USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1104 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 45 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 84 HIS : no HE2:sc= -16.4! C(o=-16!,f=-17!) USER MOD Set 2.1: A 32 TYR OH : rot -143:sc= 0.0123 USER MOD Set 2.2: A 34 SER OG : rot -69:sc= 0.669 USER MOD Set 2.3: A 36 HIS : no HD1:sc= -2.74 K(o=-5.7,f=-7.9!) USER MOD Set 2.4: A 41 CYS SG : rot -154:sc= -3.64! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 154:sc= -0.344 (180deg=-1.57!) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.698) USER MOD Single : A 11 LYS NZ :NH3+ -103:sc= -0.0291 (180deg=-1.67!) USER MOD Single : A 12 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.234) USER MOD Single : A 13 ASN : amide:sc= 0.775 K(o=0.77,f=-0.25) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -1.29! K(o=-1.3!,f=-0.16) USER MOD Single : A 20 ASN : amide:sc= -0.35 K(o=-0.35,f=-2.6!) USER MOD Single : A 24 LYS NZ :NH3+ 152:sc= -1.88! (180deg=-3.3!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 CYS SG : rot 65:sc= -6.58! USER MOD Single : A 51 MET CE :methyl -109:sc= -0.0521 (180deg=-3.63!) USER MOD Single : A 52 TYR OH : rot 180:sc= -1.71 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -81:sc= -5.6! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 172:sc= 0.499! USER MOD Single : A 76 MET CE :methyl -113:sc= -3.74! (180deg=-8.72!) USER MOD Single : A 78 GLN : amide:sc= -0.0413 K(o=-0.041,f=-1.6) USER MOD Single : A 79 TYR OH : rot 141:sc=-0.00091 USER MOD Single : A 80 MET CE :methyl 166:sc= -0.61 (180deg=-0.978) USER MOD Single : A 81 MET CE :methyl 153:sc= -0.738 (180deg=-2.37!) USER MOD Single : A 83 SER OG : rot -98:sc= -0.352! USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 32:sc= -0.936! USER MOD Single : A 98 SER OG : rot -70:sc= 1.02! USER MOD Single : A 99 ASN : amide:sc= -0.0307 K(o=-0.031,f=-2!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 103 LYS NZ :NH3+ -162:sc= -0.255 (180deg=-1.08) USER MOD Single : A 104 TYR OH : rot 165:sc= -1.03 USER MOD Single : A 107 THR OG1 : rot -81:sc= 1.06 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -179:sc= -4.12! (180deg=-4.28!) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.593 USER MOD Single : A 123 SER OG : rot 34:sc= 0.0308 USER MOD Single : A 124 MET CE :methyl 169:sc= -13.9! (180deg=-14.6!) USER MOD Single : A 125 ASN : amide:sc= -4.6! K(o=-4.6!,f=-0.83) USER MOD Single : A 131 GLN : amide:sc= -14.3! C(o=-14!,f=-17!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.0329 K(o=-0.033,f=-1.7!) USER MOD Single : A 140 ASN : amide:sc= -0.866 K(o=-0.87,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 98.767 -16.362 5.327 1.00 0.00 N ATOM 2 CA MET A 1 98.512 -15.022 4.729 1.00 0.00 C ATOM 3 C MET A 1 99.581 -14.044 5.206 1.00 0.00 C ATOM 4 O MET A 1 99.280 -13.063 5.884 1.00 0.00 O ATOM 5 CB MET A 1 97.128 -14.530 5.155 1.00 0.00 C ATOM 6 CG MET A 1 97.003 -14.613 6.677 1.00 0.00 C ATOM 7 SD MET A 1 95.261 -14.469 7.148 1.00 0.00 S ATOM 8 CE MET A 1 95.343 -15.494 8.636 1.00 0.00 C ATOM 0 H1 MET A 1 97.874 -16.891 5.387 1.00 0.00 H new ATOM 0 H2 MET A 1 99.440 -16.886 4.731 1.00 0.00 H new ATOM 0 H3 MET A 1 99.166 -16.246 6.280 1.00 0.00 H new ATOM 0 HA MET A 1 98.548 -15.091 3.642 1.00 0.00 H new ATOM 0 HB2 MET A 1 96.977 -13.503 4.823 1.00 0.00 H new ATOM 0 HB3 MET A 1 96.354 -15.135 4.682 1.00 0.00 H new ATOM 0 HG2 MET A 1 97.411 -15.558 7.035 1.00 0.00 H new ATOM 0 HG3 MET A 1 97.584 -13.818 7.144 1.00 0.00 H new ATOM 0 HE1 MET A 1 94.357 -15.544 9.098 1.00 0.00 H new ATOM 0 HE2 MET A 1 95.670 -16.499 8.368 1.00 0.00 H new ATOM 0 HE3 MET A 1 96.052 -15.058 9.340 1.00 0.00 H new ATOM 20 N GLU A 2 100.832 -14.320 4.846 1.00 0.00 N ATOM 21 CA GLU A 2 101.937 -13.457 5.244 1.00 0.00 C ATOM 22 C GLU A 2 102.962 -13.346 4.119 1.00 0.00 C ATOM 23 O GLU A 2 103.602 -14.332 3.750 1.00 0.00 O ATOM 24 CB GLU A 2 102.612 -14.017 6.499 1.00 0.00 C ATOM 25 CG GLU A 2 102.489 -15.542 6.507 1.00 0.00 C ATOM 26 CD GLU A 2 103.145 -16.110 7.760 1.00 0.00 C ATOM 27 OE1 GLU A 2 104.224 -15.651 8.101 1.00 0.00 O ATOM 28 OE2 GLU A 2 102.561 -16.996 8.361 1.00 0.00 O ATOM 0 H GLU A 2 101.103 -15.127 4.284 1.00 0.00 H new ATOM 0 HA GLU A 2 101.540 -12.465 5.458 1.00 0.00 H new ATOM 0 HB2 GLU A 2 103.662 -13.726 6.521 1.00 0.00 H new ATOM 0 HB3 GLU A 2 102.147 -13.599 7.392 1.00 0.00 H new ATOM 0 HG2 GLU A 2 101.438 -15.831 6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 2 102.963 -15.958 5.618 1.00 0.00 H new ATOM 35 N PHE A 3 103.112 -12.141 3.579 1.00 0.00 N ATOM 36 CA PHE A 3 104.063 -11.914 2.496 1.00 0.00 C ATOM 37 C PHE A 3 104.459 -10.442 2.431 1.00 0.00 C ATOM 38 O PHE A 3 103.907 -9.609 3.149 1.00 0.00 O ATOM 39 CB PHE A 3 103.445 -12.338 1.162 1.00 0.00 C ATOM 40 CG PHE A 3 103.186 -13.825 1.177 1.00 0.00 C ATOM 41 CD1 PHE A 3 104.237 -14.721 0.949 1.00 0.00 C ATOM 42 CD2 PHE A 3 101.895 -14.308 1.418 1.00 0.00 C ATOM 43 CE1 PHE A 3 103.998 -16.100 0.962 1.00 0.00 C ATOM 44 CE2 PHE A 3 101.655 -15.688 1.431 1.00 0.00 C ATOM 45 CZ PHE A 3 102.707 -16.583 1.203 1.00 0.00 C ATOM 0 H PHE A 3 102.592 -11.313 3.870 1.00 0.00 H new ATOM 0 HA PHE A 3 104.955 -12.510 2.689 1.00 0.00 H new ATOM 0 HB2 PHE A 3 102.514 -11.798 0.992 1.00 0.00 H new ATOM 0 HB3 PHE A 3 104.115 -12.083 0.341 1.00 0.00 H new ATOM 0 HD1 PHE A 3 105.233 -14.348 0.763 1.00 0.00 H new ATOM 0 HD2 PHE A 3 101.084 -13.617 1.594 1.00 0.00 H new ATOM 0 HE1 PHE A 3 104.809 -16.791 0.786 1.00 0.00 H new ATOM 0 HE2 PHE A 3 100.659 -16.061 1.617 1.00 0.00 H new ATOM 0 HZ PHE A 3 102.522 -17.647 1.213 1.00 0.00 H new ATOM 55 N ILE A 4 105.417 -10.131 1.566 1.00 0.00 N ATOM 56 CA ILE A 4 105.880 -8.755 1.415 1.00 0.00 C ATOM 57 C ILE A 4 104.774 -7.880 0.836 1.00 0.00 C ATOM 58 O ILE A 4 104.537 -6.768 1.310 1.00 0.00 O ATOM 59 CB ILE A 4 107.101 -8.712 0.495 1.00 0.00 C ATOM 60 CG1 ILE A 4 107.131 -9.974 -0.370 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.376 -8.643 1.338 1.00 0.00 C ATOM 62 CD1 ILE A 4 108.034 -9.741 -1.583 1.00 0.00 C ATOM 0 H ILE A 4 105.886 -10.806 0.962 1.00 0.00 H new ATOM 0 HA ILE A 4 106.154 -8.373 2.399 1.00 0.00 H new ATOM 0 HB ILE A 4 107.042 -7.832 -0.145 1.00 0.00 H new ATOM 0 HG12 ILE A 4 107.498 -10.819 0.213 1.00 0.00 H new ATOM 0 HG13 ILE A 4 106.123 -10.227 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 4 109.245 -8.612 0.681 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.356 -7.745 1.955 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.436 -9.523 1.979 1.00 0.00 H new ATOM 0 HD11 ILE A 4 108.055 -10.640 -2.199 1.00 0.00 H new ATOM 0 HD12 ILE A 4 107.647 -8.908 -2.170 1.00 0.00 H new ATOM 0 HD13 ILE A 4 109.044 -9.509 -1.245 1.00 0.00 H new ATOM 74 N GLN A 5 104.103 -8.389 -0.188 1.00 0.00 N ATOM 75 CA GLN A 5 103.023 -7.646 -0.829 1.00 0.00 C ATOM 76 C GLN A 5 102.273 -6.800 0.194 1.00 0.00 C ATOM 77 O GLN A 5 101.748 -7.319 1.179 1.00 0.00 O ATOM 78 CB GLN A 5 102.051 -8.616 -1.503 1.00 0.00 C ATOM 79 CG GLN A 5 101.788 -9.803 -0.575 1.00 0.00 C ATOM 80 CD GLN A 5 100.305 -10.153 -0.585 1.00 0.00 C ATOM 81 OE1 GLN A 5 99.919 -11.214 -1.076 1.00 0.00 O ATOM 82 NE2 GLN A 5 99.444 -9.319 -0.068 1.00 0.00 N ATOM 0 H GLN A 5 104.285 -9.308 -0.592 1.00 0.00 H new ATOM 0 HA GLN A 5 103.457 -6.986 -1.580 1.00 0.00 H new ATOM 0 HB2 GLN A 5 101.115 -8.107 -1.734 1.00 0.00 H new ATOM 0 HB3 GLN A 5 102.466 -8.965 -2.448 1.00 0.00 H new ATOM 0 HG2 GLN A 5 102.375 -10.663 -0.896 1.00 0.00 H new ATOM 0 HG3 GLN A 5 102.106 -9.560 0.439 1.00 0.00 H new ATOM 0 HE21 GLN A 5 99.766 -8.440 0.338 1.00 0.00 H new ATOM 0 HE22 GLN A 5 98.450 -9.546 -0.070 1.00 0.00 H new ATOM 91 N GLY A 6 102.225 -5.493 -0.047 1.00 0.00 N ATOM 92 CA GLY A 6 101.536 -4.583 0.860 1.00 0.00 C ATOM 93 C GLY A 6 102.476 -3.488 1.353 1.00 0.00 C ATOM 94 O GLY A 6 102.039 -2.507 1.955 1.00 0.00 O ATOM 0 H GLY A 6 102.652 -5.043 -0.857 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.683 -4.133 0.351 1.00 0.00 H new ATOM 0 HA3 GLY A 6 101.143 -5.140 1.710 1.00 0.00 H new ATOM 98 N ILE A 7 103.768 -3.662 1.095 1.00 0.00 N ATOM 99 CA ILE A 7 104.759 -2.690 1.515 1.00 0.00 C ATOM 100 C ILE A 7 105.164 -1.796 0.348 1.00 0.00 C ATOM 101 O ILE A 7 104.744 -2.015 -0.789 1.00 0.00 O ATOM 102 CB ILE A 7 105.988 -3.416 2.051 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.524 -4.370 0.981 1.00 0.00 C ATOM 104 CG2 ILE A 7 105.610 -4.212 3.302 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.717 -5.148 1.541 1.00 0.00 C ATOM 0 H ILE A 7 104.148 -4.467 0.598 1.00 0.00 H new ATOM 0 HA ILE A 7 104.327 -2.067 2.298 1.00 0.00 H new ATOM 0 HB ILE A 7 106.757 -2.686 2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.740 -5.060 0.669 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.825 -3.809 0.096 1.00 0.00 H new ATOM 0 HG21 ILE A 7 106.490 -4.730 3.683 1.00 0.00 H new ATOM 0 HG22 ILE A 7 105.230 -3.532 4.065 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.840 -4.941 3.050 1.00 0.00 H new ATOM 0 HD11 ILE A 7 108.099 -5.827 0.779 1.00 0.00 H new ATOM 0 HD12 ILE A 7 108.503 -4.450 1.831 1.00 0.00 H new ATOM 0 HD13 ILE A 7 107.401 -5.721 2.412 1.00 0.00 H new ATOM 117 N LYS A 8 105.984 -0.791 0.635 1.00 0.00 N ATOM 118 CA LYS A 8 106.441 0.126 -0.399 1.00 0.00 C ATOM 119 C LYS A 8 107.938 -0.038 -0.638 1.00 0.00 C ATOM 120 O LYS A 8 108.728 -0.075 0.306 1.00 0.00 O ATOM 121 CB LYS A 8 106.138 1.570 0.010 1.00 0.00 C ATOM 122 CG LYS A 8 107.108 2.007 1.110 1.00 0.00 C ATOM 123 CD LYS A 8 106.971 1.072 2.313 1.00 0.00 C ATOM 124 CE LYS A 8 107.399 1.809 3.583 1.00 0.00 C ATOM 125 NZ LYS A 8 108.634 2.596 3.308 1.00 0.00 N ATOM 0 H LYS A 8 106.343 -0.592 1.569 1.00 0.00 H new ATOM 0 HA LYS A 8 105.912 -0.106 -1.323 1.00 0.00 H new ATOM 0 HB2 LYS A 8 106.230 2.230 -0.853 1.00 0.00 H new ATOM 0 HB3 LYS A 8 105.110 1.650 0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 8 108.132 1.988 0.736 1.00 0.00 H new ATOM 0 HG3 LYS A 8 106.897 3.034 1.408 1.00 0.00 H new ATOM 0 HD2 LYS A 8 105.940 0.732 2.407 1.00 0.00 H new ATOM 0 HD3 LYS A 8 107.587 0.185 2.169 1.00 0.00 H new ATOM 0 HE2 LYS A 8 106.601 2.471 3.919 1.00 0.00 H new ATOM 0 HE3 LYS A 8 107.581 1.095 4.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 109.157 2.742 4.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 109.233 2.078 2.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 108.375 3.518 2.903 1.00 0.00 H new ATOM 139 N LEU A 9 108.320 -0.144 -1.905 1.00 0.00 N ATOM 140 CA LEU A 9 109.725 -0.309 -2.258 1.00 0.00 C ATOM 141 C LEU A 9 110.325 1.018 -2.707 1.00 0.00 C ATOM 142 O LEU A 9 109.603 1.987 -2.942 1.00 0.00 O ATOM 143 CB LEU A 9 109.859 -1.337 -3.381 1.00 0.00 C ATOM 144 CG LEU A 9 110.534 -2.596 -2.838 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.724 -3.137 -1.658 1.00 0.00 C ATOM 146 CD2 LEU A 9 110.600 -3.654 -3.940 1.00 0.00 C ATOM 0 H LEU A 9 107.682 -0.119 -2.700 1.00 0.00 H new ATOM 0 HA LEU A 9 110.265 -0.657 -1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 9 108.876 -1.583 -3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 9 110.445 -0.922 -4.201 1.00 0.00 H new ATOM 0 HG LEU A 9 111.544 -2.355 -2.506 1.00 0.00 H new ATOM 0 HD11 LEU A 9 110.203 -4.035 -1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.676 -2.382 -0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.715 -3.380 -1.990 1.00 0.00 H new ATOM 0 HD21 LEU A 9 111.081 -4.552 -3.554 1.00 0.00 H new ATOM 0 HD22 LEU A 9 109.591 -3.897 -4.272 1.00 0.00 H new ATOM 0 HD23 LEU A 9 111.175 -3.268 -4.781 1.00 0.00 H new ATOM 158 N VAL A 10 111.650 1.059 -2.822 1.00 0.00 N ATOM 159 CA VAL A 10 112.325 2.280 -3.242 1.00 0.00 C ATOM 160 C VAL A 10 113.021 2.080 -4.585 1.00 0.00 C ATOM 161 O VAL A 10 113.839 1.174 -4.744 1.00 0.00 O ATOM 162 CB VAL A 10 113.354 2.694 -2.190 1.00 0.00 C ATOM 163 CG1 VAL A 10 114.372 3.647 -2.818 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.642 3.398 -1.034 1.00 0.00 C ATOM 0 H VAL A 10 112.269 0.271 -2.633 1.00 0.00 H new ATOM 0 HA VAL A 10 111.576 3.065 -3.350 1.00 0.00 H new ATOM 0 HB VAL A 10 113.869 1.809 -1.817 1.00 0.00 H new ATOM 0 HG11 VAL A 10 115.105 3.942 -2.068 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.878 3.146 -3.643 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.859 4.533 -3.192 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.374 3.694 -0.282 1.00 0.00 H new ATOM 0 HG22 VAL A 10 112.128 4.283 -1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 10 111.916 2.719 -0.586 1.00 0.00 H new ATOM 174 N LYS A 11 112.691 2.935 -5.548 1.00 0.00 N ATOM 175 CA LYS A 11 113.289 2.848 -6.875 1.00 0.00 C ATOM 176 C LYS A 11 114.675 3.485 -6.879 1.00 0.00 C ATOM 177 O LYS A 11 114.892 4.526 -6.259 1.00 0.00 O ATOM 178 CB LYS A 11 112.399 3.557 -7.897 1.00 0.00 C ATOM 179 CG LYS A 11 110.965 3.616 -7.368 1.00 0.00 C ATOM 180 CD LYS A 11 110.042 4.170 -8.454 1.00 0.00 C ATOM 181 CE LYS A 11 109.944 3.166 -9.603 1.00 0.00 C ATOM 182 NZ LYS A 11 108.537 3.104 -10.091 1.00 0.00 N ATOM 0 H LYS A 11 112.017 3.692 -5.435 1.00 0.00 H new ATOM 0 HA LYS A 11 113.382 1.795 -7.143 1.00 0.00 H new ATOM 0 HB2 LYS A 11 112.771 4.564 -8.083 1.00 0.00 H new ATOM 0 HB3 LYS A 11 112.426 3.027 -8.849 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.635 2.621 -7.069 1.00 0.00 H new ATOM 0 HG3 LYS A 11 110.919 4.247 -6.481 1.00 0.00 H new ATOM 0 HD2 LYS A 11 109.052 4.363 -8.041 1.00 0.00 H new ATOM 0 HD3 LYS A 11 110.426 5.122 -8.821 1.00 0.00 H new ATOM 0 HE2 LYS A 11 110.609 3.460 -10.415 1.00 0.00 H new ATOM 0 HE3 LYS A 11 110.267 2.181 -9.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 108.082 2.242 -9.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 108.016 3.938 -9.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 108.531 3.089 -11.131 1.00 0.00 H new ATOM 196 N LYS A 12 115.608 2.851 -7.583 1.00 0.00 N ATOM 197 CA LYS A 12 116.972 3.359 -7.664 1.00 0.00 C ATOM 198 C LYS A 12 116.971 4.872 -7.858 1.00 0.00 C ATOM 199 O LYS A 12 117.937 5.552 -7.509 1.00 0.00 O ATOM 200 CB LYS A 12 117.707 2.694 -8.829 1.00 0.00 C ATOM 201 CG LYS A 12 116.687 2.122 -9.816 1.00 0.00 C ATOM 202 CD LYS A 12 117.403 1.677 -11.093 1.00 0.00 C ATOM 203 CE LYS A 12 116.554 0.630 -11.815 1.00 0.00 C ATOM 204 NZ LYS A 12 115.197 1.185 -12.080 1.00 0.00 N ATOM 0 H LYS A 12 115.445 1.989 -8.103 1.00 0.00 H new ATOM 0 HA LYS A 12 117.483 3.125 -6.730 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.347 3.420 -9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 12 118.355 1.900 -8.458 1.00 0.00 H new ATOM 0 HG2 LYS A 12 116.165 1.277 -9.366 1.00 0.00 H new ATOM 0 HG3 LYS A 12 115.934 2.873 -10.052 1.00 0.00 H new ATOM 0 HD2 LYS A 12 117.574 2.534 -11.744 1.00 0.00 H new ATOM 0 HD3 LYS A 12 118.381 1.262 -10.849 1.00 0.00 H new ATOM 0 HE2 LYS A 12 117.031 0.344 -12.753 1.00 0.00 H new ATOM 0 HE3 LYS A 12 116.477 -0.272 -11.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 114.722 0.610 -12.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 114.638 1.168 -11.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 115.283 2.165 -12.417 1.00 0.00 H new ATOM 218 N ASN A 13 115.883 5.393 -8.413 1.00 0.00 N ATOM 219 CA ASN A 13 115.769 6.827 -8.644 1.00 0.00 C ATOM 220 C ASN A 13 115.386 7.545 -7.354 1.00 0.00 C ATOM 221 O ASN A 13 114.806 8.630 -7.384 1.00 0.00 O ATOM 222 CB ASN A 13 114.715 7.102 -9.718 1.00 0.00 C ATOM 223 CG ASN A 13 115.071 8.371 -10.486 1.00 0.00 C ATOM 224 OD1 ASN A 13 115.075 8.373 -11.717 1.00 0.00 O ATOM 225 ND2 ASN A 13 115.372 9.458 -9.828 1.00 0.00 N ATOM 0 H ASN A 13 115.073 4.848 -8.709 1.00 0.00 H new ATOM 0 HA ASN A 13 116.735 7.201 -8.983 1.00 0.00 H new ATOM 0 HB2 ASN A 13 114.654 6.257 -10.404 1.00 0.00 H new ATOM 0 HB3 ASN A 13 113.733 7.210 -9.257 1.00 0.00 H new ATOM 0 HD21 ASN A 13 115.611 10.311 -10.334 1.00 0.00 H new ATOM 0 HD22 ASN A 13 115.368 9.454 -8.808 1.00 0.00 H new ATOM 232 N ARG A 14 115.712 6.928 -6.223 1.00 0.00 N ATOM 233 CA ARG A 14 115.395 7.514 -4.926 1.00 0.00 C ATOM 234 C ARG A 14 113.894 7.747 -4.801 1.00 0.00 C ATOM 235 O ARG A 14 113.450 8.615 -4.052 1.00 0.00 O ATOM 236 CB ARG A 14 116.136 8.842 -4.757 1.00 0.00 C ATOM 237 CG ARG A 14 117.496 8.761 -5.453 1.00 0.00 C ATOM 238 CD ARG A 14 118.460 9.756 -4.807 1.00 0.00 C ATOM 239 NE ARG A 14 119.537 10.089 -5.732 1.00 0.00 N ATOM 240 CZ ARG A 14 120.741 10.436 -5.289 1.00 0.00 C ATOM 241 NH1 ARG A 14 120.975 10.484 -4.007 1.00 0.00 N ATOM 242 NH2 ARG A 14 121.688 10.731 -6.137 1.00 0.00 N ATOM 0 H ARG A 14 116.192 6.029 -6.178 1.00 0.00 H new ATOM 0 HA ARG A 14 115.712 6.822 -4.146 1.00 0.00 H new ATOM 0 HB2 ARG A 14 115.547 9.656 -5.180 1.00 0.00 H new ATOM 0 HB3 ARG A 14 116.270 9.063 -3.698 1.00 0.00 H new ATOM 0 HG2 ARG A 14 117.896 7.750 -5.377 1.00 0.00 H new ATOM 0 HG3 ARG A 14 117.387 8.982 -6.515 1.00 0.00 H new ATOM 0 HD2 ARG A 14 117.923 10.661 -4.522 1.00 0.00 H new ATOM 0 HD3 ARG A 14 118.875 9.330 -3.893 1.00 0.00 H new ATOM 0 HE ARG A 14 119.363 10.055 -6.737 1.00 0.00 H new ATOM 0 HH11 ARG A 14 120.234 10.255 -3.344 1.00 0.00 H new ATOM 0 HH12 ARG A 14 121.899 10.750 -3.667 1.00 0.00 H new ATOM 0 HH21 ARG A 14 121.504 10.695 -7.140 1.00 0.00 H new ATOM 0 HH22 ARG A 14 122.612 10.997 -5.797 1.00 0.00 H new ATOM 256 N CYS A 15 113.118 6.964 -5.544 1.00 0.00 N ATOM 257 CA CYS A 15 111.666 7.093 -5.513 1.00 0.00 C ATOM 258 C CYS A 15 111.045 5.970 -4.690 1.00 0.00 C ATOM 259 O CYS A 15 111.730 5.029 -4.292 1.00 0.00 O ATOM 260 CB CYS A 15 111.108 7.055 -6.937 1.00 0.00 C ATOM 261 SG CYS A 15 110.871 8.746 -7.538 1.00 0.00 S ATOM 0 H CYS A 15 113.467 6.239 -6.170 1.00 0.00 H new ATOM 0 HA CYS A 15 111.415 8.047 -5.050 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.793 6.517 -7.593 1.00 0.00 H new ATOM 0 HB3 CYS A 15 110.161 6.516 -6.954 1.00 0.00 H new ATOM 0 HG CYS A 15 110.399 8.714 -8.749 1.00 0.00 H new ATOM 267 N GLU A 16 109.744 6.076 -4.439 1.00 0.00 N ATOM 268 CA GLU A 16 109.042 5.061 -3.663 1.00 0.00 C ATOM 269 C GLU A 16 107.819 4.557 -4.424 1.00 0.00 C ATOM 270 O GLU A 16 107.149 5.320 -5.120 1.00 0.00 O ATOM 271 CB GLU A 16 108.609 5.636 -2.315 1.00 0.00 C ATOM 272 CG GLU A 16 107.748 6.878 -2.544 1.00 0.00 C ATOM 273 CD GLU A 16 107.111 7.322 -1.232 1.00 0.00 C ATOM 274 OE1 GLU A 16 107.001 6.496 -0.340 1.00 0.00 O ATOM 275 OE2 GLU A 16 106.744 8.481 -1.137 1.00 0.00 O ATOM 0 H GLU A 16 109.159 6.848 -4.759 1.00 0.00 H new ATOM 0 HA GLU A 16 109.721 4.225 -3.495 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.048 4.890 -1.753 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.485 5.892 -1.719 1.00 0.00 H new ATOM 0 HG2 GLU A 16 108.359 7.683 -2.952 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.973 6.662 -3.279 1.00 0.00 H new ATOM 282 N VAL A 17 107.539 3.266 -4.288 1.00 0.00 N ATOM 283 CA VAL A 17 106.400 2.660 -4.968 1.00 0.00 C ATOM 284 C VAL A 17 105.865 1.476 -4.169 1.00 0.00 C ATOM 285 O VAL A 17 106.461 1.068 -3.174 1.00 0.00 O ATOM 286 CB VAL A 17 106.799 2.194 -6.368 1.00 0.00 C ATOM 287 CG1 VAL A 17 106.197 3.139 -7.411 1.00 0.00 C ATOM 288 CG2 VAL A 17 108.322 2.197 -6.500 1.00 0.00 C ATOM 0 H VAL A 17 108.083 2.620 -3.715 1.00 0.00 H new ATOM 0 HA VAL A 17 105.617 3.414 -5.052 1.00 0.00 H new ATOM 0 HB VAL A 17 106.425 1.183 -6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 17 106.481 2.807 -8.410 1.00 0.00 H new ATOM 0 HG12 VAL A 17 105.111 3.134 -7.322 1.00 0.00 H new ATOM 0 HG13 VAL A 17 106.570 4.150 -7.245 1.00 0.00 H new ATOM 0 HG21 VAL A 17 108.601 1.864 -7.500 1.00 0.00 H new ATOM 0 HG22 VAL A 17 108.700 3.206 -6.335 1.00 0.00 H new ATOM 0 HG23 VAL A 17 108.753 1.523 -5.760 1.00 0.00 H new ATOM 298 N ASN A 18 104.739 0.929 -4.613 1.00 0.00 N ATOM 299 CA ASN A 18 104.135 -0.212 -3.933 1.00 0.00 C ATOM 300 C ASN A 18 104.667 -1.521 -4.512 1.00 0.00 C ATOM 301 O ASN A 18 104.230 -1.963 -5.575 1.00 0.00 O ATOM 302 CB ASN A 18 102.613 -0.165 -4.086 1.00 0.00 C ATOM 303 CG ASN A 18 101.999 0.637 -2.944 1.00 0.00 C ATOM 304 OD1 ASN A 18 101.042 1.383 -3.152 1.00 0.00 O ATOM 305 ND2 ASN A 18 102.495 0.527 -1.741 1.00 0.00 N ATOM 0 H ASN A 18 104.229 1.254 -5.434 1.00 0.00 H new ATOM 0 HA ASN A 18 104.395 -0.162 -2.876 1.00 0.00 H new ATOM 0 HB2 ASN A 18 102.349 0.287 -5.042 1.00 0.00 H new ATOM 0 HB3 ASN A 18 102.208 -1.177 -4.090 1.00 0.00 H new ATOM 0 HD21 ASN A 18 102.089 1.060 -0.971 1.00 0.00 H new ATOM 0 HD22 ASN A 18 103.288 -0.092 -1.571 1.00 0.00 H new ATOM 312 N ALA A 19 105.613 -2.134 -3.807 1.00 0.00 N ATOM 313 CA ALA A 19 106.201 -3.392 -4.260 1.00 0.00 C ATOM 314 C ALA A 19 105.143 -4.296 -4.885 1.00 0.00 C ATOM 315 O ALA A 19 105.458 -5.162 -5.700 1.00 0.00 O ATOM 316 CB ALA A 19 106.860 -4.115 -3.082 1.00 0.00 C ATOM 0 H ALA A 19 105.987 -1.784 -2.925 1.00 0.00 H new ATOM 0 HA ALA A 19 106.952 -3.162 -5.016 1.00 0.00 H new ATOM 0 HB1 ALA A 19 107.296 -5.052 -3.428 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.643 -3.485 -2.660 1.00 0.00 H new ATOM 0 HB3 ALA A 19 106.111 -4.324 -2.318 1.00 0.00 H new ATOM 322 N ASN A 20 103.888 -4.092 -4.499 1.00 0.00 N ATOM 323 CA ASN A 20 102.797 -4.900 -5.029 1.00 0.00 C ATOM 324 C ASN A 20 102.839 -4.919 -6.552 1.00 0.00 C ATOM 325 O ASN A 20 102.930 -5.979 -7.170 1.00 0.00 O ATOM 326 CB ASN A 20 101.456 -4.333 -4.561 1.00 0.00 C ATOM 327 CG ASN A 20 100.629 -5.428 -3.896 1.00 0.00 C ATOM 328 OD1 ASN A 20 101.094 -6.071 -2.954 1.00 0.00 O ATOM 329 ND2 ASN A 20 99.425 -5.679 -4.330 1.00 0.00 N ATOM 0 H ASN A 20 103.603 -3.380 -3.827 1.00 0.00 H new ATOM 0 HA ASN A 20 102.910 -5.920 -4.660 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.623 -3.515 -3.860 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.911 -3.919 -5.409 1.00 0.00 H new ATOM 0 HD21 ASN A 20 98.866 -6.409 -3.889 1.00 0.00 H new ATOM 0 HD22 ASN A 20 99.042 -5.145 -5.110 1.00 0.00 H new ATOM 336 N GLU A 21 102.771 -3.734 -7.148 1.00 0.00 N ATOM 337 CA GLU A 21 102.801 -3.618 -8.600 1.00 0.00 C ATOM 338 C GLU A 21 104.215 -3.317 -9.085 1.00 0.00 C ATOM 339 O GLU A 21 104.573 -3.632 -10.220 1.00 0.00 O ATOM 340 CB GLU A 21 101.855 -2.505 -9.054 1.00 0.00 C ATOM 341 CG GLU A 21 101.962 -1.319 -8.093 1.00 0.00 C ATOM 342 CD GLU A 21 101.071 -0.178 -8.570 1.00 0.00 C ATOM 343 OE1 GLU A 21 100.238 -0.421 -9.429 1.00 0.00 O ATOM 344 OE2 GLU A 21 101.234 0.924 -8.073 1.00 0.00 O ATOM 0 H GLU A 21 102.695 -2.846 -6.652 1.00 0.00 H new ATOM 0 HA GLU A 21 102.478 -4.567 -9.028 1.00 0.00 H new ATOM 0 HB2 GLU A 21 102.107 -2.190 -10.067 1.00 0.00 H new ATOM 0 HB3 GLU A 21 100.830 -2.873 -9.081 1.00 0.00 H new ATOM 0 HG2 GLU A 21 101.667 -1.626 -7.090 1.00 0.00 H new ATOM 0 HG3 GLU A 21 102.997 -0.982 -8.032 1.00 0.00 H new ATOM 351 N ALA A 22 105.011 -2.703 -8.219 1.00 0.00 N ATOM 352 CA ALA A 22 106.385 -2.358 -8.569 1.00 0.00 C ATOM 353 C ALA A 22 107.219 -3.615 -8.794 1.00 0.00 C ATOM 354 O ALA A 22 108.121 -3.630 -9.632 1.00 0.00 O ATOM 355 CB ALA A 22 107.009 -1.521 -7.452 1.00 0.00 C ATOM 0 H ALA A 22 104.733 -2.435 -7.275 1.00 0.00 H new ATOM 0 HA ALA A 22 106.370 -1.781 -9.494 1.00 0.00 H new ATOM 0 HB1 ALA A 22 108.035 -1.266 -7.718 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.431 -0.607 -7.316 1.00 0.00 H new ATOM 0 HB3 ALA A 22 107.006 -2.093 -6.524 1.00 0.00 H new ATOM 361 N LEU A 23 106.916 -4.667 -8.041 1.00 0.00 N ATOM 362 CA LEU A 23 107.650 -5.921 -8.167 1.00 0.00 C ATOM 363 C LEU A 23 107.327 -6.605 -9.492 1.00 0.00 C ATOM 364 O LEU A 23 107.900 -7.644 -9.819 1.00 0.00 O ATOM 365 CB LEU A 23 107.293 -6.857 -7.011 1.00 0.00 C ATOM 366 CG LEU A 23 107.989 -6.380 -5.734 1.00 0.00 C ATOM 367 CD1 LEU A 23 107.393 -7.106 -4.527 1.00 0.00 C ATOM 368 CD2 LEU A 23 109.485 -6.689 -5.825 1.00 0.00 C ATOM 0 H LEU A 23 106.173 -4.677 -7.342 1.00 0.00 H new ATOM 0 HA LEU A 23 108.716 -5.696 -8.137 1.00 0.00 H new ATOM 0 HB2 LEU A 23 106.213 -6.875 -6.864 1.00 0.00 H new ATOM 0 HB3 LEU A 23 107.600 -7.876 -7.246 1.00 0.00 H new ATOM 0 HG LEU A 23 107.844 -5.306 -5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 23 107.888 -6.767 -3.617 1.00 0.00 H new ATOM 0 HD12 LEU A 23 106.327 -6.889 -4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 23 107.539 -8.180 -4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 23 109.982 -6.350 -4.916 1.00 0.00 H new ATOM 0 HD22 LEU A 23 109.628 -7.764 -5.938 1.00 0.00 H new ATOM 0 HD23 LEU A 23 109.911 -6.174 -6.686 1.00 0.00 H new ATOM 380 N LYS A 24 106.405 -6.019 -10.249 1.00 0.00 N ATOM 381 CA LYS A 24 106.015 -6.586 -11.535 1.00 0.00 C ATOM 382 C LYS A 24 106.214 -8.099 -11.531 1.00 0.00 C ATOM 383 O LYS A 24 105.399 -8.838 -10.977 1.00 0.00 O ATOM 384 CB LYS A 24 106.847 -5.961 -12.655 1.00 0.00 C ATOM 385 CG LYS A 24 106.580 -6.705 -13.966 1.00 0.00 C ATOM 386 CD LYS A 24 106.593 -5.711 -15.130 1.00 0.00 C ATOM 387 CE LYS A 24 105.224 -5.036 -15.243 1.00 0.00 C ATOM 388 NZ LYS A 24 105.102 -3.981 -14.197 1.00 0.00 N ATOM 0 H LYS A 24 105.918 -5.159 -9.997 1.00 0.00 H new ATOM 0 HA LYS A 24 104.960 -6.369 -11.705 1.00 0.00 H new ATOM 0 HB2 LYS A 24 106.594 -4.906 -12.765 1.00 0.00 H new ATOM 0 HB3 LYS A 24 107.907 -6.010 -12.406 1.00 0.00 H new ATOM 0 HG2 LYS A 24 107.338 -7.473 -14.121 1.00 0.00 H new ATOM 0 HG3 LYS A 24 105.617 -7.213 -13.918 1.00 0.00 H new ATOM 0 HD2 LYS A 24 107.368 -4.961 -14.972 1.00 0.00 H new ATOM 0 HD3 LYS A 24 106.833 -6.227 -16.060 1.00 0.00 H new ATOM 0 HE2 LYS A 24 105.104 -4.597 -16.233 1.00 0.00 H new ATOM 0 HE3 LYS A 24 104.431 -5.775 -15.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 104.454 -3.238 -14.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 104.729 -4.401 -13.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 106.038 -3.567 -14.011 1.00 0.00 H new ATOM 402 N ASP A 25 107.301 -8.555 -12.146 1.00 0.00 N ATOM 403 CA ASP A 25 107.592 -9.984 -12.197 1.00 0.00 C ATOM 404 C ASP A 25 106.425 -10.745 -12.814 1.00 0.00 C ATOM 405 O ASP A 25 106.530 -11.265 -13.926 1.00 0.00 O ATOM 406 CB ASP A 25 107.856 -10.508 -10.786 1.00 0.00 C ATOM 407 CG ASP A 25 107.838 -12.031 -10.786 1.00 0.00 C ATOM 408 OD1 ASP A 25 107.770 -12.600 -11.862 1.00 0.00 O ATOM 409 OD2 ASP A 25 107.892 -12.606 -9.712 1.00 0.00 O ATOM 0 H ASP A 25 107.989 -7.963 -12.612 1.00 0.00 H new ATOM 0 HA ASP A 25 108.477 -10.137 -12.815 1.00 0.00 H new ATOM 0 HB2 ASP A 25 108.821 -10.147 -10.429 1.00 0.00 H new ATOM 0 HB3 ASP A 25 107.100 -10.127 -10.100 1.00 0.00 H new ATOM 414 N LYS A 26 105.315 -10.813 -12.087 1.00 0.00 N ATOM 415 CA LYS A 26 104.141 -11.521 -12.579 1.00 0.00 C ATOM 416 C LYS A 26 104.562 -12.823 -13.249 1.00 0.00 C ATOM 417 O LYS A 26 103.771 -13.461 -13.945 1.00 0.00 O ATOM 418 CB LYS A 26 103.384 -10.648 -13.581 1.00 0.00 C ATOM 419 CG LYS A 26 103.378 -9.197 -13.094 1.00 0.00 C ATOM 420 CD LYS A 26 102.523 -8.345 -14.035 1.00 0.00 C ATOM 421 CE LYS A 26 101.048 -8.702 -13.849 1.00 0.00 C ATOM 422 NZ LYS A 26 100.264 -7.461 -13.596 1.00 0.00 N ATOM 0 H LYS A 26 105.204 -10.391 -11.165 1.00 0.00 H new ATOM 0 HA LYS A 26 103.487 -11.746 -11.736 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.854 -10.711 -14.562 1.00 0.00 H new ATOM 0 HB3 LYS A 26 102.362 -11.009 -13.694 1.00 0.00 H new ATOM 0 HG2 LYS A 26 102.983 -9.145 -12.079 1.00 0.00 H new ATOM 0 HG3 LYS A 26 104.396 -8.810 -13.060 1.00 0.00 H new ATOM 0 HD2 LYS A 26 102.681 -7.286 -13.828 1.00 0.00 H new ATOM 0 HD3 LYS A 26 102.822 -8.516 -15.069 1.00 0.00 H new ATOM 0 HE2 LYS A 26 100.671 -9.208 -14.737 1.00 0.00 H new ATOM 0 HE3 LYS A 26 100.933 -9.394 -13.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 99.261 -7.704 -13.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 100.619 -6.996 -12.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 100.365 -6.816 -14.405 1.00 0.00 H new ATOM 436 N ASP A 27 105.816 -13.208 -13.035 1.00 0.00 N ATOM 437 CA ASP A 27 106.342 -14.433 -13.624 1.00 0.00 C ATOM 438 C ASP A 27 107.324 -15.112 -12.674 1.00 0.00 C ATOM 439 O ASP A 27 107.017 -16.152 -12.091 1.00 0.00 O ATOM 440 CB ASP A 27 107.044 -14.117 -14.946 1.00 0.00 C ATOM 441 CG ASP A 27 106.059 -13.477 -15.919 1.00 0.00 C ATOM 442 OD1 ASP A 27 104.938 -13.952 -15.995 1.00 0.00 O ATOM 443 OD2 ASP A 27 106.440 -12.520 -16.573 1.00 0.00 O ATOM 0 H ASP A 27 106.483 -12.692 -12.461 1.00 0.00 H new ATOM 0 HA ASP A 27 105.508 -15.110 -13.807 1.00 0.00 H new ATOM 0 HB2 ASP A 27 107.883 -13.444 -14.770 1.00 0.00 H new ATOM 0 HB3 ASP A 27 107.453 -15.031 -15.378 1.00 0.00 H new ATOM 448 N ILE A 28 108.512 -14.527 -12.530 1.00 0.00 N ATOM 449 CA ILE A 28 109.533 -15.096 -11.658 1.00 0.00 C ATOM 450 C ILE A 28 110.211 -14.006 -10.830 1.00 0.00 C ATOM 451 O ILE A 28 110.231 -12.840 -11.221 1.00 0.00 O ATOM 452 CB ILE A 28 110.575 -15.817 -12.512 1.00 0.00 C ATOM 453 CG1 ILE A 28 109.922 -17.047 -13.150 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.765 -16.236 -11.644 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.814 -18.275 -12.958 1.00 0.00 C ATOM 0 H ILE A 28 108.788 -13.666 -13.003 1.00 0.00 H new ATOM 0 HA ILE A 28 109.059 -15.800 -10.973 1.00 0.00 H new ATOM 0 HB ILE A 28 110.940 -15.151 -13.294 1.00 0.00 H new ATOM 0 HG12 ILE A 28 108.945 -17.224 -12.701 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.757 -16.871 -14.213 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.503 -16.749 -12.261 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.218 -15.351 -11.197 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.422 -16.906 -10.856 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.340 -19.144 -13.415 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.781 -18.099 -13.429 1.00 0.00 H new ATOM 0 HD13 ILE A 28 110.957 -18.458 -11.893 1.00 0.00 H new ATOM 467 N ILE A 29 110.766 -14.395 -9.687 1.00 0.00 N ATOM 468 CA ILE A 29 111.446 -13.441 -8.818 1.00 0.00 C ATOM 469 C ILE A 29 112.728 -14.050 -8.258 1.00 0.00 C ATOM 470 O ILE A 29 112.787 -15.247 -7.980 1.00 0.00 O ATOM 471 CB ILE A 29 110.520 -13.023 -7.673 1.00 0.00 C ATOM 472 CG1 ILE A 29 109.862 -11.688 -8.025 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.329 -12.864 -6.383 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.479 -11.614 -7.383 1.00 0.00 C ATOM 0 H ILE A 29 110.759 -15.355 -9.343 1.00 0.00 H new ATOM 0 HA ILE A 29 111.707 -12.560 -9.404 1.00 0.00 H new ATOM 0 HB ILE A 29 109.757 -13.787 -7.526 1.00 0.00 H new ATOM 0 HG12 ILE A 29 110.481 -10.862 -7.675 1.00 0.00 H new ATOM 0 HG13 ILE A 29 109.778 -11.587 -9.107 1.00 0.00 H new ATOM 0 HG21 ILE A 29 110.665 -12.566 -5.571 1.00 0.00 H new ATOM 0 HG22 ILE A 29 111.805 -13.812 -6.133 1.00 0.00 H new ATOM 0 HG23 ILE A 29 112.094 -12.100 -6.525 1.00 0.00 H new ATOM 0 HD11 ILE A 29 108.011 -10.662 -7.635 1.00 0.00 H new ATOM 0 HD12 ILE A 29 107.861 -12.431 -7.755 1.00 0.00 H new ATOM 0 HD13 ILE A 29 108.576 -11.696 -6.300 1.00 0.00 H new ATOM 486 N GLY A 30 113.753 -13.219 -8.096 1.00 0.00 N ATOM 487 CA GLY A 30 115.029 -13.691 -7.571 1.00 0.00 C ATOM 488 C GLY A 30 115.536 -12.786 -6.455 1.00 0.00 C ATOM 489 O GLY A 30 115.771 -11.596 -6.666 1.00 0.00 O ATOM 0 H GLY A 30 113.726 -12.224 -8.319 1.00 0.00 H new ATOM 0 HA2 GLY A 30 114.916 -14.708 -7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 30 115.764 -13.728 -8.375 1.00 0.00 H new ATOM 493 N PHE A 31 115.708 -13.359 -5.267 1.00 0.00 N ATOM 494 CA PHE A 31 116.192 -12.595 -4.125 1.00 0.00 C ATOM 495 C PHE A 31 117.715 -12.667 -4.045 1.00 0.00 C ATOM 496 O PHE A 31 118.288 -13.752 -3.963 1.00 0.00 O ATOM 497 CB PHE A 31 115.590 -13.147 -2.831 1.00 0.00 C ATOM 498 CG PHE A 31 114.103 -12.888 -2.797 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.231 -13.718 -3.513 1.00 0.00 C ATOM 500 CD2 PHE A 31 113.595 -11.825 -2.041 1.00 0.00 C ATOM 501 CE1 PHE A 31 111.851 -13.483 -3.474 1.00 0.00 C ATOM 502 CE2 PHE A 31 112.216 -11.590 -2.003 1.00 0.00 C ATOM 503 CZ PHE A 31 111.344 -12.419 -2.719 1.00 0.00 C ATOM 0 H PHE A 31 115.521 -14.343 -5.072 1.00 0.00 H new ATOM 0 HA PHE A 31 115.889 -11.556 -4.252 1.00 0.00 H new ATOM 0 HB2 PHE A 31 115.782 -14.218 -2.760 1.00 0.00 H new ATOM 0 HB3 PHE A 31 116.068 -12.679 -1.970 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.623 -14.539 -4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.267 -11.186 -1.487 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.178 -14.122 -4.026 1.00 0.00 H new ATOM 0 HE2 PHE A 31 111.824 -10.769 -1.421 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.280 -12.237 -2.689 1.00 0.00 H new ATOM 513 N TYR A 32 118.365 -11.507 -4.070 1.00 0.00 N ATOM 514 CA TYR A 32 119.823 -11.464 -4.003 1.00 0.00 C ATOM 515 C TYR A 32 120.291 -10.962 -2.640 1.00 0.00 C ATOM 516 O TYR A 32 119.847 -9.915 -2.168 1.00 0.00 O ATOM 517 CB TYR A 32 120.368 -10.547 -5.100 1.00 0.00 C ATOM 518 CG TYR A 32 121.878 -10.573 -5.074 1.00 0.00 C ATOM 519 CD1 TYR A 32 122.561 -11.782 -5.251 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.594 -9.387 -4.872 1.00 0.00 C ATOM 521 CE1 TYR A 32 123.960 -11.805 -5.227 1.00 0.00 C ATOM 522 CE2 TYR A 32 123.993 -9.410 -4.848 1.00 0.00 C ATOM 523 CZ TYR A 32 124.676 -10.620 -5.025 1.00 0.00 C ATOM 524 OH TYR A 32 126.056 -10.643 -5.002 1.00 0.00 O ATOM 0 H TYR A 32 117.913 -10.595 -4.135 1.00 0.00 H new ATOM 0 HA TYR A 32 120.201 -12.476 -4.150 1.00 0.00 H new ATOM 0 HB2 TYR A 32 120.005 -10.873 -6.075 1.00 0.00 H new ATOM 0 HB3 TYR A 32 120.009 -9.529 -4.950 1.00 0.00 H new ATOM 0 HD1 TYR A 32 122.008 -12.697 -5.406 1.00 0.00 H new ATOM 0 HD2 TYR A 32 122.067 -8.455 -4.735 1.00 0.00 H new ATOM 0 HE1 TYR A 32 124.487 -12.738 -5.364 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.546 -8.495 -4.693 1.00 0.00 H new ATOM 0 HH TYR A 32 126.383 -10.006 -4.332 1.00 0.00 H new ATOM 534 N PHE A 33 121.196 -11.712 -2.014 1.00 0.00 N ATOM 535 CA PHE A 33 121.723 -11.328 -0.708 1.00 0.00 C ATOM 536 C PHE A 33 123.242 -11.194 -0.768 1.00 0.00 C ATOM 537 O PHE A 33 123.951 -12.171 -1.017 1.00 0.00 O ATOM 538 CB PHE A 33 121.351 -12.376 0.344 1.00 0.00 C ATOM 539 CG PHE A 33 119.882 -12.698 0.246 1.00 0.00 C ATOM 540 CD1 PHE A 33 119.388 -13.359 -0.883 1.00 0.00 C ATOM 541 CD2 PHE A 33 119.015 -12.343 1.287 1.00 0.00 C ATOM 542 CE1 PHE A 33 118.027 -13.664 -0.973 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.652 -12.648 1.196 1.00 0.00 C ATOM 544 CZ PHE A 33 117.157 -13.310 0.065 1.00 0.00 C ATOM 0 H PHE A 33 121.576 -12.582 -2.387 1.00 0.00 H new ATOM 0 HA PHE A 33 121.286 -10.368 -0.433 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.942 -13.280 0.195 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.585 -12.003 1.341 1.00 0.00 H new ATOM 0 HD1 PHE A 33 120.058 -13.634 -1.685 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.398 -11.834 2.159 1.00 0.00 H new ATOM 0 HE1 PHE A 33 117.646 -14.174 -1.845 1.00 0.00 H new ATOM 0 HE2 PHE A 33 116.982 -12.373 1.997 1.00 0.00 H new ATOM 0 HZ PHE A 33 116.106 -13.547 -0.006 1.00 0.00 H new ATOM 554 N SER A 34 123.733 -9.981 -0.536 1.00 0.00 N ATOM 555 CA SER A 34 125.168 -9.730 -0.564 1.00 0.00 C ATOM 556 C SER A 34 125.451 -8.229 -0.575 1.00 0.00 C ATOM 557 O SER A 34 125.749 -7.655 -1.621 1.00 0.00 O ATOM 558 CB SER A 34 125.787 -10.377 -1.802 1.00 0.00 C ATOM 559 OG SER A 34 126.968 -9.670 -2.160 1.00 0.00 O ATOM 0 H SER A 34 123.162 -9.162 -0.328 1.00 0.00 H new ATOM 0 HA SER A 34 125.611 -10.164 0.332 1.00 0.00 H new ATOM 0 HB2 SER A 34 126.022 -11.422 -1.601 1.00 0.00 H new ATOM 0 HB3 SER A 34 125.076 -10.363 -2.628 1.00 0.00 H new ATOM 0 HG SER A 34 126.728 -8.782 -2.498 1.00 0.00 H new ATOM 565 N ALA A 35 125.364 -7.604 0.596 1.00 0.00 N ATOM 566 CA ALA A 35 125.622 -6.171 0.704 1.00 0.00 C ATOM 567 C ALA A 35 127.085 -5.878 0.394 1.00 0.00 C ATOM 568 O ALA A 35 127.698 -5.005 1.009 1.00 0.00 O ATOM 569 CB ALA A 35 125.292 -5.679 2.114 1.00 0.00 C ATOM 0 H ALA A 35 125.120 -8.061 1.475 1.00 0.00 H new ATOM 0 HA ALA A 35 124.989 -5.650 -0.014 1.00 0.00 H new ATOM 0 HB1 ALA A 35 125.489 -4.609 2.181 1.00 0.00 H new ATOM 0 HB2 ALA A 35 124.240 -5.869 2.329 1.00 0.00 H new ATOM 0 HB3 ALA A 35 125.911 -6.208 2.838 1.00 0.00 H new ATOM 575 N HIS A 36 127.639 -6.620 -0.556 1.00 0.00 N ATOM 576 CA HIS A 36 129.034 -6.442 -0.940 1.00 0.00 C ATOM 577 C HIS A 36 129.282 -5.026 -1.450 1.00 0.00 C ATOM 578 O HIS A 36 130.212 -4.793 -2.222 1.00 0.00 O ATOM 579 CB HIS A 36 129.409 -7.450 -2.027 1.00 0.00 C ATOM 580 CG HIS A 36 129.737 -8.773 -1.392 1.00 0.00 C ATOM 581 ND1 HIS A 36 130.020 -8.895 -0.041 1.00 0.00 N ATOM 582 CD2 HIS A 36 129.831 -10.041 -1.911 1.00 0.00 C ATOM 583 CE1 HIS A 36 130.269 -10.195 0.205 1.00 0.00 C ATOM 584 NE2 HIS A 36 130.167 -10.936 -0.900 1.00 0.00 N ATOM 0 H HIS A 36 127.146 -7.348 -1.073 1.00 0.00 H new ATOM 0 HA HIS A 36 129.653 -6.608 -0.058 1.00 0.00 H new ATOM 0 HB2 HIS A 36 128.584 -7.566 -2.730 1.00 0.00 H new ATOM 0 HB3 HIS A 36 130.264 -7.086 -2.596 1.00 0.00 H new ATOM 0 HD2 HIS A 36 129.669 -10.303 -2.946 1.00 0.00 H new ATOM 0 HE1 HIS A 36 130.521 -10.590 1.178 1.00 0.00 H new ATOM 0 HE2 HIS A 36 130.306 -11.943 -0.985 1.00 0.00 H new ATOM 593 N TRP A 37 128.454 -4.081 -1.015 1.00 0.00 N ATOM 594 CA TRP A 37 128.614 -2.699 -1.444 1.00 0.00 C ATOM 595 C TRP A 37 129.652 -1.991 -0.578 1.00 0.00 C ATOM 596 O TRP A 37 130.478 -1.232 -1.084 1.00 0.00 O ATOM 597 CB TRP A 37 127.273 -1.968 -1.367 1.00 0.00 C ATOM 598 CG TRP A 37 127.087 -1.390 -0.001 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.215 -1.852 0.923 1.00 0.00 C ATOM 600 CD2 TRP A 37 127.767 -0.255 0.607 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.311 -1.068 2.059 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.257 -0.074 1.914 1.00 0.00 C ATOM 603 CE3 TRP A 37 128.767 0.626 0.158 1.00 0.00 C ATOM 604 CZ2 TRP A 37 127.720 0.945 2.745 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.237 1.653 0.993 1.00 0.00 C ATOM 606 CH2 TRP A 37 128.714 1.811 2.284 1.00 0.00 C ATOM 0 H TRP A 37 127.677 -4.245 -0.375 1.00 0.00 H new ATOM 0 HA TRP A 37 128.961 -2.691 -2.477 1.00 0.00 H new ATOM 0 HB2 TRP A 37 127.237 -1.176 -2.115 1.00 0.00 H new ATOM 0 HB3 TRP A 37 126.460 -2.657 -1.594 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.552 -2.695 0.795 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.751 -1.208 2.900 1.00 0.00 H new ATOM 0 HE3 TRP A 37 129.176 0.512 -0.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.313 1.064 3.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.005 2.324 0.639 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.080 2.602 2.922 1.00 0.00 H new ATOM 617 N CYS A 38 129.613 -2.253 0.725 1.00 0.00 N ATOM 618 CA CYS A 38 130.567 -1.640 1.642 1.00 0.00 C ATOM 619 C CYS A 38 131.906 -2.371 1.580 1.00 0.00 C ATOM 620 O CYS A 38 132.959 -1.748 1.448 1.00 0.00 O ATOM 621 CB CYS A 38 130.026 -1.679 3.074 1.00 0.00 C ATOM 622 SG CYS A 38 130.098 -0.020 3.792 1.00 0.00 S ATOM 0 H CYS A 38 128.939 -2.879 1.166 1.00 0.00 H new ATOM 0 HA CYS A 38 130.713 -0.602 1.344 1.00 0.00 H new ATOM 0 HB2 CYS A 38 128.999 -2.043 3.076 1.00 0.00 H new ATOM 0 HB3 CYS A 38 130.612 -2.373 3.677 1.00 0.00 H new ATOM 0 HG CYS A 38 129.297 0.770 3.140 1.00 0.00 H new ATOM 628 N PRO A 39 131.878 -3.674 1.673 1.00 0.00 N ATOM 629 CA PRO A 39 133.096 -4.519 1.627 1.00 0.00 C ATOM 630 C PRO A 39 133.458 -4.932 0.201 1.00 0.00 C ATOM 631 O PRO A 39 132.645 -4.809 -0.716 1.00 0.00 O ATOM 632 CB PRO A 39 132.698 -5.733 2.465 1.00 0.00 C ATOM 633 CG PRO A 39 131.207 -5.846 2.344 1.00 0.00 C ATOM 634 CD PRO A 39 130.673 -4.497 1.834 1.00 0.00 C ATOM 0 HA PRO A 39 133.980 -4.001 1.997 1.00 0.00 H new ATOM 0 HB2 PRO A 39 133.189 -6.636 2.102 1.00 0.00 H new ATOM 0 HB3 PRO A 39 132.997 -5.604 3.505 1.00 0.00 H new ATOM 0 HG2 PRO A 39 130.939 -6.648 1.656 1.00 0.00 H new ATOM 0 HG3 PRO A 39 130.763 -6.093 3.308 1.00 0.00 H new ATOM 0 HD2 PRO A 39 130.139 -4.610 0.891 1.00 0.00 H new ATOM 0 HD3 PRO A 39 129.976 -4.050 2.543 1.00 0.00 H new ATOM 642 N PRO A 40 134.654 -5.417 0.007 1.00 0.00 N ATOM 643 CA PRO A 40 135.137 -5.860 -1.334 1.00 0.00 C ATOM 644 C PRO A 40 134.458 -7.149 -1.794 1.00 0.00 C ATOM 645 O PRO A 40 133.967 -7.928 -0.977 1.00 0.00 O ATOM 646 CB PRO A 40 136.638 -6.076 -1.128 1.00 0.00 C ATOM 647 CG PRO A 40 136.809 -6.334 0.333 1.00 0.00 C ATOM 648 CD PRO A 40 135.678 -5.593 1.047 1.00 0.00 C ATOM 0 HA PRO A 40 134.911 -5.130 -2.111 1.00 0.00 H new ATOM 0 HB2 PRO A 40 136.998 -6.918 -1.720 1.00 0.00 H new ATOM 0 HB3 PRO A 40 137.207 -5.200 -1.441 1.00 0.00 H new ATOM 0 HG2 PRO A 40 136.766 -7.402 0.545 1.00 0.00 H new ATOM 0 HG3 PRO A 40 137.781 -5.980 0.677 1.00 0.00 H new ATOM 0 HD2 PRO A 40 135.295 -6.167 1.891 1.00 0.00 H new ATOM 0 HD3 PRO A 40 136.015 -4.634 1.441 1.00 0.00 H new ATOM 656 N CYS A 41 134.437 -7.364 -3.106 1.00 0.00 N ATOM 657 CA CYS A 41 133.816 -8.561 -3.666 1.00 0.00 C ATOM 658 C CYS A 41 133.390 -8.315 -5.110 1.00 0.00 C ATOM 659 O CYS A 41 132.318 -8.748 -5.535 1.00 0.00 O ATOM 660 CB CYS A 41 132.596 -8.955 -2.830 1.00 0.00 C ATOM 661 SG CYS A 41 133.076 -10.211 -1.618 1.00 0.00 S ATOM 0 H CYS A 41 134.839 -6.731 -3.797 1.00 0.00 H new ATOM 0 HA CYS A 41 134.545 -9.371 -3.647 1.00 0.00 H new ATOM 0 HB2 CYS A 41 132.192 -8.080 -2.322 1.00 0.00 H new ATOM 0 HB3 CYS A 41 131.808 -9.341 -3.477 1.00 0.00 H new ATOM 0 HG CYS A 41 132.038 -10.927 -1.301 1.00 0.00 H new ATOM 667 N ARG A 42 134.237 -7.616 -5.858 1.00 0.00 N ATOM 668 CA ARG A 42 133.941 -7.313 -7.255 1.00 0.00 C ATOM 669 C ARG A 42 134.282 -8.501 -8.152 1.00 0.00 C ATOM 670 O ARG A 42 135.193 -9.274 -7.856 1.00 0.00 O ATOM 671 CB ARG A 42 134.742 -6.089 -7.703 1.00 0.00 C ATOM 672 CG ARG A 42 133.901 -4.827 -7.501 1.00 0.00 C ATOM 673 CD ARG A 42 133.713 -4.573 -6.005 1.00 0.00 C ATOM 674 NE ARG A 42 133.771 -3.142 -5.725 1.00 0.00 N ATOM 675 CZ ARG A 42 134.261 -2.686 -4.578 1.00 0.00 C ATOM 676 NH1 ARG A 42 134.703 -3.522 -3.678 1.00 0.00 N ATOM 677 NH2 ARG A 42 134.302 -1.402 -4.351 1.00 0.00 N ATOM 0 H ARG A 42 135.129 -7.250 -5.524 1.00 0.00 H new ATOM 0 HA ARG A 42 132.875 -7.105 -7.341 1.00 0.00 H new ATOM 0 HB2 ARG A 42 135.667 -6.018 -7.131 1.00 0.00 H new ATOM 0 HB3 ARG A 42 135.022 -6.188 -8.752 1.00 0.00 H new ATOM 0 HG2 ARG A 42 134.391 -3.972 -7.967 1.00 0.00 H new ATOM 0 HG3 ARG A 42 132.932 -4.942 -7.986 1.00 0.00 H new ATOM 0 HD2 ARG A 42 132.755 -4.976 -5.678 1.00 0.00 H new ATOM 0 HD3 ARG A 42 134.487 -5.093 -5.440 1.00 0.00 H new ATOM 0 HE ARG A 42 133.429 -2.481 -6.422 1.00 0.00 H new ATOM 0 HH11 ARG A 42 134.672 -4.526 -3.856 1.00 0.00 H new ATOM 0 HH12 ARG A 42 135.079 -3.171 -2.797 1.00 0.00 H new ATOM 0 HH21 ARG A 42 133.958 -0.748 -5.054 1.00 0.00 H new ATOM 0 HH22 ARG A 42 134.678 -1.052 -3.470 1.00 0.00 H new ATOM 691 N GLY A 43 133.544 -8.635 -9.250 1.00 0.00 N ATOM 692 CA GLY A 43 133.775 -9.729 -10.188 1.00 0.00 C ATOM 693 C GLY A 43 132.510 -10.556 -10.393 1.00 0.00 C ATOM 694 O GLY A 43 132.246 -11.037 -11.494 1.00 0.00 O ATOM 0 H GLY A 43 132.786 -8.004 -9.511 1.00 0.00 H new ATOM 0 HA2 GLY A 43 134.109 -9.327 -11.145 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.575 -10.369 -9.815 1.00 0.00 H new ATOM 698 N PHE A 44 131.730 -10.714 -9.329 1.00 0.00 N ATOM 699 CA PHE A 44 130.492 -11.483 -9.411 1.00 0.00 C ATOM 700 C PHE A 44 129.345 -10.600 -9.890 1.00 0.00 C ATOM 701 O PHE A 44 128.463 -11.047 -10.622 1.00 0.00 O ATOM 702 CB PHE A 44 130.148 -12.068 -8.040 1.00 0.00 C ATOM 703 CG PHE A 44 128.929 -12.952 -8.164 1.00 0.00 C ATOM 704 CD1 PHE A 44 127.663 -12.378 -8.333 1.00 0.00 C ATOM 705 CD2 PHE A 44 129.066 -14.343 -8.110 1.00 0.00 C ATOM 706 CE1 PHE A 44 126.533 -13.196 -8.449 1.00 0.00 C ATOM 707 CE2 PHE A 44 127.936 -15.163 -8.225 1.00 0.00 C ATOM 708 CZ PHE A 44 126.670 -14.589 -8.395 1.00 0.00 C ATOM 0 H PHE A 44 131.930 -10.324 -8.408 1.00 0.00 H new ATOM 0 HA PHE A 44 130.636 -12.293 -10.126 1.00 0.00 H new ATOM 0 HB2 PHE A 44 130.990 -12.643 -7.656 1.00 0.00 H new ATOM 0 HB3 PHE A 44 129.958 -11.266 -7.327 1.00 0.00 H new ATOM 0 HD1 PHE A 44 127.558 -11.304 -8.374 1.00 0.00 H new ATOM 0 HD2 PHE A 44 130.043 -14.785 -7.980 1.00 0.00 H new ATOM 0 HE1 PHE A 44 125.557 -12.754 -8.580 1.00 0.00 H new ATOM 0 HE2 PHE A 44 128.041 -16.237 -8.183 1.00 0.00 H new ATOM 0 HZ PHE A 44 125.799 -15.221 -8.485 1.00 0.00 H new ATOM 718 N THR A 45 129.362 -9.344 -9.462 1.00 0.00 N ATOM 719 CA THR A 45 128.316 -8.402 -9.841 1.00 0.00 C ATOM 720 C THR A 45 128.197 -8.294 -11.358 1.00 0.00 C ATOM 721 O THR A 45 127.135 -8.560 -11.922 1.00 0.00 O ATOM 722 CB THR A 45 128.599 -7.021 -9.240 1.00 0.00 C ATOM 723 OG1 THR A 45 128.088 -6.973 -7.915 1.00 0.00 O ATOM 724 CG2 THR A 45 127.924 -5.940 -10.088 1.00 0.00 C ATOM 0 H THR A 45 130.084 -8.955 -8.856 1.00 0.00 H new ATOM 0 HA THR A 45 127.370 -8.776 -9.448 1.00 0.00 H new ATOM 0 HB THR A 45 129.675 -6.845 -9.225 1.00 0.00 H new ATOM 0 HG1 THR A 45 128.268 -6.092 -7.527 1.00 0.00 H new ATOM 0 HG21 THR A 45 128.128 -4.960 -9.657 1.00 0.00 H new ATOM 0 HG22 THR A 45 128.315 -5.978 -11.105 1.00 0.00 H new ATOM 0 HG23 THR A 45 126.848 -6.112 -10.107 1.00 0.00 H new ATOM 732 N PRO A 46 129.251 -7.913 -12.025 1.00 0.00 N ATOM 733 CA PRO A 46 129.250 -7.771 -13.508 1.00 0.00 C ATOM 734 C PRO A 46 128.729 -9.024 -14.202 1.00 0.00 C ATOM 735 O PRO A 46 128.452 -9.007 -15.401 1.00 0.00 O ATOM 736 CB PRO A 46 130.720 -7.509 -13.871 1.00 0.00 C ATOM 737 CG PRO A 46 131.512 -7.764 -12.628 1.00 0.00 C ATOM 738 CD PRO A 46 130.557 -7.576 -11.453 1.00 0.00 C ATOM 0 HA PRO A 46 128.589 -6.968 -13.835 1.00 0.00 H new ATOM 0 HB2 PRO A 46 131.044 -8.165 -14.679 1.00 0.00 H new ATOM 0 HB3 PRO A 46 130.858 -6.485 -14.217 1.00 0.00 H new ATOM 0 HG2 PRO A 46 131.926 -8.772 -12.633 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.353 -7.075 -12.557 1.00 0.00 H new ATOM 0 HD2 PRO A 46 130.812 -8.230 -10.619 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.579 -6.554 -11.076 1.00 0.00 H new ATOM 746 N ILE A 47 128.588 -10.106 -13.444 1.00 0.00 N ATOM 747 CA ILE A 47 128.088 -11.351 -14.011 1.00 0.00 C ATOM 748 C ILE A 47 126.567 -11.350 -14.006 1.00 0.00 C ATOM 749 O ILE A 47 125.930 -11.586 -15.034 1.00 0.00 O ATOM 750 CB ILE A 47 128.603 -12.545 -13.210 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.134 -12.515 -13.185 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.124 -13.840 -13.868 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.681 -13.939 -13.311 1.00 0.00 C ATOM 0 H ILE A 47 128.810 -10.146 -12.449 1.00 0.00 H new ATOM 0 HA ILE A 47 128.446 -11.433 -15.037 1.00 0.00 H new ATOM 0 HB ILE A 47 128.223 -12.496 -12.190 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.508 -11.898 -14.002 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.483 -12.062 -12.257 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.490 -14.694 -13.299 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.034 -13.857 -13.887 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.506 -13.893 -14.888 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.771 -13.913 -13.293 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.318 -14.543 -12.479 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.344 -14.376 -14.251 1.00 0.00 H new ATOM 765 N LEU A 48 125.991 -11.068 -12.845 1.00 0.00 N ATOM 766 CA LEU A 48 124.545 -11.026 -12.720 1.00 0.00 C ATOM 767 C LEU A 48 123.995 -9.839 -13.504 1.00 0.00 C ATOM 768 O LEU A 48 122.882 -9.890 -14.026 1.00 0.00 O ATOM 769 CB LEU A 48 124.151 -10.928 -11.240 1.00 0.00 C ATOM 770 CG LEU A 48 123.280 -9.695 -11.001 1.00 0.00 C ATOM 771 CD1 LEU A 48 121.943 -9.860 -11.725 1.00 0.00 C ATOM 772 CD2 LEU A 48 123.027 -9.539 -9.500 1.00 0.00 C ATOM 0 H LEU A 48 126.500 -10.867 -11.984 1.00 0.00 H new ATOM 0 HA LEU A 48 124.119 -11.942 -13.130 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.611 -11.826 -10.941 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.047 -10.874 -10.621 1.00 0.00 H new ATOM 0 HG LEU A 48 123.791 -8.811 -11.383 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.325 -8.979 -11.552 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.120 -9.975 -12.794 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.430 -10.743 -11.345 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.406 -8.660 -9.325 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.516 -10.425 -9.123 1.00 0.00 H new ATOM 0 HD23 LEU A 48 123.978 -9.420 -8.981 1.00 0.00 H new ATOM 784 N ALA A 49 124.785 -8.771 -13.594 1.00 0.00 N ATOM 785 CA ALA A 49 124.359 -7.588 -14.329 1.00 0.00 C ATOM 786 C ALA A 49 124.297 -7.888 -15.821 1.00 0.00 C ATOM 787 O ALA A 49 123.489 -7.312 -16.548 1.00 0.00 O ATOM 788 CB ALA A 49 125.328 -6.432 -14.073 1.00 0.00 C ATOM 0 H ALA A 49 125.711 -8.702 -13.172 1.00 0.00 H new ATOM 0 HA ALA A 49 123.365 -7.303 -13.984 1.00 0.00 H new ATOM 0 HB1 ALA A 49 125.000 -5.553 -14.627 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.348 -6.203 -13.008 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.328 -6.716 -14.401 1.00 0.00 H new ATOM 794 N ASP A 50 125.140 -8.805 -16.272 1.00 0.00 N ATOM 795 CA ASP A 50 125.142 -9.178 -17.677 1.00 0.00 C ATOM 796 C ASP A 50 123.999 -10.146 -17.938 1.00 0.00 C ATOM 797 O ASP A 50 123.449 -10.202 -19.040 1.00 0.00 O ATOM 798 CB ASP A 50 126.475 -9.830 -18.052 1.00 0.00 C ATOM 799 CG ASP A 50 127.532 -8.757 -18.291 1.00 0.00 C ATOM 800 OD1 ASP A 50 127.179 -7.590 -18.270 1.00 0.00 O ATOM 801 OD2 ASP A 50 128.679 -9.120 -18.491 1.00 0.00 O ATOM 0 H ASP A 50 125.822 -9.298 -15.695 1.00 0.00 H new ATOM 0 HA ASP A 50 125.011 -8.284 -18.287 1.00 0.00 H new ATOM 0 HB2 ASP A 50 126.799 -10.500 -17.255 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.353 -10.437 -18.949 1.00 0.00 H new ATOM 806 N MET A 51 123.642 -10.901 -16.905 1.00 0.00 N ATOM 807 CA MET A 51 122.557 -11.863 -17.014 1.00 0.00 C ATOM 808 C MET A 51 121.211 -11.153 -16.991 1.00 0.00 C ATOM 809 O MET A 51 120.386 -11.341 -17.886 1.00 0.00 O ATOM 810 CB MET A 51 122.634 -12.867 -15.863 1.00 0.00 C ATOM 811 CG MET A 51 122.089 -14.217 -16.327 1.00 0.00 C ATOM 812 SD MET A 51 120.286 -14.126 -16.440 1.00 0.00 S ATOM 813 CE MET A 51 119.942 -14.459 -14.698 1.00 0.00 C ATOM 0 H MET A 51 124.087 -10.864 -15.988 1.00 0.00 H new ATOM 0 HA MET A 51 122.656 -12.393 -17.961 1.00 0.00 H new ATOM 0 HB2 MET A 51 123.666 -12.975 -15.529 1.00 0.00 H new ATOM 0 HB3 MET A 51 122.059 -12.504 -15.011 1.00 0.00 H new ATOM 0 HG2 MET A 51 122.513 -14.480 -17.296 1.00 0.00 H new ATOM 0 HG3 MET A 51 122.382 -15.000 -15.628 1.00 0.00 H new ATOM 0 HE1 MET A 51 119.508 -15.454 -14.596 1.00 0.00 H new ATOM 0 HE2 MET A 51 120.869 -14.407 -14.128 1.00 0.00 H new ATOM 0 HE3 MET A 51 119.240 -13.717 -14.317 1.00 0.00 H new ATOM 823 N TYR A 52 120.995 -10.331 -15.972 1.00 0.00 N ATOM 824 CA TYR A 52 119.740 -9.601 -15.868 1.00 0.00 C ATOM 825 C TYR A 52 119.663 -8.560 -16.975 1.00 0.00 C ATOM 826 O TYR A 52 118.576 -8.162 -17.391 1.00 0.00 O ATOM 827 CB TYR A 52 119.616 -8.933 -14.494 1.00 0.00 C ATOM 828 CG TYR A 52 120.027 -7.483 -14.590 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.250 -7.147 -15.169 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.182 -6.479 -14.101 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.637 -5.805 -15.263 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.569 -5.136 -14.193 1.00 0.00 C ATOM 833 CZ TYR A 52 120.796 -4.800 -14.774 1.00 0.00 C ATOM 834 OH TYR A 52 121.176 -3.476 -14.867 1.00 0.00 O ATOM 0 H TYR A 52 121.660 -10.155 -15.219 1.00 0.00 H new ATOM 0 HA TYR A 52 118.912 -10.302 -15.978 1.00 0.00 H new ATOM 0 HB2 TYR A 52 118.589 -9.006 -14.135 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.244 -9.451 -13.770 1.00 0.00 H new ATOM 0 HD1 TYR A 52 121.900 -7.923 -15.546 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.234 -6.740 -13.654 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.584 -5.546 -15.713 1.00 0.00 H new ATOM 0 HE2 TYR A 52 118.920 -4.360 -13.815 1.00 0.00 H new ATOM 0 HH TYR A 52 120.478 -2.907 -14.481 1.00 0.00 H new ATOM 844 N SER A 53 120.826 -8.132 -17.461 1.00 0.00 N ATOM 845 CA SER A 53 120.867 -7.151 -18.534 1.00 0.00 C ATOM 846 C SER A 53 120.347 -7.769 -19.822 1.00 0.00 C ATOM 847 O SER A 53 119.565 -7.151 -20.546 1.00 0.00 O ATOM 848 CB SER A 53 122.297 -6.647 -18.740 1.00 0.00 C ATOM 849 OG SER A 53 122.396 -6.025 -20.014 1.00 0.00 O ATOM 0 H SER A 53 121.739 -8.446 -17.132 1.00 0.00 H new ATOM 0 HA SER A 53 120.234 -6.307 -18.260 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.562 -5.939 -17.955 1.00 0.00 H new ATOM 0 HB3 SER A 53 123.001 -7.477 -18.672 1.00 0.00 H new ATOM 0 HG SER A 53 123.310 -5.699 -20.149 1.00 0.00 H new ATOM 855 N GLU A 54 120.767 -8.998 -20.095 1.00 0.00 N ATOM 856 CA GLU A 54 120.313 -9.689 -21.289 1.00 0.00 C ATOM 857 C GLU A 54 118.831 -10.009 -21.147 1.00 0.00 C ATOM 858 O GLU A 54 118.011 -9.627 -21.986 1.00 0.00 O ATOM 859 CB GLU A 54 121.122 -10.975 -21.490 1.00 0.00 C ATOM 860 CG GLU A 54 120.186 -12.125 -21.861 1.00 0.00 C ATOM 861 CD GLU A 54 120.987 -13.279 -22.454 1.00 0.00 C ATOM 862 OE1 GLU A 54 122.195 -13.142 -22.561 1.00 0.00 O ATOM 863 OE2 GLU A 54 120.381 -14.281 -22.794 1.00 0.00 O ATOM 0 H GLU A 54 121.414 -9.529 -19.512 1.00 0.00 H new ATOM 0 HA GLU A 54 120.461 -9.052 -22.161 1.00 0.00 H new ATOM 0 HB2 GLU A 54 121.863 -10.830 -22.276 1.00 0.00 H new ATOM 0 HB3 GLU A 54 121.668 -11.218 -20.578 1.00 0.00 H new ATOM 0 HG2 GLU A 54 119.645 -12.463 -20.978 1.00 0.00 H new ATOM 0 HG3 GLU A 54 119.441 -11.782 -22.579 1.00 0.00 H new ATOM 870 N LEU A 55 118.492 -10.700 -20.065 1.00 0.00 N ATOM 871 CA LEU A 55 117.107 -11.052 -19.808 1.00 0.00 C ATOM 872 C LEU A 55 116.244 -9.797 -19.776 1.00 0.00 C ATOM 873 O LEU A 55 115.117 -9.801 -20.265 1.00 0.00 O ATOM 874 CB LEU A 55 116.990 -11.795 -18.474 1.00 0.00 C ATOM 875 CG LEU A 55 116.954 -13.302 -18.732 1.00 0.00 C ATOM 876 CD1 LEU A 55 116.871 -14.048 -17.398 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.726 -13.648 -19.579 1.00 0.00 C ATOM 0 H LEU A 55 119.153 -11.024 -19.359 1.00 0.00 H new ATOM 0 HA LEU A 55 116.758 -11.703 -20.610 1.00 0.00 H new ATOM 0 HB2 LEU A 55 117.834 -11.545 -17.831 1.00 0.00 H new ATOM 0 HB3 LEU A 55 116.087 -11.483 -17.950 1.00 0.00 H new ATOM 0 HG LEU A 55 117.859 -13.598 -19.262 1.00 0.00 H new ATOM 0 HD11 LEU A 55 116.845 -15.122 -17.583 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.743 -13.805 -16.790 1.00 0.00 H new ATOM 0 HD13 LEU A 55 115.966 -13.749 -16.870 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.701 -14.722 -19.762 1.00 0.00 H new ATOM 0 HD22 LEU A 55 114.822 -13.350 -19.048 1.00 0.00 H new ATOM 0 HD23 LEU A 55 115.779 -13.119 -20.530 1.00 0.00 H new ATOM 889 N VAL A 56 116.785 -8.717 -19.209 1.00 0.00 N ATOM 890 CA VAL A 56 116.046 -7.461 -19.138 1.00 0.00 C ATOM 891 C VAL A 56 115.727 -6.977 -20.539 1.00 0.00 C ATOM 892 O VAL A 56 114.596 -6.587 -20.832 1.00 0.00 O ATOM 893 CB VAL A 56 116.860 -6.408 -18.386 1.00 0.00 C ATOM 894 CG1 VAL A 56 116.315 -5.016 -18.705 1.00 0.00 C ATOM 895 CG2 VAL A 56 116.751 -6.663 -16.880 1.00 0.00 C ATOM 0 H VAL A 56 117.718 -8.688 -18.799 1.00 0.00 H new ATOM 0 HA VAL A 56 115.114 -7.627 -18.597 1.00 0.00 H new ATOM 0 HB VAL A 56 117.904 -6.468 -18.694 1.00 0.00 H new ATOM 0 HG11 VAL A 56 116.896 -4.266 -18.168 1.00 0.00 H new ATOM 0 HG12 VAL A 56 116.389 -4.833 -19.777 1.00 0.00 H new ATOM 0 HG13 VAL A 56 115.271 -4.955 -18.397 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.331 -5.913 -16.341 1.00 0.00 H new ATOM 0 HG22 VAL A 56 115.706 -6.602 -16.575 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.138 -7.656 -16.650 1.00 0.00 H new ATOM 905 N ASP A 57 116.722 -7.035 -21.407 1.00 0.00 N ATOM 906 CA ASP A 57 116.525 -6.632 -22.786 1.00 0.00 C ATOM 907 C ASP A 57 115.377 -7.439 -23.371 1.00 0.00 C ATOM 908 O ASP A 57 114.640 -6.970 -24.237 1.00 0.00 O ATOM 909 CB ASP A 57 117.801 -6.892 -23.581 1.00 0.00 C ATOM 910 CG ASP A 57 117.803 -6.061 -24.859 1.00 0.00 C ATOM 911 OD1 ASP A 57 116.889 -6.225 -25.650 1.00 0.00 O ATOM 912 OD2 ASP A 57 118.718 -5.272 -25.028 1.00 0.00 O ATOM 0 H ASP A 57 117.665 -7.354 -21.184 1.00 0.00 H new ATOM 0 HA ASP A 57 116.289 -5.569 -22.835 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.673 -6.643 -22.975 1.00 0.00 H new ATOM 0 HB3 ASP A 57 117.875 -7.951 -23.827 1.00 0.00 H new ATOM 917 N ASP A 58 115.236 -8.661 -22.869 1.00 0.00 N ATOM 918 CA ASP A 58 114.176 -9.553 -23.316 1.00 0.00 C ATOM 919 C ASP A 58 112.962 -9.420 -22.410 1.00 0.00 C ATOM 920 O ASP A 58 112.127 -10.321 -22.331 1.00 0.00 O ATOM 921 CB ASP A 58 114.672 -10.999 -23.288 1.00 0.00 C ATOM 922 CG ASP A 58 114.758 -11.551 -24.706 1.00 0.00 C ATOM 923 OD1 ASP A 58 115.314 -10.872 -25.553 1.00 0.00 O ATOM 924 OD2 ASP A 58 114.266 -12.645 -24.926 1.00 0.00 O ATOM 0 H ASP A 58 115.844 -9.056 -22.151 1.00 0.00 H new ATOM 0 HA ASP A 58 113.895 -9.282 -24.334 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.651 -11.047 -22.811 1.00 0.00 H new ATOM 0 HB3 ASP A 58 113.996 -11.612 -22.691 1.00 0.00 H new ATOM 929 N SER A 59 112.884 -8.296 -21.715 1.00 0.00 N ATOM 930 CA SER A 59 111.779 -8.057 -20.795 1.00 0.00 C ATOM 931 C SER A 59 111.934 -8.956 -19.578 1.00 0.00 C ATOM 932 O SER A 59 110.964 -9.275 -18.890 1.00 0.00 O ATOM 933 CB SER A 59 110.444 -8.339 -21.485 1.00 0.00 C ATOM 934 OG SER A 59 109.469 -7.417 -21.014 1.00 0.00 O ATOM 0 H SER A 59 113.566 -7.539 -21.768 1.00 0.00 H new ATOM 0 HA SER A 59 111.794 -7.013 -20.481 1.00 0.00 H new ATOM 0 HB2 SER A 59 110.554 -8.250 -22.566 1.00 0.00 H new ATOM 0 HB3 SER A 59 110.124 -9.361 -21.280 1.00 0.00 H new ATOM 0 HG SER A 59 108.612 -7.593 -21.455 1.00 0.00 H new ATOM 940 N ALA A 60 113.175 -9.357 -19.335 1.00 0.00 N ATOM 941 CA ALA A 60 113.507 -10.225 -18.212 1.00 0.00 C ATOM 942 C ALA A 60 112.253 -10.690 -17.477 1.00 0.00 C ATOM 943 O ALA A 60 111.749 -10.004 -16.589 1.00 0.00 O ATOM 944 CB ALA A 60 114.423 -9.480 -17.245 1.00 0.00 C ATOM 0 H ALA A 60 113.976 -9.092 -19.907 1.00 0.00 H new ATOM 0 HA ALA A 60 114.015 -11.107 -18.602 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.671 -10.129 -16.405 1.00 0.00 H new ATOM 0 HB2 ALA A 60 115.338 -9.189 -17.761 1.00 0.00 H new ATOM 0 HB3 ALA A 60 113.915 -8.589 -16.877 1.00 0.00 H new ATOM 950 N PRO A 61 111.754 -11.841 -17.837 1.00 0.00 N ATOM 951 CA PRO A 61 110.535 -12.435 -17.209 1.00 0.00 C ATOM 952 C PRO A 61 110.701 -12.673 -15.709 1.00 0.00 C ATOM 953 O PRO A 61 110.202 -13.663 -15.175 1.00 0.00 O ATOM 954 CB PRO A 61 110.352 -13.770 -17.944 1.00 0.00 C ATOM 955 CG PRO A 61 111.153 -13.660 -19.197 1.00 0.00 C ATOM 956 CD PRO A 61 112.299 -12.704 -18.893 1.00 0.00 C ATOM 0 HA PRO A 61 109.678 -11.767 -17.297 1.00 0.00 H new ATOM 0 HB2 PRO A 61 110.697 -14.603 -17.332 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.301 -13.952 -18.167 1.00 0.00 H new ATOM 0 HG2 PRO A 61 111.532 -14.635 -19.503 1.00 0.00 H new ATOM 0 HG3 PRO A 61 110.541 -13.284 -20.017 1.00 0.00 H new ATOM 0 HD2 PRO A 61 113.188 -13.237 -18.557 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.586 -12.129 -19.773 1.00 0.00 H new ATOM 964 N PHE A 62 111.389 -11.761 -15.032 1.00 0.00 N ATOM 965 CA PHE A 62 111.588 -11.899 -13.596 1.00 0.00 C ATOM 966 C PHE A 62 112.229 -10.648 -12.995 1.00 0.00 C ATOM 967 O PHE A 62 112.914 -9.894 -13.687 1.00 0.00 O ATOM 968 CB PHE A 62 112.438 -13.135 -13.311 1.00 0.00 C ATOM 969 CG PHE A 62 113.887 -12.753 -13.177 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.493 -11.949 -14.146 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.627 -13.216 -12.086 1.00 0.00 C ATOM 972 CE1 PHE A 62 115.842 -11.605 -14.023 1.00 0.00 C ATOM 973 CE2 PHE A 62 115.976 -12.875 -11.961 1.00 0.00 C ATOM 974 CZ PHE A 62 116.586 -12.068 -12.931 1.00 0.00 C ATOM 0 H PHE A 62 111.812 -10.931 -15.447 1.00 0.00 H new ATOM 0 HA PHE A 62 110.613 -12.019 -13.124 1.00 0.00 H new ATOM 0 HB2 PHE A 62 112.096 -13.617 -12.395 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.319 -13.860 -14.116 1.00 0.00 H new ATOM 0 HD1 PHE A 62 113.919 -11.594 -14.989 1.00 0.00 H new ATOM 0 HD2 PHE A 62 114.156 -13.838 -11.339 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.311 -10.982 -14.770 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.548 -13.233 -11.118 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.629 -11.804 -12.836 1.00 0.00 H new ATOM 984 N GLU A 63 111.985 -10.431 -11.704 1.00 0.00 N ATOM 985 CA GLU A 63 112.521 -9.263 -11.007 1.00 0.00 C ATOM 986 C GLU A 63 113.512 -9.672 -9.920 1.00 0.00 C ATOM 987 O GLU A 63 113.382 -10.733 -9.308 1.00 0.00 O ATOM 988 CB GLU A 63 111.373 -8.471 -10.376 1.00 0.00 C ATOM 989 CG GLU A 63 111.930 -7.520 -9.316 1.00 0.00 C ATOM 990 CD GLU A 63 111.928 -8.201 -7.951 1.00 0.00 C ATOM 991 OE1 GLU A 63 112.105 -9.408 -7.914 1.00 0.00 O ATOM 992 OE2 GLU A 63 111.751 -7.507 -6.965 1.00 0.00 O ATOM 0 H GLU A 63 111.420 -11.048 -11.120 1.00 0.00 H new ATOM 0 HA GLU A 63 113.047 -8.645 -11.735 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.842 -7.907 -11.143 1.00 0.00 H new ATOM 0 HB3 GLU A 63 110.652 -9.153 -9.925 1.00 0.00 H new ATOM 0 HG2 GLU A 63 112.944 -7.221 -9.581 1.00 0.00 H new ATOM 0 HG3 GLU A 63 111.329 -6.611 -9.279 1.00 0.00 H new ATOM 999 N ILE A 64 114.498 -8.810 -9.683 1.00 0.00 N ATOM 1000 CA ILE A 64 115.509 -9.073 -8.664 1.00 0.00 C ATOM 1001 C ILE A 64 115.218 -8.264 -7.403 1.00 0.00 C ATOM 1002 O ILE A 64 115.088 -7.041 -7.454 1.00 0.00 O ATOM 1003 CB ILE A 64 116.903 -8.712 -9.196 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.741 -9.984 -9.341 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.609 -7.761 -8.224 1.00 0.00 C ATOM 1006 CD1 ILE A 64 117.164 -10.855 -10.454 1.00 0.00 C ATOM 0 H ILE A 64 114.618 -7.928 -10.180 1.00 0.00 H new ATOM 0 HA ILE A 64 115.481 -10.135 -8.419 1.00 0.00 H new ATOM 0 HB ILE A 64 116.793 -8.225 -10.165 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.776 -9.726 -9.567 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.748 -10.536 -8.401 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.597 -7.512 -8.612 1.00 0.00 H new ATOM 0 HG22 ILE A 64 117.021 -6.849 -8.115 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.712 -8.244 -7.252 1.00 0.00 H new ATOM 0 HD11 ILE A 64 117.763 -11.760 -10.555 1.00 0.00 H new ATOM 0 HD12 ILE A 64 116.137 -11.125 -10.209 1.00 0.00 H new ATOM 0 HD13 ILE A 64 117.180 -10.303 -11.394 1.00 0.00 H new ATOM 1018 N ILE A 65 115.133 -8.953 -6.271 1.00 0.00 N ATOM 1019 CA ILE A 65 114.877 -8.284 -5.003 1.00 0.00 C ATOM 1020 C ILE A 65 116.196 -7.808 -4.405 1.00 0.00 C ATOM 1021 O ILE A 65 117.187 -8.542 -4.412 1.00 0.00 O ATOM 1022 CB ILE A 65 114.184 -9.240 -4.029 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.157 -10.089 -4.787 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.472 -8.436 -2.941 1.00 0.00 C ATOM 1025 CD1 ILE A 65 111.846 -9.311 -4.919 1.00 0.00 C ATOM 0 H ILE A 65 115.237 -9.966 -6.206 1.00 0.00 H new ATOM 0 HA ILE A 65 114.225 -7.428 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 65 114.929 -9.891 -3.572 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.540 -10.346 -5.775 1.00 0.00 H new ATOM 0 HG13 ILE A 65 112.984 -11.026 -4.258 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.979 -9.118 -2.248 1.00 0.00 H new ATOM 0 HG22 ILE A 65 114.200 -7.832 -2.399 1.00 0.00 H new ATOM 0 HG23 ILE A 65 112.728 -7.784 -3.399 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.117 -9.916 -5.458 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.461 -9.077 -3.927 1.00 0.00 H new ATOM 0 HD13 ILE A 65 112.026 -8.386 -5.466 1.00 0.00 H new ATOM 1037 N PHE A 66 116.213 -6.579 -3.898 1.00 0.00 N ATOM 1038 CA PHE A 66 117.430 -6.030 -3.315 1.00 0.00 C ATOM 1039 C PHE A 66 117.443 -6.210 -1.800 1.00 0.00 C ATOM 1040 O PHE A 66 116.665 -5.582 -1.081 1.00 0.00 O ATOM 1041 CB PHE A 66 117.547 -4.544 -3.656 1.00 0.00 C ATOM 1042 CG PHE A 66 119.003 -4.180 -3.823 1.00 0.00 C ATOM 1043 CD1 PHE A 66 119.732 -4.687 -4.906 1.00 0.00 C ATOM 1044 CD2 PHE A 66 119.625 -3.335 -2.895 1.00 0.00 C ATOM 1045 CE1 PHE A 66 121.081 -4.350 -5.059 1.00 0.00 C ATOM 1046 CE2 PHE A 66 120.974 -2.998 -3.049 1.00 0.00 C ATOM 1047 CZ PHE A 66 121.703 -3.505 -4.132 1.00 0.00 C ATOM 0 H PHE A 66 115.409 -5.952 -3.879 1.00 0.00 H new ATOM 0 HA PHE A 66 118.279 -6.570 -3.734 1.00 0.00 H new ATOM 0 HB2 PHE A 66 116.999 -4.326 -4.573 1.00 0.00 H new ATOM 0 HB3 PHE A 66 117.099 -3.942 -2.866 1.00 0.00 H new ATOM 0 HD1 PHE A 66 119.253 -5.338 -5.623 1.00 0.00 H new ATOM 0 HD2 PHE A 66 119.063 -2.943 -2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 66 121.644 -4.742 -5.893 1.00 0.00 H new ATOM 0 HE2 PHE A 66 121.453 -2.347 -2.333 1.00 0.00 H new ATOM 0 HZ PHE A 66 122.744 -3.244 -4.252 1.00 0.00 H new ATOM 1057 N VAL A 67 118.341 -7.067 -1.326 1.00 0.00 N ATOM 1058 CA VAL A 67 118.466 -7.323 0.104 1.00 0.00 C ATOM 1059 C VAL A 67 119.921 -7.177 0.532 1.00 0.00 C ATOM 1060 O VAL A 67 120.744 -6.650 -0.217 1.00 0.00 O ATOM 1061 CB VAL A 67 117.971 -8.733 0.431 1.00 0.00 C ATOM 1062 CG1 VAL A 67 117.206 -8.713 1.754 1.00 0.00 C ATOM 1063 CG2 VAL A 67 117.044 -9.218 -0.686 1.00 0.00 C ATOM 0 H VAL A 67 118.991 -7.594 -1.909 1.00 0.00 H new ATOM 0 HA VAL A 67 117.858 -6.598 0.646 1.00 0.00 H new ATOM 0 HB VAL A 67 118.824 -9.406 0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 67 116.854 -9.718 1.986 1.00 0.00 H new ATOM 0 HG12 VAL A 67 117.865 -8.367 2.550 1.00 0.00 H new ATOM 0 HG13 VAL A 67 116.353 -8.040 1.671 1.00 0.00 H new ATOM 0 HG21 VAL A 67 116.690 -10.223 -0.455 1.00 0.00 H new ATOM 0 HG22 VAL A 67 116.192 -8.544 -0.770 1.00 0.00 H new ATOM 0 HG23 VAL A 67 117.589 -9.234 -1.630 1.00 0.00 H new ATOM 1073 N SER A 68 120.240 -7.647 1.733 1.00 0.00 N ATOM 1074 CA SER A 68 121.608 -7.557 2.227 1.00 0.00 C ATOM 1075 C SER A 68 121.866 -6.186 2.846 1.00 0.00 C ATOM 1076 O SER A 68 121.263 -5.193 2.443 1.00 0.00 O ATOM 1077 CB SER A 68 122.587 -7.797 1.081 1.00 0.00 C ATOM 1078 OG SER A 68 123.086 -6.550 0.618 1.00 0.00 O ATOM 0 H SER A 68 119.580 -8.088 2.374 1.00 0.00 H new ATOM 0 HA SER A 68 121.752 -8.318 2.994 1.00 0.00 H new ATOM 0 HB2 SER A 68 123.410 -8.428 1.417 1.00 0.00 H new ATOM 0 HB3 SER A 68 122.090 -8.327 0.268 1.00 0.00 H new ATOM 0 HG SER A 68 122.430 -6.138 0.017 1.00 0.00 H new ATOM 1084 N SER A 69 122.756 -6.145 3.832 1.00 0.00 N ATOM 1085 CA SER A 69 123.087 -4.895 4.512 1.00 0.00 C ATOM 1086 C SER A 69 123.346 -3.769 3.511 1.00 0.00 C ATOM 1087 O SER A 69 124.472 -3.288 3.382 1.00 0.00 O ATOM 1088 CB SER A 69 124.324 -5.092 5.387 1.00 0.00 C ATOM 1089 OG SER A 69 124.205 -4.289 6.555 1.00 0.00 O ATOM 0 H SER A 69 123.261 -6.961 4.179 1.00 0.00 H new ATOM 0 HA SER A 69 122.235 -4.614 5.132 1.00 0.00 H new ATOM 0 HB2 SER A 69 124.426 -6.142 5.662 1.00 0.00 H new ATOM 0 HB3 SER A 69 125.223 -4.819 4.834 1.00 0.00 H new ATOM 0 HG SER A 69 124.996 -4.414 7.120 1.00 0.00 H new ATOM 1095 N ASP A 70 122.295 -3.345 2.819 1.00 0.00 N ATOM 1096 CA ASP A 70 122.409 -2.265 1.844 1.00 0.00 C ATOM 1097 C ASP A 70 122.017 -0.946 2.491 1.00 0.00 C ATOM 1098 O ASP A 70 121.821 0.059 1.809 1.00 0.00 O ATOM 1099 CB ASP A 70 121.501 -2.524 0.643 1.00 0.00 C ATOM 1100 CG ASP A 70 121.459 -4.014 0.326 1.00 0.00 C ATOM 1101 OD1 ASP A 70 122.481 -4.542 -0.078 1.00 0.00 O ATOM 1102 OD2 ASP A 70 120.404 -4.603 0.490 1.00 0.00 O ATOM 0 H ASP A 70 121.356 -3.731 2.914 1.00 0.00 H new ATOM 0 HA ASP A 70 123.443 -2.218 1.502 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.495 -2.161 0.854 1.00 0.00 H new ATOM 0 HB3 ASP A 70 121.865 -1.971 -0.223 1.00 0.00 H new ATOM 1107 N ARG A 71 121.878 -0.975 3.811 1.00 0.00 N ATOM 1108 CA ARG A 71 121.485 0.207 4.569 1.00 0.00 C ATOM 1109 C ARG A 71 121.994 1.486 3.912 1.00 0.00 C ATOM 1110 O ARG A 71 121.575 2.584 4.280 1.00 0.00 O ATOM 1111 CB ARG A 71 122.029 0.114 5.995 1.00 0.00 C ATOM 1112 CG ARG A 71 121.467 -1.136 6.676 1.00 0.00 C ATOM 1113 CD ARG A 71 121.628 -1.007 8.192 1.00 0.00 C ATOM 1114 NE ARG A 71 120.331 -0.776 8.818 1.00 0.00 N ATOM 1115 CZ ARG A 71 120.160 -0.945 10.126 1.00 0.00 C ATOM 1116 NH1 ARG A 71 121.162 -1.323 10.871 1.00 0.00 N ATOM 1117 NH2 ARG A 71 118.990 -0.732 10.663 1.00 0.00 N ATOM 0 H ARG A 71 122.032 -1.807 4.380 1.00 0.00 H new ATOM 0 HA ARG A 71 120.396 0.244 4.589 1.00 0.00 H new ATOM 0 HB2 ARG A 71 123.118 0.073 5.978 1.00 0.00 H new ATOM 0 HB3 ARG A 71 121.752 1.004 6.560 1.00 0.00 H new ATOM 0 HG2 ARG A 71 120.415 -1.260 6.421 1.00 0.00 H new ATOM 0 HG3 ARG A 71 121.989 -2.024 6.318 1.00 0.00 H new ATOM 0 HD2 ARG A 71 122.079 -1.914 8.596 1.00 0.00 H new ATOM 0 HD3 ARG A 71 122.304 -0.184 8.425 1.00 0.00 H new ATOM 0 HE ARG A 71 119.542 -0.480 8.243 1.00 0.00 H new ATOM 0 HH11 ARG A 71 122.076 -1.489 10.450 1.00 0.00 H new ATOM 0 HH12 ARG A 71 121.031 -1.453 11.874 1.00 0.00 H new ATOM 0 HH21 ARG A 71 118.207 -0.436 10.080 1.00 0.00 H new ATOM 0 HH22 ARG A 71 118.858 -0.861 11.666 1.00 0.00 H new ATOM 1131 N SER A 72 122.882 1.351 2.933 1.00 0.00 N ATOM 1132 CA SER A 72 123.402 2.520 2.246 1.00 0.00 C ATOM 1133 C SER A 72 122.452 2.922 1.127 1.00 0.00 C ATOM 1134 O SER A 72 122.309 2.206 0.137 1.00 0.00 O ATOM 1135 CB SER A 72 124.781 2.219 1.662 1.00 0.00 C ATOM 1136 OG SER A 72 125.781 2.728 2.537 1.00 0.00 O ATOM 0 H SER A 72 123.250 0.458 2.604 1.00 0.00 H new ATOM 0 HA SER A 72 123.490 3.338 2.961 1.00 0.00 H new ATOM 0 HB2 SER A 72 124.907 1.144 1.532 1.00 0.00 H new ATOM 0 HB3 SER A 72 124.878 2.673 0.676 1.00 0.00 H new ATOM 0 HG SER A 72 126.664 2.432 2.232 1.00 0.00 H new ATOM 1142 N GLU A 73 121.801 4.067 1.288 1.00 0.00 N ATOM 1143 CA GLU A 73 120.866 4.539 0.277 1.00 0.00 C ATOM 1144 C GLU A 73 121.612 4.896 -0.997 1.00 0.00 C ATOM 1145 O GLU A 73 121.069 4.793 -2.098 1.00 0.00 O ATOM 1146 CB GLU A 73 120.106 5.763 0.791 1.00 0.00 C ATOM 1147 CG GLU A 73 121.033 6.610 1.667 1.00 0.00 C ATOM 1148 CD GLU A 73 120.458 8.014 1.829 1.00 0.00 C ATOM 1149 OE1 GLU A 73 119.246 8.134 1.882 1.00 0.00 O ATOM 1150 OE2 GLU A 73 121.240 8.948 1.896 1.00 0.00 O ATOM 0 H GLU A 73 121.901 4.679 2.098 1.00 0.00 H new ATOM 0 HA GLU A 73 120.153 3.743 0.062 1.00 0.00 H new ATOM 0 HB2 GLU A 73 119.740 6.355 -0.048 1.00 0.00 H new ATOM 0 HB3 GLU A 73 119.234 5.448 1.364 1.00 0.00 H new ATOM 0 HG2 GLU A 73 121.152 6.142 2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 73 122.024 6.664 1.217 1.00 0.00 H new ATOM 1157 N ASP A 74 122.864 5.304 -0.841 1.00 0.00 N ATOM 1158 CA ASP A 74 123.678 5.663 -1.991 1.00 0.00 C ATOM 1159 C ASP A 74 124.246 4.409 -2.638 1.00 0.00 C ATOM 1160 O ASP A 74 124.158 4.236 -3.854 1.00 0.00 O ATOM 1161 CB ASP A 74 124.816 6.591 -1.567 1.00 0.00 C ATOM 1162 CG ASP A 74 124.949 6.592 -0.047 1.00 0.00 C ATOM 1163 OD1 ASP A 74 124.163 7.267 0.596 1.00 0.00 O ATOM 1164 OD2 ASP A 74 125.834 5.917 0.451 1.00 0.00 O ATOM 0 H ASP A 74 123.333 5.394 0.060 1.00 0.00 H new ATOM 0 HA ASP A 74 123.051 6.185 -2.714 1.00 0.00 H new ATOM 0 HB2 ASP A 74 125.751 6.265 -2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 74 124.624 7.603 -1.924 1.00 0.00 H new ATOM 1169 N ASP A 75 124.820 3.528 -1.824 1.00 0.00 N ATOM 1170 CA ASP A 75 125.381 2.296 -2.349 1.00 0.00 C ATOM 1171 C ASP A 75 124.257 1.376 -2.801 1.00 0.00 C ATOM 1172 O ASP A 75 124.471 0.451 -3.584 1.00 0.00 O ATOM 1173 CB ASP A 75 126.226 1.604 -1.279 1.00 0.00 C ATOM 1174 CG ASP A 75 127.043 2.640 -0.515 1.00 0.00 C ATOM 1175 OD1 ASP A 75 127.681 3.455 -1.160 1.00 0.00 O ATOM 1176 OD2 ASP A 75 127.020 2.602 0.704 1.00 0.00 O ATOM 0 H ASP A 75 124.907 3.644 -0.814 1.00 0.00 H new ATOM 0 HA ASP A 75 126.019 2.529 -3.201 1.00 0.00 H new ATOM 0 HB2 ASP A 75 125.581 1.057 -0.591 1.00 0.00 H new ATOM 0 HB3 ASP A 75 126.890 0.874 -1.743 1.00 0.00 H new ATOM 1181 N MET A 76 123.049 1.649 -2.311 1.00 0.00 N ATOM 1182 CA MET A 76 121.893 0.849 -2.681 1.00 0.00 C ATOM 1183 C MET A 76 121.434 1.219 -4.085 1.00 0.00 C ATOM 1184 O MET A 76 121.307 0.354 -4.953 1.00 0.00 O ATOM 1185 CB MET A 76 120.750 1.076 -1.688 1.00 0.00 C ATOM 1186 CG MET A 76 119.493 0.359 -2.184 1.00 0.00 C ATOM 1187 SD MET A 76 118.860 -0.723 -0.879 1.00 0.00 S ATOM 1188 CE MET A 76 118.854 0.503 0.453 1.00 0.00 C ATOM 0 H MET A 76 122.851 2.411 -1.663 1.00 0.00 H new ATOM 0 HA MET A 76 122.176 -0.204 -2.660 1.00 0.00 H new ATOM 0 HB2 MET A 76 121.030 0.702 -0.703 1.00 0.00 H new ATOM 0 HB3 MET A 76 120.554 2.143 -1.580 1.00 0.00 H new ATOM 0 HG2 MET A 76 118.734 1.088 -2.467 1.00 0.00 H new ATOM 0 HG3 MET A 76 119.722 -0.225 -3.076 1.00 0.00 H new ATOM 0 HE1 MET A 76 119.597 0.230 1.203 1.00 0.00 H new ATOM 0 HE2 MET A 76 119.095 1.485 0.045 1.00 0.00 H new ATOM 0 HE3 MET A 76 117.867 0.534 0.915 1.00 0.00 H new ATOM 1198 N PHE A 77 121.186 2.508 -4.310 1.00 0.00 N ATOM 1199 CA PHE A 77 120.743 2.965 -5.621 1.00 0.00 C ATOM 1200 C PHE A 77 121.886 2.891 -6.628 1.00 0.00 C ATOM 1201 O PHE A 77 121.664 2.653 -7.814 1.00 0.00 O ATOM 1202 CB PHE A 77 120.232 4.405 -5.533 1.00 0.00 C ATOM 1203 CG PHE A 77 119.505 4.610 -4.225 1.00 0.00 C ATOM 1204 CD1 PHE A 77 118.842 3.538 -3.614 1.00 0.00 C ATOM 1205 CD2 PHE A 77 119.492 5.873 -3.625 1.00 0.00 C ATOM 1206 CE1 PHE A 77 118.167 3.732 -2.403 1.00 0.00 C ATOM 1207 CE2 PHE A 77 118.817 6.067 -2.413 1.00 0.00 C ATOM 1208 CZ PHE A 77 118.155 4.996 -1.803 1.00 0.00 C ATOM 0 H PHE A 77 121.283 3.244 -3.610 1.00 0.00 H new ATOM 0 HA PHE A 77 119.934 2.315 -5.955 1.00 0.00 H new ATOM 0 HB2 PHE A 77 121.066 5.102 -5.609 1.00 0.00 H new ATOM 0 HB3 PHE A 77 119.564 4.615 -6.368 1.00 0.00 H new ATOM 0 HD1 PHE A 77 118.852 2.562 -4.077 1.00 0.00 H new ATOM 0 HD2 PHE A 77 120.003 6.700 -4.096 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.655 2.906 -1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 77 118.808 7.043 -1.950 1.00 0.00 H new ATOM 0 HZ PHE A 77 117.634 5.145 -0.869 1.00 0.00 H new ATOM 1218 N GLN A 78 123.107 3.100 -6.147 1.00 0.00 N ATOM 1219 CA GLN A 78 124.276 3.057 -7.018 1.00 0.00 C ATOM 1220 C GLN A 78 124.475 1.656 -7.583 1.00 0.00 C ATOM 1221 O GLN A 78 124.600 1.476 -8.795 1.00 0.00 O ATOM 1222 CB GLN A 78 125.524 3.480 -6.242 1.00 0.00 C ATOM 1223 CG GLN A 78 125.469 4.985 -5.967 1.00 0.00 C ATOM 1224 CD GLN A 78 126.099 5.750 -7.126 1.00 0.00 C ATOM 1225 OE1 GLN A 78 126.271 5.200 -8.214 1.00 0.00 O ATOM 1226 NE2 GLN A 78 126.454 6.995 -6.958 1.00 0.00 N ATOM 0 H GLN A 78 123.312 3.299 -5.168 1.00 0.00 H new ATOM 0 HA GLN A 78 124.112 3.748 -7.845 1.00 0.00 H new ATOM 0 HB2 GLN A 78 125.585 2.930 -5.303 1.00 0.00 H new ATOM 0 HB3 GLN A 78 126.420 3.236 -6.813 1.00 0.00 H new ATOM 0 HG2 GLN A 78 124.435 5.301 -5.832 1.00 0.00 H new ATOM 0 HG3 GLN A 78 125.996 5.213 -5.041 1.00 0.00 H new ATOM 0 HE21 GLN A 78 126.311 7.449 -6.056 1.00 0.00 H new ATOM 0 HE22 GLN A 78 126.875 7.514 -7.729 1.00 0.00 H new ATOM 1235 N TYR A 79 124.498 0.669 -6.699 1.00 0.00 N ATOM 1236 CA TYR A 79 124.677 -0.714 -7.124 1.00 0.00 C ATOM 1237 C TYR A 79 123.535 -1.136 -8.039 1.00 0.00 C ATOM 1238 O TYR A 79 123.744 -1.825 -9.036 1.00 0.00 O ATOM 1239 CB TYR A 79 124.729 -1.636 -5.905 1.00 0.00 C ATOM 1240 CG TYR A 79 126.169 -1.919 -5.550 1.00 0.00 C ATOM 1241 CD1 TYR A 79 126.988 -0.889 -5.074 1.00 0.00 C ATOM 1242 CD2 TYR A 79 126.686 -3.212 -5.699 1.00 0.00 C ATOM 1243 CE1 TYR A 79 128.323 -1.151 -4.746 1.00 0.00 C ATOM 1244 CE2 TYR A 79 128.021 -3.475 -5.371 1.00 0.00 C ATOM 1245 CZ TYR A 79 128.840 -2.444 -4.895 1.00 0.00 C ATOM 1246 OH TYR A 79 130.157 -2.702 -4.572 1.00 0.00 O ATOM 0 H TYR A 79 124.396 0.796 -5.692 1.00 0.00 H new ATOM 0 HA TYR A 79 125.617 -0.791 -7.671 1.00 0.00 H new ATOM 0 HB2 TYR A 79 124.220 -1.170 -5.061 1.00 0.00 H new ATOM 0 HB3 TYR A 79 124.206 -2.568 -6.118 1.00 0.00 H new ATOM 0 HD1 TYR A 79 126.590 0.108 -4.960 1.00 0.00 H new ATOM 0 HD2 TYR A 79 126.054 -4.007 -6.067 1.00 0.00 H new ATOM 0 HE1 TYR A 79 128.955 -0.356 -4.378 1.00 0.00 H new ATOM 0 HE2 TYR A 79 128.419 -4.472 -5.485 1.00 0.00 H new ATOM 0 HH TYR A 79 130.221 -3.577 -4.135 1.00 0.00 H new ATOM 1256 N MET A 80 122.327 -0.711 -7.691 1.00 0.00 N ATOM 1257 CA MET A 80 121.151 -1.043 -8.485 1.00 0.00 C ATOM 1258 C MET A 80 121.250 -0.417 -9.872 1.00 0.00 C ATOM 1259 O MET A 80 120.940 -1.057 -10.876 1.00 0.00 O ATOM 1260 CB MET A 80 119.888 -0.540 -7.785 1.00 0.00 C ATOM 1261 CG MET A 80 119.542 -1.472 -6.621 1.00 0.00 C ATOM 1262 SD MET A 80 118.492 -0.594 -5.437 1.00 0.00 S ATOM 1263 CE MET A 80 117.041 -0.423 -6.505 1.00 0.00 C ATOM 0 H MET A 80 122.136 -0.139 -6.869 1.00 0.00 H new ATOM 0 HA MET A 80 121.100 -2.127 -8.589 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.043 0.475 -7.418 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.059 -0.501 -8.492 1.00 0.00 H new ATOM 0 HG2 MET A 80 119.028 -2.359 -6.992 1.00 0.00 H new ATOM 0 HG3 MET A 80 120.454 -1.814 -6.131 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.180 -0.130 -5.905 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.233 0.339 -7.260 1.00 0.00 H new ATOM 0 HE3 MET A 80 116.835 -1.375 -6.994 1.00 0.00 H new ATOM 1273 N MET A 81 121.680 0.841 -9.920 1.00 0.00 N ATOM 1274 CA MET A 81 121.811 1.545 -11.191 1.00 0.00 C ATOM 1275 C MET A 81 123.119 1.174 -11.883 1.00 0.00 C ATOM 1276 O MET A 81 123.272 1.382 -13.087 1.00 0.00 O ATOM 1277 CB MET A 81 121.768 3.058 -10.959 1.00 0.00 C ATOM 1278 CG MET A 81 120.466 3.626 -11.525 1.00 0.00 C ATOM 1279 SD MET A 81 120.596 3.751 -13.327 1.00 0.00 S ATOM 1280 CE MET A 81 118.822 3.750 -13.683 1.00 0.00 C ATOM 0 H MET A 81 121.942 1.389 -9.101 1.00 0.00 H new ATOM 0 HA MET A 81 120.979 1.250 -11.831 1.00 0.00 H new ATOM 0 HB2 MET A 81 121.838 3.275 -9.893 1.00 0.00 H new ATOM 0 HB3 MET A 81 122.623 3.534 -11.438 1.00 0.00 H new ATOM 0 HG2 MET A 81 119.628 2.984 -11.254 1.00 0.00 H new ATOM 0 HG3 MET A 81 120.267 4.608 -11.095 1.00 0.00 H new ATOM 0 HE1 MET A 81 118.638 4.279 -14.618 1.00 0.00 H new ATOM 0 HE2 MET A 81 118.469 2.722 -13.772 1.00 0.00 H new ATOM 0 HE3 MET A 81 118.288 4.248 -12.874 1.00 0.00 H new ATOM 1290 N GLU A 82 124.062 0.629 -11.121 1.00 0.00 N ATOM 1291 CA GLU A 82 125.352 0.241 -11.681 1.00 0.00 C ATOM 1292 C GLU A 82 125.182 -0.867 -12.716 1.00 0.00 C ATOM 1293 O GLU A 82 126.090 -1.129 -13.501 1.00 0.00 O ATOM 1294 CB GLU A 82 126.281 -0.239 -10.565 1.00 0.00 C ATOM 1295 CG GLU A 82 126.882 0.970 -9.845 1.00 0.00 C ATOM 1296 CD GLU A 82 128.351 1.124 -10.224 1.00 0.00 C ATOM 1297 OE1 GLU A 82 129.165 0.404 -9.669 1.00 0.00 O ATOM 1298 OE2 GLU A 82 128.642 1.962 -11.062 1.00 0.00 O ATOM 0 H GLU A 82 123.959 0.447 -10.123 1.00 0.00 H new ATOM 0 HA GLU A 82 125.789 1.112 -12.170 1.00 0.00 H new ATOM 0 HB2 GLU A 82 125.728 -0.858 -9.859 1.00 0.00 H new ATOM 0 HB3 GLU A 82 127.075 -0.860 -10.980 1.00 0.00 H new ATOM 0 HG2 GLU A 82 126.332 1.873 -10.111 1.00 0.00 H new ATOM 0 HG3 GLU A 82 126.787 0.846 -8.766 1.00 0.00 H new ATOM 1305 N SER A 83 124.010 -1.504 -12.708 1.00 0.00 N ATOM 1306 CA SER A 83 123.710 -2.584 -13.649 1.00 0.00 C ATOM 1307 C SER A 83 123.220 -3.823 -12.907 1.00 0.00 C ATOM 1308 O SER A 83 122.975 -4.864 -13.515 1.00 0.00 O ATOM 1309 CB SER A 83 124.947 -2.945 -14.474 1.00 0.00 C ATOM 1310 OG SER A 83 126.022 -3.262 -13.600 1.00 0.00 O ATOM 0 H SER A 83 123.252 -1.290 -12.059 1.00 0.00 H new ATOM 0 HA SER A 83 122.925 -2.232 -14.318 1.00 0.00 H new ATOM 0 HB2 SER A 83 124.730 -3.793 -15.123 1.00 0.00 H new ATOM 0 HB3 SER A 83 125.223 -2.111 -15.120 1.00 0.00 H new ATOM 0 HG SER A 83 126.603 -2.479 -13.498 1.00 0.00 H new ATOM 1316 N HIS A 84 123.083 -3.708 -11.591 1.00 0.00 N ATOM 1317 CA HIS A 84 122.625 -4.832 -10.782 1.00 0.00 C ATOM 1318 C HIS A 84 121.114 -4.765 -10.568 1.00 0.00 C ATOM 1319 O HIS A 84 120.591 -3.767 -10.073 1.00 0.00 O ATOM 1320 CB HIS A 84 123.338 -4.822 -9.428 1.00 0.00 C ATOM 1321 CG HIS A 84 124.072 -6.121 -9.230 1.00 0.00 C ATOM 1322 ND1 HIS A 84 124.232 -6.693 -7.978 1.00 0.00 N ATOM 1323 CD2 HIS A 84 124.695 -6.970 -10.113 1.00 0.00 C ATOM 1324 CE1 HIS A 84 124.925 -7.836 -8.140 1.00 0.00 C ATOM 1325 NE2 HIS A 84 125.232 -8.051 -9.422 1.00 0.00 N ATOM 0 H HIS A 84 123.280 -2.857 -11.065 1.00 0.00 H new ATOM 0 HA HIS A 84 122.860 -5.756 -11.311 1.00 0.00 H new ATOM 0 HB2 HIS A 84 124.038 -3.987 -9.381 1.00 0.00 H new ATOM 0 HB3 HIS A 84 122.614 -4.677 -8.626 1.00 0.00 H new ATOM 0 HD1 HIS A 84 123.888 -6.317 -7.095 1.00 0.00 H new ATOM 0 HD2 HIS A 84 124.758 -6.821 -11.181 1.00 0.00 H new ATOM 0 HE1 HIS A 84 125.199 -8.498 -7.332 1.00 0.00 H new ATOM 1334 N GLY A 85 120.421 -5.837 -10.943 1.00 0.00 N ATOM 1335 CA GLY A 85 118.970 -5.894 -10.786 1.00 0.00 C ATOM 1336 C GLY A 85 118.297 -4.712 -11.473 1.00 0.00 C ATOM 1337 O GLY A 85 118.702 -3.565 -11.287 1.00 0.00 O ATOM 0 H GLY A 85 120.837 -6.672 -11.355 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.592 -6.826 -11.206 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.716 -5.896 -9.726 1.00 0.00 H new ATOM 1341 N ASP A 86 117.271 -4.996 -12.271 1.00 0.00 N ATOM 1342 CA ASP A 86 116.562 -3.936 -12.977 1.00 0.00 C ATOM 1343 C ASP A 86 115.112 -3.833 -12.505 1.00 0.00 C ATOM 1344 O ASP A 86 114.182 -4.033 -13.285 1.00 0.00 O ATOM 1345 CB ASP A 86 116.593 -4.203 -14.485 1.00 0.00 C ATOM 1346 CG ASP A 86 117.364 -3.095 -15.195 1.00 0.00 C ATOM 1347 OD1 ASP A 86 117.229 -1.953 -14.790 1.00 0.00 O ATOM 1348 OD2 ASP A 86 118.078 -3.405 -16.134 1.00 0.00 O ATOM 0 H ASP A 86 116.917 -5.937 -12.443 1.00 0.00 H new ATOM 0 HA ASP A 86 117.062 -2.992 -12.761 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.061 -5.167 -14.682 1.00 0.00 H new ATOM 0 HB3 ASP A 86 115.576 -4.257 -14.874 1.00 0.00 H new ATOM 1353 N TRP A 87 114.917 -3.513 -11.225 1.00 0.00 N ATOM 1354 CA TRP A 87 113.565 -3.386 -10.693 1.00 0.00 C ATOM 1355 C TRP A 87 113.532 -2.507 -9.447 1.00 0.00 C ATOM 1356 O TRP A 87 113.689 -1.289 -9.532 1.00 0.00 O ATOM 1357 CB TRP A 87 113.000 -4.767 -10.367 1.00 0.00 C ATOM 1358 CG TRP A 87 112.943 -5.572 -11.623 1.00 0.00 C ATOM 1359 CD1 TRP A 87 111.888 -5.626 -12.467 1.00 0.00 C ATOM 1360 CD2 TRP A 87 113.971 -6.424 -12.196 1.00 0.00 C ATOM 1361 NE1 TRP A 87 112.205 -6.460 -13.525 1.00 0.00 N ATOM 1362 CE2 TRP A 87 113.481 -6.975 -13.401 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.269 -6.768 -11.788 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 114.255 -7.836 -14.175 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 116.052 -7.634 -12.565 1.00 0.00 C ATOM 1366 CH2 TRP A 87 115.547 -8.166 -13.755 1.00 0.00 C ATOM 0 H TRP A 87 115.663 -3.341 -10.551 1.00 0.00 H new ATOM 0 HA TRP A 87 112.950 -2.910 -11.457 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.626 -5.266 -9.627 1.00 0.00 H new ATOM 0 HB3 TRP A 87 112.005 -4.675 -9.932 1.00 0.00 H new ATOM 0 HD1 TRP A 87 110.952 -5.104 -12.337 1.00 0.00 H new ATOM 0 HE1 TRP A 87 111.575 -6.668 -14.300 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.668 -6.363 -10.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 113.860 -8.246 -15.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 117.050 -7.891 -12.242 1.00 0.00 H new ATOM 0 HH2 TRP A 87 116.155 -8.832 -14.350 1.00 0.00 H new ATOM 1377 N LEU A 88 113.288 -3.125 -8.296 1.00 0.00 N ATOM 1378 CA LEU A 88 113.191 -2.373 -7.049 1.00 0.00 C ATOM 1379 C LEU A 88 114.085 -2.941 -5.951 1.00 0.00 C ATOM 1380 O LEU A 88 114.734 -3.974 -6.113 1.00 0.00 O ATOM 1381 CB LEU A 88 111.743 -2.375 -6.568 1.00 0.00 C ATOM 1382 CG LEU A 88 110.886 -1.558 -7.534 1.00 0.00 C ATOM 1383 CD1 LEU A 88 109.929 -2.487 -8.282 1.00 0.00 C ATOM 1384 CD2 LEU A 88 110.080 -0.523 -6.749 1.00 0.00 C ATOM 0 H LEU A 88 113.155 -4.132 -8.200 1.00 0.00 H new ATOM 0 HA LEU A 88 113.530 -1.358 -7.255 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.369 -3.397 -6.509 1.00 0.00 H new ATOM 0 HB3 LEU A 88 111.681 -1.954 -5.564 1.00 0.00 H new ATOM 0 HG LEU A 88 111.532 -1.051 -8.250 1.00 0.00 H new ATOM 0 HD11 LEU A 88 109.319 -1.903 -8.970 1.00 0.00 H new ATOM 0 HD12 LEU A 88 110.502 -3.225 -8.843 1.00 0.00 H new ATOM 0 HD13 LEU A 88 109.283 -2.996 -7.567 1.00 0.00 H new ATOM 0 HD21 LEU A 88 109.468 0.060 -7.437 1.00 0.00 H new ATOM 0 HD22 LEU A 88 109.435 -1.031 -6.032 1.00 0.00 H new ATOM 0 HD23 LEU A 88 110.761 0.141 -6.217 1.00 0.00 H new ATOM 1396 N ALA A 89 114.084 -2.234 -4.827 1.00 0.00 N ATOM 1397 CA ALA A 89 114.868 -2.624 -3.662 1.00 0.00 C ATOM 1398 C ALA A 89 114.054 -2.402 -2.393 1.00 0.00 C ATOM 1399 O ALA A 89 113.587 -1.292 -2.134 1.00 0.00 O ATOM 1400 CB ALA A 89 116.155 -1.800 -3.597 1.00 0.00 C ATOM 0 H ALA A 89 113.543 -1.379 -4.698 1.00 0.00 H new ATOM 0 HA ALA A 89 115.124 -3.680 -3.746 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.734 -2.098 -2.723 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.743 -1.972 -4.498 1.00 0.00 H new ATOM 0 HB3 ALA A 89 115.906 -0.741 -3.523 1.00 0.00 H new ATOM 1406 N ILE A 90 113.882 -3.457 -1.604 1.00 0.00 N ATOM 1407 CA ILE A 90 113.118 -3.347 -0.369 1.00 0.00 C ATOM 1408 C ILE A 90 113.890 -2.551 0.667 1.00 0.00 C ATOM 1409 O ILE A 90 114.936 -2.992 1.145 1.00 0.00 O ATOM 1410 CB ILE A 90 112.826 -4.727 0.205 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.763 -5.754 -0.930 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.489 -4.689 0.952 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.705 -6.815 -0.611 1.00 0.00 C ATOM 0 H ILE A 90 114.256 -4.386 -1.795 1.00 0.00 H new ATOM 0 HA ILE A 90 112.183 -2.839 -0.604 1.00 0.00 H new ATOM 0 HB ILE A 90 113.618 -5.013 0.897 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.521 -5.257 -1.870 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.737 -6.226 -1.060 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.275 -5.675 1.365 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.545 -3.961 1.761 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.695 -4.404 0.262 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.664 -7.543 -1.421 1.00 0.00 H new ATOM 0 HD12 ILE A 90 111.966 -7.321 0.319 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.731 -6.337 -0.503 1.00 0.00 H new ATOM 1425 N PRO A 91 113.398 -1.404 1.035 1.00 0.00 N ATOM 1426 CA PRO A 91 114.069 -0.561 2.048 1.00 0.00 C ATOM 1427 C PRO A 91 114.427 -1.373 3.290 1.00 0.00 C ATOM 1428 O PRO A 91 113.546 -1.796 4.036 1.00 0.00 O ATOM 1429 CB PRO A 91 113.039 0.522 2.376 1.00 0.00 C ATOM 1430 CG PRO A 91 112.134 0.590 1.189 1.00 0.00 C ATOM 1431 CD PRO A 91 112.164 -0.788 0.526 1.00 0.00 C ATOM 0 HA PRO A 91 115.010 -0.145 1.686 1.00 0.00 H new ATOM 0 HB2 PRO A 91 112.482 0.273 3.279 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.523 1.482 2.555 1.00 0.00 H new ATOM 0 HG2 PRO A 91 111.120 0.851 1.491 1.00 0.00 H new ATOM 0 HG3 PRO A 91 112.467 1.360 0.493 1.00 0.00 H new ATOM 0 HD2 PRO A 91 111.286 -1.377 0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 91 112.178 -0.707 -0.561 1.00 0.00 H new ATOM 1439 N TYR A 92 115.720 -1.601 3.495 1.00 0.00 N ATOM 1440 CA TYR A 92 116.176 -2.377 4.644 1.00 0.00 C ATOM 1441 C TYR A 92 115.212 -2.215 5.811 1.00 0.00 C ATOM 1442 O TYR A 92 115.101 -3.092 6.667 1.00 0.00 O ATOM 1443 CB TYR A 92 117.577 -1.927 5.064 1.00 0.00 C ATOM 1444 CG TYR A 92 117.718 -0.439 4.855 1.00 0.00 C ATOM 1445 CD1 TYR A 92 118.183 0.057 3.632 1.00 0.00 C ATOM 1446 CD2 TYR A 92 117.386 0.447 5.888 1.00 0.00 C ATOM 1447 CE1 TYR A 92 118.316 1.436 3.439 1.00 0.00 C ATOM 1448 CE2 TYR A 92 117.520 1.827 5.696 1.00 0.00 C ATOM 1449 CZ TYR A 92 117.984 2.322 4.472 1.00 0.00 C ATOM 1450 OH TYR A 92 118.116 3.682 4.283 1.00 0.00 O ATOM 0 H TYR A 92 116.466 -1.263 2.887 1.00 0.00 H new ATOM 0 HA TYR A 92 116.210 -3.428 4.358 1.00 0.00 H new ATOM 0 HB2 TYR A 92 117.750 -2.175 6.111 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.330 -2.459 4.482 1.00 0.00 H new ATOM 0 HD1 TYR A 92 118.440 -0.626 2.836 1.00 0.00 H new ATOM 0 HD2 TYR A 92 117.027 0.065 6.832 1.00 0.00 H new ATOM 0 HE1 TYR A 92 118.674 1.817 2.494 1.00 0.00 H new ATOM 0 HE2 TYR A 92 117.265 2.510 6.493 1.00 0.00 H new ATOM 0 HH TYR A 92 117.842 4.154 5.097 1.00 0.00 H new ATOM 1460 N ARG A 93 114.511 -1.088 5.834 1.00 0.00 N ATOM 1461 CA ARG A 93 113.547 -0.821 6.895 1.00 0.00 C ATOM 1462 C ARG A 93 112.209 -1.472 6.570 1.00 0.00 C ATOM 1463 O ARG A 93 111.164 -1.068 7.081 1.00 0.00 O ATOM 1464 CB ARG A 93 113.359 0.689 7.071 1.00 0.00 C ATOM 1465 CG ARG A 93 114.272 1.191 8.191 1.00 0.00 C ATOM 1466 CD ARG A 93 114.010 2.678 8.433 1.00 0.00 C ATOM 1467 NE ARG A 93 114.345 3.032 9.809 1.00 0.00 N ATOM 1468 CZ ARG A 93 115.604 3.024 10.233 1.00 0.00 C ATOM 1469 NH1 ARG A 93 116.566 2.694 9.415 1.00 0.00 N ATOM 1470 NH2 ARG A 93 115.878 3.345 11.467 1.00 0.00 N ATOM 0 H ARG A 93 114.591 -0.349 5.136 1.00 0.00 H new ATOM 0 HA ARG A 93 113.930 -1.243 7.824 1.00 0.00 H new ATOM 0 HB2 ARG A 93 113.591 1.206 6.140 1.00 0.00 H new ATOM 0 HB3 ARG A 93 112.319 0.911 7.309 1.00 0.00 H new ATOM 0 HG2 ARG A 93 114.090 0.625 9.105 1.00 0.00 H new ATOM 0 HG3 ARG A 93 115.316 1.034 7.922 1.00 0.00 H new ATOM 0 HD2 ARG A 93 114.603 3.276 7.741 1.00 0.00 H new ATOM 0 HD3 ARG A 93 112.963 2.907 8.236 1.00 0.00 H new ATOM 0 HE ARG A 93 113.600 3.290 10.456 1.00 0.00 H new ATOM 0 HH11 ARG A 93 116.351 2.442 8.450 1.00 0.00 H new ATOM 0 HH12 ARG A 93 117.533 2.688 9.741 1.00 0.00 H new ATOM 0 HH21 ARG A 93 115.126 3.602 12.106 1.00 0.00 H new ATOM 0 HH22 ARG A 93 116.844 3.339 11.793 1.00 0.00 H new ATOM 1484 N SER A 94 112.258 -2.481 5.713 1.00 0.00 N ATOM 1485 CA SER A 94 111.056 -3.194 5.304 1.00 0.00 C ATOM 1486 C SER A 94 110.991 -4.569 5.963 1.00 0.00 C ATOM 1487 O SER A 94 111.020 -5.591 5.282 1.00 0.00 O ATOM 1488 CB SER A 94 111.037 -3.358 3.786 1.00 0.00 C ATOM 1489 OG SER A 94 111.537 -2.174 3.179 1.00 0.00 O ATOM 0 H SER A 94 113.118 -2.825 5.287 1.00 0.00 H new ATOM 0 HA SER A 94 110.191 -2.611 5.620 1.00 0.00 H new ATOM 0 HB2 SER A 94 111.644 -4.215 3.494 1.00 0.00 H new ATOM 0 HB3 SER A 94 110.021 -3.555 3.443 1.00 0.00 H new ATOM 0 HG SER A 94 112.216 -1.770 3.759 1.00 0.00 H new ATOM 1495 N GLY A 95 110.904 -4.581 7.290 1.00 0.00 N ATOM 1496 CA GLY A 95 110.835 -5.833 8.042 1.00 0.00 C ATOM 1497 C GLY A 95 110.645 -7.037 7.121 1.00 0.00 C ATOM 1498 O GLY A 95 111.505 -7.915 7.052 1.00 0.00 O ATOM 0 H GLY A 95 110.880 -3.740 7.867 1.00 0.00 H new ATOM 0 HA2 GLY A 95 111.749 -5.960 8.622 1.00 0.00 H new ATOM 0 HA3 GLY A 95 110.010 -5.785 8.753 1.00 0.00 H new ATOM 1502 N PRO A 96 109.545 -7.094 6.416 1.00 0.00 N ATOM 1503 CA PRO A 96 109.244 -8.213 5.481 1.00 0.00 C ATOM 1504 C PRO A 96 110.484 -8.700 4.731 1.00 0.00 C ATOM 1505 O PRO A 96 110.550 -9.853 4.308 1.00 0.00 O ATOM 1506 CB PRO A 96 108.224 -7.599 4.526 1.00 0.00 C ATOM 1507 CG PRO A 96 107.499 -6.570 5.333 1.00 0.00 C ATOM 1508 CD PRO A 96 108.456 -6.103 6.437 1.00 0.00 C ATOM 0 HA PRO A 96 108.878 -9.099 5.999 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.714 -7.149 3.663 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.538 -8.355 4.144 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.197 -5.731 4.705 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.590 -6.989 5.764 1.00 0.00 H new ATOM 0 HD2 PRO A 96 108.829 -5.098 6.241 1.00 0.00 H new ATOM 0 HD3 PRO A 96 107.961 -6.076 7.408 1.00 0.00 H new ATOM 1516 N ALA A 97 111.468 -7.819 4.582 1.00 0.00 N ATOM 1517 CA ALA A 97 112.703 -8.178 3.897 1.00 0.00 C ATOM 1518 C ALA A 97 113.556 -9.065 4.796 1.00 0.00 C ATOM 1519 O ALA A 97 114.176 -10.025 4.336 1.00 0.00 O ATOM 1520 CB ALA A 97 113.483 -6.916 3.525 1.00 0.00 C ATOM 0 H ALA A 97 111.435 -6.859 4.924 1.00 0.00 H new ATOM 0 HA ALA A 97 112.455 -8.724 2.986 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.404 -7.195 3.014 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.876 -6.294 2.866 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.725 -6.358 4.430 1.00 0.00 H new ATOM 1526 N SER A 98 113.567 -8.748 6.087 1.00 0.00 N ATOM 1527 CA SER A 98 114.331 -9.539 7.040 1.00 0.00 C ATOM 1528 C SER A 98 113.654 -10.888 7.226 1.00 0.00 C ATOM 1529 O SER A 98 114.211 -11.929 6.884 1.00 0.00 O ATOM 1530 CB SER A 98 114.418 -8.811 8.383 1.00 0.00 C ATOM 1531 OG SER A 98 113.128 -8.773 8.979 1.00 0.00 O ATOM 0 H SER A 98 113.062 -7.959 6.492 1.00 0.00 H new ATOM 0 HA SER A 98 115.341 -9.685 6.658 1.00 0.00 H new ATOM 0 HB2 SER A 98 115.121 -9.321 9.042 1.00 0.00 H new ATOM 0 HB3 SER A 98 114.794 -7.798 8.238 1.00 0.00 H new ATOM 0 HG SER A 98 112.549 -8.169 8.468 1.00 0.00 H new ATOM 1537 N ASN A 99 112.439 -10.857 7.758 1.00 0.00 N ATOM 1538 CA ASN A 99 111.684 -12.083 7.967 1.00 0.00 C ATOM 1539 C ASN A 99 111.785 -12.956 6.725 1.00 0.00 C ATOM 1540 O ASN A 99 111.808 -14.183 6.811 1.00 0.00 O ATOM 1541 CB ASN A 99 110.217 -11.758 8.253 1.00 0.00 C ATOM 1542 CG ASN A 99 110.083 -11.118 9.631 1.00 0.00 C ATOM 1543 OD1 ASN A 99 110.993 -11.221 10.455 1.00 0.00 O ATOM 1544 ND2 ASN A 99 108.998 -10.458 9.931 1.00 0.00 N ATOM 0 H ASN A 99 111.960 -10.005 8.050 1.00 0.00 H new ATOM 0 HA ASN A 99 112.098 -12.616 8.823 1.00 0.00 H new ATOM 0 HB2 ASN A 99 109.830 -11.082 7.490 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.619 -12.668 8.206 1.00 0.00 H new ATOM 0 HD21 ASN A 99 108.902 -10.026 10.850 1.00 0.00 H new ATOM 0 HD22 ASN A 99 108.246 -10.374 9.247 1.00 0.00 H new ATOM 1551 N VAL A 100 111.862 -12.304 5.568 1.00 0.00 N ATOM 1552 CA VAL A 100 111.980 -13.012 4.301 1.00 0.00 C ATOM 1553 C VAL A 100 113.254 -13.849 4.291 1.00 0.00 C ATOM 1554 O VAL A 100 113.218 -15.060 4.073 1.00 0.00 O ATOM 1555 CB VAL A 100 112.016 -12.003 3.150 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.843 -12.565 1.993 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.592 -11.722 2.671 1.00 0.00 C ATOM 0 H VAL A 100 111.845 -11.288 5.484 1.00 0.00 H new ATOM 0 HA VAL A 100 111.120 -13.671 4.178 1.00 0.00 H new ATOM 0 HB VAL A 100 112.472 -11.077 3.500 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.865 -11.843 1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.860 -12.759 2.333 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.394 -13.494 1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.619 -11.004 1.852 1.00 0.00 H new ATOM 0 HG22 VAL A 100 110.135 -12.649 2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 100 110.006 -11.312 3.494 1.00 0.00 H new ATOM 1567 N THR A 101 114.379 -13.188 4.540 1.00 0.00 N ATOM 1568 CA THR A 101 115.672 -13.864 4.573 1.00 0.00 C ATOM 1569 C THR A 101 115.697 -14.913 5.667 1.00 0.00 C ATOM 1570 O THR A 101 116.145 -16.043 5.466 1.00 0.00 O ATOM 1571 CB THR A 101 116.771 -12.850 4.873 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.500 -11.636 4.185 1.00 0.00 O ATOM 1573 CG2 THR A 101 118.123 -13.408 4.426 1.00 0.00 C ATOM 0 H THR A 101 114.422 -12.185 4.722 1.00 0.00 H new ATOM 0 HA THR A 101 115.833 -14.336 3.604 1.00 0.00 H new ATOM 0 HB THR A 101 116.801 -12.656 5.945 1.00 0.00 H new ATOM 0 HG1 THR A 101 117.206 -10.985 4.380 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.906 -12.681 4.642 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.330 -14.334 4.963 1.00 0.00 H new ATOM 0 HG23 THR A 101 118.098 -13.607 3.355 1.00 0.00 H new ATOM 1581 N ALA A 102 115.219 -14.512 6.829 1.00 0.00 N ATOM 1582 CA ALA A 102 115.184 -15.387 7.982 1.00 0.00 C ATOM 1583 C ALA A 102 114.102 -16.447 7.815 1.00 0.00 C ATOM 1584 O ALA A 102 114.147 -17.502 8.447 1.00 0.00 O ATOM 1585 CB ALA A 102 114.926 -14.550 9.230 1.00 0.00 C ATOM 0 H ALA A 102 114.847 -13.578 6.999 1.00 0.00 H new ATOM 0 HA ALA A 102 116.141 -15.899 8.080 1.00 0.00 H new ATOM 0 HB1 ALA A 102 114.898 -15.200 10.105 1.00 0.00 H new ATOM 0 HB2 ALA A 102 115.724 -13.817 9.348 1.00 0.00 H new ATOM 0 HB3 ALA A 102 113.971 -14.034 9.131 1.00 0.00 H new ATOM 1591 N LYS A 103 113.135 -16.162 6.949 1.00 0.00 N ATOM 1592 CA LYS A 103 112.051 -17.102 6.694 1.00 0.00 C ATOM 1593 C LYS A 103 112.499 -18.161 5.692 1.00 0.00 C ATOM 1594 O LYS A 103 112.143 -19.334 5.813 1.00 0.00 O ATOM 1595 CB LYS A 103 110.829 -16.363 6.146 1.00 0.00 C ATOM 1596 CG LYS A 103 109.839 -17.375 5.566 1.00 0.00 C ATOM 1597 CD LYS A 103 108.453 -16.733 5.463 1.00 0.00 C ATOM 1598 CE LYS A 103 107.454 -17.758 4.924 1.00 0.00 C ATOM 1599 NZ LYS A 103 108.075 -18.514 3.800 1.00 0.00 N ATOM 0 H LYS A 103 113.080 -15.294 6.416 1.00 0.00 H new ATOM 0 HA LYS A 103 111.784 -17.587 7.633 1.00 0.00 H new ATOM 0 HB2 LYS A 103 110.353 -15.786 6.939 1.00 0.00 H new ATOM 0 HB3 LYS A 103 111.134 -15.654 5.376 1.00 0.00 H new ATOM 0 HG2 LYS A 103 110.173 -17.704 4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.795 -18.261 6.200 1.00 0.00 H new ATOM 0 HD2 LYS A 103 108.132 -16.377 6.442 1.00 0.00 H new ATOM 0 HD3 LYS A 103 108.491 -15.865 4.805 1.00 0.00 H new ATOM 0 HE2 LYS A 103 107.157 -18.444 5.717 1.00 0.00 H new ATOM 0 HE3 LYS A 103 106.549 -17.255 4.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 107.331 -18.980 3.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 108.605 -17.858 3.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 108.723 -19.232 4.181 1.00 0.00 H new ATOM 1613 N TYR A 104 113.281 -17.739 4.702 1.00 0.00 N ATOM 1614 CA TYR A 104 113.770 -18.662 3.684 1.00 0.00 C ATOM 1615 C TYR A 104 114.909 -19.514 4.236 1.00 0.00 C ATOM 1616 O TYR A 104 115.326 -20.489 3.611 1.00 0.00 O ATOM 1617 CB TYR A 104 114.260 -17.881 2.463 1.00 0.00 C ATOM 1618 CG TYR A 104 113.217 -17.943 1.373 1.00 0.00 C ATOM 1619 CD1 TYR A 104 112.763 -19.183 0.908 1.00 0.00 C ATOM 1620 CD2 TYR A 104 112.704 -16.760 0.827 1.00 0.00 C ATOM 1621 CE1 TYR A 104 111.796 -19.240 -0.104 1.00 0.00 C ATOM 1622 CE2 TYR A 104 111.738 -16.818 -0.185 1.00 0.00 C ATOM 1623 CZ TYR A 104 111.284 -18.058 -0.649 1.00 0.00 C ATOM 1624 OH TYR A 104 110.331 -18.114 -1.646 1.00 0.00 O ATOM 0 H TYR A 104 113.587 -16.773 4.584 1.00 0.00 H new ATOM 0 HA TYR A 104 112.950 -19.318 3.391 1.00 0.00 H new ATOM 0 HB2 TYR A 104 114.455 -16.844 2.736 1.00 0.00 H new ATOM 0 HB3 TYR A 104 115.201 -18.299 2.105 1.00 0.00 H new ATOM 0 HD1 TYR A 104 113.158 -20.095 1.329 1.00 0.00 H new ATOM 0 HD2 TYR A 104 113.053 -15.803 1.186 1.00 0.00 H new ATOM 0 HE1 TYR A 104 111.446 -20.196 -0.463 1.00 0.00 H new ATOM 0 HE2 TYR A 104 111.343 -15.906 -0.608 1.00 0.00 H new ATOM 0 HH TYR A 104 109.911 -17.234 -1.746 1.00 0.00 H new ATOM 1634 N GLY A 105 115.407 -19.141 5.411 1.00 0.00 N ATOM 1635 CA GLY A 105 116.497 -19.881 6.037 1.00 0.00 C ATOM 1636 C GLY A 105 117.816 -19.610 5.322 1.00 0.00 C ATOM 1637 O GLY A 105 118.687 -20.478 5.254 1.00 0.00 O ATOM 0 H GLY A 105 115.076 -18.337 5.945 1.00 0.00 H new ATOM 0 HA2 GLY A 105 116.581 -19.596 7.086 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.278 -20.949 6.014 1.00 0.00 H new ATOM 1641 N ILE A 106 117.957 -18.400 4.790 1.00 0.00 N ATOM 1642 CA ILE A 106 119.173 -18.023 4.081 1.00 0.00 C ATOM 1643 C ILE A 106 120.327 -17.845 5.063 1.00 0.00 C ATOM 1644 O ILE A 106 120.753 -18.801 5.712 1.00 0.00 O ATOM 1645 CB ILE A 106 118.936 -16.724 3.312 1.00 0.00 C ATOM 1646 CG1 ILE A 106 117.565 -16.781 2.625 1.00 0.00 C ATOM 1647 CG2 ILE A 106 120.034 -16.548 2.262 1.00 0.00 C ATOM 1648 CD1 ILE A 106 117.724 -17.210 1.165 1.00 0.00 C ATOM 0 H ILE A 106 117.248 -17.668 4.836 1.00 0.00 H new ATOM 0 HA ILE A 106 119.434 -18.815 3.379 1.00 0.00 H new ATOM 0 HB ILE A 106 118.958 -15.880 4.002 1.00 0.00 H new ATOM 0 HG12 ILE A 106 116.916 -17.483 3.149 1.00 0.00 H new ATOM 0 HG13 ILE A 106 117.084 -15.804 2.674 1.00 0.00 H new ATOM 0 HG21 ILE A 106 119.867 -15.622 1.712 1.00 0.00 H new ATOM 0 HG22 ILE A 106 121.005 -16.507 2.755 1.00 0.00 H new ATOM 0 HG23 ILE A 106 120.014 -17.390 1.570 1.00 0.00 H new ATOM 0 HD11 ILE A 106 116.745 -17.247 0.688 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.356 -16.492 0.642 1.00 0.00 H new ATOM 0 HD13 ILE A 106 118.185 -18.197 1.124 1.00 0.00 H new ATOM 1660 N THR A 107 120.827 -16.619 5.173 1.00 0.00 N ATOM 1661 CA THR A 107 121.928 -16.336 6.087 1.00 0.00 C ATOM 1662 C THR A 107 123.230 -16.928 5.560 1.00 0.00 C ATOM 1663 O THR A 107 124.293 -16.741 6.153 1.00 0.00 O ATOM 1664 CB THR A 107 121.614 -16.918 7.465 1.00 0.00 C ATOM 1665 OG1 THR A 107 122.137 -18.236 7.552 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.099 -16.952 7.670 1.00 0.00 C ATOM 0 H THR A 107 120.492 -15.812 4.646 1.00 0.00 H new ATOM 0 HA THR A 107 122.047 -15.255 6.166 1.00 0.00 H new ATOM 0 HB THR A 107 122.069 -16.297 8.236 1.00 0.00 H new ATOM 0 HG1 THR A 107 121.523 -18.861 7.114 1.00 0.00 H new ATOM 0 HG21 THR A 107 119.874 -17.367 8.652 1.00 0.00 H new ATOM 0 HG22 THR A 107 119.700 -15.940 7.604 1.00 0.00 H new ATOM 0 HG23 THR A 107 119.642 -17.574 6.900 1.00 0.00 H new ATOM 1674 N GLY A 108 123.141 -17.640 4.441 1.00 0.00 N ATOM 1675 CA GLY A 108 124.322 -18.249 3.840 1.00 0.00 C ATOM 1676 C GLY A 108 125.011 -17.267 2.899 1.00 0.00 C ATOM 1677 O GLY A 108 125.834 -17.657 2.071 1.00 0.00 O ATOM 0 H GLY A 108 122.271 -17.809 3.936 1.00 0.00 H new ATOM 0 HA2 GLY A 108 125.015 -18.560 4.622 1.00 0.00 H new ATOM 0 HA3 GLY A 108 124.036 -19.147 3.292 1.00 0.00 H new ATOM 1681 N ILE A 109 124.665 -15.992 3.034 1.00 0.00 N ATOM 1682 CA ILE A 109 125.248 -14.953 2.196 1.00 0.00 C ATOM 1683 C ILE A 109 126.764 -15.116 2.110 1.00 0.00 C ATOM 1684 O ILE A 109 127.412 -15.478 3.093 1.00 0.00 O ATOM 1685 CB ILE A 109 124.908 -13.585 2.788 1.00 0.00 C ATOM 1686 CG1 ILE A 109 123.843 -13.761 3.876 1.00 0.00 C ATOM 1687 CG2 ILE A 109 124.370 -12.655 1.696 1.00 0.00 C ATOM 1688 CD1 ILE A 109 122.634 -14.510 3.303 1.00 0.00 C ATOM 0 H ILE A 109 123.985 -15.654 3.715 1.00 0.00 H new ATOM 0 HA ILE A 109 124.837 -15.036 1.190 1.00 0.00 H new ATOM 0 HB ILE A 109 125.809 -13.145 3.215 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.259 -14.313 4.719 1.00 0.00 H new ATOM 0 HG13 ILE A 109 123.533 -12.787 4.255 1.00 0.00 H new ATOM 0 HG21 ILE A 109 124.131 -11.684 2.130 1.00 0.00 H new ATOM 0 HG22 ILE A 109 125.125 -12.530 0.920 1.00 0.00 H new ATOM 0 HG23 ILE A 109 123.470 -13.088 1.260 1.00 0.00 H new ATOM 0 HD11 ILE A 109 121.880 -14.632 4.080 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.212 -13.940 2.475 1.00 0.00 H new ATOM 0 HD13 ILE A 109 122.949 -15.490 2.946 1.00 0.00 H new ATOM 1700 N PRO A 110 127.337 -14.855 0.962 1.00 0.00 N ATOM 1701 CA PRO A 110 126.584 -14.414 -0.249 1.00 0.00 C ATOM 1702 C PRO A 110 125.825 -15.565 -0.904 1.00 0.00 C ATOM 1703 O PRO A 110 126.345 -16.675 -1.023 1.00 0.00 O ATOM 1704 CB PRO A 110 127.677 -13.884 -1.177 1.00 0.00 C ATOM 1705 CG PRO A 110 128.918 -14.615 -0.786 1.00 0.00 C ATOM 1706 CD PRO A 110 128.782 -14.955 0.700 1.00 0.00 C ATOM 0 HA PRO A 110 125.822 -13.672 -0.012 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.427 -14.066 -2.222 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.802 -12.807 -1.062 1.00 0.00 H new ATOM 0 HG2 PRO A 110 129.036 -15.521 -1.380 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.801 -14.000 -0.963 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.158 -15.955 0.916 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.348 -14.261 1.321 1.00 0.00 H new ATOM 1714 N ALA A 111 124.592 -15.296 -1.325 1.00 0.00 N ATOM 1715 CA ALA A 111 123.778 -16.326 -1.961 1.00 0.00 C ATOM 1716 C ALA A 111 122.641 -15.701 -2.764 1.00 0.00 C ATOM 1717 O ALA A 111 122.264 -14.552 -2.536 1.00 0.00 O ATOM 1718 CB ALA A 111 123.197 -17.262 -0.899 1.00 0.00 C ATOM 0 H ALA A 111 124.140 -14.386 -1.239 1.00 0.00 H new ATOM 0 HA ALA A 111 124.415 -16.893 -2.640 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.590 -18.028 -1.382 1.00 0.00 H new ATOM 0 HB2 ALA A 111 124.009 -17.736 -0.348 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.577 -16.689 -0.209 1.00 0.00 H new ATOM 1724 N LEU A 112 122.101 -16.469 -3.705 1.00 0.00 N ATOM 1725 CA LEU A 112 121.007 -15.985 -4.539 1.00 0.00 C ATOM 1726 C LEU A 112 119.839 -16.967 -4.505 1.00 0.00 C ATOM 1727 O LEU A 112 120.008 -18.151 -4.791 1.00 0.00 O ATOM 1728 CB LEU A 112 121.495 -15.818 -5.979 1.00 0.00 C ATOM 1729 CG LEU A 112 120.637 -14.778 -6.701 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.446 -14.157 -7.840 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.391 -15.457 -7.272 1.00 0.00 C ATOM 0 H LEU A 112 122.401 -17.423 -3.908 1.00 0.00 H new ATOM 0 HA LEU A 112 120.669 -15.023 -4.153 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.540 -15.508 -5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 112 121.443 -16.772 -6.503 1.00 0.00 H new ATOM 0 HG LEU A 112 120.338 -13.999 -6.000 1.00 0.00 H new ATOM 0 HD11 LEU A 112 120.837 -13.415 -8.357 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.336 -13.677 -7.434 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.742 -14.936 -8.543 1.00 0.00 H new ATOM 0 HD21 LEU A 112 118.778 -14.718 -7.787 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.690 -16.234 -7.975 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.816 -15.904 -6.461 1.00 0.00 H new ATOM 1743 N VAL A 113 118.657 -16.471 -4.148 1.00 0.00 N ATOM 1744 CA VAL A 113 117.476 -17.324 -4.077 1.00 0.00 C ATOM 1745 C VAL A 113 116.523 -17.021 -5.229 1.00 0.00 C ATOM 1746 O VAL A 113 116.280 -15.862 -5.559 1.00 0.00 O ATOM 1747 CB VAL A 113 116.763 -17.108 -2.735 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.243 -17.160 -2.924 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.192 -18.196 -1.744 1.00 0.00 C ATOM 0 H VAL A 113 118.493 -15.494 -3.906 1.00 0.00 H new ATOM 0 HA VAL A 113 117.791 -18.365 -4.156 1.00 0.00 H new ATOM 0 HB VAL A 113 117.037 -16.128 -2.346 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.751 -17.005 -1.964 1.00 0.00 H new ATOM 0 HG12 VAL A 113 114.936 -16.379 -3.619 1.00 0.00 H new ATOM 0 HG13 VAL A 113 114.959 -18.133 -3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.685 -18.041 -0.792 1.00 0.00 H new ATOM 0 HG22 VAL A 113 116.926 -19.176 -2.142 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.270 -18.146 -1.593 1.00 0.00 H new ATOM 1759 N ILE A 114 115.988 -18.077 -5.835 1.00 0.00 N ATOM 1760 CA ILE A 114 115.063 -17.909 -6.949 1.00 0.00 C ATOM 1761 C ILE A 114 113.718 -18.562 -6.656 1.00 0.00 C ATOM 1762 O ILE A 114 113.645 -19.750 -6.344 1.00 0.00 O ATOM 1763 CB ILE A 114 115.651 -18.509 -8.227 1.00 0.00 C ATOM 1764 CG1 ILE A 114 117.058 -17.950 -8.455 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.760 -18.146 -9.415 1.00 0.00 C ATOM 1766 CD1 ILE A 114 116.984 -16.429 -8.618 1.00 0.00 C ATOM 0 H ILE A 114 116.176 -19.046 -5.577 1.00 0.00 H new ATOM 0 HA ILE A 114 114.907 -16.839 -7.087 1.00 0.00 H new ATOM 0 HB ILE A 114 115.704 -19.593 -8.128 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.703 -18.205 -7.614 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.500 -18.400 -9.344 1.00 0.00 H new ATOM 0 HG21 ILE A 114 115.178 -18.573 -10.327 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.758 -18.544 -9.254 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.708 -17.062 -9.513 1.00 0.00 H new ATOM 0 HD11 ILE A 114 117.986 -16.031 -8.780 1.00 0.00 H new ATOM 0 HD12 ILE A 114 116.354 -16.185 -9.473 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.560 -15.987 -7.717 1.00 0.00 H new ATOM 1778 N VAL A 115 112.659 -17.768 -6.760 1.00 0.00 N ATOM 1779 CA VAL A 115 111.310 -18.264 -6.514 1.00 0.00 C ATOM 1780 C VAL A 115 110.355 -17.748 -7.584 1.00 0.00 C ATOM 1781 O VAL A 115 110.576 -16.686 -8.165 1.00 0.00 O ATOM 1782 CB VAL A 115 110.829 -17.811 -5.133 1.00 0.00 C ATOM 1783 CG1 VAL A 115 112.028 -17.669 -4.194 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.118 -16.461 -5.257 1.00 0.00 C ATOM 0 H VAL A 115 112.708 -16.781 -7.012 1.00 0.00 H new ATOM 0 HA VAL A 115 111.327 -19.353 -6.549 1.00 0.00 H new ATOM 0 HB VAL A 115 110.138 -18.551 -4.730 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.684 -17.346 -3.211 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.535 -18.630 -4.104 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.720 -16.930 -4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.776 -16.138 -4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 115 110.809 -15.721 -5.661 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.262 -16.560 -5.925 1.00 0.00 H new ATOM 1794 N LYS A 116 109.294 -18.504 -7.840 1.00 0.00 N ATOM 1795 CA LYS A 116 108.314 -18.110 -8.841 1.00 0.00 C ATOM 1796 C LYS A 116 107.419 -16.998 -8.304 1.00 0.00 C ATOM 1797 O LYS A 116 107.096 -16.971 -7.117 1.00 0.00 O ATOM 1798 CB LYS A 116 107.460 -19.319 -9.225 1.00 0.00 C ATOM 1799 CG LYS A 116 108.293 -20.273 -10.085 1.00 0.00 C ATOM 1800 CD LYS A 116 107.369 -21.239 -10.827 1.00 0.00 C ATOM 1801 CE LYS A 116 108.002 -21.624 -12.165 1.00 0.00 C ATOM 1802 NZ LYS A 116 107.448 -20.759 -13.244 1.00 0.00 N ATOM 0 H LYS A 116 109.092 -19.387 -7.371 1.00 0.00 H new ATOM 0 HA LYS A 116 108.840 -17.740 -9.721 1.00 0.00 H new ATOM 0 HB2 LYS A 116 107.110 -19.831 -8.329 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.576 -18.995 -9.773 1.00 0.00 H new ATOM 0 HG2 LYS A 116 108.891 -19.706 -10.799 1.00 0.00 H new ATOM 0 HG3 LYS A 116 108.989 -20.830 -9.457 1.00 0.00 H new ATOM 0 HD2 LYS A 116 107.197 -22.131 -10.224 1.00 0.00 H new ATOM 0 HD3 LYS A 116 106.397 -20.774 -10.993 1.00 0.00 H new ATOM 0 HE2 LYS A 116 109.085 -21.510 -12.113 1.00 0.00 H new ATOM 0 HE3 LYS A 116 107.802 -22.672 -12.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 107.878 -21.021 -14.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 106.418 -20.889 -13.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 107.661 -19.763 -13.034 1.00 0.00 H new ATOM 1816 N LYS A 117 107.026 -16.082 -9.182 1.00 0.00 N ATOM 1817 CA LYS A 117 106.169 -14.972 -8.776 1.00 0.00 C ATOM 1818 C LYS A 117 105.017 -15.473 -7.913 1.00 0.00 C ATOM 1819 O LYS A 117 104.705 -14.886 -6.876 1.00 0.00 O ATOM 1820 CB LYS A 117 105.613 -14.262 -10.011 1.00 0.00 C ATOM 1821 CG LYS A 117 104.912 -12.970 -9.583 1.00 0.00 C ATOM 1822 CD LYS A 117 103.408 -13.220 -9.465 1.00 0.00 C ATOM 1823 CE LYS A 117 102.726 -11.976 -8.893 1.00 0.00 C ATOM 1824 NZ LYS A 117 103.086 -10.788 -9.717 1.00 0.00 N ATOM 0 H LYS A 117 107.283 -16.084 -10.169 1.00 0.00 H new ATOM 0 HA LYS A 117 106.766 -14.271 -8.193 1.00 0.00 H new ATOM 0 HB2 LYS A 117 106.420 -14.037 -10.709 1.00 0.00 H new ATOM 0 HB3 LYS A 117 104.912 -14.913 -10.534 1.00 0.00 H new ATOM 0 HG2 LYS A 117 105.310 -12.627 -8.628 1.00 0.00 H new ATOM 0 HG3 LYS A 117 105.104 -12.181 -10.310 1.00 0.00 H new ATOM 0 HD2 LYS A 117 102.991 -13.459 -10.443 1.00 0.00 H new ATOM 0 HD3 LYS A 117 103.221 -14.079 -8.820 1.00 0.00 H new ATOM 0 HE2 LYS A 117 101.645 -12.112 -8.885 1.00 0.00 H new ATOM 0 HE3 LYS A 117 103.035 -11.822 -7.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 102.636 -9.940 -9.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 104.119 -10.665 -9.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 102.755 -10.929 -10.693 1.00 0.00 H new ATOM 1838 N ASP A 118 104.387 -16.558 -8.348 1.00 0.00 N ATOM 1839 CA ASP A 118 103.268 -17.128 -7.607 1.00 0.00 C ATOM 1840 C ASP A 118 103.713 -17.556 -6.212 1.00 0.00 C ATOM 1841 O ASP A 118 102.885 -17.826 -5.342 1.00 0.00 O ATOM 1842 CB ASP A 118 102.705 -18.336 -8.358 1.00 0.00 C ATOM 1843 CG ASP A 118 101.188 -18.379 -8.214 1.00 0.00 C ATOM 1844 OD1 ASP A 118 100.523 -17.665 -8.947 1.00 0.00 O ATOM 1845 OD2 ASP A 118 100.712 -19.125 -7.374 1.00 0.00 O ATOM 0 H ASP A 118 104.629 -17.058 -9.204 1.00 0.00 H new ATOM 0 HA ASP A 118 102.494 -16.367 -7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 118 102.977 -18.278 -9.412 1.00 0.00 H new ATOM 0 HB3 ASP A 118 103.142 -19.254 -7.966 1.00 0.00 H new ATOM 1850 N GLY A 119 105.024 -17.618 -6.007 1.00 0.00 N ATOM 1851 CA GLY A 119 105.567 -18.016 -4.714 1.00 0.00 C ATOM 1852 C GLY A 119 106.054 -19.459 -4.752 1.00 0.00 C ATOM 1853 O GLY A 119 106.267 -20.081 -3.712 1.00 0.00 O ATOM 0 H GLY A 119 105.726 -17.399 -6.714 1.00 0.00 H new ATOM 0 HA2 GLY A 119 106.391 -17.356 -4.442 1.00 0.00 H new ATOM 0 HA3 GLY A 119 104.803 -17.906 -3.944 1.00 0.00 H new ATOM 1857 N THR A 120 106.226 -19.986 -5.960 1.00 0.00 N ATOM 1858 CA THR A 120 106.688 -21.359 -6.125 1.00 0.00 C ATOM 1859 C THR A 120 108.208 -21.427 -6.045 1.00 0.00 C ATOM 1860 O THR A 120 108.905 -20.525 -6.508 1.00 0.00 O ATOM 1861 CB THR A 120 106.223 -21.907 -7.475 1.00 0.00 C ATOM 1862 OG1 THR A 120 105.256 -21.030 -8.035 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.608 -23.295 -7.284 1.00 0.00 C ATOM 0 H THR A 120 106.054 -19.487 -6.833 1.00 0.00 H new ATOM 0 HA THR A 120 106.266 -21.963 -5.322 1.00 0.00 H new ATOM 0 HB THR A 120 107.077 -21.982 -8.148 1.00 0.00 H new ATOM 0 HG1 THR A 120 104.959 -21.380 -8.901 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.278 -23.682 -8.248 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.353 -23.968 -6.858 1.00 0.00 H new ATOM 0 HG23 THR A 120 104.755 -23.225 -6.609 1.00 0.00 H new ATOM 1871 N LEU A 121 108.718 -22.504 -5.459 1.00 0.00 N ATOM 1872 CA LEU A 121 110.161 -22.678 -5.331 1.00 0.00 C ATOM 1873 C LEU A 121 110.720 -23.368 -6.567 1.00 0.00 C ATOM 1874 O LEU A 121 110.092 -24.262 -7.133 1.00 0.00 O ATOM 1875 CB LEU A 121 110.483 -23.505 -4.083 1.00 0.00 C ATOM 1876 CG LEU A 121 111.856 -23.107 -3.533 1.00 0.00 C ATOM 1877 CD1 LEU A 121 112.937 -23.422 -4.570 1.00 0.00 C ATOM 1878 CD2 LEU A 121 111.870 -21.608 -3.223 1.00 0.00 C ATOM 0 H LEU A 121 108.161 -23.264 -5.068 1.00 0.00 H new ATOM 0 HA LEU A 121 110.623 -21.696 -5.236 1.00 0.00 H new ATOM 0 HB2 LEU A 121 109.717 -23.346 -3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 121 110.474 -24.567 -4.328 1.00 0.00 H new ATOM 0 HG LEU A 121 112.054 -23.669 -2.620 1.00 0.00 H new ATOM 0 HD11 LEU A 121 113.913 -23.138 -4.176 1.00 0.00 H new ATOM 0 HD12 LEU A 121 112.931 -24.490 -4.789 1.00 0.00 H new ATOM 0 HD13 LEU A 121 112.738 -22.863 -5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 121 112.848 -21.326 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 121 111.669 -21.046 -4.135 1.00 0.00 H new ATOM 0 HD23 LEU A 121 111.104 -21.383 -2.481 1.00 0.00 H new ATOM 1890 N ILE A 122 111.902 -22.934 -6.983 1.00 0.00 N ATOM 1891 CA ILE A 122 112.543 -23.497 -8.159 1.00 0.00 C ATOM 1892 C ILE A 122 113.995 -23.843 -7.861 1.00 0.00 C ATOM 1893 O ILE A 122 114.389 -25.009 -7.877 1.00 0.00 O ATOM 1894 CB ILE A 122 112.490 -22.473 -9.288 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.403 -22.915 -10.429 1.00 0.00 C ATOM 1896 CG2 ILE A 122 112.951 -21.112 -8.763 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.703 -22.650 -11.760 1.00 0.00 C ATOM 0 H ILE A 122 112.434 -22.195 -6.523 1.00 0.00 H new ATOM 0 HA ILE A 122 112.019 -24.408 -8.449 1.00 0.00 H new ATOM 0 HB ILE A 122 111.467 -22.395 -9.656 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.348 -22.373 -10.386 1.00 0.00 H new ATOM 0 HG13 ILE A 122 113.639 -23.975 -10.333 1.00 0.00 H new ATOM 0 HG21 ILE A 122 112.914 -20.379 -9.569 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.295 -20.794 -7.953 1.00 0.00 H new ATOM 0 HG23 ILE A 122 113.973 -21.192 -8.393 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.349 -22.963 -12.580 1.00 0.00 H new ATOM 0 HD12 ILE A 122 111.770 -23.212 -11.799 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.489 -21.585 -11.853 1.00 0.00 H new ATOM 1909 N SER A 123 114.777 -22.813 -7.583 1.00 0.00 N ATOM 1910 CA SER A 123 116.192 -22.992 -7.273 1.00 0.00 C ATOM 1911 C SER A 123 116.662 -21.909 -6.308 1.00 0.00 C ATOM 1912 O SER A 123 116.617 -20.721 -6.626 1.00 0.00 O ATOM 1913 CB SER A 123 117.020 -22.932 -8.555 1.00 0.00 C ATOM 1914 OG SER A 123 117.260 -24.253 -9.022 1.00 0.00 O ATOM 0 H SER A 123 114.460 -21.844 -7.565 1.00 0.00 H new ATOM 0 HA SER A 123 116.325 -23.967 -6.805 1.00 0.00 H new ATOM 0 HB2 SER A 123 116.493 -22.355 -9.315 1.00 0.00 H new ATOM 0 HB3 SER A 123 117.965 -22.423 -8.367 1.00 0.00 H new ATOM 0 HG SER A 123 116.489 -24.820 -8.810 1.00 0.00 H new ATOM 1920 N MET A 124 117.106 -22.320 -5.127 1.00 0.00 N ATOM 1921 CA MET A 124 117.573 -21.367 -4.129 1.00 0.00 C ATOM 1922 C MET A 124 118.990 -20.904 -4.446 1.00 0.00 C ATOM 1923 O MET A 124 119.191 -20.062 -5.319 1.00 0.00 O ATOM 1924 CB MET A 124 117.524 -21.999 -2.738 1.00 0.00 C ATOM 1925 CG MET A 124 116.153 -22.646 -2.523 1.00 0.00 C ATOM 1926 SD MET A 124 115.081 -21.515 -1.600 1.00 0.00 S ATOM 1927 CE MET A 124 114.790 -20.325 -2.933 1.00 0.00 C ATOM 0 H MET A 124 117.152 -23.297 -4.839 1.00 0.00 H new ATOM 0 HA MET A 124 116.916 -20.497 -4.148 1.00 0.00 H new ATOM 0 HB2 MET A 124 118.311 -22.746 -2.638 1.00 0.00 H new ATOM 0 HB3 MET A 124 117.705 -21.241 -1.975 1.00 0.00 H new ATOM 0 HG2 MET A 124 115.700 -22.888 -3.484 1.00 0.00 H new ATOM 0 HG3 MET A 124 116.264 -23.583 -1.978 1.00 0.00 H new ATOM 0 HE1 MET A 124 113.994 -19.640 -2.642 1.00 0.00 H new ATOM 0 HE2 MET A 124 115.703 -19.760 -3.122 1.00 0.00 H new ATOM 0 HE3 MET A 124 114.498 -20.857 -3.838 1.00 0.00 H new ATOM 1937 N ASN A 125 119.969 -21.457 -3.736 1.00 0.00 N ATOM 1938 CA ASN A 125 121.360 -21.089 -3.959 1.00 0.00 C ATOM 1939 C ASN A 125 121.777 -21.435 -5.383 1.00 0.00 C ATOM 1940 O ASN A 125 122.813 -22.060 -5.602 1.00 0.00 O ATOM 1941 CB ASN A 125 122.262 -21.825 -2.967 1.00 0.00 C ATOM 1942 CG ASN A 125 123.675 -21.253 -3.022 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.522 -21.609 -2.204 1.00 0.00 O ATOM 1944 ND2 ASN A 125 123.980 -20.382 -3.945 1.00 0.00 N ATOM 0 H ASN A 125 119.825 -22.156 -3.007 1.00 0.00 H new ATOM 0 HA ASN A 125 121.463 -20.014 -3.810 1.00 0.00 H new ATOM 0 HB2 ASN A 125 121.861 -21.729 -1.958 1.00 0.00 H new ATOM 0 HB3 ASN A 125 122.282 -22.889 -3.202 1.00 0.00 H new ATOM 0 HD21 ASN A 125 124.923 -19.995 -3.989 1.00 0.00 H new ATOM 0 HD22 ASN A 125 123.276 -20.089 -4.622 1.00 0.00 H new ATOM 1951 N GLY A 126 120.963 -21.019 -6.347 1.00 0.00 N ATOM 1952 CA GLY A 126 121.259 -21.288 -7.745 1.00 0.00 C ATOM 1953 C GLY A 126 122.336 -20.342 -8.251 1.00 0.00 C ATOM 1954 O GLY A 126 122.536 -20.197 -9.454 1.00 0.00 O ATOM 0 H GLY A 126 120.101 -20.499 -6.186 1.00 0.00 H new ATOM 0 HA2 GLY A 126 121.589 -22.320 -7.861 1.00 0.00 H new ATOM 0 HA3 GLY A 126 120.355 -21.173 -8.343 1.00 0.00 H new ATOM 1958 N ARG A 127 123.022 -19.687 -7.322 1.00 0.00 N ATOM 1959 CA ARG A 127 124.069 -18.747 -7.693 1.00 0.00 C ATOM 1960 C ARG A 127 124.941 -19.319 -8.800 1.00 0.00 C ATOM 1961 O ARG A 127 124.696 -19.067 -9.980 1.00 0.00 O ATOM 1962 CB ARG A 127 124.931 -18.408 -6.476 1.00 0.00 C ATOM 1963 CG ARG A 127 125.843 -17.226 -6.808 1.00 0.00 C ATOM 1964 CD ARG A 127 127.077 -17.264 -5.906 1.00 0.00 C ATOM 1965 NE ARG A 127 126.826 -18.103 -4.741 1.00 0.00 N ATOM 1966 CZ ARG A 127 127.687 -18.152 -3.729 1.00 0.00 C ATOM 1967 NH1 ARG A 127 128.779 -17.438 -3.768 1.00 0.00 N ATOM 1968 NH2 ARG A 127 127.440 -18.911 -2.698 1.00 0.00 N ATOM 0 H ARG A 127 122.874 -19.788 -6.318 1.00 0.00 H new ATOM 0 HA ARG A 127 123.594 -17.837 -8.060 1.00 0.00 H new ATOM 0 HB2 ARG A 127 124.296 -18.163 -5.625 1.00 0.00 H new ATOM 0 HB3 ARG A 127 125.529 -19.273 -6.189 1.00 0.00 H new ATOM 0 HG2 ARG A 127 126.143 -17.268 -7.855 1.00 0.00 H new ATOM 0 HG3 ARG A 127 125.306 -16.288 -6.668 1.00 0.00 H new ATOM 0 HD2 ARG A 127 127.931 -17.649 -6.463 1.00 0.00 H new ATOM 0 HD3 ARG A 127 127.334 -16.254 -5.587 1.00 0.00 H new ATOM 0 HE ARG A 127 125.974 -18.663 -4.701 1.00 0.00 H new ATOM 0 HH11 ARG A 127 128.971 -16.843 -4.574 1.00 0.00 H new ATOM 0 HH12 ARG A 127 129.440 -17.475 -2.992 1.00 0.00 H new ATOM 0 HH21 ARG A 127 126.586 -19.468 -2.667 1.00 0.00 H new ATOM 0 HH22 ARG A 127 128.101 -18.948 -1.922 1.00 0.00 H new ATOM 1982 N GLY A 128 125.958 -20.086 -8.428 1.00 0.00 N ATOM 1983 CA GLY A 128 126.848 -20.672 -9.419 1.00 0.00 C ATOM 1984 C GLY A 128 126.059 -21.237 -10.591 1.00 0.00 C ATOM 1985 O GLY A 128 126.538 -21.245 -11.724 1.00 0.00 O ATOM 0 H GLY A 128 126.185 -20.314 -7.460 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.548 -19.917 -9.777 1.00 0.00 H new ATOM 0 HA3 GLY A 128 127.440 -21.463 -8.959 1.00 0.00 H new ATOM 1989 N GLU A 129 124.847 -21.706 -10.317 1.00 0.00 N ATOM 1990 CA GLU A 129 124.011 -22.265 -11.368 1.00 0.00 C ATOM 1991 C GLU A 129 123.742 -21.219 -12.439 1.00 0.00 C ATOM 1992 O GLU A 129 123.931 -21.477 -13.627 1.00 0.00 O ATOM 1993 CB GLU A 129 122.691 -22.771 -10.785 1.00 0.00 C ATOM 1994 CG GLU A 129 122.794 -24.276 -10.527 1.00 0.00 C ATOM 1995 CD GLU A 129 123.743 -24.540 -9.362 1.00 0.00 C ATOM 1996 OE1 GLU A 129 124.699 -23.797 -9.221 1.00 0.00 O ATOM 1997 OE2 GLU A 129 123.498 -25.484 -8.628 1.00 0.00 O ATOM 0 H GLU A 129 124.427 -21.710 -9.388 1.00 0.00 H new ATOM 0 HA GLU A 129 124.538 -23.105 -11.821 1.00 0.00 H new ATOM 0 HB2 GLU A 129 122.466 -22.246 -9.857 1.00 0.00 H new ATOM 0 HB3 GLU A 129 121.873 -22.564 -11.475 1.00 0.00 H new ATOM 0 HG2 GLU A 129 121.808 -24.684 -10.304 1.00 0.00 H new ATOM 0 HG3 GLU A 129 123.153 -24.783 -11.422 1.00 0.00 H new ATOM 2004 N VAL A 130 123.317 -20.035 -12.018 1.00 0.00 N ATOM 2005 CA VAL A 130 123.049 -18.967 -12.970 1.00 0.00 C ATOM 2006 C VAL A 130 124.359 -18.502 -13.592 1.00 0.00 C ATOM 2007 O VAL A 130 124.487 -18.417 -14.813 1.00 0.00 O ATOM 2008 CB VAL A 130 122.346 -17.801 -12.270 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.378 -16.785 -11.778 1.00 0.00 C ATOM 2010 CG2 VAL A 130 121.389 -17.122 -13.252 1.00 0.00 C ATOM 0 H VAL A 130 123.153 -19.793 -11.041 1.00 0.00 H new ATOM 0 HA VAL A 130 122.394 -19.340 -13.757 1.00 0.00 H new ATOM 0 HB VAL A 130 121.787 -18.182 -11.415 1.00 0.00 H new ATOM 0 HG11 VAL A 130 122.868 -15.960 -11.282 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.057 -17.267 -11.075 1.00 0.00 H new ATOM 0 HG13 VAL A 130 123.946 -16.403 -12.626 1.00 0.00 H new ATOM 0 HG21 VAL A 130 120.887 -16.291 -12.756 1.00 0.00 H new ATOM 0 HG22 VAL A 130 121.951 -16.747 -14.108 1.00 0.00 H new ATOM 0 HG23 VAL A 130 120.646 -17.843 -13.593 1.00 0.00 H new ATOM 2020 N GLN A 131 125.331 -18.213 -12.737 1.00 0.00 N ATOM 2021 CA GLN A 131 126.638 -17.768 -13.199 1.00 0.00 C ATOM 2022 C GLN A 131 127.261 -18.815 -14.116 1.00 0.00 C ATOM 2023 O GLN A 131 128.062 -18.488 -14.992 1.00 0.00 O ATOM 2024 CB GLN A 131 127.560 -17.518 -12.004 1.00 0.00 C ATOM 2025 CG GLN A 131 127.085 -16.280 -11.241 1.00 0.00 C ATOM 2026 CD GLN A 131 128.277 -15.396 -10.887 1.00 0.00 C ATOM 2027 OE1 GLN A 131 128.133 -14.181 -10.761 1.00 0.00 O ATOM 2028 NE2 GLN A 131 129.452 -15.939 -10.719 1.00 0.00 N ATOM 0 H GLN A 131 125.239 -18.279 -11.723 1.00 0.00 H new ATOM 0 HA GLN A 131 126.511 -16.840 -13.756 1.00 0.00 H new ATOM 0 HB2 GLN A 131 127.561 -18.386 -11.345 1.00 0.00 H new ATOM 0 HB3 GLN A 131 128.585 -17.376 -12.346 1.00 0.00 H new ATOM 0 HG2 GLN A 131 126.374 -15.720 -11.848 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.562 -16.581 -10.333 1.00 0.00 H new ATOM 0 HE21 GLN A 131 129.568 -16.947 -10.824 1.00 0.00 H new ATOM 0 HE22 GLN A 131 130.254 -15.355 -10.482 1.00 0.00 H new ATOM 2037 N SER A 132 126.886 -20.077 -13.914 1.00 0.00 N ATOM 2038 CA SER A 132 127.415 -21.156 -14.736 1.00 0.00 C ATOM 2039 C SER A 132 126.682 -21.212 -16.071 1.00 0.00 C ATOM 2040 O SER A 132 127.303 -21.263 -17.132 1.00 0.00 O ATOM 2041 CB SER A 132 127.257 -22.494 -14.013 1.00 0.00 C ATOM 2042 OG SER A 132 127.819 -23.529 -14.812 1.00 0.00 O ATOM 0 H SER A 132 126.225 -20.372 -13.196 1.00 0.00 H new ATOM 0 HA SER A 132 128.473 -20.965 -14.916 1.00 0.00 H new ATOM 0 HB2 SER A 132 127.753 -22.457 -13.043 1.00 0.00 H new ATOM 0 HB3 SER A 132 126.203 -22.696 -13.824 1.00 0.00 H new ATOM 0 HG SER A 132 127.721 -24.388 -14.351 1.00 0.00 H new ATOM 2048 N LEU A 133 125.355 -21.200 -16.006 1.00 0.00 N ATOM 2049 CA LEU A 133 124.541 -21.250 -17.212 1.00 0.00 C ATOM 2050 C LEU A 133 124.323 -19.849 -17.773 1.00 0.00 C ATOM 2051 O LEU A 133 123.789 -19.690 -18.869 1.00 0.00 O ATOM 2052 CB LEU A 133 123.186 -21.887 -16.903 1.00 0.00 C ATOM 2053 CG LEU A 133 123.245 -23.383 -17.209 1.00 0.00 C ATOM 2054 CD1 LEU A 133 121.907 -24.030 -16.842 1.00 0.00 C ATOM 2055 CD2 LEU A 133 123.516 -23.587 -18.701 1.00 0.00 C ATOM 0 H LEU A 133 124.824 -21.156 -15.136 1.00 0.00 H new ATOM 0 HA LEU A 133 125.067 -21.851 -17.954 1.00 0.00 H new ATOM 0 HB2 LEU A 133 122.928 -21.729 -15.856 1.00 0.00 H new ATOM 0 HB3 LEU A 133 122.405 -21.414 -17.498 1.00 0.00 H new ATOM 0 HG LEU A 133 124.044 -23.843 -16.628 1.00 0.00 H new ATOM 0 HD11 LEU A 133 121.947 -25.097 -17.060 1.00 0.00 H new ATOM 0 HD12 LEU A 133 121.711 -23.883 -15.780 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.109 -23.571 -17.425 1.00 0.00 H new ATOM 0 HD21 LEU A 133 123.558 -24.654 -18.921 1.00 0.00 H new ATOM 0 HD22 LEU A 133 122.716 -23.128 -19.282 1.00 0.00 H new ATOM 0 HD23 LEU A 133 124.467 -23.124 -18.965 1.00 0.00 H new ATOM 2067 N GLY A 134 124.731 -18.838 -17.017 1.00 0.00 N ATOM 2068 CA GLY A 134 124.563 -17.460 -17.463 1.00 0.00 C ATOM 2069 C GLY A 134 123.100 -17.178 -17.786 1.00 0.00 C ATOM 2070 O GLY A 134 122.197 -17.727 -17.154 1.00 0.00 O ATOM 0 H GLY A 134 125.175 -18.942 -16.105 1.00 0.00 H new ATOM 0 HA2 GLY A 134 124.909 -16.776 -16.688 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.178 -17.279 -18.345 1.00 0.00 H new ATOM 2074 N PRO A 135 122.853 -16.339 -18.754 1.00 0.00 N ATOM 2075 CA PRO A 135 121.469 -15.978 -19.174 1.00 0.00 C ATOM 2076 C PRO A 135 120.684 -17.195 -19.660 1.00 0.00 C ATOM 2077 O PRO A 135 119.464 -17.139 -19.810 1.00 0.00 O ATOM 2078 CB PRO A 135 121.664 -14.969 -20.312 1.00 0.00 C ATOM 2079 CG PRO A 135 123.089 -14.523 -20.236 1.00 0.00 C ATOM 2080 CD PRO A 135 123.868 -15.645 -19.553 1.00 0.00 C ATOM 0 HA PRO A 135 120.891 -15.572 -18.344 1.00 0.00 H new ATOM 0 HB2 PRO A 135 121.450 -15.426 -21.278 1.00 0.00 H new ATOM 0 HB3 PRO A 135 120.985 -14.123 -20.203 1.00 0.00 H new ATOM 0 HG2 PRO A 135 123.486 -14.328 -21.232 1.00 0.00 H new ATOM 0 HG3 PRO A 135 123.174 -13.595 -19.671 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.329 -16.312 -20.281 1.00 0.00 H new ATOM 0 HD3 PRO A 135 124.670 -15.252 -18.928 1.00 0.00 H new ATOM 2088 N ARG A 136 121.393 -18.295 -19.899 1.00 0.00 N ATOM 2089 CA ARG A 136 120.749 -19.518 -20.361 1.00 0.00 C ATOM 2090 C ARG A 136 120.187 -20.285 -19.173 1.00 0.00 C ATOM 2091 O ARG A 136 119.438 -21.247 -19.335 1.00 0.00 O ATOM 2092 CB ARG A 136 121.757 -20.390 -21.110 1.00 0.00 C ATOM 2093 CG ARG A 136 122.877 -19.510 -21.664 1.00 0.00 C ATOM 2094 CD ARG A 136 123.328 -20.050 -23.021 1.00 0.00 C ATOM 2095 NE ARG A 136 124.583 -19.422 -23.422 1.00 0.00 N ATOM 2096 CZ ARG A 136 125.124 -19.665 -24.612 1.00 0.00 C ATOM 2097 NH1 ARG A 136 124.531 -20.477 -25.445 1.00 0.00 N ATOM 2098 NH2 ARG A 136 126.246 -19.092 -24.948 1.00 0.00 N ATOM 0 H ARG A 136 122.404 -18.364 -19.781 1.00 0.00 H new ATOM 0 HA ARG A 136 119.935 -19.256 -21.037 1.00 0.00 H new ATOM 0 HB2 ARG A 136 122.170 -21.145 -20.440 1.00 0.00 H new ATOM 0 HB3 ARG A 136 121.262 -20.922 -21.922 1.00 0.00 H new ATOM 0 HG2 ARG A 136 122.529 -18.482 -21.768 1.00 0.00 H new ATOM 0 HG3 ARG A 136 123.717 -19.493 -20.970 1.00 0.00 H new ATOM 0 HD2 ARG A 136 123.455 -21.131 -22.966 1.00 0.00 H new ATOM 0 HD3 ARG A 136 122.561 -19.857 -23.771 1.00 0.00 H new ATOM 0 HE ARG A 136 125.053 -18.786 -22.778 1.00 0.00 H new ATOM 0 HH11 ARG A 136 123.653 -20.925 -25.183 1.00 0.00 H new ATOM 0 HH12 ARG A 136 124.946 -20.664 -26.358 1.00 0.00 H new ATOM 0 HH21 ARG A 136 126.709 -18.457 -24.298 1.00 0.00 H new ATOM 0 HH22 ARG A 136 126.661 -19.279 -25.861 1.00 0.00 H new ATOM 2112 N ALA A 137 120.552 -19.837 -17.979 1.00 0.00 N ATOM 2113 CA ALA A 137 120.077 -20.472 -16.757 1.00 0.00 C ATOM 2114 C ALA A 137 118.576 -20.254 -16.603 1.00 0.00 C ATOM 2115 O ALA A 137 117.892 -21.022 -15.929 1.00 0.00 O ATOM 2116 CB ALA A 137 120.808 -19.893 -15.544 1.00 0.00 C ATOM 0 H ALA A 137 121.172 -19.041 -17.831 1.00 0.00 H new ATOM 0 HA ALA A 137 120.279 -21.541 -16.818 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.445 -20.375 -14.636 1.00 0.00 H new ATOM 0 HB2 ALA A 137 121.879 -20.070 -15.646 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.622 -18.821 -15.485 1.00 0.00 H new ATOM 2122 N PHE A 138 118.072 -19.199 -17.238 1.00 0.00 N ATOM 2123 CA PHE A 138 116.650 -18.890 -17.169 1.00 0.00 C ATOM 2124 C PHE A 138 115.832 -20.177 -17.160 1.00 0.00 C ATOM 2125 O PHE A 138 114.701 -20.203 -16.677 1.00 0.00 O ATOM 2126 CB PHE A 138 116.243 -18.028 -18.366 1.00 0.00 C ATOM 2127 CG PHE A 138 114.766 -18.198 -18.634 1.00 0.00 C ATOM 2128 CD1 PHE A 138 113.836 -17.399 -17.959 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.328 -19.156 -19.555 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.467 -17.556 -18.207 1.00 0.00 C ATOM 2131 CE2 PHE A 138 112.959 -19.314 -19.805 1.00 0.00 C ATOM 2132 CZ PHE A 138 112.029 -18.513 -19.130 1.00 0.00 C ATOM 0 H PHE A 138 118.622 -18.550 -17.801 1.00 0.00 H new ATOM 0 HA PHE A 138 116.456 -18.339 -16.249 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.468 -16.980 -18.166 1.00 0.00 H new ATOM 0 HB3 PHE A 138 116.818 -18.315 -19.246 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.174 -16.661 -17.247 1.00 0.00 H new ATOM 0 HD2 PHE A 138 115.046 -19.774 -20.073 1.00 0.00 H new ATOM 0 HE1 PHE A 138 111.749 -16.939 -17.687 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.621 -20.052 -20.517 1.00 0.00 H new ATOM 0 HZ PHE A 138 110.973 -18.634 -19.322 1.00 0.00 H new ATOM 2142 N GLN A 139 116.418 -21.245 -17.693 1.00 0.00 N ATOM 2143 CA GLN A 139 115.738 -22.533 -17.735 1.00 0.00 C ATOM 2144 C GLN A 139 115.725 -23.165 -16.351 1.00 0.00 C ATOM 2145 O GLN A 139 114.693 -23.656 -15.891 1.00 0.00 O ATOM 2146 CB GLN A 139 116.438 -23.467 -18.724 1.00 0.00 C ATOM 2147 CG GLN A 139 117.676 -24.075 -18.065 1.00 0.00 C ATOM 2148 CD GLN A 139 118.501 -24.829 -19.102 1.00 0.00 C ATOM 2149 OE1 GLN A 139 118.381 -24.570 -20.299 1.00 0.00 O ATOM 2150 NE2 GLN A 139 119.338 -25.752 -18.712 1.00 0.00 N ATOM 0 H GLN A 139 117.354 -21.244 -18.098 1.00 0.00 H new ATOM 0 HA GLN A 139 114.711 -22.374 -18.063 1.00 0.00 H new ATOM 0 HB2 GLN A 139 115.756 -24.257 -19.039 1.00 0.00 H new ATOM 0 HB3 GLN A 139 116.724 -22.916 -19.620 1.00 0.00 H new ATOM 0 HG2 GLN A 139 118.279 -23.289 -17.610 1.00 0.00 H new ATOM 0 HG3 GLN A 139 117.377 -24.751 -17.264 1.00 0.00 H new ATOM 0 HE21 GLN A 139 119.436 -25.965 -17.719 1.00 0.00 H new ATOM 0 HE22 GLN A 139 119.894 -26.260 -19.400 1.00 0.00 H new ATOM 2159 N ASN A 140 116.873 -23.140 -15.685 1.00 0.00 N ATOM 2160 CA ASN A 140 116.976 -23.702 -14.345 1.00 0.00 C ATOM 2161 C ASN A 140 116.275 -22.786 -13.351 1.00 0.00 C ATOM 2162 O ASN A 140 115.560 -23.244 -12.461 1.00 0.00 O ATOM 2163 CB ASN A 140 118.447 -23.863 -13.954 1.00 0.00 C ATOM 2164 CG ASN A 140 119.013 -25.138 -14.570 1.00 0.00 C ATOM 2165 OD1 ASN A 140 118.304 -25.856 -15.273 1.00 0.00 O ATOM 2166 ND2 ASN A 140 120.257 -25.464 -14.344 1.00 0.00 N ATOM 0 H ASN A 140 117.739 -22.740 -16.047 1.00 0.00 H new ATOM 0 HA ASN A 140 116.498 -24.682 -14.332 1.00 0.00 H new ATOM 0 HB2 ASN A 140 119.019 -23.000 -14.294 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.542 -23.900 -12.869 1.00 0.00 H new ATOM 0 HD21 ASN A 140 120.643 -26.316 -14.751 1.00 0.00 H new ATOM 0 HD22 ASN A 140 120.843 -24.867 -13.761 1.00 0.00 H new ATOM 2173 N TRP A 141 116.481 -21.486 -13.524 1.00 0.00 N ATOM 2174 CA TRP A 141 115.860 -20.496 -12.653 1.00 0.00 C ATOM 2175 C TRP A 141 114.356 -20.452 -12.904 1.00 0.00 C ATOM 2176 O TRP A 141 113.587 -20.010 -12.050 1.00 0.00 O ATOM 2177 CB TRP A 141 116.455 -19.113 -12.927 1.00 0.00 C ATOM 2178 CG TRP A 141 117.662 -18.890 -12.070 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.439 -19.862 -11.537 1.00 0.00 C ATOM 2180 CD2 TRP A 141 118.246 -17.624 -11.646 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.456 -19.272 -10.809 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.381 -17.896 -10.847 1.00 0.00 C ATOM 2183 CE3 TRP A 141 117.904 -16.279 -11.875 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 120.147 -16.871 -10.293 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.675 -15.246 -11.320 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.793 -15.542 -10.530 1.00 0.00 C ATOM 0 H TRP A 141 117.072 -21.094 -14.257 1.00 0.00 H new ATOM 0 HA TRP A 141 116.048 -20.775 -11.616 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.726 -19.028 -13.979 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.710 -18.343 -12.727 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.289 -20.924 -11.660 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.174 -19.792 -10.305 1.00 0.00 H new ATOM 0 HE3 TRP A 141 117.043 -16.040 -12.482 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 121.008 -17.104 -9.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 118.405 -14.217 -11.503 1.00 0.00 H new ATOM 0 HH2 TRP A 141 120.381 -14.742 -10.104 1.00 0.00 H new ATOM 2197 N ALA A 142 113.945 -20.909 -14.086 1.00 0.00 N ATOM 2198 CA ALA A 142 112.532 -20.913 -14.444 1.00 0.00 C ATOM 2199 C ALA A 142 112.066 -22.316 -14.799 1.00 0.00 C ATOM 2200 O ALA A 142 110.940 -22.519 -15.252 1.00 0.00 O ATOM 2201 CB ALA A 142 112.282 -19.970 -15.622 1.00 0.00 C ATOM 0 H ALA A 142 114.567 -21.278 -14.805 1.00 0.00 H new ATOM 0 HA ALA A 142 111.963 -20.567 -13.581 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.223 -19.982 -15.879 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.577 -18.957 -15.346 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.868 -20.297 -16.481 1.00 0.00 H new ATOM 2207 N ARG A 143 112.947 -23.272 -14.587 1.00 0.00 N ATOM 2208 CA ARG A 143 112.643 -24.667 -14.883 1.00 0.00 C ATOM 2209 C ARG A 143 111.210 -25.000 -14.477 1.00 0.00 C ATOM 2210 O ARG A 143 110.499 -25.559 -15.296 1.00 0.00 O ATOM 2211 CB ARG A 143 113.613 -25.584 -14.133 1.00 0.00 C ATOM 2212 CG ARG A 143 114.286 -26.537 -15.124 1.00 0.00 C ATOM 2213 CD ARG A 143 115.454 -27.247 -14.437 1.00 0.00 C ATOM 2214 NE ARG A 143 115.157 -28.666 -14.278 1.00 0.00 N ATOM 2215 CZ ARG A 143 114.374 -29.098 -13.293 1.00 0.00 C ATOM 2216 NH1 ARG A 143 113.858 -28.247 -12.450 1.00 0.00 N ATOM 2217 NH2 ARG A 143 114.123 -30.373 -13.171 1.00 0.00 N ATOM 2218 OXT ARG A 143 110.846 -24.692 -13.355 1.00 0.00 O ATOM 0 H ARG A 143 113.882 -23.114 -14.211 1.00 0.00 H new ATOM 0 HA ARG A 143 112.751 -24.823 -15.956 1.00 0.00 H new ATOM 0 HB2 ARG A 143 114.366 -24.989 -13.616 1.00 0.00 H new ATOM 0 HB3 ARG A 143 113.078 -26.152 -13.372 1.00 0.00 H new ATOM 0 HG2 ARG A 143 113.565 -27.269 -15.488 1.00 0.00 H new ATOM 0 HG3 ARG A 143 114.643 -25.983 -15.992 1.00 0.00 H new ATOM 0 HD2 ARG A 143 116.363 -27.122 -15.026 1.00 0.00 H new ATOM 0 HD3 ARG A 143 115.641 -26.796 -13.463 1.00 0.00 H new ATOM 0 HE ARG A 143 115.556 -29.338 -14.933 1.00 0.00 H new ATOM 0 HH11 ARG A 143 114.055 -27.251 -12.546 1.00 0.00 H new ATOM 0 HH12 ARG A 143 113.258 -28.578 -11.695 1.00 0.00 H new ATOM 0 HH21 ARG A 143 114.527 -31.038 -13.831 1.00 0.00 H new ATOM 0 HH22 ARG A 143 113.523 -30.705 -12.416 1.00 0.00 H new TER 2232 ARG A 143