98 9.064 -3.886 2.825 1.00 0.00 N ATOM 1551 CA VAL A 98 9.899 -2.701 3.022 1.00 0.00 C ATOM 1552 C VAL A 98 10.859 -2.490 1.856 1.00 0.00 C ATOM 1553 O VAL A 98 11.135 -1.357 1.464 1.00 0.00 O ATOM 1554 CB VAL A 98 10.705 -2.776 4.337 1.00 0.00 C ATOM 1555 CG1 VAL A 98 9.904 -2.188 5.487 1.00 0.00 C ATOM 1556 CG2 VAL A 98 11.114 -4.209 4.645 1.00 0.00 C ATOM 0 H VAL A 98 8.991 -4.491 3.643 1.00 0.00 H new ATOM 0 HA VAL A 98 9.216 -1.854 3.078 1.00 0.00 H new ATOM 0 HB VAL A 98 11.613 -2.187 4.212 1.00 0.00 H new ATOM 0 HG11 VAL A 98 10.488 -2.249 6.406 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.673 -1.145 5.273 1.00 0.00 H new ATOM 0 HG13 VAL A 98 8.977 -2.748 5.608 1.00 0.00 H new ATOM 0 HG21 VAL A 98 11.680 -4.234 5.576 1.00 0.00 H new ATOM 0 HG22 VAL A 98 10.223 -4.828 4.746 1.00 0.00 H new ATOM 0 HG23 VAL A 98 11.733 -4.593 3.834 1.00 0.00 H new ATOM 1566 N ASP A 99 11.361 -3.588 1.300 1.00 0.00 N ATOM 1567 CA ASP A 99 12.281 -3.512 0.170 1.00 0.00 C ATOM 1568 C ASP A 99 11.593 -2.875 -1.034 1.00 0.00 C ATOM 1569 O ASP A 99 12.235 -2.225 -1.860 1.00 0.00 O ATOM 1570 CB ASP A 99 12.791 -4.909 -0.195 1.00 0.00 C ATOM 1571 CG ASP A 99 14.280 -4.922 -0.487 1.00 0.00 C ATOM 1572 OD1 ASP A 99 14.688 -4.339 -1.513 1.00 0.00 O ATOM 1573 OD2 ASP A 99 15.035 -5.515 0.311 1.00 0.00 O ATOM 0 H ASP A 99 11.148 -4.536 1.611 1.00 0.00 H new ATOM 0 HA ASP A 99 13.130 -2.891 0.457 1.00 0.00 H new ATOM 0 HB2 ASP A 99 12.578 -5.596 0.624 1.00 0.00 H new ATOM 0 HB3 ASP A 99 12.249 -5.274 -1.067 1.00 0.00 H new ATOM 1578 N ILE A 100 10.281 -3.063 -1.118 1.00 0.00 N ATOM 1579 CA ILE A 100 9.489 -2.511 -2.208 1.00 0.00 C ATOM 1580 C ILE A 100 9.151 -1.042 -1.945 1.00 0.00 C ATOM 1581 O ILE A 100 8.668 -0.695 -0.868 1.00 0.00 O ATOM 1582 CB ILE A 100 8.177 -3.303 -2.395 1.00 0.00 C ATOM 1583 CG1 ILE A 100 8.484 -4.773 -2.689 1.00 0.00 C ATOM 1584 CG2 ILE A 100 7.329 -2.700 -3.509 1.00 0.00 C ATOM 1585 CD1 ILE A 100 7.247 -5.620 -2.890 1.00 0.00 C ATOM 0 H ILE A 100 9.741 -3.598 -0.438 1.00 0.00 H new ATOM 0 HA ILE A 100 10.087 -2.588 -3.116 1.00 0.00 H new ATOM 0 HB ILE A 100 7.606 -3.243 -1.468 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.106 -4.834 -3.582 1.00 0.00 H new ATOM 0 HG13 ILE A 100 9.067 -5.186 -1.866 1.00 0.00 H new ATOM 0 HG21 ILE A 100 6.411 -3.277 -3.620 1.00 0.00 H new ATOM 0 HG22 ILE A 100 7.082 -1.668 -3.260 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.888 -2.723 -4.445 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.540 -6.650 -3.094 1.00 0.00 H new ATOM 0 HD12 ILE A 100 6.635 -5.589 -1.989 1.00 0.00 H new ATOM 0 HD13 ILE A 100 6.673 -5.232 -3.732 1.00 0.00 H new ATOM 1597 N PRO A 101 9.397 -0.156 -2.928 1.00 0.00 N ATOM 1598 CA PRO A 101 9.109 1.274 -2.789 1.00 0.00 C ATOM 1599 C PRO A 101 7.639 1.531 -2.470 1.00 0.00 C ATOM 1600 O PRO A 101 6.859 0.595 -2.296 1.00 0.00 O ATOM 1601 CB PRO A 101 9.469 1.861 -4.163 1.00 0.00 C ATOM 1602 CG PRO A 101 9.531 0.692 -5.086 1.00 0.00 C ATOM 1603 CD PRO A 101 9.965 -0.474 -4.248 1.00 0.00 C ATOM 0 HA PRO A 101 9.669 1.722 -1.968 1.00 0.00 H new ATOM 0 HB2 PRO A 101 8.720 2.582 -4.491 1.00 0.00 H new ATOM 0 HB3 PRO A 101 10.424 2.386 -4.129 1.00 0.00 H new ATOM 0 HG2 PRO A 101 8.560 0.504 -5.543 1.00 0.00 H new ATOM 0 HG3 PRO A 101 10.236 0.873 -5.898 1.00 0.00 H new ATOM 0 HD2 PRO A 101 9.581 -1.417 -4.637 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.051 -0.563 -4.210 1.00 0.00 H new ATOM 1611 N LYS A 102 7.269 2.803 -2.397 1.00 0.00 N ATOM 1612 CA LYS A 102 5.894 3.181 -2.101 1.00 0.00 C ATOM 1613 C LYS A 102 5.146 3.551 -3.379 1.00 0.00 C ATOM 1614 O LYS A 102 4.716 4.691 -3.552 1.00 0.00 O ATOM 1615 CB LYS A 102 5.864 4.354 -1.119 1.00 0.00 C ATOM 1616 CG LYS A 102 6.541 5.608 -1.648 1.00 0.00 C ATOM 1617 CD LYS A 102 5.540 6.722 -1.904 1.00 0.00 C ATOM 1618 CE LYS A 102 5.539 7.742 -0.776 1.00 0.00 C ATOM 1619 NZ LYS A 102 6.718 8.649 -0.846 1.00 0.00 N ATOM 0 H LYS A 102 7.902 3.590 -2.539 1.00 0.00 H new ATOM 0 HA LYS A 102 5.397 2.324 -1.645 1.00 0.00 H new ATOM 0 HB2 LYS A 102 4.827 4.586 -0.875 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.350 4.053 -0.191 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.288 5.948 -0.931 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.069 5.374 -2.572 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.779 7.218 -2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 102 4.542 6.298 -2.013 1.00 0.00 H new ATOM 0 HE2 LYS A 102 4.624 8.332 -0.821 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.537 7.223 0.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.823 9.152 0.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.575 8.090 -1.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.580 9.339 -1.612 1.00 0.00 H new ATOM 1633 N ILE A 103 4.999 2.580 -4.275 1.00 0.00 N ATOM 1634 CA ILE A 103 4.305 2.812 -5.537 1.00 0.00 C ATOM 1635 C ILE A 103 3.500 1.589 -5.969 1.00 0.00 C ATOM 1636 O ILE A 103 2.394 1.729 -6.489 1.00 0.00 O ATOM 1637 CB ILE A 103 5.292 3.227 -6.650 1.00 0.00 C ATOM 1638 CG1 ILE A 103 4.566 3.415 -7.986 1.00 0.00 C ATOM 1639 CG2 ILE A 103 6.413 2.205 -6.780 1.00 0.00 C ATOM 1640 CD1 ILE A 103 3.769 4.698 -8.064 1.00 0.00 C ATOM 0 H ILE A 103 5.349 1.630 -4.152 1.00 0.00 H new ATOM 0 HA ILE A 103 3.607 3.633 -5.372 1.00 0.00 H new ATOM 0 HB ILE A 103 5.733 4.184 -6.373 1.00 0.00 H new ATOM 0 HG12 ILE A 103 5.298 3.402 -8.793 1.00 0.00 H new ATOM 0 HG13 ILE A 103 3.897 2.570 -8.149 1.00 0.00 H new ATOM 0 HG21 ILE A 103 7.098 2.515 -7.569 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.954 2.136 -5.836 1.00 0.00 H new ATOM 0 HG23 ILE A 103 5.991 1.231 -7.028 1.00 0.00 H new ATOM 0 HD11 ILE A 103 3.282 4.765 -9.037 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.013 4.705 -7.278 1.00 0.00 H new ATOM 0 HD13 ILE A 103 4.437 5.550 -7.933 1.00 0.00 H new ATOM 1652 N LEU A 104 4.031 0.391 -5.738 1.00 0.00 N ATOM 1653 CA LEU A 104 3.302 -0.817 -6.102 1.00 0.00 C ATOM 1654 C LEU A 104 2.022 -0.895 -5.276 1.00 0.00 C ATOM 1655 O LEU A 104 0.924 -0.822 -5.824 1.00 0.00 O ATOM 1656 CB LEU A 104 4.147 -2.087 -5.902 1.00 0.00 C ATOM 1657 CG LEU A 104 3.354 -3.405 -5.904 1.00 0.00 C ATOM 1658 CD1 LEU A 104 3.290 -4.003 -7.302 1.00 0.00 C ATOM 1659 CD2 LEU A 104 3.959 -4.402 -4.929 1.00 0.00 C ATOM 0 H LEU A 104 4.943 0.233 -5.310 1.00 0.00 H new ATOM 0 HA LEU A 104 3.060 -0.762 -7.163 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.899 -2.132 -6.690 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.681 -2.004 -4.956 1.00 0.00 H new ATOM 0 HG LEU A 104 2.337 -3.181 -5.582 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.724 -4.934 -7.274 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.800 -3.300 -7.976 1.00 0.00 H new ATOM 0 HD13 LEU A 104 4.300 -4.204 -7.659 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.381 -5.326 -4.948 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.989 -4.612 -5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.941 -3.984 -3.923 1.00 0.00 H new ATOM 1671 N PRO A 105 2.143 -1.015 -3.935 1.00 0.00 N ATOM 1672 CA PRO A 105 0.988 -1.075 -3.042 1.00 0.00 C ATOM 1673 C PRO A 105 -0.043 -0.013 -3.396 1.00 0.00 C ATOM 1674 O PRO A 105 -1.245 -0.208 -3.209 1.00 0.00 O ATOM 1675 CB PRO A 105 1.577 -0.810 -1.645 1.00 0.00 C ATOM 1676 CG PRO A 105 3.019 -0.470 -1.865 1.00 0.00 C ATOM 1677 CD PRO A 105 3.400 -1.076 -3.184 1.00 0.00 C ATOM 0 HA PRO A 105 0.468 -2.031 -3.109 1.00 0.00 H new ATOM 0 HB2 PRO A 105 1.054 0.008 -1.149 1.00 0.00 H new ATOM 0 HB3 PRO A 105 1.476 -1.687 -1.006 1.00 0.00 H new ATOM 0 HG2 PRO A 105 3.166 0.610 -1.877 1.00 0.00 H new ATOM 0 HG3 PRO A 105 3.639 -0.867 -1.061 1.00 0.00 H new ATOM 0 HD2 PRO A 105 4.194 -0.513 -3.675 1.00 0.00 H new ATOM 0 HD3 PRO A 105 3.757 -2.100 -3.072 1.00 0.00 H new ATOM 1685 N ILE A 106 0.442 1.104 -3.929 1.00 0.00 N ATOM 1686 CA ILE A 106 -0.430 2.191 -4.331 1.00 0.00 C ATOM 1687 C ILE A 106 -1.291 1.751 -5.509 1.00 0.00 C ATOM 1688 O ILE A 106 -2.492 2.028 -5.561 1.00 0.00 O ATOM 1689 CB ILE A 106 0.382 3.447 -4.707 1.00 0.00 C ATOM 1690 CG1 ILE A 106 1.067 4.043 -3.472 1.00 0.00 C ATOM 1691 CG2 ILE A 106 -0.494 4.491 -5.382 1.00 0.00 C ATOM 1692 CD1 ILE A 106 2.177 3.182 -2.911 1.00 0.00 C ATOM 0 H ILE A 106 1.434 1.276 -4.091 1.00 0.00 H new ATOM 0 HA ILE A 106 -1.072 2.446 -3.488 1.00 0.00 H new ATOM 0 HB ILE A 106 1.151 3.141 -5.417 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.474 5.020 -3.731 1.00 0.00 H new ATOM 0 HG13 ILE A 106 0.319 4.205 -2.696 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.109 5.364 -5.634 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.924 4.072 -6.292 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -1.295 4.787 -4.705 1.00 0.00 H new ATOM 0 HD11 ILE A 106 2.612 3.671 -2.039 1.00 0.00 H new ATOM 0 HD12 ILE A 106 1.773 2.213 -2.619 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.947 3.041 -3.670 1.00 0.00 H new ATOM 1704 N ARG A 107 -0.667 1.042 -6.442 1.00 0.00 N ATOM 1705 CA ARG A 107 -1.361 0.536 -7.615 1.00 0.00 C ATOM 1706 C ARG A 107 -2.120 -0.748 -7.281 1.00 0.00 C ATOM 1707 O ARG A 107 -3.021 -1.150 -8.012 1.00 0.00 O ATOM 1708 CB ARG A 107 -0.369 0.282 -8.752 1.00 0.00 C ATOM 1709 CG ARG A 107 0.144 1.558 -9.400 1.00 0.00 C ATOM 1710 CD ARG A 107 -0.930 2.224 -10.246 1.00 0.00 C ATOM 1711 NE ARG A 107 -0.883 3.680 -10.141 1.00 0.00 N ATOM 1712 CZ ARG A 107 -1.787 4.491 -10.685 1.00 0.00 C ATOM 1713 NH1 ARG A 107 -2.810 3.993 -11.369 1.00 0.00 N ATOM 1714 NH2 ARG A 107 -1.670 5.803 -10.543 1.00 0.00 N ATOM 0 H ARG A 107 0.324 0.805 -6.406 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.080 1.289 -7.938 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.477 -0.287 -8.366 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -0.848 -0.336 -9.512 1.00 0.00 H new ATOM 0 HG2 ARG A 107 0.481 2.249 -8.628 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.009 1.329 -10.022 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -0.804 1.931 -11.288 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -1.911 1.869 -9.932 1.00 0.00 H new ATOM 0 HE ARG A 107 -0.113 4.100 -9.621 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -2.906 2.984 -11.480 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -3.500 4.620 -11.784 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -0.887 6.191 -10.017 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -2.363 6.425 -10.960 1.00 0.00 H new ATOM 1728 N ILE A 108 -1.757 -1.385 -6.165 1.00 0.00 N ATOM 1729 CA ILE A 108 -2.424 -2.611 -5.744 1.00 0.00 C ATOM 1730 C ILE A 108 -3.836 -2.305 -5.271 1.00 0.00 C ATOM 1731 O ILE A 108 -4.793 -2.952 -5.691 1.00 0.00 O ATOM 1732 CB ILE A 108 -1.657 -3.329 -4.617 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -0.190 -3.497 -4.999 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -2.286 -4.684 -4.326 1.00 0.00 C ATOM 1735 CD1 ILE A 108 0.032 -4.515 -6.094 1.00 0.00 C ATOM 0 H ILE A 108 -1.011 -1.072 -5.544 1.00 0.00 H new ATOM 0 HA ILE A 108 -2.454 -3.273 -6.610 1.00 0.00 H new ATOM 0 HB ILE A 108 -1.715 -2.719 -3.715 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.206 -2.534 -5.322 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.376 -3.794 -4.116 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -1.732 -5.178 -3.528 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -3.322 -4.545 -4.017 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -2.255 -5.300 -5.225 1.00 0.00 H new ATOM 0 HD11 ILE A 108 1.097 -4.584 -6.316 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.334 -5.488 -5.766 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.506 -4.208 -6.991 1.00 0.00 H new ATOM 1747 N LEU A 109 -3.963 -1.302 -4.408 1.00 0.00 N ATOM 1748 CA LEU A 109 -5.269 -0.901 -3.905 1.00 0.00 C ATOM 1749 C LEU A 109 -6.032 -0.180 -5.000 1.00 0.00 C ATOM 1750 O LEU A 109 -7.165 -0.543 -5.324 1.00 0.00 O ATOM 1751 CB LEU A 109 -5.127 -0.007 -2.668 1.00 0.00 C ATOM 1752 CG LEU A 109 -4.808 -0.738 -1.354 1.00 0.00 C ATOM 1753 CD1 LEU A 109 -4.856 -2.251 -1.536 1.00 0.00 C ATOM 1754 CD2 LEU A 109 -3.449 -0.308 -0.822 1.00 0.00 C ATOM 0 H LEU A 109 -3.182 -0.756 -4.045 1.00 0.00 H new ATOM 0 HA LEU A 109 -5.823 -1.792 -3.609 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -4.340 0.723 -2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -6.054 0.551 -2.537 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.571 -0.465 -0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.626 -2.739 -0.589 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.853 -2.547 -1.864 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.124 -2.551 -2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.239 -0.835 0.109 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.679 -0.546 -1.556 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.454 0.766 -0.637 1.00 0.00 H new ATOM 1766 N SER A 110 -5.394 0.819 -5.600 1.00 0.00 N ATOM 1767 CA SER A 110 -6.012 1.552 -6.693 1.00 0.00 C ATOM 1768 C SER A 110 -6.294 0.588 -7.839 1.00 0.00 C ATOM 1769 O SER A 110 -7.237 0.773 -8.607 1.00 0.00 O ATOM 1770 CB SER A 110 -5.102 2.689 -7.164 1.00 0.00 C ATOM 1771 OG SER A 110 -5.864 3.809 -7.585 1.00 0.00 O ATOM 0 H SER A 110 -4.458 1.136 -5.349 1.00 0.00 H new ATOM 0 HA SER A 110 -6.947 1.993 -6.348 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.433 2.983 -6.355 1.00 0.00 H new ATOM 0 HB3 SER A 110 -4.475 2.342 -7.985 1.00 0.00 H new ATOM 0 HG SER A 110 -5.261 4.523 -7.880 1.00 0.00 H new ATOM 1777 N GLY A 111 -5.477 -0.460 -7.922 1.00 0.00 N ATOM 1778 CA GLY A 111 -5.656 -1.465 -8.944 1.00 0.00 C ATOM 1779 C GLY A 111 -6.803 -2.388 -8.602 1.00 0.00 C ATOM 1780 O GLY A 111 -7.636 -2.694 -9.455 1.00 0.00 O ATOM 0 H GLY A 111 -4.691 -0.627 -7.293 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -5.846 -0.983 -9.903 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -4.739 -2.044 -9.054 1.00 0.00 H new ATOM 1784 N LEU A 112 -6.868 -2.813 -7.337 1.00 0.00 N ATOM 1785 CA LEU A 112 -7.951 -3.680 -6.883 1.00 0.00 C ATOM 1786 C LEU A 112 -9.276 -2.990 -7.164 1.00 0.00 C ATOM 1787 O LEU A 112 -10.265 -3.629 -7.524 1.00 0.00 O ATOM 1788 CB LEU A 112 -7.827 -3.989 -5.382 1.00 0.00 C ATOM 1789 CG LEU A 112 -6.737 -4.997 -4.990 1.00 0.00 C ATOM 1790 CD1 LEU A 112 -6.291 -4.774 -3.550 1.00 0.00 C ATOM 1791 CD2 LEU A 112 -7.232 -6.425 -5.156 1.00 0.00 C ATOM 0 H LEU A 112 -6.188 -2.571 -6.616 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.896 -4.627 -7.420 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.637 -3.055 -4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.787 -4.366 -5.028 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.887 -4.841 -5.654 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -5.518 -5.498 -3.292 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -5.892 -3.765 -3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.143 -4.899 -2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.441 -7.119 -4.872 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.102 -6.585 -4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.508 -6.596 -6.197 1.00 0.00 H new ATOM 1803 N GLN A 113 -9.273 -1.667 -7.020 1.00 0.00 N ATOM 1804 CA GLN A 113 -10.457 -0.872 -7.284 1.00 0.00 C ATOM 1805 C GLN A 113 -10.724 -0.812 -8.786 1.00 0.00 C ATOM 1806 O GLN A 113 -11.813 -0.430 -9.214 1.00 0.00 O ATOM 1807 CB GLN A 113 -10.290 0.540 -6.722 1.00 0.00 C ATOM 1808 CG GLN A 113 -11.568 1.116 -6.134 1.00 0.00 C ATOM 1809 CD GLN A 113 -12.513 1.640 -7.197 1.00 0.00 C ATOM 1810 OE1 GLN A 113 -13.478 0.973 -7.573 1.00 0.00 O ATOM 1811 NE2 GLN A 113 -12.239 2.842 -7.692 1.00 0.00 N ATOM 0 H GLN A 113 -8.460 -1.128 -6.721 1.00 0.00 H new ATOM 0 HA GLN A 113 -11.308 -1.342 -6.792 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -9.519 0.527 -5.951 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -9.936 1.198 -7.515 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -12.074 0.347 -5.550 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -11.316 1.924 -5.447 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -11.429 3.361 -7.352 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -12.838 3.246 -8.412 1.00 0.00 H new ATOM 1820 N GLU A 114 -9.727 -1.201 -9.585 1.00 0.00 N ATOM 1821 CA GLU A 114 -9.873 -1.197 -11.030 1.00 0.00 C ATOM 1822 C GLU A 114 -10.759 -2.353 -11.473 1.00 0.00 C ATOM 1823 O GLU A 114 -11.363 -2.305 -12.543 1.00 0.00 O ATOM 1824 CB GLU A 114 -8.504 -1.295 -11.706 1.00 0.00 C ATOM 1825 CG GLU A 114 -8.531 -0.934 -13.183 1.00 0.00 C ATOM 1826 CD GLU A 114 -7.154 -0.973 -13.815 1.00 0.00 C ATOM 1827 OE1 GLU A 114 -6.263 -0.235 -13.343 1.00 0.00 O ATOM 1828 OE2 GLU A 114 -6.967 -1.738 -14.783 1.00 0.00 O ATOM 0 H GLU A 114 -8.817 -1.520 -9.251 1.00 0.00 H new ATOM 0 HA GLU A 114 -10.342 -0.259 -11.328 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.805 -0.635 -11.191 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -8.124 -2.311 -11.595 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -9.189 -1.624 -13.711 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -8.954 0.063 -13.302 1.00 0.00 H new ATOM 1835 N TYR A 115 -10.833 -3.397 -10.645 1.00 0.00 N ATOM 1836 CA TYR A 115 -11.649 -4.550 -10.973 1.00 0.00 C ATOM 1837 C TYR A 115 -13.104 -4.322 -10.561 1.00 0.00 C ATOM 1838 O TYR A 115 -13.883 -3.756 -11.327 1.00 0.00 O ATOM 1839 CB TYR A 115 -11.078 -5.809 -10.316 1.00 0.00 C ATOM 1840 CG TYR A 115 -9.755 -6.239 -10.907 1.00 0.00 C ATOM 1841 CD1 TYR A 115 -9.610 -7.485 -11.507 1.00 0.00 C ATOM 1842 CD2 TYR A 115 -8.653 -5.394 -10.874 1.00 0.00 C ATOM 1843 CE1 TYR A 115 -8.403 -7.874 -12.056 1.00 0.00 C ATOM 1844 CE2 TYR A 115 -7.444 -5.778 -11.419 1.00 0.00 C ATOM 1845 CZ TYR A 115 -7.323 -7.019 -12.009 1.00 0.00 C ATOM 1846 OH TYR A 115 -6.122 -7.400 -12.556 1.00 0.00 O ATOM 0 H TYR A 115 -10.341 -3.461 -9.754 1.00 0.00 H new ATOM 0 HA TYR A 115 -11.631 -4.692 -12.054 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -10.951 -5.629 -9.249 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -11.796 -6.622 -10.418 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -10.453 -8.159 -11.545 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -8.743 -4.421 -10.415 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -8.306 -8.844 -12.520 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -6.596 -5.110 -11.384 1.00 0.00 H new ATOM 0 HH TYR A 115 -5.545 -6.615 -12.657 1.00 0.00 H new ATOM 1856 N GLU A 116 -13.467 -4.756 -9.351 1.00 0.00 N ATOM 1857 CA GLU A 116 -14.831 -4.590 -8.839 1.00 0.00 C ATOM 1858 C GLU A 116 -15.102 -5.545 -7.681 1.00 0.00 C ATOM 1859 O GLU A 116 -15.948 -5.276 -6.828 1.00 0.00 O ATOM 1860 CB GLU A 116 -15.868 -4.833 -9.943 1.00 0.00 C ATOM 1861 CG GLU A 116 -15.544 -6.021 -10.833 1.00 0.00 C ATOM 1862 CD GLU A 116 -16.787 -6.714 -11.354 1.00 0.00 C ATOM 1863 OE1 GLU A 116 -16.758 -7.955 -11.499 1.00 0.00 O ATOM 1864 OE2 GLU A 116 -17.791 -6.018 -11.617 1.00 0.00 O ATOM 0 H GLU A 116 -12.833 -5.227 -8.705 1.00 0.00 H new ATOM 0 HA GLU A 116 -14.919 -3.563 -8.485 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -16.844 -4.989 -9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -15.945 -3.938 -10.560 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -14.939 -5.685 -11.676 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -14.941 -6.736 -10.273 1.00 0.00 H new ATOM 1871 N SER A 117 -14.389 -6.665 -7.663 1.00 0.00 N ATOM 1872 CA SER A 117 -14.561 -7.666 -6.615 1.00 0.00 C ATOM 1873 C SER A 117 -13.597 -7.435 -5.457 1.00 0.00 C ATOM 1874 O SER A 117 -13.919 -6.713 -4.514 1.00 0.00 O ATOM 1875 CB SER A 117 -14.385 -9.073 -7.190 1.00 0.00 C ATOM 1876 OG SER A 117 -15.576 -9.524 -7.814 1.00 0.00 O ATOM 0 H SER A 117 -13.686 -6.904 -8.362 1.00 0.00 H new ATOM 0 HA SER A 117 -15.574 -7.570 -6.224 1.00 0.00 H new ATOM 0 HB2 SER A 117 -13.569 -9.074 -7.913 1.00 0.00 H new ATOM 0 HB3 SER A 117 -14.105 -9.762 -6.393 1.00 0.00 H new ATOM 0 HG SER A 117 -15.436 -10.425 -8.174 1.00 0.00 H new ATOM 1882 N ASN A 118 -12.420 -8.053 -5.527 1.00 0.00 N ATOM 1883 CA ASN A 118 -11.415 -7.922 -4.475 1.00 0.00 C ATOM 1884 C ASN A 118 -12.070 -7.960 -3.096 1.00 0.00 C ATOM 1885 O ASN A 118 -11.618 -7.291 -2.168 1.00 0.00 O ATOM 1886 CB ASN A 118 -10.640 -6.613 -4.646 1.00 0.00 C ATOM 1887 CG ASN A 118 -11.520 -5.391 -4.469 1.00 0.00 C ATOM 1888 OD1 ASN A 118 -12.206 -5.247 -3.457 1.00 0.00 O ATOM 1889 ND2 ASN A 118 -11.507 -4.502 -5.455 1.00 0.00 N ATOM 0 H ASN A 118 -12.138 -8.651 -6.304 1.00 0.00 H new ATOM 0 HA ASN A 118 -10.723 -8.761 -4.556 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -9.826 -6.579 -3.922 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -10.186 -6.590 -5.637 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -12.080 -3.661 -5.391 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -10.924 -4.660 -6.277 1.00 0.00 H new ATOM 1896 N ALA A 119 -13.160 -8.719 -2.982 1.00 0.00 N ATOM 1897 CA ALA A 119 -13.895 -8.806 -1.723 1.00 0.00 C ATOM 1898 C ALA A 119 -13.866 -10.200 -1.093 1.00 0.00 C ATOM 1899 O ALA A 119 -14.839 -10.610 -0.457 1.00 0.00 O ATOM 1900 CB ALA A 119 -15.331 -8.370 -1.949 1.00 0.00 C ATOM 0 H ALA A 119 -13.550 -9.278 -3.741 1.00 0.00 H new ATOM 0 HA ALA A 119 -13.396 -8.142 -1.018 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -15.883 -8.434 -1.011 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -15.346 -7.342 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -15.797 -9.021 -2.689 1.00 0.00 H new ATOM 1906 N THR A 120 -12.759 -10.926 -1.241 1.00 0.00 N ATOM 1907 CA THR A 120 -12.659 -12.255 -0.641 1.00 0.00 C ATOM 1908 C THR A 120 -11.208 -12.581 -0.300 1.00 0.00 C ATOM 1909 O THR A 120 -10.285 -12.123 -0.970 1.00 0.00 O ATOM 1910 CB THR A 120 -13.256 -13.330 -1.567 1.00 0.00 C ATOM 1911 OG1 THR A 120 -12.253 -14.200 -2.060 1.00 0.00 O ATOM 1912 CG2 THR A 120 -14.000 -12.767 -2.761 1.00 0.00 C ATOM 0 H THR A 120 -11.934 -10.625 -1.760 1.00 0.00 H new ATOM 0 HA THR A 120 -13.238 -12.252 0.282 1.00 0.00 H new ATOM 0 HB THR A 120 -13.967 -13.866 -0.939 1.00 0.00 H new ATOM 0 HG1 THR A 120 -12.662 -14.873 -2.644 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.391 -13.586 -3.365 1.00 0.00 H new ATOM 0 HG22 THR A 120 -14.825 -12.145 -2.415 1.00 0.00 H new ATOM 0 HG23 THR A 120 -13.319 -12.165 -3.363 1.00 0.00 H new ATOM 1920 N ASN A 121 -11.012 -13.375 0.748 1.00 0.00 N ATOM 1921 CA ASN A 121 -9.667 -13.757 1.177 1.00 0.00 C ATOM 1922 C ASN A 121 -8.994 -14.685 0.174 1.00 0.00 C ATOM 1923 O ASN A 121 -8.137 -15.492 0.536 1.00 0.00 O ATOM 1924 CB ASN A 121 -9.702 -14.415 2.561 1.00 0.00 C ATOM 1925 CG ASN A 121 -10.874 -15.359 2.734 1.00 0.00 C ATOM 1926 OD1 ASN A 121 -10.961 -16.360 1.866 1.00 0.00 O flip ATOM 1927 ND2 ASN A 121 -11.695 -15.192 3.637 1.00 0.00 N flip ATOM 0 H ASN A 121 -11.764 -13.766 1.316 1.00 0.00 H new ATOM 0 HA ASN A 121 -9.078 -12.842 1.235 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -8.774 -14.963 2.721 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -9.750 -13.640 3.326 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -11.591 -14.409 4.283 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -12.479 -15.836 3.739 1.00 0.00 H new ATOM 1934 N GLU A 122 -9.376 -14.560 -1.090 1.00 0.00 N ATOM 1935 CA GLU A 122 -8.805 -15.369 -2.148 1.00 0.00 C ATOM 1936 C GLU A 122 -9.255 -14.829 -3.493 1.00 0.00 C ATOM 1937 O GLU A 122 -9.358 -15.572 -4.470 1.00 0.00 O ATOM 1938 CB GLU A 122 -9.228 -16.832 -1.996 1.00 0.00 C ATOM 1939 CG GLU A 122 -8.232 -17.818 -2.582 1.00 0.00 C ATOM 1940 CD GLU A 122 -7.018 -18.016 -1.697 1.00 0.00 C ATOM 1941 OE1 GLU A 122 -6.164 -17.106 -1.645 1.00 0.00 O ATOM 1942 OE2 GLU A 122 -6.920 -19.083 -1.052 1.00 0.00 O ATOM 0 H GLU A 122 -10.086 -13.899 -1.405 1.00 0.00 H new ATOM 0 HA GLU A 122 -7.718 -15.322 -2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.366 -17.053 -0.938 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -10.194 -16.974 -2.480 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -8.725 -18.778 -2.736 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -7.909 -17.464 -3.561 1.00 0.00 H new ATOM 1949 N LEU A 123 -9.532 -13.525 -3.536 1.00 0.00 N ATOM 1950 CA LEU A 123 -9.979 -12.895 -4.756 1.00 0.00 C ATOM 1951 C LEU A 123 -9.196 -11.617 -4.982 1.00 0.00 C ATOM 1952 O LEU A 123 -8.646 -11.393 -6.058 1.00 0.00 O ATOM 1953 CB LEU A 123 -11.470 -12.613 -4.659 1.00 0.00 C ATOM 1954 CG LEU A 123 -12.132 -12.220 -5.963 1.00 0.00 C ATOM 1955 CD1 LEU A 123 -13.636 -12.208 -5.789 1.00 0.00 C ATOM 1956 CD2 LEU A 123 -11.620 -10.865 -6.405 1.00 0.00 C ATOM 0 H LEU A 123 -9.452 -12.896 -2.737 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.806 -13.557 -5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -11.968 -13.501 -4.269 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -11.627 -11.815 -3.934 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.885 -12.947 -6.737 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -14.109 -11.925 -6.729 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -13.976 -13.201 -5.496 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -13.907 -11.489 -5.016 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -12.098 -10.584 -7.344 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -11.853 -10.122 -5.643 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.540 -10.913 -6.547 1.00 0.00 H new ATOM 1968 N LEU A 124 -9.119 -10.791 -3.946 1.00 0.00 N ATOM 1969 CA LEU A 124 -8.362 -9.556 -4.028 1.00 0.00 C ATOM 1970 C LEU A 124 -6.935 -9.890 -4.442 1.00 0.00 C ATOM 1971 O LEU A 124 -6.361 -9.252 -5.323 1.00 0.00 O ATOM 1972 CB LEU A 124 -8.400 -8.828 -2.684 1.00 0.00 C ATOM 1973 CG LEU A 124 -7.069 -8.727 -1.936 1.00 0.00 C ATOM 1974 CD1 LEU A 124 -6.899 -7.337 -1.359 1.00 0.00 C ATOM 1975 CD2 LEU A 124 -6.995 -9.779 -0.843 1.00 0.00 C ATOM 0 H LEU A 124 -9.570 -10.955 -3.046 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.799 -8.890 -4.772 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -8.777 -7.819 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -9.118 -9.335 -2.039 1.00 0.00 H new ATOM 0 HG LEU A 124 -6.255 -8.910 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -5.948 -7.277 -0.829 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.912 -6.604 -2.166 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -7.714 -7.128 -0.666 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -6.042 -9.694 -0.320 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.811 -9.628 -0.137 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.078 -10.771 -1.287 1.00 0.00 H new ATOM 1987 N SER A 125 -6.385 -10.927 -3.808 1.00 0.00 N ATOM 1988 CA SER A 125 -5.036 -11.386 -4.119 1.00 0.00 C ATOM 1989 C SER A 125 -4.859 -11.513 -5.628 1.00 0.00 C ATOM 1990 O SER A 125 -3.762 -11.330 -6.161 1.00 0.00 O ATOM 1991 CB SER A 125 -4.777 -12.743 -3.457 1.00 0.00 C ATOM 1992 OG SER A 125 -5.665 -13.729 -3.954 1.00 0.00 O ATOM 0 H SER A 125 -6.854 -11.462 -3.078 1.00 0.00 H new ATOM 0 HA SER A 125 -4.323 -10.657 -3.735 1.00 0.00 H new ATOM 0 HB2 SER A 125 -3.747 -13.050 -3.640 1.00 0.00 H new ATOM 0 HB3 SER A 125 -4.895 -12.653 -2.377 1.00 0.00 H new ATOM 0 HG SER A 125 -5.479 -14.587 -3.518 1.00 0.00 H new ATOM 1998 N SER A 126 -5.956 -11.828 -6.309 1.00 0.00 N ATOM 1999 CA SER A 126 -5.947 -11.984 -7.754 1.00 0.00 C ATOM 2000 C SER A 126 -5.536 -10.699 -8.438 1.00 0.00 C ATOM 2001 O SER A 126 -4.539 -10.654 -9.159 1.00 0.00 O ATOM 2002 CB SER A 126 -7.333 -12.396 -8.238 1.00 0.00 C ATOM 2003 OG SER A 126 -7.253 -13.306 -9.321 1.00 0.00 O ATOM 0 H SER A 126 -6.867 -11.981 -5.877 1.00 0.00 H new ATOM 0 HA SER A 126 -5.222 -12.758 -8.007 1.00 0.00 H new ATOM 0 HB2 SER A 126 -7.886 -12.853 -7.417 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.891 -11.511 -8.545 1.00 0.00 H new ATOM 0 HG SER A 126 -8.157 -13.553 -9.608 1.00 0.00 H new ATOM 2009 N HIS A 127 -6.314 -9.655 -8.211 1.00 0.00 N ATOM 2010 CA HIS A 127 -6.028 -8.368 -8.810 1.00 0.00 C ATOM 2011 C HIS A 127 -4.640 -7.911 -8.402 1.00 0.00 C ATOM 2012 O HIS A 127 -3.914 -7.327 -9.193 1.00 0.00 O ATOM 2013 CB HIS A 127 -7.074 -7.331 -8.403 1.00 0.00 C ATOM 2014 CG HIS A 127 -8.482 -7.842 -8.464 1.00 0.00 C ATOM 2015 ND1 HIS A 127 -8.988 -8.982 -8.990 1.00 0.00 N flip ATOM 2016 CD2 HIS A 127 -9.556 -7.150 -7.946 1.00 0.00 C flip ATOM 2017 CE1 HIS A 127 -10.346 -8.957 -8.784 1.00 0.00 C flip ATOM 2018 NE2 HIS A 127 -10.664 -7.843 -8.151 1.00 0.00 N flip ATOM 0 H HIS A 127 -7.144 -9.675 -7.619 1.00 0.00 H new ATOM 0 HA HIS A 127 -6.066 -8.472 -9.894 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -6.863 -6.993 -7.388 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -6.984 -6.461 -9.054 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -9.501 -6.192 -7.450 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -11.041 -9.725 -9.090 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -11.604 -7.564 -7.868 1.00 0.00 H new ATOM 2027 N VAL A 128 -4.260 -8.199 -7.165 1.00 0.00 N ATOM 2028 CA VAL A 128 -2.940 -7.820 -6.684 1.00 0.00 C ATOM 2029 C VAL A 128 -1.865 -8.337 -7.633 1.00 0.00 C ATOM 2030 O VAL A 128 -0.934 -7.613 -7.978 1.00 0.00 O ATOM 2031 CB VAL A 128 -2.670 -8.353 -5.266 1.00 0.00 C ATOM 2032 CG1 VAL A 128 -1.322 -7.848 -4.753 1.00 0.00 C ATOM 2033 CG2 VAL A 128 -3.795 -7.948 -4.327 1.00 0.00 C ATOM 0 H VAL A 128 -4.840 -8.688 -6.483 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.910 -6.731 -6.648 1.00 0.00 H new ATOM 0 HB VAL A 128 -2.632 -9.442 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.147 -8.234 -3.749 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -0.528 -8.191 -5.417 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -1.328 -6.758 -4.727 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -3.591 -8.332 -3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.865 -6.861 -4.291 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.737 -8.361 -4.689 1.00 0.00 H new ATOM 2043 N GLY A 129 -2.008 -9.588 -8.069 1.00 0.00 N ATOM 2044 CA GLY A 129 -1.036 -10.150 -8.988 1.00 0.00 C ATOM 2045 C GLY A 129 -1.233 -9.646 -10.407 1.00 0.00 C ATOM 2046 O GLY A 129 -0.270 -9.277 -11.080 1.00 0.00 O ATOM 0 H GLY A 129 -2.769 -10.213 -7.805 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -0.031 -9.898 -8.651 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.113 -11.237 -8.976 1.00 0.00 H new ATOM 2050 N GLN A 130 -2.484 -9.625 -10.857 1.00 0.00 N ATOM 2051 CA GLN A 130 -2.808 -9.152 -12.203 1.00 0.00 C ATOM 2052 C GLN A 130 -2.492 -7.664 -12.341 1.00 0.00 C ATOM 2053 O GLN A 130 -2.262 -7.165 -13.444 1.00 0.00 O ATOM 2054 CB GLN A 130 -4.285 -9.406 -12.509 1.00 0.00 C ATOM 2055 CG GLN A 130 -4.625 -10.876 -12.692 1.00 0.00 C ATOM 2056 CD GLN A 130 -4.645 -11.294 -14.148 1.00 0.00 C ATOM 2057 OE1 GLN A 130 -4.929 -10.487 -15.034 1.00 0.00 O ATOM 2058 NE2 GLN A 130 -4.344 -12.562 -14.405 1.00 0.00 N ATOM 0 H GLN A 130 -3.291 -9.929 -10.312 1.00 0.00 H new ATOM 0 HA GLN A 130 -2.197 -9.703 -12.918 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -4.890 -9.000 -11.698 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -4.558 -8.863 -13.414 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -3.897 -11.483 -12.154 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -5.599 -11.078 -12.247 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -4.115 -13.197 -13.640 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -4.342 -12.901 -15.367 1.00 0.00 H new ATOM 2067 N ILE A 131 -2.459 -6.972 -11.208 1.00 0.00 N ATOM 2068 CA ILE A 131 -2.144 -5.549 -11.171 1.00 0.00 C ATOM 2069 C ILE A 131 -0.638 -5.381 -11.007 1.00 0.00 C ATOM 2070 O ILE A 131 -0.050 -4.386 -11.430 1.00 0.00 O ATOM 2071 CB ILE A 131 -2.896 -4.853 -10.019 1.00 0.00 C ATOM 2072 CG1 ILE A 131 -4.399 -4.982 -10.236 1.00 0.00 C ATOM 2073 CG2 ILE A 131 -2.525 -3.379 -9.898 1.00 0.00 C ATOM 2074 CD1 ILE A 131 -5.187 -4.783 -8.973 1.00 0.00 C ATOM 0 H ILE A 131 -2.649 -7.380 -10.293 1.00 0.00 H new ATOM 0 HA ILE A 131 -2.463 -5.083 -12.103 1.00 0.00 H new ATOM 0 HB ILE A 131 -2.604 -5.346 -9.092 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -4.719 -4.250 -10.978 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -4.619 -5.968 -10.645 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.079 -2.931 -9.073 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -1.456 -3.287 -9.709 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.775 -2.864 -10.825 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -6.251 -4.886 -9.188 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -4.891 -5.531 -8.238 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -4.992 -3.787 -8.576 1.00 0.00 H new ATOM 2086 N LEU A 132 -0.025 -6.399 -10.402 1.00 0.00 N ATOM 2087 CA LEU A 132 1.413 -6.432 -10.178 1.00 0.00 C ATOM 2088 C LEU A 132 2.162 -6.454 -11.508 1.00 0.00 C ATOM 2089 O LEU A 132 3.111 -5.701 -11.714 1.00 0.00 O ATOM 2090 CB LEU A 132 1.772 -7.683 -9.369 1.00 0.00 C ATOM 2091 CG LEU A 132 2.489 -7.430 -8.045 1.00 0.00 C ATOM 2092 CD1 LEU A 132 1.503 -6.961 -6.987 1.00 0.00 C ATOM 2093 CD2 LEU A 132 3.205 -8.691 -7.587 1.00 0.00 C ATOM 0 H LEU A 132 -0.516 -7.223 -10.055 1.00 0.00 H new ATOM 0 HA LEU A 132 1.704 -5.537 -9.628 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.856 -8.237 -9.165 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.402 -8.324 -9.986 1.00 0.00 H new ATOM 0 HG LEU A 132 3.230 -6.644 -8.194 1.00 0.00 H new ATOM 0 HD11 LEU A 132 2.031 -6.785 -6.050 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.030 -6.036 -7.316 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.740 -7.725 -6.836 1.00 0.00 H new ATOM 0 HD21 LEU A 132 3.713 -8.498 -6.642 1.00 0.00 H new ATOM 0 HD22 LEU A 132 2.479 -9.493 -7.452 1.00 0.00 H new ATOM 0 HD23 LEU A 132 3.937 -8.987 -8.338 1.00 0.00 H new ATOM 2105 N ASP A 133 1.726 -7.334 -12.405 1.00 0.00 N ATOM 2106 CA ASP A 133 2.352 -7.465 -13.717 1.00 0.00 C ATOM 2107 C ASP A 133 2.131 -6.212 -14.551 1.00 0.00 C ATOM 2108 O ASP A 133 3.053 -5.708 -15.195 1.00 0.00 O ATOM 2109 CB ASP A 133 1.794 -8.686 -14.451 1.00 0.00 C ATOM 2110 CG ASP A 133 2.532 -9.962 -14.097 1.00 0.00 C ATOM 2111 OD1 ASP A 133 3.651 -10.165 -14.614 1.00 0.00 O ATOM 2112 OD2 ASP A 133 1.991 -10.760 -13.302 1.00 0.00 O ATOM 0 H ASP A 133 0.942 -7.967 -12.247 1.00 0.00 H new ATOM 0 HA ASP A 133 3.424 -7.597 -13.570 1.00 0.00 H new ATOM 0 HB2 ASP A 133 0.738 -8.801 -14.208 1.00 0.00 H new ATOM 0 HB3 ASP A 133 1.857 -8.520 -15.526 1.00 0.00 H new ATOM 2117 N SER A 134 0.904 -5.709 -14.531 1.00 0.00 N ATOM 2118 CA SER A 134 0.555 -4.508 -15.279 1.00 0.00 C ATOM 2119 C SER A 134 1.145 -3.265 -14.617 1.00 0.00 C ATOM 2120 O SER A 134 1.255 -2.210 -15.242 1.00 0.00 O ATOM 2121 CB SER A 134 -0.963 -4.370 -15.386 1.00 0.00 C ATOM 2122 OG SER A 134 -1.450 -4.984 -16.569 1.00 0.00 O ATOM 0 H SER A 134 0.131 -6.115 -14.003 1.00 0.00 H new ATOM 0 HA SER A 134 0.975 -4.600 -16.281 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.435 -4.826 -14.515 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.237 -3.315 -15.381 1.00 0.00 H new ATOM 0 HG SER A 134 -2.424 -4.883 -16.613 1.00 0.00 H new ATOM 2128 N PHE A 135 1.523 -3.398 -13.348 1.00 0.00 N ATOM 2129 CA PHE A 135 2.102 -2.291 -12.595 1.00 0.00 C ATOM 2130 C PHE A 135 3.247 -1.640 -13.366 1.00 0.00 C ATOM 2131 O PHE A 135 3.151 -0.488 -13.786 1.00 0.00 O ATOM 2132 CB PHE A 135 2.600 -2.786 -11.238 1.00 0.00 C ATOM 2133 CG PHE A 135 3.274 -1.727 -10.416 1.00 0.00 C ATOM 2134 CD1 PHE A 135 2.730 -0.458 -10.319 1.00 0.00 C ATOM 2135 CD2 PHE A 135 4.454 -2.001 -9.744 1.00 0.00 C ATOM 2136 CE1 PHE A 135 3.349 0.519 -9.566 1.00 0.00 C ATOM 2137 CE2 PHE A 135 5.078 -1.028 -8.990 1.00 0.00 C ATOM 2138 CZ PHE A 135 4.524 0.234 -8.900 1.00 0.00 C ATOM 0 H PHE A 135 1.438 -4.266 -12.819 1.00 0.00 H new ATOM 0 HA PHE A 135 1.326 -1.541 -12.443 1.00 0.00 H new ATOM 0 HB2 PHE A 135 1.756 -3.186 -10.676 1.00 0.00 H new ATOM 0 HB3 PHE A 135 3.297 -3.609 -11.396 1.00 0.00 H new ATOM 0 HD1 PHE A 135 1.811 -0.230 -10.838 1.00 0.00 H new ATOM 0 HD2 PHE A 135 4.890 -2.987 -9.811 1.00 0.00 H new ATOM 0 HE1 PHE A 135 2.915 1.505 -9.498 1.00 0.00 H new ATOM 0 HE2 PHE A 135 5.998 -1.253 -8.471 1.00 0.00 H new ATOM 0 HZ PHE A 135 5.009 0.997 -8.309 1.00 0.00 H new ATOM 2148 N HIS A 136 4.332 -2.387 -13.546 1.00 0.00 N ATOM 2149 CA HIS A 136 5.501 -1.885 -14.263 1.00 0.00 C ATOM 2150 C HIS A 136 5.106 -1.290 -15.610 1.00 0.00 C ATOM 2151 O HIS A 136 5.514 -0.181 -15.954 1.00 0.00 O ATOM 2152 CB HIS A 136 6.522 -3.007 -14.464 1.00 0.00 C ATOM 2153 CG HIS A 136 7.944 -2.547 -14.382 1.00 0.00 C ATOM 2154 ND1 HIS A 136 8.464 -1.306 -14.241 1.00 0.00 N flip ATOM 2155 CD2 HIS A 136 9.019 -3.407 -14.445 1.00 0.00 C flip ATOM 2156 CE1 HIS A 136 9.831 -1.439 -14.221 1.00 0.00 C flip ATOM 2157 NE2 HIS A 136 10.141 -2.716 -14.345 1.00 0.00 N flip ATOM 0 H HIS A 136 4.427 -3.344 -13.205 1.00 0.00 H new ATOM 0 HA HIS A 136 5.952 -1.096 -13.661 1.00 0.00 H new ATOM 0 HB2 HIS A 136 6.355 -3.778 -13.712 1.00 0.00 H new ATOM 0 HB3 HIS A 136 6.354 -3.469 -15.437 1.00 0.00 H new ATOM 0 HD2 HIS A 136 8.955 -4.479 -14.558 1.00 0.00 H new ATOM 0 HE1 HIS A 136 10.538 -0.629 -14.120 1.00 0.00 H new ATOM 0 HE2 HIS A 136 11.085 -3.103 -14.361 1.00 0.00 H new ATOM 2166 N GLU A 137 4.300 -2.031 -16.368 1.00 0.00 N ATOM 2167 CA GLU A 137 3.844 -1.566 -17.673 1.00 0.00 C ATOM 2168 C GLU A 137 3.299 -0.147 -17.570 1.00 0.00 C ATOM 2169 O GLU A 137 3.405 0.643 -18.509 1.00 0.00 O ATOM 2170 CB GLU A 137 2.771 -2.503 -18.227 1.00 0.00 C ATOM 2171 CG GLU A 137 2.909 -2.778 -19.716 1.00 0.00 C ATOM 2172 CD GLU A 137 2.246 -1.712 -20.568 1.00 0.00 C ATOM 2173 OE1 GLU A 137 1.055 -1.420 -20.334 1.00 0.00 O ATOM 2174 OE2 GLU A 137 2.920 -1.169 -21.469 1.00 0.00 O ATOM 0 H GLU A 137 3.951 -2.952 -16.101 1.00 0.00 H new ATOM 0 HA GLU A 137 4.694 -1.565 -18.355 1.00 0.00 H new ATOM 0 HB2 GLU A 137 2.813 -3.449 -17.687 1.00 0.00 H new ATOM 0 HB3 GLU A 137 1.789 -2.070 -18.036 1.00 0.00 H new ATOM 0 HG2 GLU A 137 3.966 -2.839 -19.974 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.468 -3.748 -19.945 1.00 0.00 H new ATOM 2181 N GLU A 138 2.730 0.176 -16.412 1.00 0.00 N ATOM 2182 CA GLU A 138 2.185 1.503 -16.175 1.00 0.00 C ATOM 2183 C GLU A 138 3.307 2.471 -15.821 1.00 0.00 C ATOM 2184 O GLU A 138 3.272 3.642 -16.197 1.00 0.00 O ATOM 2185 CB GLU A 138 1.146 1.466 -15.051 1.00 0.00 C ATOM 2186 CG GLU A 138 -0.288 1.399 -15.553 1.00 0.00 C ATOM 2187 CD GLU A 138 -1.296 1.793 -14.493 1.00 0.00 C ATOM 2188 OE1 GLU A 138 -1.356 1.112 -13.446 1.00 0.00 O ATOM 2189 OE2 GLU A 138 -2.026 2.783 -14.707 1.00 0.00 O ATOM 0 H GLU A 138 2.636 -0.466 -15.625 1.00 0.00 H new ATOM 0 HA GLU A 138 1.694 1.845 -17.086 1.00 0.00 H new ATOM 0 HB2 GLU A 138 1.341 0.602 -14.415 1.00 0.00 H new ATOM 0 HB3 GLU A 138 1.264 2.353 -14.429 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -0.398 2.056 -16.416 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -0.502 0.386 -15.894 1.00 0.00 H new ATOM 2196 N LEU A 139 4.316 1.967 -15.112 1.00 0.00 N ATOM 2197 CA LEU A 139 5.459 2.788 -14.730 1.00 0.00 C ATOM 2198 C LEU A 139 6.261 3.160 -15.966 1.00 0.00 C ATOM 2199 O LEU A 139 6.819 4.255 -16.057 1.00 0.00 O ATOM 2200 CB LEU A 139 6.354 2.044 -13.740 1.00 0.00 C ATOM 2201 CG LEU A 139 5.619 1.321 -12.614 1.00 0.00 C ATOM 2202 CD1 LEU A 139 6.598 0.519 -11.777 1.00 0.00 C ATOM 2203 CD2 LEU A 139 4.856 2.315 -11.750 1.00 0.00 C ATOM 0 H LEU A 139 4.364 0.999 -14.793 1.00 0.00 H new ATOM 0 HA LEU A 139 5.088 3.693 -14.249 1.00 0.00 H new ATOM 0 HB2 LEU A 139 6.949 1.315 -14.290 1.00 0.00 H new ATOM 0 HB3 LEU A 139 7.051 2.757 -13.298 1.00 0.00 H new ATOM 0 HG LEU A 139 4.898 0.632 -13.054 1.00 0.00 H new ATOM 0 HD11 LEU A 139 6.061 0.009 -10.978 1.00 0.00 H new ATOM 0 HD12 LEU A 139 7.097 -0.218 -12.407 1.00 0.00 H new ATOM 0 HD13 LEU A 139 7.341 1.189 -11.344 1.00 0.00 H new ATOM 0 HD21 LEU A 139 4.338 1.782 -10.953 1.00 0.00 H new ATOM 0 HD22 LEU A 139 5.554 3.030 -11.315 1.00 0.00 H new ATOM 0 HD23 LEU A 139 4.128 2.846 -12.363 1.00 0.00 H new ATOM 2215 N VAL A 140 6.292 2.245 -16.928 1.00 0.00 N ATOM 2216 CA VAL A 140 6.995 2.473 -18.177 1.00 0.00 C ATOM 2217 C VAL A 140 6.200 3.444 -19.020 1.00 0.00 C ATOM 2218 O VAL A 140 6.729 4.418 -19.555 1.00 0.00 O ATOM 2219 CB VAL A 140 7.180 1.164 -18.953 1.00 0.00 C ATOM 2220 CG1 VAL A 140 7.810 1.421 -20.312 1.00 0.00 C ATOM 2221 CG2 VAL A 140 8.004 0.178 -18.139 1.00 0.00 C ATOM 0 H VAL A 140 5.835 1.335 -16.863 1.00 0.00 H new ATOM 0 HA VAL A 140 7.980 2.881 -17.952 1.00 0.00 H new ATOM 0 HB VAL A 140 6.198 0.724 -19.126 1.00 0.00 H new ATOM 0 HG11 VAL A 140 7.930 0.476 -20.842 1.00 0.00 H new ATOM 0 HG12 VAL A 140 7.167 2.083 -20.892 1.00 0.00 H new ATOM 0 HG13 VAL A 140 8.785 1.889 -20.178 1.00 0.00 H new ATOM 0 HG21 VAL A 140 8.127 -0.747 -18.703 1.00 0.00 H new ATOM 0 HG22 VAL A 140 8.983 0.608 -17.930 1.00 0.00 H new ATOM 0 HG23 VAL A 140 7.493 -0.035 -17.200 1.00 0.00 H new ATOM 2231 N GLU A 141 4.908 3.169 -19.106 1.00 0.00 N ATOM 2232 CA GLU A 141 3.993 4.009 -19.852 1.00 0.00 C ATOM 2233 C GLU A 141 3.975 5.409 -19.250 1.00 0.00 C ATOM 2234 O GLU A 141 3.867 6.407 -19.961 1.00 0.00 O ATOM 2235 CB GLU A 141 2.593 3.397 -19.813 1.00 0.00 C ATOM 2236 CG GLU A 141 1.708 3.802 -20.980 1.00 0.00 C ATOM 2237 CD GLU A 141 1.702 5.299 -21.222 1.00 0.00 C ATOM 2238 OE1 GLU A 141 0.962 6.012 -20.513 1.00 0.00 O ATOM 2239 OE2 GLU A 141 2.439 5.758 -22.121 1.00 0.00 O ATOM 0 H GLU A 141 4.469 2.362 -18.663 1.00 0.00 H new ATOM 0 HA GLU A 141 4.321 4.077 -20.889 1.00 0.00 H new ATOM 0 HB2 GLU A 141 2.683 2.311 -19.799 1.00 0.00 H new ATOM 0 HB3 GLU A 141 2.106 3.689 -18.883 1.00 0.00 H new ATOM 0 HG2 GLU A 141 2.049 3.294 -21.882 1.00 0.00 H new ATOM 0 HG3 GLU A 141 0.689 3.465 -20.791 1.00 0.00 H new ATOM 2246 N TYR A 142 4.098 5.460 -17.928 1.00 0.00 N ATOM 2247 CA TYR A 142 4.117 6.720 -17.201 1.00 0.00 C ATOM 2248 C TYR A 142 5.383 7.504 -17.539 1.00 0.00 C ATOM 2249 O TYR A 142 5.399 8.734 -17.490 1.00 0.00 O ATOM 2250 CB TYR A 142 4.031 6.443 -15.690 1.00 0.00 C ATOM 2251 CG TYR A 142 4.869 7.366 -14.829 1.00 0.00 C ATOM 2252 CD1 TYR A 142 4.288 8.417 -14.135 1.00 0.00 C ATOM 2253 CD2 TYR A 142 6.239 7.177 -14.714 1.00 0.00 C ATOM 2254 CE1 TYR A 142 5.052 9.257 -13.346 1.00 0.00 C ATOM 2255 CE2 TYR A 142 7.010 8.013 -13.930 1.00 0.00 C ATOM 2256 CZ TYR A 142 6.413 9.052 -13.247 1.00 0.00 C ATOM 2257 OH TYR A 142 7.175 9.886 -12.463 1.00 0.00 O ATOM 0 H TYR A 142 4.187 4.634 -17.336 1.00 0.00 H new ATOM 0 HA TYR A 142 3.258 7.322 -17.496 1.00 0.00 H new ATOM 0 HB2 TYR A 142 2.990 6.523 -15.378 1.00 0.00 H new ATOM 0 HB3 TYR A 142 4.341 5.415 -15.505 1.00 0.00 H new ATOM 0 HD1 TYR A 142 3.223 8.582 -14.212 1.00 0.00 H new ATOM 0 HD2 TYR A 142 6.710 6.363 -15.246 1.00 0.00 H new ATOM 0 HE1 TYR A 142 4.586 10.070 -12.810 1.00 0.00 H new ATOM 0 HE2 TYR A 142 8.075 7.854 -13.852 1.00 0.00 H new ATOM 0 HH TYR A 142 8.113 9.604 -12.501 1.00 0.00 H new ATOM 2267 N ARG A 143 6.444 6.777 -17.881 1.00 0.00 N ATOM 2268 CA ARG A 143 7.721 7.389 -18.225 1.00 0.00 C ATOM 2269 C ARG A 143 7.709 7.954 -19.645 1.00 0.00 C ATOM 2270 O ARG A 143 8.688 8.559 -20.086 1.00 0.00 O ATOM 2271 CB ARG A 143 8.846 6.361 -18.083 1.00 0.00 C ATOM 2272 CG ARG A 143 9.402 6.262 -16.672 1.00 0.00 C ATOM 2273 CD ARG A 143 10.903 6.029 -16.679 1.00 0.00 C ATOM 2274 NE ARG A 143 11.305 5.022 -15.698 1.00 0.00 N ATOM 2275 CZ ARG A 143 10.944 3.743 -15.759 1.00 0.00 C ATOM 2276 NH1 ARG A 143 10.179 3.308 -16.752 1.00 0.00 N ATOM 2277 NH2 ARG A 143 11.350 2.895 -14.824 1.00 0.00 N ATOM 0 H ARG A 143 6.442 5.758 -17.927 1.00 0.00 H new ATOM 0 HA ARG A 143 7.892 8.217 -17.537 1.00 0.00 H new ATOM 0 HB2 ARG A 143 8.474 5.383 -18.388 1.00 0.00 H new ATOM 0 HB3 ARG A 143 9.654 6.622 -18.766 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.178 7.179 -16.127 1.00 0.00 H new ATOM 0 HG3 ARG A 143 8.909 5.447 -16.142 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.216 5.712 -17.674 1.00 0.00 H new ATOM 0 HD3 ARG A 143 11.417 6.967 -16.467 1.00 0.00 H new ATOM 0 HE ARG A 143 11.897 5.317 -14.922 1.00 0.00 H new ATOM 0 HH11 ARG A 143 9.864 3.955 -17.475 1.00 0.00 H new ATOM 0 HH12 ARG A 143 9.906 2.326 -16.793 1.00 0.00 H new ATOM 0 HH21 ARG A 143 11.939 3.223 -14.059 1.00 0.00 H new ATOM 0 HH22 ARG A 143 11.074 1.914 -14.870 1.00 0.00 H new ATOM 2291 N ASN A 144 6.606 7.754 -20.361 1.00 0.00 N ATOM 2292 CA ASN A 144 6.487 8.250 -21.729 1.00 0.00 C ATOM 2293 C ASN A 144 5.589 9.482 -21.790 1.00 0.00 C ATOM 2294 O ASN A 144 5.845 10.409 -22.558 1.00 0.00 O ATOM 2295 CB ASN A 144 5.931 7.156 -22.643 1.00 0.00 C ATOM 2296 CG ASN A 144 7.027 6.368 -23.335 1.00 0.00 C ATOM 2297 OD1 ASN A 144 6.994 6.170 -24.550 1.00 0.00 O ATOM 2298 ND2 ASN A 144 8.008 5.914 -22.562 1.00 0.00 N ATOM 0 H ASN A 144 5.785 7.254 -20.019 1.00 0.00 H new ATOM 0 HA ASN A 144 7.482 8.533 -22.072 1.00 0.00 H new ATOM 0 HB2 ASN A 144 5.313 6.476 -22.057 1.00 0.00 H new ATOM 0 HB3 ASN A 144 5.283 7.608 -23.394 1.00 0.00 H new ATOM 0 HD21 ASN A 144 8.773 5.378 -22.971 1.00 0.00 H new ATOM 0 HD22 ASN A 144 7.996 6.101 -21.559 1.00 0.00 H new ATOM 2305 N GLN A 145 4.539 9.484 -20.976 1.00 0.00 N ATOM 2306 CA GLN A 145 3.605 10.604 -20.940 1.00 0.00 C ATOM 2307 C GLN A 145 4.201 11.789 -20.191 1.00 0.00 C ATOM 2308 O GLN A 145 4.589 12.789 -20.796 1.00 0.00 O ATOM 2309 CB GLN A 145 2.290 10.176 -20.285 1.00 0.00 C ATOM 2310 CG GLN A 145 1.553 9.090 -21.053 1.00 0.00 C ATOM 2311 CD GLN A 145 0.051 9.290 -21.049 1.00 0.00 C ATOM 2312 OE1 GLN A 145 -0.573 9.415 -22.103 1.00 0.00 O ATOM 2313 NE2 GLN A 145 -0.540 9.322 -19.860 1.00 0.00 N ATOM 0 H GLN A 145 4.313 8.725 -20.334 1.00 0.00 H new ATOM 0 HA GLN A 145 3.408 10.913 -21.966 1.00 0.00 H new ATOM 0 HB2 GLN A 145 2.496 9.820 -19.276 1.00 0.00 H new ATOM 0 HB3 GLN A 145 1.641 11.046 -20.190 1.00 0.00 H new ATOM 0 HG2 GLN A 145 1.911 9.072 -22.083 1.00 0.00 H new ATOM 0 HG3 GLN A 145 1.788 8.119 -20.617 1.00 0.00 H new ATOM 0 HE21 GLN A 145 0.015 9.214 -19.011 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -1.549 9.454 -19.796 1.00 0.00 H new ATOM 2322 N THR A 146 4.267 11.670 -18.872 1.00 0.00 N ATOM 2323 CA THR A 146 4.815 12.731 -18.033 1.00 0.00 C ATOM 2324 C THR A 146 6.234 12.392 -17.586 1.00 0.00 C ATOM 2325 O THR A 146 6.562 11.229 -17.358 1.00 0.00 O ATOM 2326 CB THR A 146 3.923 12.955 -16.812 1.00 0.00 C ATOM 2327 OG1 THR A 146 3.265 11.756 -16.443 1.00 0.00 O ATOM 2328 CG2 THR A 146 2.861 14.012 -17.033 1.00 0.00 C ATOM 0 H THR A 146 3.948 10.849 -18.358 1.00 0.00 H new ATOM 0 HA THR A 146 4.848 13.647 -18.623 1.00 0.00 H new ATOM 0 HB THR A 146 4.594 13.295 -16.023 1.00 0.00 H new ATOM 0 HG1 THR A 146 2.701 11.921 -15.659 1.00 0.00 H new ATOM 0 HG21 THR A 146 2.263 14.122 -16.128 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.338 14.963 -17.270 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.217 13.713 -17.860 1.00 0.00 H new ATOM 2336 N LEU A 147 7.070 13.418 -17.463 1.00 0.00 N ATOM 2337 CA LEU A 147 8.453 13.229 -17.043 1.00 0.00 C ATOM 2338 C LEU A 147 9.123 14.572 -16.757 1.00 0.00 C ATOM 2339 O LEU A 147 10.230 14.839 -17.225 1.00 0.00 O ATOM 2340 CB LEU A 147 9.236 12.471 -18.119 1.00 0.00 C ATOM 2341 CG LEU A 147 10.216 11.424 -17.589 1.00 0.00 C ATOM 2342 CD1 LEU A 147 9.588 10.040 -17.616 1.00 0.00 C ATOM 2343 CD2 LEU A 147 11.506 11.440 -18.397 1.00 0.00 C ATOM 0 H LEU A 147 6.814 14.388 -17.648 1.00 0.00 H new ATOM 0 HA LEU A 147 8.452 12.642 -16.125 1.00 0.00 H new ATOM 0 HB2 LEU A 147 8.526 11.979 -18.784 1.00 0.00 H new ATOM 0 HB3 LEU A 147 9.789 13.192 -18.721 1.00 0.00 H new ATOM 0 HG LEU A 147 10.455 11.673 -16.555 1.00 0.00 H new ATOM 0 HD11 LEU A 147 10.301 9.309 -17.235 1.00 0.00 H new ATOM 0 HD12 LEU A 147 8.694 10.034 -16.992 1.00 0.00 H new ATOM 0 HD13 LEU A 147 9.318 9.783 -18.640 1.00 0.00 H new ATOM 0 HD21 LEU A 147 12.191 10.688 -18.004 1.00 0.00 H new ATOM 0 HD22 LEU A 147 11.284 11.219 -19.441 1.00 0.00 H new ATOM 0 HD23 LEU A 147 11.968 12.424 -18.325 1.00 0.00 H new ATOM 2355 N ASN A 148 8.442 15.413 -15.985 1.00 0.00 N ATOM 2356 CA ASN A 148 8.969 16.728 -15.637 1.00 0.00 C ATOM 2357 C ASN A 148 9.626 16.704 -14.259 1.00 0.00 C ATOM 2358 O ASN A 148 9.521 17.664 -13.497 1.00 0.00 O ATOM 2359 CB ASN A 148 7.852 17.773 -15.667 1.00 0.00 C ATOM 2360 CG ASN A 148 7.544 18.249 -17.073 1.00 0.00 C ATOM 2361 OD1 ASN A 148 8.217 19.136 -17.601 1.00 0.00 O ATOM 2362 ND2 ASN A 148 6.522 17.665 -17.686 1.00 0.00 N ATOM 0 H ASN A 148 7.525 15.208 -15.589 1.00 0.00 H new ATOM 0 HA ASN A 148 9.726 16.996 -16.374 1.00 0.00 H new ATOM 0 HB2 ASN A 148 6.950 17.350 -15.224 1.00 0.00 H new ATOM 0 HB3 ASN A 148 8.139 18.626 -15.052 1.00 0.00 H new ATOM 0 HD21 ASN A 148 6.266 17.947 -18.632 1.00 0.00 H new ATOM 0 HD22 ASN A 148 5.992 16.934 -17.211 1.00 0.00 H new ATOM 2369 N SER A 149 10.300 15.602 -13.949 1.00 0.00 N ATOM 2370 CA SER A 149 10.971 15.454 -12.664 1.00 0.00 C ATOM 2371 C SER A 149 12.387 14.915 -12.848 1.00 0.00 C ATOM 2372 O SER A 149 12.940 14.364 -11.872 1.00 0.00 O ATOM 2373 CB SER A 149 10.172 14.524 -11.750 1.00 0.00 C ATOM 2374 OG SER A 149 9.079 15.204 -11.158 1.00 0.00 O ATOM 2375 OXT SER A 149 12.926 15.044 -13.965 1.00 0.00 O ATOM 0 H SER A 149 10.396 14.799 -14.570 1.00 0.00 H new ATOM 0 HA SER A 149 11.034 16.439 -12.201 1.00 0.00 H new ATOM 0 HB2 SER A 149 9.807 13.672 -12.323 1.00 0.00 H new ATOM 0 HB3 SER A 149 10.823 14.128 -10.971 1.00 0.00 H new ATOM 0 HG SER A 149 8.584 14.587 -10.580 1.00 0.00 H new TER 2381 SER A 149