USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=34 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 139 GLN : amide:sc= -0.141 K(o=-3.2,f=-6!) USER MOD Set 1.2: A 140 ASN : amide:sc= -3.07 K(o=-3.2,f=-11!) USER MOD Set 2.1: A 32 TYR OH : rot 176:sc= 0.219 USER MOD Set 2.2: A 34 SER OG : rot 133:sc= -4.97! USER MOD Set 3.1: A 26 LYS NZ :NH3+ 147:sc= 0.383 (180deg=-1.25) USER MOD Set 3.2: A 59 SER OG : rot -50:sc= 0.716 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.0149 (180deg=-0.319) USER MOD Single : A 5 GLN : amide:sc= -1.54 K(o=-1.5,f=-0.48) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 144:sc= 0.0828 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.226 K(o=-0.23,f=-0.94!) USER MOD Single : A 20 ASN : amide:sc= -0.812 K(o=-0.81,f=-7.1!) USER MOD Single : A 24 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0251) USER MOD Single : A 36 HIS : no HD1:sc= -20.4! C(o=-20!,f=-22!) USER MOD Single : A 38 CYS SG : rot -107:sc= -2.51! USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl -123:sc= -0.858 (180deg=-6.97!) USER MOD Single : A 52 TYR OH : rot 141:sc= -0.766 USER MOD Single : A 53 SER OG : rot -0:sc= -3.84 USER MOD Single : A 68 SER OG : rot 110:sc= -2.05! USER MOD Single : A 69 SER OG : rot -68:sc= 1.22 USER MOD Single : A 72 SER OG : rot -151:sc= 0.181! USER MOD Single : A 76 MET CE :methyl -113:sc= -2.16 (180deg=-4.96!) USER MOD Single : A 78 GLN : amide:sc= -1.17 K(o=-1.2,f=-5.4!) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl 167:sc= 0 (180deg=-0.181) USER MOD Single : A 83 SER OG : rot 75:sc= 0.425 USER MOD Single : A 84 HIS : no HE2:sc= -11.4! C(o=-11!,f=-11!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 82:sc= 0 USER MOD Single : A 98 SER OG : rot 68:sc= 0.902 USER MOD Single : A 99 ASN : amide:sc= 0.148 K(o=0.15,f=-2.2!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0219 USER MOD Single : A 103 LYS NZ :NH3+ 168:sc= 0.327 (180deg=0.275) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -69:sc= 1.04 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 150:sc= -0.0606 (180deg=-0.443) USER MOD Single : A 120 THR OG1 : rot -170:sc= -0.845 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 135:sc= -9.62! (180deg=-11!) USER MOD Single : A 125 ASN : amide:sc= -1.74! K(o=-1.7!,f=-0.47) USER MOD Single : A 131 GLN : amide:sc= -23.4! C(o=-23!,f=-26!) USER MOD Single : A 132 SER OG : rot 69:sc= 0.402 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 102.202 -15.293 7.090 1.00 0.00 N ATOM 2 CA MET A 1 101.126 -14.384 6.603 1.00 0.00 C ATOM 3 C MET A 1 101.696 -12.982 6.414 1.00 0.00 C ATOM 4 O MET A 1 101.259 -12.236 5.537 1.00 0.00 O ATOM 5 CB MET A 1 99.988 -14.352 7.623 1.00 0.00 C ATOM 6 CG MET A 1 98.806 -13.570 7.046 1.00 0.00 C ATOM 7 SD MET A 1 99.219 -11.809 6.984 1.00 0.00 S ATOM 8 CE MET A 1 97.773 -11.205 7.890 1.00 0.00 C ATOM 0 H1 MET A 1 101.905 -16.282 6.964 1.00 0.00 H new ATOM 0 H2 MET A 1 103.073 -15.121 6.548 1.00 0.00 H new ATOM 0 H3 MET A 1 102.380 -15.111 8.098 1.00 0.00 H new ATOM 0 HA MET A 1 100.741 -14.746 5.650 1.00 0.00 H new ATOM 0 HB2 MET A 1 99.679 -15.368 7.871 1.00 0.00 H new ATOM 0 HB3 MET A 1 100.328 -13.887 8.548 1.00 0.00 H new ATOM 0 HG2 MET A 1 98.569 -13.934 6.046 1.00 0.00 H new ATOM 0 HG3 MET A 1 97.919 -13.725 7.660 1.00 0.00 H new ATOM 0 HE1 MET A 1 97.822 -10.119 7.972 1.00 0.00 H new ATOM 0 HE2 MET A 1 96.865 -11.488 7.357 1.00 0.00 H new ATOM 0 HE3 MET A 1 97.759 -11.644 8.888 1.00 0.00 H new ATOM 20 N GLU A 2 102.673 -12.628 7.242 1.00 0.00 N ATOM 21 CA GLU A 2 103.295 -11.312 7.158 1.00 0.00 C ATOM 22 C GLU A 2 104.086 -11.176 5.861 1.00 0.00 C ATOM 23 O GLU A 2 105.133 -10.529 5.826 1.00 0.00 O ATOM 24 CB GLU A 2 104.227 -11.098 8.352 1.00 0.00 C ATOM 25 CG GLU A 2 104.006 -9.697 8.928 1.00 0.00 C ATOM 26 CD GLU A 2 104.076 -8.659 7.814 1.00 0.00 C ATOM 27 OE1 GLU A 2 105.041 -8.684 7.068 1.00 0.00 O ATOM 28 OE2 GLU A 2 103.165 -7.853 7.724 1.00 0.00 O ATOM 0 H GLU A 2 103.049 -13.230 7.975 1.00 0.00 H new ATOM 0 HA GLU A 2 102.509 -10.557 7.172 1.00 0.00 H new ATOM 0 HB2 GLU A 2 104.035 -11.851 9.116 1.00 0.00 H new ATOM 0 HB3 GLU A 2 105.265 -11.216 8.042 1.00 0.00 H new ATOM 0 HG2 GLU A 2 103.036 -9.647 9.423 1.00 0.00 H new ATOM 0 HG3 GLU A 2 104.761 -9.482 9.684 1.00 0.00 H new ATOM 35 N PHE A 3 103.579 -11.790 4.796 1.00 0.00 N ATOM 36 CA PHE A 3 104.248 -11.729 3.502 1.00 0.00 C ATOM 37 C PHE A 3 104.673 -10.299 3.185 1.00 0.00 C ATOM 38 O PHE A 3 104.525 -9.400 4.012 1.00 0.00 O ATOM 39 CB PHE A 3 103.313 -12.241 2.405 1.00 0.00 C ATOM 40 CG PHE A 3 103.459 -13.738 2.277 1.00 0.00 C ATOM 41 CD1 PHE A 3 103.382 -14.549 3.416 1.00 0.00 C ATOM 42 CD2 PHE A 3 103.671 -14.316 1.019 1.00 0.00 C ATOM 43 CE1 PHE A 3 103.519 -15.938 3.297 1.00 0.00 C ATOM 44 CE2 PHE A 3 103.806 -15.704 0.901 1.00 0.00 C ATOM 45 CZ PHE A 3 103.730 -16.516 2.039 1.00 0.00 C ATOM 0 H PHE A 3 102.714 -12.331 4.803 1.00 0.00 H new ATOM 0 HA PHE A 3 105.137 -12.359 3.544 1.00 0.00 H new ATOM 0 HB2 PHE A 3 102.281 -11.985 2.643 1.00 0.00 H new ATOM 0 HB3 PHE A 3 103.550 -11.759 1.456 1.00 0.00 H new ATOM 0 HD1 PHE A 3 103.217 -14.104 4.386 1.00 0.00 H new ATOM 0 HD2 PHE A 3 103.730 -13.691 0.140 1.00 0.00 H new ATOM 0 HE1 PHE A 3 103.462 -16.563 4.176 1.00 0.00 H new ATOM 0 HE2 PHE A 3 103.969 -16.149 -0.069 1.00 0.00 H new ATOM 0 HZ PHE A 3 103.834 -17.587 1.947 1.00 0.00 H new ATOM 55 N ILE A 4 105.203 -10.096 1.983 1.00 0.00 N ATOM 56 CA ILE A 4 105.646 -8.770 1.569 1.00 0.00 C ATOM 57 C ILE A 4 104.469 -7.942 1.067 1.00 0.00 C ATOM 58 O ILE A 4 104.250 -6.818 1.517 1.00 0.00 O ATOM 59 CB ILE A 4 106.697 -8.889 0.465 1.00 0.00 C ATOM 60 CG1 ILE A 4 106.478 -10.191 -0.311 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.095 -8.897 1.087 1.00 0.00 C ATOM 62 CD1 ILE A 4 107.045 -10.044 -1.724 1.00 0.00 C ATOM 0 H ILE A 4 105.335 -10.827 1.284 1.00 0.00 H new ATOM 0 HA ILE A 4 106.084 -8.270 2.433 1.00 0.00 H new ATOM 0 HB ILE A 4 106.606 -8.041 -0.213 1.00 0.00 H new ATOM 0 HG12 ILE A 4 106.965 -11.020 0.203 1.00 0.00 H new ATOM 0 HG13 ILE A 4 105.414 -10.425 -0.357 1.00 0.00 H new ATOM 0 HG21 ILE A 4 108.843 -8.982 0.299 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.253 -7.971 1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.186 -9.744 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 4 106.889 -10.970 -2.277 1.00 0.00 H new ATOM 0 HD12 ILE A 4 106.538 -9.226 -2.236 1.00 0.00 H new ATOM 0 HD13 ILE A 4 108.112 -9.830 -1.667 1.00 0.00 H new ATOM 74 N GLN A 5 103.717 -8.505 0.133 1.00 0.00 N ATOM 75 CA GLN A 5 102.565 -7.810 -0.427 1.00 0.00 C ATOM 76 C GLN A 5 101.904 -6.932 0.631 1.00 0.00 C ATOM 77 O GLN A 5 101.427 -7.426 1.652 1.00 0.00 O ATOM 78 CB GLN A 5 101.549 -8.824 -0.958 1.00 0.00 C ATOM 79 CG GLN A 5 101.071 -9.717 0.188 1.00 0.00 C ATOM 80 CD GLN A 5 101.149 -11.183 -0.227 1.00 0.00 C ATOM 81 OE1 GLN A 5 100.127 -11.867 -0.285 1.00 0.00 O ATOM 82 NE2 GLN A 5 102.307 -11.708 -0.520 1.00 0.00 N ATOM 0 H GLN A 5 103.881 -9.435 -0.252 1.00 0.00 H new ATOM 0 HA GLN A 5 102.909 -7.178 -1.246 1.00 0.00 H new ATOM 0 HB2 GLN A 5 100.702 -8.305 -1.406 1.00 0.00 H new ATOM 0 HB3 GLN A 5 102.001 -9.431 -1.742 1.00 0.00 H new ATOM 0 HG2 GLN A 5 101.685 -9.548 1.073 1.00 0.00 H new ATOM 0 HG3 GLN A 5 100.046 -9.460 0.457 1.00 0.00 H new ATOM 0 HE21 GLN A 5 103.152 -11.139 -0.471 1.00 0.00 H new ATOM 0 HE22 GLN A 5 102.367 -12.688 -0.798 1.00 0.00 H new ATOM 91 N GLY A 6 101.880 -5.627 0.378 1.00 0.00 N ATOM 92 CA GLY A 6 101.276 -4.688 1.315 1.00 0.00 C ATOM 93 C GLY A 6 102.253 -3.575 1.685 1.00 0.00 C ATOM 94 O GLY A 6 101.860 -2.558 2.255 1.00 0.00 O ATOM 0 H GLY A 6 102.269 -5.199 -0.462 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.378 -4.256 0.873 1.00 0.00 H new ATOM 0 HA3 GLY A 6 100.965 -5.217 2.216 1.00 0.00 H new ATOM 98 N ILE A 7 103.526 -3.771 1.355 1.00 0.00 N ATOM 99 CA ILE A 7 104.542 -2.781 1.656 1.00 0.00 C ATOM 100 C ILE A 7 104.883 -1.966 0.414 1.00 0.00 C ATOM 101 O ILE A 7 104.400 -2.252 -0.682 1.00 0.00 O ATOM 102 CB ILE A 7 105.801 -3.475 2.168 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.326 -4.436 1.100 1.00 0.00 C ATOM 104 CG2 ILE A 7 105.474 -4.254 3.442 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.813 -4.702 1.339 1.00 0.00 C ATOM 0 H ILE A 7 103.873 -4.605 0.881 1.00 0.00 H new ATOM 0 HA ILE A 7 104.154 -2.109 2.422 1.00 0.00 H new ATOM 0 HB ILE A 7 106.563 -2.727 2.387 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.769 -5.372 1.132 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.177 -4.010 0.108 1.00 0.00 H new ATOM 0 HG21 ILE A 7 106.374 -4.749 3.807 1.00 0.00 H new ATOM 0 HG22 ILE A 7 105.104 -3.567 4.203 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.711 -5.002 3.226 1.00 0.00 H new ATOM 0 HD11 ILE A 7 108.187 -5.387 0.578 1.00 0.00 H new ATOM 0 HD12 ILE A 7 108.364 -3.763 1.285 1.00 0.00 H new ATOM 0 HD13 ILE A 7 107.949 -5.146 2.325 1.00 0.00 H new ATOM 117 N LYS A 8 105.719 -0.950 0.593 1.00 0.00 N ATOM 118 CA LYS A 8 106.121 -0.099 -0.517 1.00 0.00 C ATOM 119 C LYS A 8 107.617 -0.238 -0.782 1.00 0.00 C ATOM 120 O LYS A 8 108.424 -0.228 0.148 1.00 0.00 O ATOM 121 CB LYS A 8 105.787 1.361 -0.204 1.00 0.00 C ATOM 122 CG LYS A 8 106.732 1.882 0.880 1.00 0.00 C ATOM 123 CD LYS A 8 106.587 1.026 2.140 1.00 0.00 C ATOM 124 CE LYS A 8 106.891 1.878 3.374 1.00 0.00 C ATOM 125 NZ LYS A 8 105.613 2.325 3.995 1.00 0.00 N ATOM 0 H LYS A 8 106.129 -0.697 1.492 1.00 0.00 H new ATOM 0 HA LYS A 8 105.576 -0.411 -1.408 1.00 0.00 H new ATOM 0 HB2 LYS A 8 105.881 1.967 -1.105 1.00 0.00 H new ATOM 0 HB3 LYS A 8 104.753 1.445 0.130 1.00 0.00 H new ATOM 0 HG2 LYS A 8 107.762 1.852 0.524 1.00 0.00 H new ATOM 0 HG3 LYS A 8 106.503 2.923 1.107 1.00 0.00 H new ATOM 0 HD2 LYS A 8 105.577 0.622 2.204 1.00 0.00 H new ATOM 0 HD3 LYS A 8 107.268 0.176 2.095 1.00 0.00 H new ATOM 0 HE2 LYS A 8 107.475 1.302 4.092 1.00 0.00 H new ATOM 0 HE3 LYS A 8 107.493 2.742 3.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 105.819 2.904 4.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 105.072 2.889 3.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 105.055 1.494 4.276 1.00 0.00 H new ATOM 139 N LEU A 9 107.979 -0.367 -2.054 1.00 0.00 N ATOM 140 CA LEU A 9 109.381 -0.507 -2.425 1.00 0.00 C ATOM 141 C LEU A 9 109.956 0.834 -2.867 1.00 0.00 C ATOM 142 O LEU A 9 109.213 1.785 -3.113 1.00 0.00 O ATOM 143 CB LEU A 9 109.526 -1.527 -3.555 1.00 0.00 C ATOM 144 CG LEU A 9 110.108 -2.823 -2.993 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.305 -3.249 -1.761 1.00 0.00 C ATOM 146 CD2 LEU A 9 110.029 -3.921 -4.056 1.00 0.00 C ATOM 0 H LEU A 9 107.327 -0.377 -2.839 1.00 0.00 H new ATOM 0 HA LEU A 9 109.934 -0.855 -1.552 1.00 0.00 H new ATOM 0 HB2 LEU A 9 108.556 -1.719 -4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 9 110.175 -1.132 -4.336 1.00 0.00 H new ATOM 0 HG LEU A 9 111.149 -2.663 -2.713 1.00 0.00 H new ATOM 0 HD11 LEU A 9 109.719 -4.174 -1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.359 -2.467 -1.003 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.264 -3.410 -2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 9 110.444 -4.846 -3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 9 108.988 -4.082 -4.336 1.00 0.00 H new ATOM 0 HD23 LEU A 9 110.599 -3.618 -4.935 1.00 0.00 H new ATOM 158 N VAL A 10 111.279 0.908 -2.963 1.00 0.00 N ATOM 159 CA VAL A 10 111.931 2.145 -3.373 1.00 0.00 C ATOM 160 C VAL A 10 112.536 2.002 -4.766 1.00 0.00 C ATOM 161 O VAL A 10 112.976 0.920 -5.156 1.00 0.00 O ATOM 162 CB VAL A 10 113.030 2.510 -2.373 1.00 0.00 C ATOM 163 CG1 VAL A 10 114.110 3.336 -3.074 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.424 3.329 -1.231 1.00 0.00 C ATOM 0 H VAL A 10 111.914 0.135 -2.765 1.00 0.00 H new ATOM 0 HA VAL A 10 111.181 2.936 -3.397 1.00 0.00 H new ATOM 0 HB VAL A 10 113.475 1.598 -1.975 1.00 0.00 H new ATOM 0 HG11 VAL A 10 114.891 3.595 -2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.541 2.754 -3.889 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.668 4.248 -3.474 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.205 3.591 -0.517 1.00 0.00 H new ATOM 0 HG22 VAL A 10 111.979 4.240 -1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 10 111.656 2.741 -0.729 1.00 0.00 H new ATOM 174 N LYS A 11 112.558 3.103 -5.509 1.00 0.00 N ATOM 175 CA LYS A 11 113.115 3.096 -6.856 1.00 0.00 C ATOM 176 C LYS A 11 114.445 3.843 -6.882 1.00 0.00 C ATOM 177 O LYS A 11 114.616 4.848 -6.190 1.00 0.00 O ATOM 178 CB LYS A 11 112.136 3.754 -7.831 1.00 0.00 C ATOM 179 CG LYS A 11 110.742 3.155 -7.636 1.00 0.00 C ATOM 180 CD LYS A 11 109.714 4.000 -8.393 1.00 0.00 C ATOM 181 CE LYS A 11 109.727 3.613 -9.873 1.00 0.00 C ATOM 182 NZ LYS A 11 108.491 4.126 -10.530 1.00 0.00 N ATOM 0 H LYS A 11 112.198 4.007 -5.203 1.00 0.00 H new ATOM 0 HA LYS A 11 113.283 2.062 -7.158 1.00 0.00 H new ATOM 0 HB2 LYS A 11 112.108 4.831 -7.663 1.00 0.00 H new ATOM 0 HB3 LYS A 11 112.469 3.600 -8.857 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.722 2.127 -7.999 1.00 0.00 H new ATOM 0 HG3 LYS A 11 110.493 3.124 -6.575 1.00 0.00 H new ATOM 0 HD2 LYS A 11 108.720 3.844 -7.974 1.00 0.00 H new ATOM 0 HD3 LYS A 11 109.945 5.059 -8.281 1.00 0.00 H new ATOM 0 HE2 LYS A 11 110.610 4.027 -10.361 1.00 0.00 H new ATOM 0 HE3 LYS A 11 109.784 2.529 -9.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 108.498 3.864 -11.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 107.656 3.711 -10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 108.456 5.162 -10.442 1.00 0.00 H new ATOM 196 N LYS A 12 115.382 3.345 -7.684 1.00 0.00 N ATOM 197 CA LYS A 12 116.697 3.969 -7.790 1.00 0.00 C ATOM 198 C LYS A 12 116.566 5.487 -7.848 1.00 0.00 C ATOM 199 O LYS A 12 117.470 6.213 -7.434 1.00 0.00 O ATOM 200 CB LYS A 12 117.415 3.468 -9.045 1.00 0.00 C ATOM 201 CG LYS A 12 116.386 3.158 -10.133 1.00 0.00 C ATOM 202 CD LYS A 12 117.080 3.113 -11.496 1.00 0.00 C ATOM 203 CE LYS A 12 116.732 1.803 -12.204 1.00 0.00 C ATOM 204 NZ LYS A 12 117.329 1.803 -13.570 1.00 0.00 N ATOM 0 H LYS A 12 115.257 2.517 -8.266 1.00 0.00 H new ATOM 0 HA LYS A 12 117.278 3.699 -6.908 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.119 4.221 -9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 12 117.995 2.575 -8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 12 115.901 2.203 -9.928 1.00 0.00 H new ATOM 0 HG3 LYS A 12 115.605 3.918 -10.136 1.00 0.00 H new ATOM 0 HD2 LYS A 12 116.766 3.962 -12.104 1.00 0.00 H new ATOM 0 HD3 LYS A 12 118.160 3.194 -11.369 1.00 0.00 H new ATOM 0 HE2 LYS A 12 117.109 0.956 -11.631 1.00 0.00 H new ATOM 0 HE3 LYS A 12 115.650 1.688 -12.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 117.644 0.842 -13.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 116.617 2.117 -14.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 118.143 2.450 -13.593 1.00 0.00 H new ATOM 218 N ASN A 13 115.436 5.961 -8.359 1.00 0.00 N ATOM 219 CA ASN A 13 115.200 7.395 -8.458 1.00 0.00 C ATOM 220 C ASN A 13 114.815 7.959 -7.095 1.00 0.00 C ATOM 221 O ASN A 13 114.173 9.005 -7.003 1.00 0.00 O ATOM 222 CB ASN A 13 114.083 7.675 -9.465 1.00 0.00 C ATOM 223 CG ASN A 13 114.620 7.552 -10.886 1.00 0.00 C ATOM 224 OD1 ASN A 13 114.959 6.455 -11.330 1.00 0.00 O ATOM 225 ND2 ASN A 13 114.717 8.619 -11.631 1.00 0.00 N ATOM 0 H ASN A 13 114.675 5.379 -8.708 1.00 0.00 H new ATOM 0 HA ASN A 13 116.117 7.877 -8.797 1.00 0.00 H new ATOM 0 HB2 ASN A 13 113.263 6.973 -9.315 1.00 0.00 H new ATOM 0 HB3 ASN A 13 113.680 8.675 -9.305 1.00 0.00 H new ATOM 0 HD21 ASN A 13 115.074 8.545 -12.584 1.00 0.00 H new ATOM 0 HD22 ASN A 13 114.435 9.527 -11.261 1.00 0.00 H new ATOM 232 N ARG A 14 115.209 7.254 -6.039 1.00 0.00 N ATOM 233 CA ARG A 14 114.898 7.689 -4.683 1.00 0.00 C ATOM 234 C ARG A 14 113.395 7.888 -4.524 1.00 0.00 C ATOM 235 O ARG A 14 112.951 8.767 -3.786 1.00 0.00 O ATOM 236 CB ARG A 14 115.625 8.998 -4.374 1.00 0.00 C ATOM 237 CG ARG A 14 117.112 8.848 -4.703 1.00 0.00 C ATOM 238 CD ARG A 14 117.767 10.228 -4.751 1.00 0.00 C ATOM 239 NE ARG A 14 117.620 10.902 -3.466 1.00 0.00 N ATOM 240 CZ ARG A 14 117.905 12.193 -3.329 1.00 0.00 C ATOM 241 NH1 ARG A 14 118.324 12.880 -4.356 1.00 0.00 N ATOM 242 NH2 ARG A 14 117.766 12.773 -2.169 1.00 0.00 N ATOM 0 H ARG A 14 115.740 6.385 -6.096 1.00 0.00 H new ATOM 0 HA ARG A 14 115.230 6.920 -3.986 1.00 0.00 H new ATOM 0 HB2 ARG A 14 115.193 9.812 -4.957 1.00 0.00 H new ATOM 0 HB3 ARG A 14 115.499 9.257 -3.323 1.00 0.00 H new ATOM 0 HG2 ARG A 14 117.601 8.228 -3.951 1.00 0.00 H new ATOM 0 HG3 ARG A 14 117.234 8.343 -5.661 1.00 0.00 H new ATOM 0 HD2 ARG A 14 118.824 10.128 -4.998 1.00 0.00 H new ATOM 0 HD3 ARG A 14 117.311 10.828 -5.538 1.00 0.00 H new ATOM 0 HE ARG A 14 117.293 10.373 -2.658 1.00 0.00 H new ATOM 0 HH11 ARG A 14 118.433 12.426 -5.263 1.00 0.00 H new ATOM 0 HH12 ARG A 14 118.543 13.871 -4.252 1.00 0.00 H new ATOM 0 HH21 ARG A 14 117.438 12.236 -1.366 1.00 0.00 H new ATOM 0 HH22 ARG A 14 117.985 13.764 -2.065 1.00 0.00 H new ATOM 256 N CYS A 15 112.618 7.070 -5.227 1.00 0.00 N ATOM 257 CA CYS A 15 111.165 7.170 -5.160 1.00 0.00 C ATOM 258 C CYS A 15 110.572 5.993 -4.395 1.00 0.00 C ATOM 259 O CYS A 15 111.273 5.034 -4.067 1.00 0.00 O ATOM 260 CB CYS A 15 110.581 7.208 -6.573 1.00 0.00 C ATOM 261 SG CYS A 15 110.117 8.908 -6.989 1.00 0.00 S ATOM 0 H CYS A 15 112.967 6.337 -5.844 1.00 0.00 H new ATOM 0 HA CYS A 15 110.911 8.090 -4.633 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.311 6.833 -7.290 1.00 0.00 H new ATOM 0 HB3 CYS A 15 109.710 6.556 -6.635 1.00 0.00 H new ATOM 0 HG CYS A 15 109.623 8.941 -8.191 1.00 0.00 H new ATOM 267 N GLU A 16 109.275 6.072 -4.114 1.00 0.00 N ATOM 268 CA GLU A 16 108.591 5.008 -3.389 1.00 0.00 C ATOM 269 C GLU A 16 107.402 4.494 -4.193 1.00 0.00 C ATOM 270 O GLU A 16 106.748 5.254 -4.908 1.00 0.00 O ATOM 271 CB GLU A 16 108.111 5.526 -2.033 1.00 0.00 C ATOM 272 CG GLU A 16 109.314 5.752 -1.116 1.00 0.00 C ATOM 273 CD GLU A 16 108.899 5.580 0.342 1.00 0.00 C ATOM 274 OE1 GLU A 16 108.168 4.644 0.621 1.00 0.00 O ATOM 275 OE2 GLU A 16 109.320 6.386 1.155 1.00 0.00 O ATOM 0 H GLU A 16 108.680 6.858 -4.376 1.00 0.00 H new ATOM 0 HA GLU A 16 109.292 4.187 -3.235 1.00 0.00 H new ATOM 0 HB2 GLU A 16 107.559 6.457 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU A 16 107.425 4.810 -1.581 1.00 0.00 H new ATOM 0 HG2 GLU A 16 110.107 5.046 -1.363 1.00 0.00 H new ATOM 0 HG3 GLU A 16 109.718 6.752 -1.272 1.00 0.00 H new ATOM 282 N VAL A 17 107.127 3.199 -4.075 1.00 0.00 N ATOM 283 CA VAL A 17 106.015 2.596 -4.801 1.00 0.00 C ATOM 284 C VAL A 17 105.497 1.362 -4.071 1.00 0.00 C ATOM 285 O VAL A 17 106.087 0.912 -3.089 1.00 0.00 O ATOM 286 CB VAL A 17 106.457 2.211 -6.213 1.00 0.00 C ATOM 287 CG1 VAL A 17 107.723 1.358 -6.141 1.00 0.00 C ATOM 288 CG2 VAL A 17 105.346 1.416 -6.903 1.00 0.00 C ATOM 0 H VAL A 17 107.654 2.552 -3.489 1.00 0.00 H new ATOM 0 HA VAL A 17 105.210 3.329 -4.861 1.00 0.00 H new ATOM 0 HB VAL A 17 106.662 3.117 -6.783 1.00 0.00 H new ATOM 0 HG11 VAL A 17 108.036 1.085 -7.149 1.00 0.00 H new ATOM 0 HG12 VAL A 17 108.517 1.926 -5.656 1.00 0.00 H new ATOM 0 HG13 VAL A 17 107.520 0.454 -5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 17 105.665 1.143 -7.909 1.00 0.00 H new ATOM 0 HG22 VAL A 17 105.137 0.512 -6.331 1.00 0.00 H new ATOM 0 HG23 VAL A 17 104.444 2.026 -6.961 1.00 0.00 H new ATOM 298 N ASN A 18 104.387 0.823 -4.561 1.00 0.00 N ATOM 299 CA ASN A 18 103.786 -0.361 -3.957 1.00 0.00 C ATOM 300 C ASN A 18 104.360 -1.634 -4.575 1.00 0.00 C ATOM 301 O ASN A 18 104.004 -2.006 -5.694 1.00 0.00 O ATOM 302 CB ASN A 18 102.269 -0.334 -4.154 1.00 0.00 C ATOM 303 CG ASN A 18 101.564 -0.406 -2.803 1.00 0.00 C ATOM 304 OD1 ASN A 18 102.092 -0.990 -1.857 1.00 0.00 O ATOM 305 ND2 ASN A 18 100.396 0.157 -2.657 1.00 0.00 N ATOM 0 H ASN A 18 103.886 1.185 -5.372 1.00 0.00 H new ATOM 0 HA ASN A 18 104.015 -0.356 -2.891 1.00 0.00 H new ATOM 0 HB2 ASN A 18 101.978 0.577 -4.677 1.00 0.00 H new ATOM 0 HB3 ASN A 18 101.961 -1.172 -4.779 1.00 0.00 H new ATOM 0 HD21 ASN A 18 99.918 0.114 -1.757 1.00 0.00 H new ATOM 0 HD22 ASN A 18 99.961 0.640 -3.443 1.00 0.00 H new ATOM 312 N ALA A 19 105.251 -2.295 -3.842 1.00 0.00 N ATOM 313 CA ALA A 19 105.871 -3.525 -4.326 1.00 0.00 C ATOM 314 C ALA A 19 104.825 -4.474 -4.904 1.00 0.00 C ATOM 315 O ALA A 19 105.140 -5.325 -5.737 1.00 0.00 O ATOM 316 CB ALA A 19 106.617 -4.220 -3.184 1.00 0.00 C ATOM 0 H ALA A 19 105.559 -2.002 -2.915 1.00 0.00 H new ATOM 0 HA ALA A 19 106.575 -3.261 -5.116 1.00 0.00 H new ATOM 0 HB1 ALA A 19 107.076 -5.137 -3.554 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.391 -3.557 -2.798 1.00 0.00 H new ATOM 0 HB3 ALA A 19 105.916 -4.462 -2.386 1.00 0.00 H new ATOM 322 N ASN A 20 103.583 -4.328 -4.455 1.00 0.00 N ATOM 323 CA ASN A 20 102.504 -5.181 -4.936 1.00 0.00 C ATOM 324 C ASN A 20 102.513 -5.240 -6.458 1.00 0.00 C ATOM 325 O ASN A 20 102.597 -6.315 -7.051 1.00 0.00 O ATOM 326 CB ASN A 20 101.157 -4.640 -4.453 1.00 0.00 C ATOM 327 CG ASN A 20 100.577 -5.560 -3.385 1.00 0.00 C ATOM 328 OD1 ASN A 20 101.301 -6.363 -2.795 1.00 0.00 O ATOM 329 ND2 ASN A 20 99.305 -5.492 -3.098 1.00 0.00 N ATOM 0 H ASN A 20 103.300 -3.633 -3.764 1.00 0.00 H new ATOM 0 HA ASN A 20 102.654 -6.186 -4.541 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.283 -3.635 -4.049 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.465 -4.562 -5.292 1.00 0.00 H new ATOM 0 HD21 ASN A 20 98.910 -6.104 -2.384 1.00 0.00 H new ATOM 0 HD22 ASN A 20 98.707 -4.827 -3.587 1.00 0.00 H new ATOM 336 N GLU A 21 102.429 -4.072 -7.081 1.00 0.00 N ATOM 337 CA GLU A 21 102.430 -3.988 -8.536 1.00 0.00 C ATOM 338 C GLU A 21 103.836 -3.696 -9.046 1.00 0.00 C ATOM 339 O GLU A 21 104.181 -4.035 -10.178 1.00 0.00 O ATOM 340 CB GLU A 21 101.477 -2.886 -8.998 1.00 0.00 C ATOM 341 CG GLU A 21 101.784 -1.593 -8.240 1.00 0.00 C ATOM 342 CD GLU A 21 102.404 -0.570 -9.186 1.00 0.00 C ATOM 343 OE1 GLU A 21 103.560 -0.739 -9.535 1.00 0.00 O ATOM 344 OE2 GLU A 21 101.714 0.369 -9.547 1.00 0.00 O ATOM 0 H GLU A 21 102.360 -3.173 -6.604 1.00 0.00 H new ATOM 0 HA GLU A 21 102.096 -4.944 -8.940 1.00 0.00 H new ATOM 0 HB2 GLU A 21 101.584 -2.725 -10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 21 100.444 -3.187 -8.822 1.00 0.00 H new ATOM 0 HG2 GLU A 21 100.869 -1.191 -7.805 1.00 0.00 H new ATOM 0 HG3 GLU A 21 102.466 -1.798 -7.415 1.00 0.00 H new ATOM 351 N ALA A 22 104.641 -3.064 -8.201 1.00 0.00 N ATOM 352 CA ALA A 22 106.009 -2.727 -8.570 1.00 0.00 C ATOM 353 C ALA A 22 106.830 -3.990 -8.810 1.00 0.00 C ATOM 354 O ALA A 22 107.800 -3.977 -9.566 1.00 0.00 O ATOM 355 CB ALA A 22 106.656 -1.897 -7.460 1.00 0.00 C ATOM 0 H ALA A 22 104.372 -2.776 -7.260 1.00 0.00 H new ATOM 0 HA ALA A 22 105.984 -2.147 -9.492 1.00 0.00 H new ATOM 0 HB1 ALA A 22 107.679 -1.648 -7.741 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.086 -0.979 -7.313 1.00 0.00 H new ATOM 0 HB3 ALA A 22 106.664 -2.472 -6.534 1.00 0.00 H new ATOM 361 N LEU A 23 106.435 -5.081 -8.162 1.00 0.00 N ATOM 362 CA LEU A 23 107.147 -6.344 -8.314 1.00 0.00 C ATOM 363 C LEU A 23 106.940 -6.910 -9.715 1.00 0.00 C ATOM 364 O LEU A 23 107.631 -7.841 -10.127 1.00 0.00 O ATOM 365 CB LEU A 23 106.654 -7.352 -7.275 1.00 0.00 C ATOM 366 CG LEU A 23 107.326 -7.071 -5.931 1.00 0.00 C ATOM 367 CD1 LEU A 23 106.642 -7.892 -4.836 1.00 0.00 C ATOM 368 CD2 LEU A 23 108.804 -7.460 -6.010 1.00 0.00 C ATOM 0 H LEU A 23 105.633 -5.117 -7.532 1.00 0.00 H new ATOM 0 HA LEU A 23 108.211 -6.160 -8.162 1.00 0.00 H new ATOM 0 HB2 LEU A 23 105.571 -7.284 -7.173 1.00 0.00 H new ATOM 0 HB3 LEU A 23 106.881 -8.367 -7.602 1.00 0.00 H new ATOM 0 HG LEU A 23 107.240 -6.010 -5.697 1.00 0.00 H new ATOM 0 HD11 LEU A 23 107.121 -7.691 -3.878 1.00 0.00 H new ATOM 0 HD12 LEU A 23 105.589 -7.617 -4.779 1.00 0.00 H new ATOM 0 HD13 LEU A 23 106.728 -8.953 -5.070 1.00 0.00 H new ATOM 0 HD21 LEU A 23 109.285 -7.260 -5.052 1.00 0.00 H new ATOM 0 HD22 LEU A 23 108.889 -8.521 -6.244 1.00 0.00 H new ATOM 0 HD23 LEU A 23 109.293 -6.876 -6.790 1.00 0.00 H new ATOM 380 N LYS A 24 105.986 -6.337 -10.442 1.00 0.00 N ATOM 381 CA LYS A 24 105.695 -6.786 -11.799 1.00 0.00 C ATOM 382 C LYS A 24 106.111 -8.242 -11.987 1.00 0.00 C ATOM 383 O LYS A 24 105.288 -9.150 -11.874 1.00 0.00 O ATOM 384 CB LYS A 24 106.432 -5.904 -12.808 1.00 0.00 C ATOM 385 CG LYS A 24 106.112 -6.372 -14.230 1.00 0.00 C ATOM 386 CD LYS A 24 104.698 -5.928 -14.610 1.00 0.00 C ATOM 387 CE LYS A 24 104.771 -4.895 -15.736 1.00 0.00 C ATOM 388 NZ LYS A 24 105.380 -3.638 -15.218 1.00 0.00 N ATOM 0 H LYS A 24 105.404 -5.565 -10.117 1.00 0.00 H new ATOM 0 HA LYS A 24 104.621 -6.708 -11.965 1.00 0.00 H new ATOM 0 HB2 LYS A 24 106.135 -4.863 -12.681 1.00 0.00 H new ATOM 0 HB3 LYS A 24 107.507 -5.952 -12.632 1.00 0.00 H new ATOM 0 HG2 LYS A 24 106.835 -5.957 -14.932 1.00 0.00 H new ATOM 0 HG3 LYS A 24 106.193 -7.457 -14.293 1.00 0.00 H new ATOM 0 HD2 LYS A 24 104.109 -6.788 -14.929 1.00 0.00 H new ATOM 0 HD3 LYS A 24 104.194 -5.501 -13.743 1.00 0.00 H new ATOM 0 HE2 LYS A 24 105.364 -5.285 -16.564 1.00 0.00 H new ATOM 0 HE3 LYS A 24 103.773 -4.695 -16.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 105.307 -2.893 -15.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 104.877 -3.337 -14.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 106.382 -3.805 -14.993 1.00 0.00 H new ATOM 402 N ASP A 25 107.393 -8.458 -12.274 1.00 0.00 N ATOM 403 CA ASP A 25 107.897 -9.813 -12.473 1.00 0.00 C ATOM 404 C ASP A 25 106.958 -10.598 -13.375 1.00 0.00 C ATOM 405 O ASP A 25 105.981 -11.186 -12.908 1.00 0.00 O ATOM 406 CB ASP A 25 108.029 -10.524 -11.126 1.00 0.00 C ATOM 407 CG ASP A 25 106.732 -10.393 -10.334 1.00 0.00 C ATOM 408 OD1 ASP A 25 105.751 -10.996 -10.735 1.00 0.00 O ATOM 409 OD2 ASP A 25 106.740 -9.694 -9.335 1.00 0.00 O ATOM 0 H ASP A 25 108.093 -7.722 -12.373 1.00 0.00 H new ATOM 0 HA ASP A 25 108.877 -9.754 -12.947 1.00 0.00 H new ATOM 0 HB2 ASP A 25 108.263 -11.577 -11.283 1.00 0.00 H new ATOM 0 HB3 ASP A 25 108.855 -10.095 -10.559 1.00 0.00 H new ATOM 414 N LYS A 26 107.258 -10.609 -14.669 1.00 0.00 N ATOM 415 CA LYS A 26 106.427 -11.334 -15.617 1.00 0.00 C ATOM 416 C LYS A 26 105.881 -12.593 -14.963 1.00 0.00 C ATOM 417 O LYS A 26 104.854 -13.128 -15.379 1.00 0.00 O ATOM 418 CB LYS A 26 107.241 -11.709 -16.855 1.00 0.00 C ATOM 419 CG LYS A 26 107.790 -10.439 -17.509 1.00 0.00 C ATOM 420 CD LYS A 26 108.246 -10.754 -18.936 1.00 0.00 C ATOM 421 CE LYS A 26 107.249 -10.163 -19.934 1.00 0.00 C ATOM 422 NZ LYS A 26 107.835 -10.205 -21.304 1.00 0.00 N ATOM 0 H LYS A 26 108.060 -10.130 -15.080 1.00 0.00 H new ATOM 0 HA LYS A 26 105.598 -10.694 -15.920 1.00 0.00 H new ATOM 0 HB2 LYS A 26 108.061 -12.371 -16.577 1.00 0.00 H new ATOM 0 HB3 LYS A 26 106.616 -12.254 -17.563 1.00 0.00 H new ATOM 0 HG2 LYS A 26 107.023 -9.664 -17.524 1.00 0.00 H new ATOM 0 HG3 LYS A 26 108.625 -10.050 -16.927 1.00 0.00 H new ATOM 0 HD2 LYS A 26 109.239 -10.341 -19.111 1.00 0.00 H new ATOM 0 HD3 LYS A 26 108.320 -11.833 -19.075 1.00 0.00 H new ATOM 0 HE2 LYS A 26 106.316 -10.725 -19.909 1.00 0.00 H new ATOM 0 HE3 LYS A 26 107.010 -9.135 -19.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 107.078 -10.354 -22.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 108.317 -9.305 -21.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 108.520 -10.985 -21.365 1.00 0.00 H new ATOM 436 N ASP A 27 106.574 -13.060 -13.926 1.00 0.00 N ATOM 437 CA ASP A 27 106.142 -14.254 -13.215 1.00 0.00 C ATOM 438 C ASP A 27 107.287 -14.870 -12.411 1.00 0.00 C ATOM 439 O ASP A 27 107.135 -15.954 -11.850 1.00 0.00 O ATOM 440 CB ASP A 27 105.605 -15.282 -14.214 1.00 0.00 C ATOM 441 CG ASP A 27 105.718 -16.688 -13.634 1.00 0.00 C ATOM 442 OD1 ASP A 27 105.186 -16.909 -12.560 1.00 0.00 O ATOM 443 OD2 ASP A 27 106.336 -17.523 -14.274 1.00 0.00 O ATOM 0 H ASP A 27 107.427 -12.633 -13.565 1.00 0.00 H new ATOM 0 HA ASP A 27 105.355 -13.966 -12.518 1.00 0.00 H new ATOM 0 HB2 ASP A 27 104.564 -15.061 -14.451 1.00 0.00 H new ATOM 0 HB3 ASP A 27 106.164 -15.220 -15.147 1.00 0.00 H new ATOM 448 N ILE A 28 108.436 -14.190 -12.349 1.00 0.00 N ATOM 449 CA ILE A 28 109.573 -14.723 -11.602 1.00 0.00 C ATOM 450 C ILE A 28 110.292 -13.613 -10.839 1.00 0.00 C ATOM 451 O ILE A 28 110.232 -12.443 -11.219 1.00 0.00 O ATOM 452 CB ILE A 28 110.551 -15.394 -12.571 1.00 0.00 C ATOM 453 CG1 ILE A 28 109.858 -16.592 -13.230 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.801 -15.863 -11.815 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.788 -17.807 -13.214 1.00 0.00 C ATOM 0 H ILE A 28 108.600 -13.289 -12.798 1.00 0.00 H new ATOM 0 HA ILE A 28 109.203 -15.453 -10.882 1.00 0.00 H new ATOM 0 HB ILE A 28 110.855 -14.680 -13.336 1.00 0.00 H new ATOM 0 HG12 ILE A 28 108.934 -16.824 -12.701 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.585 -16.346 -14.256 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.491 -16.339 -12.512 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.288 -15.006 -11.351 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.513 -16.578 -11.044 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.288 -18.654 -13.684 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.701 -17.574 -13.763 1.00 0.00 H new ATOM 0 HD13 ILE A 28 111.039 -18.060 -12.184 1.00 0.00 H new ATOM 467 N ILE A 29 110.978 -13.988 -9.763 1.00 0.00 N ATOM 468 CA ILE A 29 111.709 -13.016 -8.957 1.00 0.00 C ATOM 469 C ILE A 29 113.025 -13.611 -8.463 1.00 0.00 C ATOM 470 O ILE A 29 113.107 -14.805 -8.170 1.00 0.00 O ATOM 471 CB ILE A 29 110.857 -12.578 -7.763 1.00 0.00 C ATOM 472 CG1 ILE A 29 110.098 -11.299 -8.125 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.759 -12.306 -6.558 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.669 -11.387 -7.590 1.00 0.00 C ATOM 0 H ILE A 29 111.043 -14.950 -9.431 1.00 0.00 H new ATOM 0 HA ILE A 29 111.929 -12.148 -9.578 1.00 0.00 H new ATOM 0 HB ILE A 29 110.150 -13.369 -7.514 1.00 0.00 H new ATOM 0 HG12 ILE A 29 110.604 -10.431 -7.702 1.00 0.00 H new ATOM 0 HG13 ILE A 29 110.085 -11.164 -9.207 1.00 0.00 H new ATOM 0 HG21 ILE A 29 111.149 -11.994 -5.710 1.00 0.00 H new ATOM 0 HG22 ILE A 29 112.304 -13.214 -6.299 1.00 0.00 H new ATOM 0 HG23 ILE A 29 112.468 -11.516 -6.805 1.00 0.00 H new ATOM 0 HD11 ILE A 29 108.127 -10.477 -7.847 1.00 0.00 H new ATOM 0 HD12 ILE A 29 108.166 -12.246 -8.034 1.00 0.00 H new ATOM 0 HD13 ILE A 29 108.693 -11.501 -6.506 1.00 0.00 H new ATOM 486 N GLY A 30 114.050 -12.770 -8.372 1.00 0.00 N ATOM 487 CA GLY A 30 115.358 -13.223 -7.913 1.00 0.00 C ATOM 488 C GLY A 30 115.834 -12.391 -6.729 1.00 0.00 C ATOM 489 O GLY A 30 116.109 -11.201 -6.866 1.00 0.00 O ATOM 0 H GLY A 30 114.002 -11.779 -8.608 1.00 0.00 H new ATOM 0 HA2 GLY A 30 115.304 -14.273 -7.627 1.00 0.00 H new ATOM 0 HA3 GLY A 30 116.079 -13.151 -8.727 1.00 0.00 H new ATOM 493 N PHE A 31 115.925 -13.026 -5.567 1.00 0.00 N ATOM 494 CA PHE A 31 116.364 -12.335 -4.361 1.00 0.00 C ATOM 495 C PHE A 31 117.880 -12.418 -4.213 1.00 0.00 C ATOM 496 O PHE A 31 118.443 -13.506 -4.107 1.00 0.00 O ATOM 497 CB PHE A 31 115.703 -12.962 -3.134 1.00 0.00 C ATOM 498 CG PHE A 31 114.249 -12.561 -3.069 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.289 -13.289 -3.782 1.00 0.00 C ATOM 500 CD2 PHE A 31 113.860 -11.467 -2.287 1.00 0.00 C ATOM 501 CE1 PHE A 31 111.941 -12.921 -3.714 1.00 0.00 C ATOM 502 CE2 PHE A 31 112.510 -11.101 -2.219 1.00 0.00 C ATOM 503 CZ PHE A 31 111.551 -11.829 -2.933 1.00 0.00 C ATOM 0 H PHE A 31 115.702 -14.012 -5.434 1.00 0.00 H new ATOM 0 HA PHE A 31 116.074 -11.287 -4.442 1.00 0.00 H new ATOM 0 HB2 PHE A 31 115.788 -14.048 -3.180 1.00 0.00 H new ATOM 0 HB3 PHE A 31 116.218 -12.640 -2.229 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.589 -14.134 -4.384 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.600 -10.906 -1.737 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.201 -13.481 -4.266 1.00 0.00 H new ATOM 0 HE2 PHE A 31 112.209 -10.257 -1.616 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.510 -11.547 -2.881 1.00 0.00 H new ATOM 513 N TYR A 32 118.534 -11.262 -4.204 1.00 0.00 N ATOM 514 CA TYR A 32 119.986 -11.224 -4.064 1.00 0.00 C ATOM 515 C TYR A 32 120.376 -10.765 -2.662 1.00 0.00 C ATOM 516 O TYR A 32 120.066 -9.645 -2.259 1.00 0.00 O ATOM 517 CB TYR A 32 120.586 -10.273 -5.101 1.00 0.00 C ATOM 518 CG TYR A 32 122.092 -10.293 -4.990 1.00 0.00 C ATOM 519 CD1 TYR A 32 122.813 -11.394 -5.465 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.766 -9.211 -4.412 1.00 0.00 C ATOM 521 CE1 TYR A 32 124.210 -11.414 -5.363 1.00 0.00 C ATOM 522 CE2 TYR A 32 124.163 -9.230 -4.311 1.00 0.00 C ATOM 523 CZ TYR A 32 124.884 -10.331 -4.785 1.00 0.00 C ATOM 524 OH TYR A 32 126.261 -10.350 -4.684 1.00 0.00 O ATOM 0 H TYR A 32 118.089 -10.348 -4.291 1.00 0.00 H new ATOM 0 HA TYR A 32 120.375 -12.229 -4.226 1.00 0.00 H new ATOM 0 HB2 TYR A 32 120.281 -10.572 -6.104 1.00 0.00 H new ATOM 0 HB3 TYR A 32 120.212 -9.262 -4.942 1.00 0.00 H new ATOM 0 HD1 TYR A 32 122.292 -12.229 -5.910 1.00 0.00 H new ATOM 0 HD2 TYR A 32 122.209 -8.362 -4.044 1.00 0.00 H new ATOM 0 HE1 TYR A 32 124.767 -12.264 -5.730 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.684 -8.394 -3.867 1.00 0.00 H new ATOM 0 HH TYR A 32 126.574 -9.496 -4.319 1.00 0.00 H new ATOM 534 N PHE A 33 121.063 -11.635 -1.923 1.00 0.00 N ATOM 535 CA PHE A 33 121.490 -11.299 -0.569 1.00 0.00 C ATOM 536 C PHE A 33 123.009 -11.168 -0.505 1.00 0.00 C ATOM 537 O PHE A 33 123.737 -12.132 -0.759 1.00 0.00 O ATOM 538 CB PHE A 33 121.036 -12.378 0.417 1.00 0.00 C ATOM 539 CG PHE A 33 119.548 -12.613 0.292 1.00 0.00 C ATOM 540 CD1 PHE A 33 118.713 -11.617 -0.234 1.00 0.00 C ATOM 541 CD2 PHE A 33 119.001 -13.832 0.710 1.00 0.00 C ATOM 542 CE1 PHE A 33 117.337 -11.843 -0.340 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.624 -14.057 0.603 1.00 0.00 C ATOM 544 CZ PHE A 33 116.792 -13.062 0.078 1.00 0.00 C ATOM 0 H PHE A 33 121.333 -12.568 -2.236 1.00 0.00 H new ATOM 0 HA PHE A 33 121.035 -10.347 -0.298 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.575 -13.306 0.224 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.278 -12.074 1.435 1.00 0.00 H new ATOM 0 HD1 PHE A 33 119.132 -10.676 -0.557 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.643 -14.600 1.116 1.00 0.00 H new ATOM 0 HE1 PHE A 33 116.694 -11.076 -0.745 1.00 0.00 H new ATOM 0 HE2 PHE A 33 117.204 -14.998 0.925 1.00 0.00 H new ATOM 0 HZ PHE A 33 115.729 -13.235 -0.005 1.00 0.00 H new ATOM 554 N SER A 34 123.474 -9.972 -0.161 1.00 0.00 N ATOM 555 CA SER A 34 124.904 -9.711 -0.061 1.00 0.00 C ATOM 556 C SER A 34 125.187 -8.222 -0.234 1.00 0.00 C ATOM 557 O SER A 34 125.336 -7.736 -1.355 1.00 0.00 O ATOM 558 CB SER A 34 125.655 -10.503 -1.130 1.00 0.00 C ATOM 559 OG SER A 34 124.875 -10.546 -2.318 1.00 0.00 O ATOM 0 H SER A 34 122.882 -9.169 0.053 1.00 0.00 H new ATOM 0 HA SER A 34 125.245 -10.023 0.926 1.00 0.00 H new ATOM 0 HB2 SER A 34 126.620 -10.039 -1.332 1.00 0.00 H new ATOM 0 HB3 SER A 34 125.855 -11.514 -0.776 1.00 0.00 H new ATOM 0 HG SER A 34 125.439 -10.325 -3.088 1.00 0.00 H new ATOM 565 N ALA A 35 125.258 -7.501 0.881 1.00 0.00 N ATOM 566 CA ALA A 35 125.523 -6.066 0.837 1.00 0.00 C ATOM 567 C ALA A 35 126.334 -5.714 -0.403 1.00 0.00 C ATOM 568 O ALA A 35 125.994 -4.786 -1.138 1.00 0.00 O ATOM 569 CB ALA A 35 126.287 -5.637 2.090 1.00 0.00 C ATOM 0 H ALA A 35 125.137 -7.883 1.819 1.00 0.00 H new ATOM 0 HA ALA A 35 124.570 -5.538 0.797 1.00 0.00 H new ATOM 0 HB1 ALA A 35 126.481 -4.565 2.049 1.00 0.00 H new ATOM 0 HB2 ALA A 35 125.692 -5.865 2.975 1.00 0.00 H new ATOM 0 HB3 ALA A 35 127.234 -6.175 2.141 1.00 0.00 H new ATOM 575 N HIS A 36 127.401 -6.468 -0.629 1.00 0.00 N ATOM 576 CA HIS A 36 128.261 -6.246 -1.787 1.00 0.00 C ATOM 577 C HIS A 36 128.877 -4.849 -1.761 1.00 0.00 C ATOM 578 O HIS A 36 129.950 -4.631 -2.326 1.00 0.00 O ATOM 579 CB HIS A 36 127.461 -6.426 -3.079 1.00 0.00 C ATOM 580 CG HIS A 36 126.744 -5.146 -3.410 1.00 0.00 C ATOM 581 ND1 HIS A 36 125.361 -5.066 -3.464 1.00 0.00 N ATOM 582 CD2 HIS A 36 127.204 -3.886 -3.709 1.00 0.00 C ATOM 583 CE1 HIS A 36 125.040 -3.799 -3.782 1.00 0.00 C ATOM 584 NE2 HIS A 36 126.126 -3.039 -3.943 1.00 0.00 N ATOM 0 H HIS A 36 127.693 -7.238 -0.028 1.00 0.00 H new ATOM 0 HA HIS A 36 129.067 -6.979 -1.749 1.00 0.00 H new ATOM 0 HB2 HIS A 36 128.127 -6.703 -3.896 1.00 0.00 H new ATOM 0 HB3 HIS A 36 126.743 -7.238 -2.964 1.00 0.00 H new ATOM 0 HD2 HIS A 36 128.244 -3.598 -3.755 1.00 0.00 H new ATOM 0 HE1 HIS A 36 124.027 -3.440 -3.893 1.00 0.00 H new ATOM 0 HE2 HIS A 36 126.158 -2.049 -4.186 1.00 0.00 H new ATOM 593 N TRP A 37 128.202 -3.902 -1.115 1.00 0.00 N ATOM 594 CA TRP A 37 128.717 -2.541 -1.049 1.00 0.00 C ATOM 595 C TRP A 37 129.690 -2.384 0.114 1.00 0.00 C ATOM 596 O TRP A 37 130.770 -1.815 -0.043 1.00 0.00 O ATOM 597 CB TRP A 37 127.560 -1.552 -0.912 1.00 0.00 C ATOM 598 CG TRP A 37 127.287 -1.278 0.531 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.225 -1.753 1.220 1.00 0.00 C ATOM 600 CD2 TRP A 37 128.059 -0.474 1.468 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.291 -1.284 2.519 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.405 -0.496 2.722 1.00 0.00 C ATOM 603 CE3 TRP A 37 129.250 0.266 1.354 1.00 0.00 C ATOM 604 CZ2 TRP A 37 127.914 0.191 3.824 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.766 0.957 2.462 1.00 0.00 C ATOM 606 CH2 TRP A 37 129.098 0.920 3.694 1.00 0.00 C ATOM 0 H TRP A 37 127.313 -4.049 -0.638 1.00 0.00 H new ATOM 0 HA TRP A 37 129.257 -2.330 -1.972 1.00 0.00 H new ATOM 0 HB2 TRP A 37 127.803 -0.623 -1.427 1.00 0.00 H new ATOM 0 HB3 TRP A 37 126.667 -1.957 -1.389 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.452 -2.393 0.821 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.600 -1.495 3.239 1.00 0.00 H new ATOM 0 HE3 TRP A 37 129.771 0.303 0.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.396 0.159 4.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.682 1.520 2.365 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.499 1.455 4.542 1.00 0.00 H new ATOM 617 N CYS A 38 129.311 -2.901 1.279 1.00 0.00 N ATOM 618 CA CYS A 38 130.177 -2.815 2.449 1.00 0.00 C ATOM 619 C CYS A 38 131.374 -3.748 2.282 1.00 0.00 C ATOM 620 O CYS A 38 132.522 -3.341 2.464 1.00 0.00 O ATOM 621 CB CYS A 38 129.393 -3.182 3.713 1.00 0.00 C ATOM 622 SG CYS A 38 130.259 -4.491 4.617 1.00 0.00 S ATOM 0 H CYS A 38 128.423 -3.377 1.437 1.00 0.00 H new ATOM 0 HA CYS A 38 130.539 -1.791 2.547 1.00 0.00 H new ATOM 0 HB2 CYS A 38 129.279 -2.304 4.348 1.00 0.00 H new ATOM 0 HB3 CYS A 38 128.390 -3.515 3.446 1.00 0.00 H new ATOM 0 HG CYS A 38 129.614 -5.612 4.482 1.00 0.00 H new ATOM 628 N PRO A 39 131.121 -4.981 1.934 1.00 0.00 N ATOM 629 CA PRO A 39 132.181 -6.002 1.726 1.00 0.00 C ATOM 630 C PRO A 39 132.739 -5.968 0.304 1.00 0.00 C ATOM 631 O PRO A 39 132.142 -5.372 -0.593 1.00 0.00 O ATOM 632 CB PRO A 39 131.444 -7.312 1.990 1.00 0.00 C ATOM 633 CG PRO A 39 130.027 -7.056 1.583 1.00 0.00 C ATOM 634 CD PRO A 39 129.783 -5.545 1.703 1.00 0.00 C ATOM 0 HA PRO A 39 133.047 -5.846 2.370 1.00 0.00 H new ATOM 0 HB2 PRO A 39 131.877 -8.130 1.414 1.00 0.00 H new ATOM 0 HB3 PRO A 39 131.507 -7.594 3.041 1.00 0.00 H new ATOM 0 HG2 PRO A 39 129.854 -7.393 0.561 1.00 0.00 H new ATOM 0 HG3 PRO A 39 129.338 -7.608 2.222 1.00 0.00 H new ATOM 0 HD2 PRO A 39 129.332 -5.141 0.797 1.00 0.00 H new ATOM 0 HD3 PRO A 39 129.106 -5.315 2.526 1.00 0.00 H new ATOM 642 N PRO A 40 133.862 -6.597 0.089 1.00 0.00 N ATOM 643 CA PRO A 40 134.515 -6.647 -1.250 1.00 0.00 C ATOM 644 C PRO A 40 133.835 -7.647 -2.184 1.00 0.00 C ATOM 645 O PRO A 40 132.778 -7.366 -2.746 1.00 0.00 O ATOM 646 CB PRO A 40 135.946 -7.081 -0.930 1.00 0.00 C ATOM 647 CG PRO A 40 135.847 -7.867 0.336 1.00 0.00 C ATOM 648 CD PRO A 40 134.636 -7.328 1.103 1.00 0.00 C ATOM 0 HA PRO A 40 134.459 -5.693 -1.774 1.00 0.00 H new ATOM 0 HB2 PRO A 40 136.363 -7.685 -1.736 1.00 0.00 H new ATOM 0 HB3 PRO A 40 136.600 -6.218 -0.807 1.00 0.00 H new ATOM 0 HG2 PRO A 40 135.727 -8.929 0.122 1.00 0.00 H new ATOM 0 HG3 PRO A 40 136.756 -7.762 0.928 1.00 0.00 H new ATOM 0 HD2 PRO A 40 134.052 -8.136 1.544 1.00 0.00 H new ATOM 0 HD3 PRO A 40 134.941 -6.673 1.919 1.00 0.00 H new ATOM 656 N CYS A 41 134.449 -8.817 -2.339 1.00 0.00 N ATOM 657 CA CYS A 41 133.894 -9.853 -3.204 1.00 0.00 C ATOM 658 C CYS A 41 133.533 -9.282 -4.573 1.00 0.00 C ATOM 659 O CYS A 41 132.472 -9.584 -5.120 1.00 0.00 O ATOM 660 CB CYS A 41 132.647 -10.459 -2.558 1.00 0.00 C ATOM 661 SG CYS A 41 132.492 -12.193 -3.053 1.00 0.00 S ATOM 0 H CYS A 41 135.324 -9.070 -1.881 1.00 0.00 H new ATOM 0 HA CYS A 41 134.650 -10.627 -3.337 1.00 0.00 H new ATOM 0 HB2 CYS A 41 132.714 -10.384 -1.473 1.00 0.00 H new ATOM 0 HB3 CYS A 41 131.760 -9.903 -2.862 1.00 0.00 H new ATOM 0 HG CYS A 41 131.433 -12.709 -2.502 1.00 0.00 H new ATOM 667 N ARG A 42 134.421 -8.460 -5.120 1.00 0.00 N ATOM 668 CA ARG A 42 134.185 -7.855 -6.427 1.00 0.00 C ATOM 669 C ARG A 42 134.542 -8.830 -7.545 1.00 0.00 C ATOM 670 O ARG A 42 135.435 -9.663 -7.391 1.00 0.00 O ATOM 671 CB ARG A 42 135.022 -6.582 -6.571 1.00 0.00 C ATOM 672 CG ARG A 42 136.484 -6.894 -6.246 1.00 0.00 C ATOM 673 CD ARG A 42 137.346 -5.664 -6.537 1.00 0.00 C ATOM 674 NE ARG A 42 136.820 -4.941 -7.689 1.00 0.00 N ATOM 675 CZ ARG A 42 135.983 -3.920 -7.537 1.00 0.00 C ATOM 676 NH1 ARG A 42 135.618 -3.549 -6.339 1.00 0.00 N ATOM 677 NH2 ARG A 42 135.527 -3.288 -8.583 1.00 0.00 N ATOM 0 H ARG A 42 135.305 -8.198 -4.683 1.00 0.00 H new ATOM 0 HA ARG A 42 133.127 -7.606 -6.504 1.00 0.00 H new ATOM 0 HB2 ARG A 42 134.939 -6.192 -7.585 1.00 0.00 H new ATOM 0 HB3 ARG A 42 134.646 -5.809 -5.901 1.00 0.00 H new ATOM 0 HG2 ARG A 42 136.582 -7.180 -5.199 1.00 0.00 H new ATOM 0 HG3 ARG A 42 136.827 -7.740 -6.841 1.00 0.00 H new ATOM 0 HD2 ARG A 42 137.365 -5.010 -5.665 1.00 0.00 H new ATOM 0 HD3 ARG A 42 138.375 -5.969 -6.729 1.00 0.00 H new ATOM 0 HE ARG A 42 137.099 -5.224 -8.628 1.00 0.00 H new ATOM 0 HH11 ARG A 42 135.975 -4.043 -5.521 1.00 0.00 H new ATOM 0 HH12 ARG A 42 134.976 -2.765 -6.221 1.00 0.00 H new ATOM 0 HH21 ARG A 42 135.813 -3.577 -9.518 1.00 0.00 H new ATOM 0 HH22 ARG A 42 134.885 -2.504 -8.466 1.00 0.00 H new ATOM 691 N GLY A 43 133.842 -8.719 -8.670 1.00 0.00 N ATOM 692 CA GLY A 43 134.098 -9.596 -9.807 1.00 0.00 C ATOM 693 C GLY A 43 132.898 -10.493 -10.093 1.00 0.00 C ATOM 694 O GLY A 43 132.614 -10.819 -11.245 1.00 0.00 O ATOM 0 H GLY A 43 133.099 -8.036 -8.818 1.00 0.00 H new ATOM 0 HA2 GLY A 43 134.325 -8.996 -10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.975 -10.211 -9.605 1.00 0.00 H new ATOM 698 N PHE A 44 132.198 -10.891 -9.035 1.00 0.00 N ATOM 699 CA PHE A 44 131.030 -11.752 -9.183 1.00 0.00 C ATOM 700 C PHE A 44 129.828 -10.950 -9.670 1.00 0.00 C ATOM 701 O PHE A 44 129.203 -11.291 -10.673 1.00 0.00 O ATOM 702 CB PHE A 44 130.699 -12.406 -7.839 1.00 0.00 C ATOM 703 CG PHE A 44 129.880 -13.653 -8.069 1.00 0.00 C ATOM 704 CD1 PHE A 44 130.510 -14.843 -8.455 1.00 0.00 C ATOM 705 CD2 PHE A 44 128.493 -13.621 -7.894 1.00 0.00 C ATOM 706 CE1 PHE A 44 129.750 -16.000 -8.665 1.00 0.00 C ATOM 707 CE2 PHE A 44 127.732 -14.778 -8.103 1.00 0.00 C ATOM 708 CZ PHE A 44 128.362 -15.967 -8.489 1.00 0.00 C ATOM 0 H PHE A 44 132.417 -10.633 -8.073 1.00 0.00 H new ATOM 0 HA PHE A 44 131.258 -12.522 -9.920 1.00 0.00 H new ATOM 0 HB2 PHE A 44 131.618 -12.655 -7.309 1.00 0.00 H new ATOM 0 HB3 PHE A 44 130.147 -11.708 -7.210 1.00 0.00 H new ATOM 0 HD1 PHE A 44 131.581 -14.868 -8.591 1.00 0.00 H new ATOM 0 HD2 PHE A 44 128.008 -12.703 -7.597 1.00 0.00 H new ATOM 0 HE1 PHE A 44 130.235 -16.918 -8.963 1.00 0.00 H new ATOM 0 HE2 PHE A 44 126.661 -14.753 -7.967 1.00 0.00 H new ATOM 0 HZ PHE A 44 127.776 -16.860 -8.651 1.00 0.00 H new ATOM 718 N THR A 45 129.510 -9.882 -8.947 1.00 0.00 N ATOM 719 CA THR A 45 128.378 -9.036 -9.309 1.00 0.00 C ATOM 720 C THR A 45 128.370 -8.749 -10.809 1.00 0.00 C ATOM 721 O THR A 45 127.406 -9.074 -11.504 1.00 0.00 O ATOM 722 CB THR A 45 128.430 -7.719 -8.531 1.00 0.00 C ATOM 723 OG1 THR A 45 127.838 -7.903 -7.252 1.00 0.00 O ATOM 724 CG2 THR A 45 127.662 -6.640 -9.298 1.00 0.00 C ATOM 0 H THR A 45 130.015 -9.583 -8.113 1.00 0.00 H new ATOM 0 HA THR A 45 127.463 -9.569 -9.052 1.00 0.00 H new ATOM 0 HB THR A 45 129.468 -7.408 -8.412 1.00 0.00 H new ATOM 0 HG1 THR A 45 127.872 -7.061 -6.752 1.00 0.00 H new ATOM 0 HG21 THR A 45 127.700 -5.703 -8.743 1.00 0.00 H new ATOM 0 HG22 THR A 45 128.115 -6.499 -10.279 1.00 0.00 H new ATOM 0 HG23 THR A 45 126.624 -6.949 -9.419 1.00 0.00 H new ATOM 732 N PRO A 46 129.412 -8.147 -11.316 1.00 0.00 N ATOM 733 CA PRO A 46 129.526 -7.808 -12.760 1.00 0.00 C ATOM 734 C PRO A 46 129.032 -8.937 -13.660 1.00 0.00 C ATOM 735 O PRO A 46 128.789 -8.732 -14.849 1.00 0.00 O ATOM 736 CB PRO A 46 131.025 -7.547 -12.976 1.00 0.00 C ATOM 737 CG PRO A 46 131.695 -7.734 -11.645 1.00 0.00 C ATOM 738 CD PRO A 46 130.602 -7.722 -10.579 1.00 0.00 C ATOM 0 HA PRO A 46 128.907 -6.949 -13.019 1.00 0.00 H new ATOM 0 HB2 PRO A 46 131.435 -8.236 -13.715 1.00 0.00 H new ATOM 0 HB3 PRO A 46 131.191 -6.538 -13.354 1.00 0.00 H new ATOM 0 HG2 PRO A 46 132.245 -8.675 -11.621 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.417 -6.938 -11.463 1.00 0.00 H new ATOM 0 HD2 PRO A 46 130.832 -8.402 -9.759 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.474 -6.731 -10.145 1.00 0.00 H new ATOM 746 N ILE A 47 128.876 -10.127 -13.088 1.00 0.00 N ATOM 747 CA ILE A 47 128.400 -11.269 -13.858 1.00 0.00 C ATOM 748 C ILE A 47 126.880 -11.244 -13.943 1.00 0.00 C ATOM 749 O ILE A 47 126.299 -11.464 -15.008 1.00 0.00 O ATOM 750 CB ILE A 47 128.852 -12.574 -13.203 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.382 -12.611 -13.148 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.335 -13.757 -14.024 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.879 -14.007 -13.537 1.00 0.00 C ATOM 0 H ILE A 47 129.070 -10.324 -12.106 1.00 0.00 H new ATOM 0 HA ILE A 47 128.819 -11.209 -14.862 1.00 0.00 H new ATOM 0 HB ILE A 47 128.454 -12.635 -12.190 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.798 -11.865 -13.825 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.726 -12.358 -12.145 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.655 -14.690 -13.560 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.246 -13.726 -14.061 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.735 -13.700 -15.036 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.968 -14.030 -13.497 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.475 -14.744 -12.843 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.548 -14.242 -14.549 1.00 0.00 H new ATOM 765 N LEU A 48 126.241 -10.967 -12.813 1.00 0.00 N ATOM 766 CA LEU A 48 124.790 -10.907 -12.769 1.00 0.00 C ATOM 767 C LEU A 48 124.287 -9.759 -13.634 1.00 0.00 C ATOM 768 O LEU A 48 123.207 -9.837 -14.213 1.00 0.00 O ATOM 769 CB LEU A 48 124.317 -10.737 -11.319 1.00 0.00 C ATOM 770 CG LEU A 48 123.591 -9.399 -11.152 1.00 0.00 C ATOM 771 CD1 LEU A 48 122.270 -9.431 -11.923 1.00 0.00 C ATOM 772 CD2 LEU A 48 123.305 -9.164 -9.669 1.00 0.00 C ATOM 0 H LEU A 48 126.703 -10.782 -11.922 1.00 0.00 H new ATOM 0 HA LEU A 48 124.382 -11.839 -13.161 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.651 -11.556 -11.048 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.171 -10.783 -10.643 1.00 0.00 H new ATOM 0 HG LEU A 48 124.217 -8.595 -11.540 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.755 -8.478 -11.803 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.470 -9.604 -12.980 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.642 -10.234 -11.536 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.788 -8.212 -9.544 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.678 -9.970 -9.287 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.244 -9.142 -9.116 1.00 0.00 H new ATOM 784 N ALA A 49 125.077 -8.693 -13.725 1.00 0.00 N ATOM 785 CA ALA A 49 124.687 -7.545 -14.533 1.00 0.00 C ATOM 786 C ALA A 49 124.636 -7.928 -16.007 1.00 0.00 C ATOM 787 O ALA A 49 123.867 -7.362 -16.783 1.00 0.00 O ATOM 788 CB ALA A 49 125.680 -6.397 -14.332 1.00 0.00 C ATOM 0 H ALA A 49 125.978 -8.601 -13.256 1.00 0.00 H new ATOM 0 HA ALA A 49 123.696 -7.220 -14.217 1.00 0.00 H new ATOM 0 HB1 ALA A 49 125.379 -5.544 -14.941 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.693 -6.107 -13.281 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.677 -6.722 -14.631 1.00 0.00 H new ATOM 794 N ASP A 50 125.446 -8.905 -16.386 1.00 0.00 N ATOM 795 CA ASP A 50 125.459 -9.359 -17.766 1.00 0.00 C ATOM 796 C ASP A 50 124.284 -10.294 -18.006 1.00 0.00 C ATOM 797 O ASP A 50 123.715 -10.334 -19.099 1.00 0.00 O ATOM 798 CB ASP A 50 126.771 -10.085 -18.071 1.00 0.00 C ATOM 799 CG ASP A 50 127.669 -9.200 -18.929 1.00 0.00 C ATOM 800 OD1 ASP A 50 128.126 -8.187 -18.426 1.00 0.00 O ATOM 801 OD2 ASP A 50 127.888 -9.549 -20.078 1.00 0.00 O ATOM 0 H ASP A 50 126.094 -9.392 -15.767 1.00 0.00 H new ATOM 0 HA ASP A 50 125.375 -8.495 -18.425 1.00 0.00 H new ATOM 0 HB2 ASP A 50 127.279 -10.341 -17.141 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.566 -11.021 -18.590 1.00 0.00 H new ATOM 806 N MET A 51 123.921 -11.042 -16.969 1.00 0.00 N ATOM 807 CA MET A 51 122.809 -11.976 -17.071 1.00 0.00 C ATOM 808 C MET A 51 121.479 -11.236 -17.044 1.00 0.00 C ATOM 809 O MET A 51 120.606 -11.485 -17.876 1.00 0.00 O ATOM 810 CB MET A 51 122.866 -12.983 -15.922 1.00 0.00 C ATOM 811 CG MET A 51 122.210 -14.292 -16.359 1.00 0.00 C ATOM 812 SD MET A 51 120.412 -14.091 -16.345 1.00 0.00 S ATOM 813 CE MET A 51 120.187 -14.290 -14.563 1.00 0.00 C ATOM 0 H MET A 51 124.377 -11.019 -16.057 1.00 0.00 H new ATOM 0 HA MET A 51 122.891 -12.506 -18.020 1.00 0.00 H new ATOM 0 HB2 MET A 51 123.901 -13.162 -15.632 1.00 0.00 H new ATOM 0 HB3 MET A 51 122.355 -12.582 -15.047 1.00 0.00 H new ATOM 0 HG2 MET A 51 122.549 -14.567 -17.358 1.00 0.00 H new ATOM 0 HG3 MET A 51 122.503 -15.101 -15.689 1.00 0.00 H new ATOM 0 HE1 MET A 51 119.494 -15.110 -14.373 1.00 0.00 H new ATOM 0 HE2 MET A 51 121.147 -14.511 -14.097 1.00 0.00 H new ATOM 0 HE3 MET A 51 119.783 -13.369 -14.142 1.00 0.00 H new ATOM 823 N TYR A 52 121.325 -10.328 -16.091 1.00 0.00 N ATOM 824 CA TYR A 52 120.090 -9.568 -15.985 1.00 0.00 C ATOM 825 C TYR A 52 119.991 -8.582 -17.143 1.00 0.00 C ATOM 826 O TYR A 52 118.895 -8.205 -17.554 1.00 0.00 O ATOM 827 CB TYR A 52 120.023 -8.830 -14.643 1.00 0.00 C ATOM 828 CG TYR A 52 120.424 -7.388 -14.829 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.619 -7.081 -15.479 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.603 -6.362 -14.351 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.997 -5.745 -15.657 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.979 -5.026 -14.526 1.00 0.00 C ATOM 833 CZ TYR A 52 121.176 -4.717 -15.180 1.00 0.00 C ATOM 834 OH TYR A 52 121.547 -3.400 -15.355 1.00 0.00 O ATOM 0 H TYR A 52 122.030 -10.102 -15.389 1.00 0.00 H new ATOM 0 HA TYR A 52 119.247 -10.257 -16.034 1.00 0.00 H new ATOM 0 HB2 TYR A 52 119.013 -8.886 -14.237 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.684 -9.310 -13.921 1.00 0.00 H new ATOM 0 HD1 TYR A 52 122.253 -7.875 -15.845 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.678 -6.601 -13.847 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.922 -5.508 -16.162 1.00 0.00 H new ATOM 0 HE2 TYR A 52 119.345 -4.234 -14.156 1.00 0.00 H new ATOM 0 HH TYR A 52 120.756 -2.863 -15.572 1.00 0.00 H new ATOM 844 N SER A 53 121.142 -8.179 -17.680 1.00 0.00 N ATOM 845 CA SER A 53 121.152 -7.250 -18.801 1.00 0.00 C ATOM 846 C SER A 53 120.604 -7.931 -20.046 1.00 0.00 C ATOM 847 O SER A 53 119.808 -7.349 -20.782 1.00 0.00 O ATOM 848 CB SER A 53 122.572 -6.753 -19.070 1.00 0.00 C ATOM 849 OG SER A 53 123.449 -7.867 -19.161 1.00 0.00 O ATOM 0 H SER A 53 122.064 -8.477 -17.361 1.00 0.00 H new ATOM 0 HA SER A 53 120.522 -6.397 -18.549 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.599 -6.177 -19.995 1.00 0.00 H new ATOM 0 HB3 SER A 53 122.894 -6.086 -18.270 1.00 0.00 H new ATOM 0 HG SER A 53 122.941 -8.695 -19.029 1.00 0.00 H new ATOM 855 N GLU A 54 121.020 -9.173 -20.269 1.00 0.00 N ATOM 856 CA GLU A 54 120.541 -9.917 -21.422 1.00 0.00 C ATOM 857 C GLU A 54 119.059 -10.226 -21.244 1.00 0.00 C ATOM 858 O GLU A 54 118.243 -9.962 -22.130 1.00 0.00 O ATOM 859 CB GLU A 54 121.348 -11.210 -21.579 1.00 0.00 C ATOM 860 CG GLU A 54 120.405 -12.393 -21.806 1.00 0.00 C ATOM 861 CD GLU A 54 119.549 -12.149 -23.045 1.00 0.00 C ATOM 862 OE1 GLU A 54 120.118 -11.947 -24.104 1.00 0.00 O ATOM 863 OE2 GLU A 54 118.336 -12.169 -22.915 1.00 0.00 O ATOM 0 H GLU A 54 121.678 -9.677 -19.675 1.00 0.00 H new ATOM 0 HA GLU A 54 120.671 -9.320 -22.324 1.00 0.00 H new ATOM 0 HB2 GLU A 54 122.037 -11.118 -22.418 1.00 0.00 H new ATOM 0 HB3 GLU A 54 121.952 -11.382 -20.688 1.00 0.00 H new ATOM 0 HG2 GLU A 54 120.982 -13.310 -21.927 1.00 0.00 H new ATOM 0 HG3 GLU A 54 119.766 -12.531 -20.934 1.00 0.00 H new ATOM 870 N LEU A 55 118.719 -10.774 -20.084 1.00 0.00 N ATOM 871 CA LEU A 55 117.335 -11.104 -19.789 1.00 0.00 C ATOM 872 C LEU A 55 116.463 -9.861 -19.885 1.00 0.00 C ATOM 873 O LEU A 55 115.351 -9.917 -20.407 1.00 0.00 O ATOM 874 CB LEU A 55 117.222 -11.707 -18.387 1.00 0.00 C ATOM 875 CG LEU A 55 117.198 -13.232 -18.488 1.00 0.00 C ATOM 876 CD1 LEU A 55 117.085 -13.837 -17.088 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.991 -13.670 -19.325 1.00 0.00 C ATOM 0 H LEU A 55 119.379 -10.997 -19.339 1.00 0.00 H new ATOM 0 HA LEU A 55 116.991 -11.835 -20.520 1.00 0.00 H new ATOM 0 HB2 LEU A 55 118.063 -11.386 -17.773 1.00 0.00 H new ATOM 0 HB3 LEU A 55 116.316 -11.350 -17.898 1.00 0.00 H new ATOM 0 HG LEU A 55 118.118 -13.576 -18.961 1.00 0.00 H new ATOM 0 HD11 LEU A 55 117.068 -14.924 -17.162 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.940 -13.527 -16.488 1.00 0.00 H new ATOM 0 HD13 LEU A 55 116.166 -13.491 -16.615 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.974 -14.757 -19.397 1.00 0.00 H new ATOM 0 HD22 LEU A 55 115.073 -13.323 -18.850 1.00 0.00 H new ATOM 0 HD23 LEU A 55 116.066 -13.241 -20.324 1.00 0.00 H new ATOM 889 N VAL A 56 116.974 -8.734 -19.391 1.00 0.00 N ATOM 890 CA VAL A 56 116.220 -7.485 -19.444 1.00 0.00 C ATOM 891 C VAL A 56 115.910 -7.141 -20.888 1.00 0.00 C ATOM 892 O VAL A 56 114.773 -6.819 -21.232 1.00 0.00 O ATOM 893 CB VAL A 56 117.017 -6.356 -18.792 1.00 0.00 C ATOM 894 CG1 VAL A 56 116.338 -5.018 -19.085 1.00 0.00 C ATOM 895 CG2 VAL A 56 117.065 -6.578 -17.277 1.00 0.00 C ATOM 0 H VAL A 56 117.894 -8.661 -18.956 1.00 0.00 H new ATOM 0 HA VAL A 56 115.286 -7.608 -18.896 1.00 0.00 H new ATOM 0 HB VAL A 56 118.030 -6.347 -19.194 1.00 0.00 H new ATOM 0 HG11 VAL A 56 116.906 -4.212 -18.620 1.00 0.00 H new ATOM 0 HG12 VAL A 56 116.298 -4.859 -20.163 1.00 0.00 H new ATOM 0 HG13 VAL A 56 115.325 -5.028 -18.681 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.633 -5.774 -16.809 1.00 0.00 H new ATOM 0 HG22 VAL A 56 116.051 -6.585 -16.878 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.545 -7.533 -17.064 1.00 0.00 H new ATOM 905 N ASP A 57 116.921 -7.245 -21.733 1.00 0.00 N ATOM 906 CA ASP A 57 116.739 -6.976 -23.146 1.00 0.00 C ATOM 907 C ASP A 57 115.600 -7.840 -23.663 1.00 0.00 C ATOM 908 O ASP A 57 114.851 -7.444 -24.557 1.00 0.00 O ATOM 909 CB ASP A 57 118.024 -7.306 -23.898 1.00 0.00 C ATOM 910 CG ASP A 57 118.054 -6.571 -25.234 1.00 0.00 C ATOM 911 OD1 ASP A 57 117.137 -5.807 -25.488 1.00 0.00 O ATOM 912 OD2 ASP A 57 118.994 -6.781 -25.982 1.00 0.00 O ATOM 0 H ASP A 57 117.869 -7.512 -21.467 1.00 0.00 H new ATOM 0 HA ASP A 57 116.501 -5.923 -23.299 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.889 -7.021 -23.298 1.00 0.00 H new ATOM 0 HB3 ASP A 57 118.091 -8.381 -24.064 1.00 0.00 H new ATOM 917 N ASP A 58 115.478 -9.024 -23.074 1.00 0.00 N ATOM 918 CA ASP A 58 114.429 -9.960 -23.448 1.00 0.00 C ATOM 919 C ASP A 58 113.207 -9.756 -22.567 1.00 0.00 C ATOM 920 O ASP A 58 112.377 -10.653 -22.414 1.00 0.00 O ATOM 921 CB ASP A 58 114.934 -11.394 -23.286 1.00 0.00 C ATOM 922 CG ASP A 58 115.049 -12.066 -24.650 1.00 0.00 C ATOM 923 OD1 ASP A 58 114.034 -12.186 -25.317 1.00 0.00 O ATOM 924 OD2 ASP A 58 116.150 -12.452 -25.008 1.00 0.00 O ATOM 0 H ASP A 58 116.095 -9.358 -22.334 1.00 0.00 H new ATOM 0 HA ASP A 58 114.156 -9.783 -24.488 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.905 -11.392 -22.790 1.00 0.00 H new ATOM 0 HB3 ASP A 58 114.252 -11.958 -22.650 1.00 0.00 H new ATOM 929 N SER A 59 113.115 -8.576 -21.976 1.00 0.00 N ATOM 930 CA SER A 59 112.003 -8.263 -21.089 1.00 0.00 C ATOM 931 C SER A 59 112.151 -9.054 -19.799 1.00 0.00 C ATOM 932 O SER A 59 111.179 -9.305 -19.086 1.00 0.00 O ATOM 933 CB SER A 59 110.675 -8.608 -21.763 1.00 0.00 C ATOM 934 OG SER A 59 109.620 -7.924 -21.099 1.00 0.00 O ATOM 0 H SER A 59 113.792 -7.822 -22.092 1.00 0.00 H new ATOM 0 HA SER A 59 112.012 -7.196 -20.865 1.00 0.00 H new ATOM 0 HB2 SER A 59 110.703 -8.324 -22.815 1.00 0.00 H new ATOM 0 HB3 SER A 59 110.505 -9.684 -21.728 1.00 0.00 H new ATOM 0 HG SER A 59 109.689 -8.075 -20.133 1.00 0.00 H new ATOM 940 N ALA A 60 113.389 -9.438 -19.520 1.00 0.00 N ATOM 941 CA ALA A 60 113.717 -10.205 -18.324 1.00 0.00 C ATOM 942 C ALA A 60 112.458 -10.638 -17.583 1.00 0.00 C ATOM 943 O ALA A 60 111.929 -9.903 -16.749 1.00 0.00 O ATOM 944 CB ALA A 60 114.589 -9.363 -17.400 1.00 0.00 C ATOM 0 H ALA A 60 114.192 -9.228 -20.113 1.00 0.00 H new ATOM 0 HA ALA A 60 114.257 -11.101 -18.631 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.833 -9.938 -16.507 1.00 0.00 H new ATOM 0 HB2 ALA A 60 115.508 -9.089 -17.917 1.00 0.00 H new ATOM 0 HB3 ALA A 60 114.050 -8.460 -17.114 1.00 0.00 H new ATOM 950 N PRO A 61 111.980 -11.815 -17.874 1.00 0.00 N ATOM 951 CA PRO A 61 110.758 -12.379 -17.228 1.00 0.00 C ATOM 952 C PRO A 61 110.915 -12.536 -15.717 1.00 0.00 C ATOM 953 O PRO A 61 110.425 -13.504 -15.135 1.00 0.00 O ATOM 954 CB PRO A 61 110.585 -13.752 -17.893 1.00 0.00 C ATOM 955 CG PRO A 61 111.414 -13.716 -19.133 1.00 0.00 C ATOM 956 CD PRO A 61 112.552 -12.740 -18.861 1.00 0.00 C ATOM 0 HA PRO A 61 109.899 -11.721 -17.359 1.00 0.00 H new ATOM 0 HB2 PRO A 61 110.912 -14.551 -17.228 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.538 -13.942 -18.129 1.00 0.00 H new ATOM 0 HG2 PRO A 61 111.801 -14.707 -19.371 1.00 0.00 H new ATOM 0 HG3 PRO A 61 110.820 -13.392 -19.988 1.00 0.00 H new ATOM 0 HD2 PRO A 61 113.433 -13.249 -18.471 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.860 -12.220 -19.768 1.00 0.00 H new ATOM 964 N PHE A 62 111.585 -11.579 -15.083 1.00 0.00 N ATOM 965 CA PHE A 62 111.772 -11.639 -13.640 1.00 0.00 C ATOM 966 C PHE A 62 112.405 -10.356 -13.099 1.00 0.00 C ATOM 967 O PHE A 62 113.102 -9.641 -13.818 1.00 0.00 O ATOM 968 CB PHE A 62 112.624 -12.854 -13.284 1.00 0.00 C ATOM 969 CG PHE A 62 114.073 -12.463 -13.169 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.683 -11.731 -14.191 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.808 -12.844 -12.043 1.00 0.00 C ATOM 972 CE1 PHE A 62 116.032 -11.380 -14.088 1.00 0.00 C ATOM 973 CE2 PHE A 62 116.155 -12.493 -11.936 1.00 0.00 C ATOM 974 CZ PHE A 62 116.770 -11.761 -12.961 1.00 0.00 C ATOM 0 H PHE A 62 112.001 -10.766 -15.537 1.00 0.00 H new ATOM 0 HA PHE A 62 110.793 -11.736 -13.171 1.00 0.00 H new ATOM 0 HB2 PHE A 62 112.281 -13.284 -12.343 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.508 -13.624 -14.047 1.00 0.00 H new ATOM 0 HD1 PHE A 62 114.113 -11.437 -15.060 1.00 0.00 H new ATOM 0 HD2 PHE A 62 114.334 -13.410 -11.255 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.505 -10.815 -14.878 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.722 -12.785 -11.065 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.813 -11.491 -12.881 1.00 0.00 H new ATOM 984 N GLU A 63 112.146 -10.075 -11.823 1.00 0.00 N ATOM 985 CA GLU A 63 112.679 -8.877 -11.174 1.00 0.00 C ATOM 986 C GLU A 63 113.686 -9.247 -10.088 1.00 0.00 C ATOM 987 O GLU A 63 113.575 -10.294 -9.452 1.00 0.00 O ATOM 988 CB GLU A 63 111.536 -8.069 -10.555 1.00 0.00 C ATOM 989 CG GLU A 63 110.736 -7.383 -11.665 1.00 0.00 C ATOM 990 CD GLU A 63 110.027 -6.151 -11.110 1.00 0.00 C ATOM 991 OE1 GLU A 63 110.004 -6.001 -9.900 1.00 0.00 O ATOM 992 OE2 GLU A 63 109.517 -5.379 -11.904 1.00 0.00 O ATOM 0 H GLU A 63 111.570 -10.660 -11.218 1.00 0.00 H new ATOM 0 HA GLU A 63 113.187 -8.277 -11.930 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.886 -8.724 -9.975 1.00 0.00 H new ATOM 0 HB3 GLU A 63 111.934 -7.324 -9.866 1.00 0.00 H new ATOM 0 HG2 GLU A 63 111.401 -7.095 -12.479 1.00 0.00 H new ATOM 0 HG3 GLU A 63 110.006 -8.077 -12.081 1.00 0.00 H new ATOM 999 N ILE A 64 114.664 -8.371 -9.882 1.00 0.00 N ATOM 1000 CA ILE A 64 115.688 -8.603 -8.867 1.00 0.00 C ATOM 1001 C ILE A 64 115.343 -7.868 -7.577 1.00 0.00 C ATOM 1002 O ILE A 64 115.068 -6.668 -7.587 1.00 0.00 O ATOM 1003 CB ILE A 64 117.055 -8.136 -9.381 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.977 -9.346 -9.554 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.688 -7.163 -8.383 1.00 0.00 C ATOM 1006 CD1 ILE A 64 117.485 -10.205 -10.720 1.00 0.00 C ATOM 0 H ILE A 64 114.770 -7.499 -10.400 1.00 0.00 H new ATOM 0 HA ILE A 64 115.729 -9.672 -8.659 1.00 0.00 H new ATOM 0 HB ILE A 64 116.919 -7.633 -10.338 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.998 -9.014 -9.740 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.995 -9.936 -8.637 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.658 -6.838 -8.758 1.00 0.00 H new ATOM 0 HG22 ILE A 64 117.038 -6.297 -8.257 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.819 -7.661 -7.422 1.00 0.00 H new ATOM 0 HD11 ILE A 64 118.143 -11.066 -10.841 1.00 0.00 H new ATOM 0 HD12 ILE A 64 116.471 -10.549 -10.516 1.00 0.00 H new ATOM 0 HD13 ILE A 64 117.490 -9.613 -11.635 1.00 0.00 H new ATOM 1018 N ILE A 65 115.368 -8.595 -6.466 1.00 0.00 N ATOM 1019 CA ILE A 65 115.068 -8.005 -5.168 1.00 0.00 C ATOM 1020 C ILE A 65 116.360 -7.590 -4.472 1.00 0.00 C ATOM 1021 O ILE A 65 117.353 -8.317 -4.507 1.00 0.00 O ATOM 1022 CB ILE A 65 114.317 -9.012 -4.295 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.541 -9.982 -5.189 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.342 -8.274 -3.376 1.00 0.00 C ATOM 1025 CD1 ILE A 65 112.510 -9.207 -6.013 1.00 0.00 C ATOM 0 H ILE A 65 115.592 -9.590 -6.438 1.00 0.00 H new ATOM 0 HA ILE A 65 114.443 -7.125 -5.319 1.00 0.00 H new ATOM 0 HB ILE A 65 115.033 -9.567 -3.688 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.227 -10.511 -5.851 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.042 -10.735 -4.579 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.809 -8.995 -2.756 1.00 0.00 H new ATOM 0 HG22 ILE A 65 113.895 -7.585 -2.737 1.00 0.00 H new ATOM 0 HG23 ILE A 65 112.626 -7.715 -3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.958 -9.899 -6.649 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.817 -8.698 -5.343 1.00 0.00 H new ATOM 0 HD13 ILE A 65 113.020 -8.471 -6.634 1.00 0.00 H new ATOM 1037 N PHE A 66 116.344 -6.420 -3.841 1.00 0.00 N ATOM 1038 CA PHE A 66 117.529 -5.929 -3.147 1.00 0.00 C ATOM 1039 C PHE A 66 117.371 -6.062 -1.636 1.00 0.00 C ATOM 1040 O PHE A 66 116.467 -5.476 -1.041 1.00 0.00 O ATOM 1041 CB PHE A 66 117.779 -4.463 -3.510 1.00 0.00 C ATOM 1042 CG PHE A 66 119.069 -4.348 -4.286 1.00 0.00 C ATOM 1043 CD1 PHE A 66 120.277 -4.736 -3.695 1.00 0.00 C ATOM 1044 CD2 PHE A 66 119.057 -3.853 -5.595 1.00 0.00 C ATOM 1045 CE1 PHE A 66 121.475 -4.630 -4.413 1.00 0.00 C ATOM 1046 CE2 PHE A 66 120.254 -3.746 -6.314 1.00 0.00 C ATOM 1047 CZ PHE A 66 121.463 -4.135 -5.723 1.00 0.00 C ATOM 0 H PHE A 66 115.534 -5.801 -3.796 1.00 0.00 H new ATOM 0 HA PHE A 66 118.380 -6.533 -3.461 1.00 0.00 H new ATOM 0 HB2 PHE A 66 116.950 -4.078 -4.104 1.00 0.00 H new ATOM 0 HB3 PHE A 66 117.831 -3.857 -2.605 1.00 0.00 H new ATOM 0 HD1 PHE A 66 120.285 -5.117 -2.685 1.00 0.00 H new ATOM 0 HD2 PHE A 66 118.125 -3.554 -6.051 1.00 0.00 H new ATOM 0 HE1 PHE A 66 122.407 -4.930 -3.957 1.00 0.00 H new ATOM 0 HE2 PHE A 66 120.245 -3.364 -7.324 1.00 0.00 H new ATOM 0 HZ PHE A 66 122.386 -4.053 -6.278 1.00 0.00 H new ATOM 1057 N VAL A 67 118.265 -6.831 -1.024 1.00 0.00 N ATOM 1058 CA VAL A 67 118.233 -7.035 0.419 1.00 0.00 C ATOM 1059 C VAL A 67 119.651 -7.068 0.972 1.00 0.00 C ATOM 1060 O VAL A 67 120.556 -6.448 0.414 1.00 0.00 O ATOM 1061 CB VAL A 67 117.520 -8.348 0.750 1.00 0.00 C ATOM 1062 CG1 VAL A 67 116.939 -8.272 2.161 1.00 0.00 C ATOM 1063 CG2 VAL A 67 116.389 -8.580 -0.255 1.00 0.00 C ATOM 0 H VAL A 67 119.019 -7.322 -1.504 1.00 0.00 H new ATOM 0 HA VAL A 67 117.689 -6.209 0.877 1.00 0.00 H new ATOM 0 HB VAL A 67 118.232 -9.172 0.695 1.00 0.00 H new ATOM 0 HG11 VAL A 67 116.431 -9.207 2.396 1.00 0.00 H new ATOM 0 HG12 VAL A 67 117.744 -8.106 2.877 1.00 0.00 H new ATOM 0 HG13 VAL A 67 116.227 -7.449 2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 67 115.880 -9.515 -0.021 1.00 0.00 H new ATOM 0 HG22 VAL A 67 115.678 -7.756 -0.199 1.00 0.00 H new ATOM 0 HG23 VAL A 67 116.803 -8.635 -1.262 1.00 0.00 H new ATOM 1073 N SER A 68 119.842 -7.792 2.068 1.00 0.00 N ATOM 1074 CA SER A 68 121.164 -7.894 2.679 1.00 0.00 C ATOM 1075 C SER A 68 121.651 -6.520 3.130 1.00 0.00 C ATOM 1076 O SER A 68 121.293 -5.505 2.537 1.00 0.00 O ATOM 1077 CB SER A 68 122.159 -8.488 1.682 1.00 0.00 C ATOM 1078 OG SER A 68 123.476 -8.356 2.200 1.00 0.00 O ATOM 0 H SER A 68 119.108 -8.312 2.549 1.00 0.00 H new ATOM 0 HA SER A 68 121.092 -8.547 3.549 1.00 0.00 H new ATOM 0 HB2 SER A 68 121.929 -9.538 1.503 1.00 0.00 H new ATOM 0 HB3 SER A 68 122.080 -7.977 0.723 1.00 0.00 H new ATOM 0 HG SER A 68 123.820 -9.239 2.449 1.00 0.00 H new ATOM 1084 N SER A 69 122.459 -6.502 4.185 1.00 0.00 N ATOM 1085 CA SER A 69 122.990 -5.251 4.720 1.00 0.00 C ATOM 1086 C SER A 69 123.308 -4.260 3.601 1.00 0.00 C ATOM 1087 O SER A 69 124.473 -3.998 3.301 1.00 0.00 O ATOM 1088 CB SER A 69 124.257 -5.528 5.529 1.00 0.00 C ATOM 1089 OG SER A 69 125.002 -4.325 5.663 1.00 0.00 O ATOM 0 H SER A 69 122.761 -7.337 4.687 1.00 0.00 H new ATOM 0 HA SER A 69 122.228 -4.811 5.364 1.00 0.00 H new ATOM 0 HB2 SER A 69 123.996 -5.919 6.512 1.00 0.00 H new ATOM 0 HB3 SER A 69 124.860 -6.289 5.033 1.00 0.00 H new ATOM 0 HG SER A 69 125.358 -4.062 4.789 1.00 0.00 H new ATOM 1095 N ASP A 70 122.262 -3.707 2.998 1.00 0.00 N ATOM 1096 CA ASP A 70 122.427 -2.735 1.922 1.00 0.00 C ATOM 1097 C ASP A 70 121.902 -1.381 2.369 1.00 0.00 C ATOM 1098 O ASP A 70 121.744 -0.466 1.562 1.00 0.00 O ATOM 1099 CB ASP A 70 121.670 -3.181 0.675 1.00 0.00 C ATOM 1100 CG ASP A 70 122.371 -4.372 0.031 1.00 0.00 C ATOM 1101 OD1 ASP A 70 122.442 -5.408 0.671 1.00 0.00 O ATOM 1102 OD2 ASP A 70 122.826 -4.230 -1.091 1.00 0.00 O ATOM 0 H ASP A 70 121.292 -3.914 3.235 1.00 0.00 H new ATOM 0 HA ASP A 70 123.488 -2.660 1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.647 -3.451 0.939 1.00 0.00 H new ATOM 0 HB3 ASP A 70 121.609 -2.357 -0.036 1.00 0.00 H new ATOM 1107 N ARG A 71 121.613 -1.280 3.660 1.00 0.00 N ATOM 1108 CA ARG A 71 121.081 -0.049 4.238 1.00 0.00 C ATOM 1109 C ARG A 71 121.640 1.187 3.542 1.00 0.00 C ATOM 1110 O ARG A 71 121.204 2.306 3.816 1.00 0.00 O ATOM 1111 CB ARG A 71 121.419 0.010 5.728 1.00 0.00 C ATOM 1112 CG ARG A 71 121.278 -1.383 6.342 1.00 0.00 C ATOM 1113 CD ARG A 71 120.673 -1.266 7.743 1.00 0.00 C ATOM 1114 NE ARG A 71 120.863 -2.509 8.481 1.00 0.00 N ATOM 1115 CZ ARG A 71 120.823 -2.533 9.809 1.00 0.00 C ATOM 1116 NH1 ARG A 71 120.611 -1.431 10.474 1.00 0.00 N ATOM 1117 NH2 ARG A 71 120.995 -3.657 10.447 1.00 0.00 N ATOM 0 H ARG A 71 121.738 -2.038 4.331 1.00 0.00 H new ATOM 0 HA ARG A 71 120.000 -0.056 4.099 1.00 0.00 H new ATOM 0 HB2 ARG A 71 122.436 0.378 5.866 1.00 0.00 H new ATOM 0 HB3 ARG A 71 120.755 0.710 6.234 1.00 0.00 H new ATOM 0 HG2 ARG A 71 120.644 -2.007 5.712 1.00 0.00 H new ATOM 0 HG3 ARG A 71 122.252 -1.869 6.395 1.00 0.00 H new ATOM 0 HD2 ARG A 71 121.140 -0.441 8.281 1.00 0.00 H new ATOM 0 HD3 ARG A 71 119.610 -1.037 7.670 1.00 0.00 H new ATOM 0 HE ARG A 71 121.030 -3.375 7.969 1.00 0.00 H new ATOM 0 HH11 ARG A 71 120.476 -0.552 9.975 1.00 0.00 H new ATOM 0 HH12 ARG A 71 120.580 -1.448 11.493 1.00 0.00 H new ATOM 0 HH21 ARG A 71 121.160 -4.519 9.927 1.00 0.00 H new ATOM 0 HH22 ARG A 71 120.964 -3.675 11.466 1.00 0.00 H new ATOM 1131 N SER A 72 122.592 0.994 2.635 1.00 0.00 N ATOM 1132 CA SER A 72 123.165 2.121 1.920 1.00 0.00 C ATOM 1133 C SER A 72 122.247 2.523 0.773 1.00 0.00 C ATOM 1134 O SER A 72 122.097 1.783 -0.199 1.00 0.00 O ATOM 1135 CB SER A 72 124.543 1.749 1.373 1.00 0.00 C ATOM 1136 OG SER A 72 124.616 0.341 1.202 1.00 0.00 O ATOM 0 H SER A 72 122.976 0.083 2.383 1.00 0.00 H new ATOM 0 HA SER A 72 123.271 2.960 2.607 1.00 0.00 H new ATOM 0 HB2 SER A 72 124.717 2.252 0.422 1.00 0.00 H new ATOM 0 HB3 SER A 72 125.322 2.084 2.058 1.00 0.00 H new ATOM 0 HG SER A 72 125.544 0.045 1.314 1.00 0.00 H new ATOM 1142 N GLU A 73 121.636 3.696 0.890 1.00 0.00 N ATOM 1143 CA GLU A 73 120.736 4.175 -0.149 1.00 0.00 C ATOM 1144 C GLU A 73 121.519 4.485 -1.414 1.00 0.00 C ATOM 1145 O GLU A 73 121.001 4.366 -2.524 1.00 0.00 O ATOM 1146 CB GLU A 73 120.002 5.431 0.326 1.00 0.00 C ATOM 1147 CG GLU A 73 120.897 6.210 1.292 1.00 0.00 C ATOM 1148 CD GLU A 73 120.281 7.574 1.587 1.00 0.00 C ATOM 1149 OE1 GLU A 73 120.337 8.428 0.718 1.00 0.00 O ATOM 1150 OE2 GLU A 73 119.761 7.744 2.678 1.00 0.00 O ATOM 0 H GLU A 73 121.746 4.326 1.685 1.00 0.00 H new ATOM 0 HA GLU A 73 120.004 3.396 -0.364 1.00 0.00 H new ATOM 0 HB2 GLU A 73 119.739 6.056 -0.527 1.00 0.00 H new ATOM 0 HB3 GLU A 73 119.070 5.156 0.819 1.00 0.00 H new ATOM 0 HG2 GLU A 73 121.021 5.649 2.219 1.00 0.00 H new ATOM 0 HG3 GLU A 73 121.890 6.336 0.860 1.00 0.00 H new ATOM 1157 N ASP A 74 122.775 4.869 -1.236 1.00 0.00 N ATOM 1158 CA ASP A 74 123.625 5.180 -2.373 1.00 0.00 C ATOM 1159 C ASP A 74 124.077 3.894 -3.044 1.00 0.00 C ATOM 1160 O ASP A 74 123.993 3.760 -4.264 1.00 0.00 O ATOM 1161 CB ASP A 74 124.843 5.987 -1.918 1.00 0.00 C ATOM 1162 CG ASP A 74 124.467 7.457 -1.766 1.00 0.00 C ATOM 1163 OD1 ASP A 74 123.827 7.785 -0.781 1.00 0.00 O ATOM 1164 OD2 ASP A 74 124.825 8.233 -2.636 1.00 0.00 O ATOM 0 H ASP A 74 123.223 4.972 -0.325 1.00 0.00 H new ATOM 0 HA ASP A 74 123.056 5.776 -3.087 1.00 0.00 H new ATOM 0 HB2 ASP A 74 125.214 5.598 -0.970 1.00 0.00 H new ATOM 0 HB3 ASP A 74 125.650 5.883 -2.643 1.00 0.00 H new ATOM 1169 N ASP A 75 124.549 2.943 -2.244 1.00 0.00 N ATOM 1170 CA ASP A 75 124.997 1.672 -2.786 1.00 0.00 C ATOM 1171 C ASP A 75 123.862 1.006 -3.551 1.00 0.00 C ATOM 1172 O ASP A 75 124.091 0.291 -4.526 1.00 0.00 O ATOM 1173 CB ASP A 75 125.463 0.754 -1.658 1.00 0.00 C ATOM 1174 CG ASP A 75 126.601 1.414 -0.886 1.00 0.00 C ATOM 1175 OD1 ASP A 75 127.370 2.131 -1.503 1.00 0.00 O ATOM 1176 OD2 ASP A 75 126.684 1.193 0.310 1.00 0.00 O ATOM 0 H ASP A 75 124.629 3.029 -1.231 1.00 0.00 H new ATOM 0 HA ASP A 75 125.831 1.854 -3.464 1.00 0.00 H new ATOM 0 HB2 ASP A 75 124.632 0.540 -0.985 1.00 0.00 H new ATOM 0 HB3 ASP A 75 125.795 -0.200 -2.068 1.00 0.00 H new ATOM 1181 N MET A 76 122.635 1.253 -3.105 1.00 0.00 N ATOM 1182 CA MET A 76 121.472 0.679 -3.760 1.00 0.00 C ATOM 1183 C MET A 76 121.299 1.286 -5.147 1.00 0.00 C ATOM 1184 O MET A 76 121.349 0.579 -6.154 1.00 0.00 O ATOM 1185 CB MET A 76 120.216 0.937 -2.927 1.00 0.00 C ATOM 1186 CG MET A 76 119.735 -0.379 -2.313 1.00 0.00 C ATOM 1187 SD MET A 76 118.187 -0.097 -1.420 1.00 0.00 S ATOM 1188 CE MET A 76 118.882 0.899 -0.080 1.00 0.00 C ATOM 0 H MET A 76 122.424 1.842 -2.299 1.00 0.00 H new ATOM 0 HA MET A 76 121.622 -0.396 -3.855 1.00 0.00 H new ATOM 0 HB2 MET A 76 120.430 1.661 -2.141 1.00 0.00 H new ATOM 0 HB3 MET A 76 119.433 1.367 -3.552 1.00 0.00 H new ATOM 0 HG2 MET A 76 119.586 -1.124 -3.094 1.00 0.00 H new ATOM 0 HG3 MET A 76 120.492 -0.775 -1.635 1.00 0.00 H new ATOM 0 HE1 MET A 76 118.806 0.350 0.859 1.00 0.00 H new ATOM 0 HE2 MET A 76 119.930 1.113 -0.291 1.00 0.00 H new ATOM 0 HE3 MET A 76 118.330 1.835 0.001 1.00 0.00 H new ATOM 1198 N PHE A 77 121.084 2.597 -5.191 1.00 0.00 N ATOM 1199 CA PHE A 77 120.893 3.283 -6.462 1.00 0.00 C ATOM 1200 C PHE A 77 122.174 3.266 -7.291 1.00 0.00 C ATOM 1201 O PHE A 77 122.134 3.458 -8.507 1.00 0.00 O ATOM 1202 CB PHE A 77 120.462 4.729 -6.208 1.00 0.00 C ATOM 1203 CG PHE A 77 119.645 4.792 -4.938 1.00 0.00 C ATOM 1204 CD1 PHE A 77 118.866 3.695 -4.548 1.00 0.00 C ATOM 1205 CD2 PHE A 77 119.665 5.949 -4.150 1.00 0.00 C ATOM 1206 CE1 PHE A 77 118.109 3.756 -3.372 1.00 0.00 C ATOM 1207 CE2 PHE A 77 118.909 6.010 -2.974 1.00 0.00 C ATOM 1208 CZ PHE A 77 118.130 4.914 -2.585 1.00 0.00 C ATOM 0 H PHE A 77 121.038 3.200 -4.369 1.00 0.00 H new ATOM 0 HA PHE A 77 120.116 2.761 -7.020 1.00 0.00 H new ATOM 0 HB2 PHE A 77 121.338 5.372 -6.122 1.00 0.00 H new ATOM 0 HB3 PHE A 77 119.876 5.099 -7.049 1.00 0.00 H new ATOM 0 HD1 PHE A 77 118.849 2.802 -5.155 1.00 0.00 H new ATOM 0 HD2 PHE A 77 120.265 6.796 -4.450 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.509 2.910 -3.072 1.00 0.00 H new ATOM 0 HE2 PHE A 77 118.927 6.903 -2.366 1.00 0.00 H new ATOM 0 HZ PHE A 77 117.545 4.962 -1.678 1.00 0.00 H new ATOM 1218 N GLN A 78 123.306 3.034 -6.635 1.00 0.00 N ATOM 1219 CA GLN A 78 124.582 2.994 -7.340 1.00 0.00 C ATOM 1220 C GLN A 78 124.749 1.664 -8.062 1.00 0.00 C ATOM 1221 O GLN A 78 124.964 1.627 -9.274 1.00 0.00 O ATOM 1222 CB GLN A 78 125.736 3.194 -6.357 1.00 0.00 C ATOM 1223 CG GLN A 78 125.938 4.689 -6.104 1.00 0.00 C ATOM 1224 CD GLN A 78 127.112 4.903 -5.153 1.00 0.00 C ATOM 1225 OE1 GLN A 78 126.979 4.705 -3.946 1.00 0.00 O ATOM 1226 NE2 GLN A 78 128.261 5.298 -5.630 1.00 0.00 N ATOM 0 H GLN A 78 123.367 2.873 -5.630 1.00 0.00 H new ATOM 0 HA GLN A 78 124.594 3.799 -8.074 1.00 0.00 H new ATOM 0 HB2 GLN A 78 125.522 2.681 -5.419 1.00 0.00 H new ATOM 0 HB3 GLN A 78 126.650 2.756 -6.758 1.00 0.00 H new ATOM 0 HG2 GLN A 78 126.124 5.204 -7.047 1.00 0.00 H new ATOM 0 HG3 GLN A 78 125.032 5.120 -5.679 1.00 0.00 H new ATOM 0 HE21 GLN A 78 128.369 5.461 -6.631 1.00 0.00 H new ATOM 0 HE22 GLN A 78 129.051 5.443 -5.002 1.00 0.00 H new ATOM 1235 N TYR A 79 124.642 0.576 -7.312 1.00 0.00 N ATOM 1236 CA TYR A 79 124.775 -0.752 -7.896 1.00 0.00 C ATOM 1237 C TYR A 79 123.622 -1.016 -8.855 1.00 0.00 C ATOM 1238 O TYR A 79 123.708 -1.879 -9.729 1.00 0.00 O ATOM 1239 CB TYR A 79 124.785 -1.814 -6.795 1.00 0.00 C ATOM 1240 CG TYR A 79 126.208 -2.248 -6.533 1.00 0.00 C ATOM 1241 CD1 TYR A 79 127.143 -1.326 -6.048 1.00 0.00 C ATOM 1242 CD2 TYR A 79 126.592 -3.572 -6.776 1.00 0.00 C ATOM 1243 CE1 TYR A 79 128.462 -1.727 -5.807 1.00 0.00 C ATOM 1244 CE2 TYR A 79 127.912 -3.973 -6.534 1.00 0.00 C ATOM 1245 CZ TYR A 79 128.847 -3.051 -6.051 1.00 0.00 C ATOM 1246 OH TYR A 79 130.147 -3.446 -5.812 1.00 0.00 O ATOM 0 H TYR A 79 124.465 0.585 -6.307 1.00 0.00 H new ATOM 0 HA TYR A 79 125.716 -0.801 -8.444 1.00 0.00 H new ATOM 0 HB2 TYR A 79 124.341 -1.414 -5.884 1.00 0.00 H new ATOM 0 HB3 TYR A 79 124.181 -2.670 -7.094 1.00 0.00 H new ATOM 0 HD1 TYR A 79 126.846 -0.305 -5.860 1.00 0.00 H new ATOM 0 HD2 TYR A 79 125.871 -4.284 -7.150 1.00 0.00 H new ATOM 0 HE1 TYR A 79 129.183 -1.015 -5.433 1.00 0.00 H new ATOM 0 HE2 TYR A 79 128.208 -4.995 -6.720 1.00 0.00 H new ATOM 0 HH TYR A 79 130.246 -4.396 -6.032 1.00 0.00 H new ATOM 1256 N MET A 80 122.544 -0.254 -8.689 1.00 0.00 N ATOM 1257 CA MET A 80 121.377 -0.401 -9.548 1.00 0.00 C ATOM 1258 C MET A 80 121.594 0.344 -10.859 1.00 0.00 C ATOM 1259 O MET A 80 121.394 -0.210 -11.941 1.00 0.00 O ATOM 1260 CB MET A 80 120.135 0.148 -8.843 1.00 0.00 C ATOM 1261 CG MET A 80 119.750 -0.779 -7.690 1.00 0.00 C ATOM 1262 SD MET A 80 118.857 0.164 -6.429 1.00 0.00 S ATOM 1263 CE MET A 80 117.184 -0.285 -6.953 1.00 0.00 C ATOM 0 H MET A 80 122.456 0.466 -7.972 1.00 0.00 H new ATOM 0 HA MET A 80 121.230 -1.460 -9.760 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.332 1.152 -8.466 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.309 0.229 -9.550 1.00 0.00 H new ATOM 0 HG2 MET A 80 119.128 -1.595 -8.058 1.00 0.00 H new ATOM 0 HG3 MET A 80 120.643 -1.229 -7.258 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.457 0.196 -6.299 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.024 0.045 -7.980 1.00 0.00 H new ATOM 0 HE3 MET A 80 117.063 -1.367 -6.896 1.00 0.00 H new ATOM 1273 N MET A 81 122.004 1.605 -10.757 1.00 0.00 N ATOM 1274 CA MET A 81 122.244 2.418 -11.942 1.00 0.00 C ATOM 1275 C MET A 81 123.439 1.884 -12.726 1.00 0.00 C ATOM 1276 O MET A 81 123.532 2.078 -13.939 1.00 0.00 O ATOM 1277 CB MET A 81 122.506 3.870 -11.538 1.00 0.00 C ATOM 1278 CG MET A 81 121.204 4.667 -11.625 1.00 0.00 C ATOM 1279 SD MET A 81 121.012 5.327 -13.300 1.00 0.00 S ATOM 1280 CE MET A 81 119.234 5.650 -13.215 1.00 0.00 C ATOM 0 H MET A 81 122.176 2.082 -9.872 1.00 0.00 H new ATOM 0 HA MET A 81 121.358 2.372 -12.575 1.00 0.00 H new ATOM 0 HB2 MET A 81 122.902 3.910 -10.523 1.00 0.00 H new ATOM 0 HB3 MET A 81 123.259 4.310 -12.192 1.00 0.00 H new ATOM 0 HG2 MET A 81 120.357 4.029 -11.375 1.00 0.00 H new ATOM 0 HG3 MET A 81 121.214 5.481 -10.901 1.00 0.00 H new ATOM 0 HE1 MET A 81 118.937 6.273 -14.058 1.00 0.00 H new ATOM 0 HE2 MET A 81 118.691 4.706 -13.252 1.00 0.00 H new ATOM 0 HE3 MET A 81 119.002 6.166 -12.283 1.00 0.00 H new ATOM 1290 N GLU A 82 124.351 1.214 -12.030 1.00 0.00 N ATOM 1291 CA GLU A 82 125.535 0.660 -12.677 1.00 0.00 C ATOM 1292 C GLU A 82 125.146 -0.421 -13.677 1.00 0.00 C ATOM 1293 O GLU A 82 125.470 -0.332 -14.860 1.00 0.00 O ATOM 1294 CB GLU A 82 126.478 0.070 -11.625 1.00 0.00 C ATOM 1295 CG GLU A 82 127.332 1.186 -11.022 1.00 0.00 C ATOM 1296 CD GLU A 82 128.728 1.162 -11.633 1.00 0.00 C ATOM 1297 OE1 GLU A 82 128.848 0.741 -12.772 1.00 0.00 O ATOM 1298 OE2 GLU A 82 129.658 1.565 -10.954 1.00 0.00 O ATOM 0 H GLU A 82 124.295 1.042 -11.026 1.00 0.00 H new ATOM 0 HA GLU A 82 126.042 1.464 -13.210 1.00 0.00 H new ATOM 0 HB2 GLU A 82 125.903 -0.425 -10.843 1.00 0.00 H new ATOM 0 HB3 GLU A 82 127.118 -0.687 -12.078 1.00 0.00 H new ATOM 0 HG2 GLU A 82 126.863 2.153 -11.204 1.00 0.00 H new ATOM 0 HG3 GLU A 82 127.397 1.062 -9.941 1.00 0.00 H new ATOM 1305 N SER A 83 124.449 -1.441 -13.192 1.00 0.00 N ATOM 1306 CA SER A 83 124.022 -2.536 -14.062 1.00 0.00 C ATOM 1307 C SER A 83 123.524 -3.753 -13.272 1.00 0.00 C ATOM 1308 O SER A 83 123.206 -4.783 -13.862 1.00 0.00 O ATOM 1309 CB SER A 83 125.184 -2.959 -14.960 1.00 0.00 C ATOM 1310 OG SER A 83 125.200 -2.143 -16.124 1.00 0.00 O ATOM 0 H SER A 83 124.169 -1.536 -12.216 1.00 0.00 H new ATOM 0 HA SER A 83 123.188 -2.168 -14.660 1.00 0.00 H new ATOM 0 HB2 SER A 83 126.127 -2.864 -14.422 1.00 0.00 H new ATOM 0 HB3 SER A 83 125.080 -4.008 -15.239 1.00 0.00 H new ATOM 0 HG SER A 83 125.548 -1.255 -15.897 1.00 0.00 H new ATOM 1316 N HIS A 84 123.463 -3.649 -11.946 1.00 0.00 N ATOM 1317 CA HIS A 84 123.007 -4.767 -11.131 1.00 0.00 C ATOM 1318 C HIS A 84 121.570 -4.548 -10.661 1.00 0.00 C ATOM 1319 O HIS A 84 121.313 -3.727 -9.781 1.00 0.00 O ATOM 1320 CB HIS A 84 123.926 -4.933 -9.921 1.00 0.00 C ATOM 1321 CG HIS A 84 125.342 -4.637 -10.332 1.00 0.00 C ATOM 1322 ND1 HIS A 84 126.046 -3.553 -9.832 1.00 0.00 N ATOM 1323 CD2 HIS A 84 126.197 -5.271 -11.200 1.00 0.00 C ATOM 1324 CE1 HIS A 84 127.266 -3.565 -10.399 1.00 0.00 C ATOM 1325 NE2 HIS A 84 127.411 -4.591 -11.242 1.00 0.00 N ATOM 0 H HIS A 84 123.720 -2.813 -11.421 1.00 0.00 H new ATOM 0 HA HIS A 84 123.037 -5.671 -11.739 1.00 0.00 H new ATOM 0 HB2 HIS A 84 123.619 -4.260 -9.121 1.00 0.00 H new ATOM 0 HB3 HIS A 84 123.853 -5.948 -9.530 1.00 0.00 H new ATOM 0 HD1 HIS A 84 125.702 -2.870 -9.157 1.00 0.00 H new ATOM 0 HD2 HIS A 84 125.963 -6.162 -11.764 1.00 0.00 H new ATOM 0 HE1 HIS A 84 128.035 -2.834 -10.197 1.00 0.00 H new ATOM 1334 N GLY A 85 120.639 -5.293 -11.252 1.00 0.00 N ATOM 1335 CA GLY A 85 119.230 -5.179 -10.882 1.00 0.00 C ATOM 1336 C GLY A 85 118.586 -3.958 -11.532 1.00 0.00 C ATOM 1337 O GLY A 85 118.996 -2.825 -11.281 1.00 0.00 O ATOM 0 H GLY A 85 120.832 -5.977 -11.984 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.697 -6.080 -11.187 1.00 0.00 H new ATOM 0 HA3 GLY A 85 119.141 -5.107 -9.798 1.00 0.00 H new ATOM 1341 N ASP A 86 117.576 -4.191 -12.368 1.00 0.00 N ATOM 1342 CA ASP A 86 116.895 -3.089 -13.039 1.00 0.00 C ATOM 1343 C ASP A 86 115.400 -3.082 -12.718 1.00 0.00 C ATOM 1344 O ASP A 86 114.568 -3.198 -13.618 1.00 0.00 O ATOM 1345 CB ASP A 86 117.086 -3.198 -14.554 1.00 0.00 C ATOM 1346 CG ASP A 86 118.224 -2.286 -15.003 1.00 0.00 C ATOM 1347 OD1 ASP A 86 118.330 -1.196 -14.464 1.00 0.00 O ATOM 1348 OD2 ASP A 86 118.971 -2.690 -15.878 1.00 0.00 O ATOM 0 H ASP A 86 117.216 -5.118 -12.594 1.00 0.00 H new ATOM 0 HA ASP A 86 117.332 -2.158 -12.677 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.306 -4.230 -14.828 1.00 0.00 H new ATOM 0 HB3 ASP A 86 116.164 -2.922 -15.066 1.00 0.00 H new ATOM 1353 N TRP A 87 115.061 -2.935 -11.440 1.00 0.00 N ATOM 1354 CA TRP A 87 113.654 -2.905 -11.046 1.00 0.00 C ATOM 1355 C TRP A 87 113.458 -2.189 -9.713 1.00 0.00 C ATOM 1356 O TRP A 87 113.499 -0.959 -9.652 1.00 0.00 O ATOM 1357 CB TRP A 87 113.099 -4.328 -10.966 1.00 0.00 C ATOM 1358 CG TRP A 87 113.300 -4.987 -12.289 1.00 0.00 C ATOM 1359 CD1 TRP A 87 112.448 -4.912 -13.336 1.00 0.00 C ATOM 1360 CD2 TRP A 87 114.418 -5.800 -12.727 1.00 0.00 C ATOM 1361 NE1 TRP A 87 112.979 -5.630 -14.394 1.00 0.00 N ATOM 1362 CE2 TRP A 87 114.196 -6.195 -14.065 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.596 -6.228 -12.096 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 115.113 -6.987 -14.753 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 116.521 -7.023 -12.783 1.00 0.00 C ATOM 1366 CH2 TRP A 87 116.283 -7.400 -14.109 1.00 0.00 C ATOM 0 H TRP A 87 115.726 -2.837 -10.673 1.00 0.00 H new ATOM 0 HA TRP A 87 113.108 -2.347 -11.806 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.607 -4.889 -10.182 1.00 0.00 H new ATOM 0 HB3 TRP A 87 112.040 -4.308 -10.709 1.00 0.00 H new ATOM 0 HD1 TRP A 87 111.508 -4.380 -13.346 1.00 0.00 H new ATOM 0 HE1 TRP A 87 112.528 -5.729 -15.303 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.790 -5.942 -11.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 114.922 -7.279 -15.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 117.424 -7.347 -12.286 1.00 0.00 H new ATOM 0 HH2 TRP A 87 117.003 -8.010 -14.635 1.00 0.00 H new ATOM 1377 N LEU A 88 113.210 -2.953 -8.655 1.00 0.00 N ATOM 1378 CA LEU A 88 112.972 -2.354 -7.346 1.00 0.00 C ATOM 1379 C LEU A 88 113.870 -2.940 -6.262 1.00 0.00 C ATOM 1380 O LEU A 88 114.641 -3.871 -6.495 1.00 0.00 O ATOM 1381 CB LEU A 88 111.509 -2.551 -6.956 1.00 0.00 C ATOM 1382 CG LEU A 88 110.622 -1.782 -7.937 1.00 0.00 C ATOM 1383 CD1 LEU A 88 109.543 -2.713 -8.490 1.00 0.00 C ATOM 1384 CD2 LEU A 88 109.959 -0.606 -7.216 1.00 0.00 C ATOM 0 H LEU A 88 113.169 -3.972 -8.675 1.00 0.00 H new ATOM 0 HA LEU A 88 113.209 -1.293 -7.426 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.255 -3.611 -6.971 1.00 0.00 H new ATOM 0 HB3 LEU A 88 111.340 -2.197 -5.939 1.00 0.00 H new ATOM 0 HG LEU A 88 111.233 -1.407 -8.758 1.00 0.00 H new ATOM 0 HD11 LEU A 88 108.912 -2.164 -9.189 1.00 0.00 H new ATOM 0 HD12 LEU A 88 110.014 -3.549 -9.007 1.00 0.00 H new ATOM 0 HD13 LEU A 88 108.933 -3.091 -7.670 1.00 0.00 H new ATOM 0 HD21 LEU A 88 109.327 -0.059 -7.916 1.00 0.00 H new ATOM 0 HD22 LEU A 88 109.349 -0.980 -6.394 1.00 0.00 H new ATOM 0 HD23 LEU A 88 110.727 0.060 -6.824 1.00 0.00 H new ATOM 1396 N ALA A 89 113.744 -2.364 -5.072 1.00 0.00 N ATOM 1397 CA ALA A 89 114.523 -2.795 -3.919 1.00 0.00 C ATOM 1398 C ALA A 89 113.710 -2.640 -2.639 1.00 0.00 C ATOM 1399 O ALA A 89 113.181 -1.565 -2.358 1.00 0.00 O ATOM 1400 CB ALA A 89 115.804 -1.964 -3.814 1.00 0.00 C ATOM 0 H ALA A 89 113.105 -1.592 -4.881 1.00 0.00 H new ATOM 0 HA ALA A 89 114.781 -3.846 -4.050 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.381 -2.292 -2.949 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.398 -2.096 -4.718 1.00 0.00 H new ATOM 0 HB3 ALA A 89 115.546 -0.911 -3.700 1.00 0.00 H new ATOM 1406 N ILE A 90 113.616 -3.715 -1.864 1.00 0.00 N ATOM 1407 CA ILE A 90 112.865 -3.672 -0.615 1.00 0.00 C ATOM 1408 C ILE A 90 113.631 -2.883 0.432 1.00 0.00 C ATOM 1409 O ILE A 90 114.714 -3.289 0.853 1.00 0.00 O ATOM 1410 CB ILE A 90 112.630 -5.077 -0.078 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.573 -6.074 -1.242 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.312 -5.104 0.702 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.490 -7.124 -0.973 1.00 0.00 C ATOM 0 H ILE A 90 114.045 -4.616 -2.075 1.00 0.00 H new ATOM 0 HA ILE A 90 111.908 -3.193 -0.820 1.00 0.00 H new ATOM 0 HB ILE A 90 113.448 -5.358 0.585 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.360 -5.549 -2.173 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.541 -6.560 -1.365 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.139 -6.108 1.089 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.366 -4.400 1.532 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.492 -4.823 0.041 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.453 -7.830 -1.803 1.00 0.00 H new ATOM 0 HD12 ILE A 90 111.722 -7.658 -0.052 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.523 -6.632 -0.873 1.00 0.00 H new ATOM 1425 N PRO A 91 113.095 -1.783 0.869 1.00 0.00 N ATOM 1426 CA PRO A 91 113.756 -0.950 1.898 1.00 0.00 C ATOM 1427 C PRO A 91 114.234 -1.798 3.074 1.00 0.00 C ATOM 1428 O PRO A 91 113.425 -2.303 3.852 1.00 0.00 O ATOM 1429 CB PRO A 91 112.671 0.037 2.332 1.00 0.00 C ATOM 1430 CG PRO A 91 111.716 0.116 1.187 1.00 0.00 C ATOM 1431 CD PRO A 91 111.813 -1.211 0.431 1.00 0.00 C ATOM 0 HA PRO A 91 114.647 -0.450 1.519 1.00 0.00 H new ATOM 0 HB2 PRO A 91 112.170 -0.305 3.237 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.098 1.015 2.554 1.00 0.00 H new ATOM 0 HG2 PRO A 91 110.700 0.283 1.543 1.00 0.00 H new ATOM 0 HG3 PRO A 91 111.966 0.951 0.533 1.00 0.00 H new ATOM 0 HD2 PRO A 91 110.979 -1.870 0.674 1.00 0.00 H new ATOM 0 HD3 PRO A 91 111.793 -1.057 -0.648 1.00 0.00 H new ATOM 1439 N TYR A 92 115.547 -1.962 3.187 1.00 0.00 N ATOM 1440 CA TYR A 92 116.121 -2.761 4.266 1.00 0.00 C ATOM 1441 C TYR A 92 115.236 -2.699 5.505 1.00 0.00 C ATOM 1442 O TYR A 92 115.242 -3.610 6.331 1.00 0.00 O ATOM 1443 CB TYR A 92 117.526 -2.258 4.608 1.00 0.00 C ATOM 1444 CG TYR A 92 117.559 -0.750 4.535 1.00 0.00 C ATOM 1445 CD1 TYR A 92 117.567 -0.108 3.290 1.00 0.00 C ATOM 1446 CD2 TYR A 92 117.582 0.007 5.713 1.00 0.00 C ATOM 1447 CE1 TYR A 92 117.599 1.290 3.224 1.00 0.00 C ATOM 1448 CE2 TYR A 92 117.614 1.405 5.646 1.00 0.00 C ATOM 1449 CZ TYR A 92 117.623 2.046 4.402 1.00 0.00 C ATOM 1450 OH TYR A 92 117.654 3.425 4.336 1.00 0.00 O ATOM 0 H TYR A 92 116.232 -1.556 2.549 1.00 0.00 H new ATOM 0 HA TYR A 92 116.184 -3.796 3.930 1.00 0.00 H new ATOM 0 HB2 TYR A 92 117.808 -2.589 5.607 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.253 -2.681 3.915 1.00 0.00 H new ATOM 0 HD1 TYR A 92 117.548 -0.691 2.381 1.00 0.00 H new ATOM 0 HD2 TYR A 92 117.575 -0.488 6.673 1.00 0.00 H new ATOM 0 HE1 TYR A 92 117.605 1.785 2.264 1.00 0.00 H new ATOM 0 HE2 TYR A 92 117.632 1.989 6.554 1.00 0.00 H new ATOM 0 HH TYR A 92 117.666 3.796 5.243 1.00 0.00 H new ATOM 1460 N ARG A 93 114.473 -1.619 5.621 1.00 0.00 N ATOM 1461 CA ARG A 93 113.578 -1.447 6.760 1.00 0.00 C ATOM 1462 C ARG A 93 112.225 -2.087 6.472 1.00 0.00 C ATOM 1463 O ARG A 93 111.213 -1.734 7.078 1.00 0.00 O ATOM 1464 CB ARG A 93 113.392 0.040 7.066 1.00 0.00 C ATOM 1465 CG ARG A 93 114.050 0.373 8.408 1.00 0.00 C ATOM 1466 CD ARG A 93 113.599 1.761 8.867 1.00 0.00 C ATOM 1467 NE ARG A 93 112.245 1.699 9.404 1.00 0.00 N ATOM 1468 CZ ARG A 93 111.410 2.725 9.281 1.00 0.00 C ATOM 1469 NH1 ARG A 93 111.797 3.813 8.671 1.00 0.00 N ATOM 1470 NH2 ARG A 93 110.202 2.647 9.770 1.00 0.00 N ATOM 0 H ARG A 93 114.455 -0.854 4.946 1.00 0.00 H new ATOM 0 HA ARG A 93 114.023 -1.936 7.626 1.00 0.00 H new ATOM 0 HB2 ARG A 93 113.834 0.643 6.273 1.00 0.00 H new ATOM 0 HB3 ARG A 93 112.330 0.285 7.099 1.00 0.00 H new ATOM 0 HG2 ARG A 93 113.778 -0.374 9.154 1.00 0.00 H new ATOM 0 HG3 ARG A 93 115.135 0.346 8.310 1.00 0.00 H new ATOM 0 HD2 ARG A 93 114.282 2.140 9.627 1.00 0.00 H new ATOM 0 HD3 ARG A 93 113.634 2.458 8.030 1.00 0.00 H new ATOM 0 HE ARG A 93 111.934 0.854 9.882 1.00 0.00 H new ATOM 0 HH11 ARG A 93 112.741 3.875 8.289 1.00 0.00 H new ATOM 0 HH12 ARG A 93 111.156 4.600 8.577 1.00 0.00 H new ATOM 0 HH21 ARG A 93 109.899 1.798 10.247 1.00 0.00 H new ATOM 0 HH22 ARG A 93 109.562 3.435 9.675 1.00 0.00 H new ATOM 1484 N SER A 94 112.223 -3.024 5.536 1.00 0.00 N ATOM 1485 CA SER A 94 111.001 -3.717 5.152 1.00 0.00 C ATOM 1486 C SER A 94 110.944 -5.104 5.783 1.00 0.00 C ATOM 1487 O SER A 94 110.940 -6.113 5.080 1.00 0.00 O ATOM 1488 CB SER A 94 110.935 -3.844 3.632 1.00 0.00 C ATOM 1489 OG SER A 94 110.166 -2.771 3.104 1.00 0.00 O ATOM 0 H SER A 94 113.055 -3.323 5.027 1.00 0.00 H new ATOM 0 HA SER A 94 110.150 -3.137 5.509 1.00 0.00 H new ATOM 0 HB2 SER A 94 111.940 -3.828 3.210 1.00 0.00 H new ATOM 0 HB3 SER A 94 110.488 -4.798 3.354 1.00 0.00 H new ATOM 0 HG SER A 94 110.730 -1.974 3.023 1.00 0.00 H new ATOM 1495 N GLY A 95 110.899 -5.143 7.112 1.00 0.00 N ATOM 1496 CA GLY A 95 110.842 -6.409 7.841 1.00 0.00 C ATOM 1497 C GLY A 95 110.636 -7.595 6.900 1.00 0.00 C ATOM 1498 O GLY A 95 111.496 -8.470 6.798 1.00 0.00 O ATOM 0 H GLY A 95 110.901 -4.314 7.706 1.00 0.00 H new ATOM 0 HA2 GLY A 95 111.766 -6.547 8.403 1.00 0.00 H new ATOM 0 HA3 GLY A 95 110.029 -6.375 8.566 1.00 0.00 H new ATOM 1502 N PRO A 96 109.523 -7.642 6.214 1.00 0.00 N ATOM 1503 CA PRO A 96 109.208 -8.744 5.264 1.00 0.00 C ATOM 1504 C PRO A 96 110.434 -9.210 4.481 1.00 0.00 C ATOM 1505 O PRO A 96 110.512 -10.367 4.067 1.00 0.00 O ATOM 1506 CB PRO A 96 108.167 -8.116 4.340 1.00 0.00 C ATOM 1507 CG PRO A 96 107.454 -7.104 5.180 1.00 0.00 C ATOM 1508 CD PRO A 96 108.431 -6.653 6.273 1.00 0.00 C ATOM 0 HA PRO A 96 108.855 -9.641 5.772 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.639 -7.648 3.476 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.476 -8.867 3.958 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.137 -6.256 4.574 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.555 -7.535 5.621 1.00 0.00 H new ATOM 0 HD2 PRO A 96 108.798 -5.644 6.087 1.00 0.00 H new ATOM 0 HD3 PRO A 96 107.955 -6.644 7.253 1.00 0.00 H new ATOM 1516 N ALA A 97 111.394 -8.311 4.293 1.00 0.00 N ATOM 1517 CA ALA A 97 112.615 -8.651 3.575 1.00 0.00 C ATOM 1518 C ALA A 97 113.524 -9.492 4.461 1.00 0.00 C ATOM 1519 O ALA A 97 114.135 -10.462 4.007 1.00 0.00 O ATOM 1520 CB ALA A 97 113.345 -7.376 3.149 1.00 0.00 C ATOM 0 H ALA A 97 111.350 -7.348 4.626 1.00 0.00 H new ATOM 0 HA ALA A 97 112.352 -9.225 2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.257 -7.640 2.613 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.699 -6.787 2.498 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.600 -6.791 4.032 1.00 0.00 H new ATOM 1526 N SER A 98 113.594 -9.125 5.736 1.00 0.00 N ATOM 1527 CA SER A 98 114.418 -9.869 6.679 1.00 0.00 C ATOM 1528 C SER A 98 113.784 -11.229 6.931 1.00 0.00 C ATOM 1529 O SER A 98 114.354 -12.264 6.590 1.00 0.00 O ATOM 1530 CB SER A 98 114.539 -9.102 7.996 1.00 0.00 C ATOM 1531 OG SER A 98 113.626 -8.011 7.989 1.00 0.00 O ATOM 0 H SER A 98 113.098 -8.328 6.135 1.00 0.00 H new ATOM 0 HA SER A 98 115.416 -10.000 6.260 1.00 0.00 H new ATOM 0 HB2 SER A 98 114.327 -9.763 8.836 1.00 0.00 H new ATOM 0 HB3 SER A 98 115.558 -8.738 8.126 1.00 0.00 H new ATOM 0 HG SER A 98 112.708 -8.352 8.025 1.00 0.00 H new ATOM 1537 N ASN A 99 112.594 -11.214 7.516 1.00 0.00 N ATOM 1538 CA ASN A 99 111.882 -12.454 7.792 1.00 0.00 C ATOM 1539 C ASN A 99 111.942 -13.360 6.569 1.00 0.00 C ATOM 1540 O ASN A 99 111.981 -14.584 6.688 1.00 0.00 O ATOM 1541 CB ASN A 99 110.424 -12.157 8.145 1.00 0.00 C ATOM 1542 CG ASN A 99 110.353 -11.367 9.447 1.00 0.00 C ATOM 1543 OD1 ASN A 99 110.728 -10.195 9.485 1.00 0.00 O ATOM 1544 ND2 ASN A 99 109.891 -11.942 10.524 1.00 0.00 N ATOM 0 H ASN A 99 112.106 -10.367 7.806 1.00 0.00 H new ATOM 0 HA ASN A 99 112.354 -12.955 8.637 1.00 0.00 H new ATOM 0 HB2 ASN A 99 109.955 -11.591 7.341 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.868 -13.089 8.245 1.00 0.00 H new ATOM 0 HD21 ASN A 99 109.840 -11.420 11.399 1.00 0.00 H new ATOM 0 HD22 ASN A 99 109.581 -12.913 10.491 1.00 0.00 H new ATOM 1551 N VAL A 100 111.965 -12.740 5.393 1.00 0.00 N ATOM 1552 CA VAL A 100 112.036 -13.486 4.143 1.00 0.00 C ATOM 1553 C VAL A 100 113.329 -14.295 4.098 1.00 0.00 C ATOM 1554 O VAL A 100 113.310 -15.511 3.902 1.00 0.00 O ATOM 1555 CB VAL A 100 111.984 -12.515 2.961 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.771 -13.088 1.782 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.527 -12.298 2.544 1.00 0.00 C ATOM 0 H VAL A 100 111.936 -11.727 5.280 1.00 0.00 H new ATOM 0 HA VAL A 100 111.189 -14.169 4.081 1.00 0.00 H new ATOM 0 HB VAL A 100 112.426 -11.564 3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.730 -12.392 0.944 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.809 -13.240 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.336 -14.042 1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.489 -11.607 1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 100 110.087 -13.251 2.251 1.00 0.00 H new ATOM 0 HG23 VAL A 100 109.967 -11.882 3.381 1.00 0.00 H new ATOM 1567 N THR A 101 114.450 -13.609 4.297 1.00 0.00 N ATOM 1568 CA THR A 101 115.755 -14.265 4.296 1.00 0.00 C ATOM 1569 C THR A 101 115.846 -15.259 5.437 1.00 0.00 C ATOM 1570 O THR A 101 116.267 -16.403 5.264 1.00 0.00 O ATOM 1571 CB THR A 101 116.852 -13.225 4.498 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.559 -12.066 3.728 1.00 0.00 O ATOM 1573 CG2 THR A 101 118.197 -13.810 4.063 1.00 0.00 C ATOM 0 H THR A 101 114.482 -12.603 4.461 1.00 0.00 H new ATOM 0 HA THR A 101 115.878 -14.777 3.342 1.00 0.00 H new ATOM 0 HB THR A 101 116.903 -12.951 5.552 1.00 0.00 H new ATOM 0 HG1 THR A 101 117.264 -11.398 3.861 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.981 -13.067 4.207 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.420 -14.693 4.661 1.00 0.00 H new ATOM 0 HG23 THR A 101 118.150 -14.087 3.010 1.00 0.00 H new ATOM 1581 N ALA A 102 115.448 -14.793 6.606 1.00 0.00 N ATOM 1582 CA ALA A 102 115.477 -15.607 7.803 1.00 0.00 C ATOM 1583 C ALA A 102 114.421 -16.702 7.719 1.00 0.00 C ATOM 1584 O ALA A 102 114.516 -17.726 8.397 1.00 0.00 O ATOM 1585 CB ALA A 102 115.228 -14.713 9.014 1.00 0.00 C ATOM 0 H ALA A 102 115.098 -13.846 6.751 1.00 0.00 H new ATOM 0 HA ALA A 102 116.452 -16.085 7.901 1.00 0.00 H new ATOM 0 HB1 ALA A 102 115.248 -15.316 9.922 1.00 0.00 H new ATOM 0 HB2 ALA A 102 116.004 -13.950 9.069 1.00 0.00 H new ATOM 0 HB3 ALA A 102 114.254 -14.233 8.918 1.00 0.00 H new ATOM 1591 N LYS A 103 113.423 -16.482 6.870 1.00 0.00 N ATOM 1592 CA LYS A 103 112.361 -17.462 6.686 1.00 0.00 C ATOM 1593 C LYS A 103 112.875 -18.634 5.858 1.00 0.00 C ATOM 1594 O LYS A 103 112.486 -19.782 6.078 1.00 0.00 O ATOM 1595 CB LYS A 103 111.164 -16.817 5.982 1.00 0.00 C ATOM 1596 CG LYS A 103 110.286 -17.905 5.362 1.00 0.00 C ATOM 1597 CD LYS A 103 110.633 -18.063 3.880 1.00 0.00 C ATOM 1598 CE LYS A 103 109.571 -18.926 3.195 1.00 0.00 C ATOM 1599 NZ LYS A 103 110.081 -20.318 3.047 1.00 0.00 N ATOM 0 H LYS A 103 113.328 -15.640 6.302 1.00 0.00 H new ATOM 0 HA LYS A 103 112.044 -17.825 7.664 1.00 0.00 H new ATOM 0 HB2 LYS A 103 110.584 -16.229 6.694 1.00 0.00 H new ATOM 0 HB3 LYS A 103 111.510 -16.131 5.209 1.00 0.00 H new ATOM 0 HG2 LYS A 103 110.438 -18.850 5.884 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.234 -17.644 5.474 1.00 0.00 H new ATOM 0 HD2 LYS A 103 110.686 -17.085 3.402 1.00 0.00 H new ATOM 0 HD3 LYS A 103 111.615 -18.523 3.773 1.00 0.00 H new ATOM 0 HE2 LYS A 103 108.652 -18.924 3.782 1.00 0.00 H new ATOM 0 HE3 LYS A 103 109.326 -18.511 2.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 109.299 -20.947 2.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 110.818 -20.342 2.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 110.482 -20.639 3.951 1.00 0.00 H new ATOM 1613 N TYR A 104 113.757 -18.336 4.907 1.00 0.00 N ATOM 1614 CA TYR A 104 114.324 -19.375 4.053 1.00 0.00 C ATOM 1615 C TYR A 104 115.451 -20.102 4.779 1.00 0.00 C ATOM 1616 O TYR A 104 115.827 -21.214 4.408 1.00 0.00 O ATOM 1617 CB TYR A 104 114.862 -18.754 2.763 1.00 0.00 C ATOM 1618 CG TYR A 104 113.729 -18.569 1.782 1.00 0.00 C ATOM 1619 CD1 TYR A 104 113.088 -19.688 1.234 1.00 0.00 C ATOM 1620 CD2 TYR A 104 113.320 -17.281 1.419 1.00 0.00 C ATOM 1621 CE1 TYR A 104 112.037 -19.517 0.325 1.00 0.00 C ATOM 1622 CE2 TYR A 104 112.269 -17.111 0.509 1.00 0.00 C ATOM 1623 CZ TYR A 104 111.628 -18.228 -0.037 1.00 0.00 C ATOM 1624 OH TYR A 104 110.592 -18.061 -0.934 1.00 0.00 O ATOM 0 H TYR A 104 114.092 -17.393 4.710 1.00 0.00 H new ATOM 0 HA TYR A 104 113.539 -20.091 3.810 1.00 0.00 H new ATOM 0 HB2 TYR A 104 115.332 -17.794 2.977 1.00 0.00 H new ATOM 0 HB3 TYR A 104 115.630 -19.395 2.331 1.00 0.00 H new ATOM 0 HD1 TYR A 104 113.405 -20.682 1.513 1.00 0.00 H new ATOM 0 HD2 TYR A 104 113.815 -16.418 1.840 1.00 0.00 H new ATOM 0 HE1 TYR A 104 111.542 -20.379 -0.097 1.00 0.00 H new ATOM 0 HE2 TYR A 104 111.953 -16.117 0.229 1.00 0.00 H new ATOM 0 HH TYR A 104 110.433 -17.104 -1.076 1.00 0.00 H new ATOM 1634 N GLY A 105 115.984 -19.468 5.820 1.00 0.00 N ATOM 1635 CA GLY A 105 117.065 -20.064 6.597 1.00 0.00 C ATOM 1636 C GLY A 105 118.411 -19.882 5.903 1.00 0.00 C ATOM 1637 O GLY A 105 119.315 -20.702 6.059 1.00 0.00 O ATOM 0 H GLY A 105 115.687 -18.547 6.143 1.00 0.00 H new ATOM 0 HA2 GLY A 105 117.099 -19.608 7.586 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.869 -21.126 6.742 1.00 0.00 H new ATOM 1641 N ILE A 106 118.540 -18.802 5.136 1.00 0.00 N ATOM 1642 CA ILE A 106 119.782 -18.528 4.427 1.00 0.00 C ATOM 1643 C ILE A 106 120.921 -18.276 5.408 1.00 0.00 C ATOM 1644 O ILE A 106 121.451 -19.211 6.010 1.00 0.00 O ATOM 1645 CB ILE A 106 119.596 -17.314 3.524 1.00 0.00 C ATOM 1646 CG1 ILE A 106 118.317 -17.500 2.699 1.00 0.00 C ATOM 1647 CG2 ILE A 106 120.804 -17.183 2.598 1.00 0.00 C ATOM 1648 CD1 ILE A 106 118.661 -18.097 1.331 1.00 0.00 C ATOM 0 H ILE A 106 117.805 -18.109 4.992 1.00 0.00 H new ATOM 0 HA ILE A 106 120.038 -19.398 3.822 1.00 0.00 H new ATOM 0 HB ILE A 106 119.510 -16.408 4.125 1.00 0.00 H new ATOM 0 HG12 ILE A 106 117.625 -18.155 3.228 1.00 0.00 H new ATOM 0 HG13 ILE A 106 117.814 -16.542 2.571 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.674 -16.316 1.951 1.00 0.00 H new ATOM 0 HG22 ILE A 106 121.708 -17.059 3.194 1.00 0.00 H new ATOM 0 HG23 ILE A 106 120.893 -18.081 1.987 1.00 0.00 H new ATOM 0 HD11 ILE A 106 117.748 -18.226 0.750 1.00 0.00 H new ATOM 0 HD12 ILE A 106 119.336 -17.426 0.800 1.00 0.00 H new ATOM 0 HD13 ILE A 106 119.144 -19.064 1.467 1.00 0.00 H new ATOM 1660 N THR A 107 121.296 -17.012 5.568 1.00 0.00 N ATOM 1661 CA THR A 107 122.374 -16.660 6.484 1.00 0.00 C ATOM 1662 C THR A 107 123.716 -17.133 5.936 1.00 0.00 C ATOM 1663 O THR A 107 124.763 -16.896 6.537 1.00 0.00 O ATOM 1664 CB THR A 107 122.117 -17.297 7.849 1.00 0.00 C ATOM 1665 OG1 THR A 107 122.794 -18.544 7.924 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.615 -17.516 8.032 1.00 0.00 C ATOM 0 H THR A 107 120.874 -16.221 5.081 1.00 0.00 H new ATOM 0 HA THR A 107 122.405 -15.576 6.590 1.00 0.00 H new ATOM 0 HB THR A 107 122.485 -16.638 8.635 1.00 0.00 H new ATOM 0 HG1 THR A 107 122.370 -19.184 7.314 1.00 0.00 H new ATOM 0 HG21 THR A 107 120.429 -17.970 9.005 1.00 0.00 H new ATOM 0 HG22 THR A 107 120.098 -16.558 7.974 1.00 0.00 H new ATOM 0 HG23 THR A 107 120.245 -18.176 7.247 1.00 0.00 H new ATOM 1674 N GLY A 108 123.675 -17.800 4.787 1.00 0.00 N ATOM 1675 CA GLY A 108 124.894 -18.298 4.159 1.00 0.00 C ATOM 1676 C GLY A 108 125.400 -17.315 3.112 1.00 0.00 C ATOM 1677 O GLY A 108 126.206 -17.668 2.251 1.00 0.00 O ATOM 0 H GLY A 108 122.818 -18.007 4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 108 125.661 -18.456 4.917 1.00 0.00 H new ATOM 0 HA3 GLY A 108 124.701 -19.265 3.694 1.00 0.00 H new ATOM 1681 N ILE A 109 124.921 -16.077 3.194 1.00 0.00 N ATOM 1682 CA ILE A 109 125.328 -15.043 2.253 1.00 0.00 C ATOM 1683 C ILE A 109 126.843 -15.074 2.051 1.00 0.00 C ATOM 1684 O ILE A 109 127.590 -15.399 2.972 1.00 0.00 O ATOM 1685 CB ILE A 109 124.901 -13.678 2.797 1.00 0.00 C ATOM 1686 CG1 ILE A 109 124.015 -13.890 4.029 1.00 0.00 C ATOM 1687 CG2 ILE A 109 124.116 -12.901 1.735 1.00 0.00 C ATOM 1688 CD1 ILE A 109 122.808 -14.760 3.658 1.00 0.00 C ATOM 0 H ILE A 109 124.253 -15.768 3.900 1.00 0.00 H new ATOM 0 HA ILE A 109 124.849 -15.222 1.290 1.00 0.00 H new ATOM 0 HB ILE A 109 125.789 -13.105 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.589 -14.368 4.823 1.00 0.00 H new ATOM 0 HG13 ILE A 109 123.677 -12.928 4.415 1.00 0.00 H new ATOM 0 HG21 ILE A 109 123.820 -11.932 2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 109 124.743 -12.752 0.856 1.00 0.00 H new ATOM 0 HG23 ILE A 109 123.226 -13.465 1.455 1.00 0.00 H new ATOM 0 HD11 ILE A 109 122.182 -14.907 4.538 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.228 -14.265 2.879 1.00 0.00 H new ATOM 0 HD13 ILE A 109 123.155 -15.727 3.293 1.00 0.00 H new ATOM 1700 N PRO A 110 127.307 -14.750 0.870 1.00 0.00 N ATOM 1701 CA PRO A 110 126.434 -14.349 -0.276 1.00 0.00 C ATOM 1702 C PRO A 110 125.641 -15.524 -0.840 1.00 0.00 C ATOM 1703 O PRO A 110 126.149 -16.641 -0.936 1.00 0.00 O ATOM 1704 CB PRO A 110 127.423 -13.815 -1.315 1.00 0.00 C ATOM 1705 CG PRO A 110 128.723 -14.476 -1.003 1.00 0.00 C ATOM 1706 CD PRO A 110 128.731 -14.734 0.503 1.00 0.00 C ATOM 0 HA PRO A 110 125.682 -13.619 0.023 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.095 -14.052 -2.327 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.509 -12.730 -1.254 1.00 0.00 H new ATOM 0 HG2 PRO A 110 128.826 -15.409 -1.557 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.560 -13.840 -1.292 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.215 -15.680 0.743 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.272 -13.954 1.039 1.00 0.00 H new ATOM 1714 N ALA A 111 124.390 -15.264 -1.211 1.00 0.00 N ATOM 1715 CA ALA A 111 123.537 -16.313 -1.762 1.00 0.00 C ATOM 1716 C ALA A 111 122.393 -15.708 -2.570 1.00 0.00 C ATOM 1717 O ALA A 111 121.986 -14.572 -2.332 1.00 0.00 O ATOM 1718 CB ALA A 111 122.967 -17.170 -0.632 1.00 0.00 C ATOM 0 H ALA A 111 123.948 -14.347 -1.141 1.00 0.00 H new ATOM 0 HA ALA A 111 124.142 -16.936 -2.421 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.332 -17.950 -1.052 1.00 0.00 H new ATOM 0 HB2 ALA A 111 123.784 -17.628 -0.075 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.378 -16.544 0.038 1.00 0.00 H new ATOM 1724 N LEU A 112 121.883 -16.475 -3.529 1.00 0.00 N ATOM 1725 CA LEU A 112 120.789 -16.002 -4.368 1.00 0.00 C ATOM 1726 C LEU A 112 119.542 -16.858 -4.158 1.00 0.00 C ATOM 1727 O LEU A 112 119.588 -18.078 -4.301 1.00 0.00 O ATOM 1728 CB LEU A 112 121.215 -16.057 -5.838 1.00 0.00 C ATOM 1729 CG LEU A 112 120.809 -14.765 -6.551 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.767 -14.504 -7.714 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.383 -14.903 -7.088 1.00 0.00 C ATOM 0 H LEU A 112 122.207 -17.418 -3.743 1.00 0.00 H new ATOM 0 HA LEU A 112 120.552 -14.974 -4.093 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.294 -16.196 -5.907 1.00 0.00 H new ATOM 0 HB3 LEU A 112 120.751 -16.913 -6.328 1.00 0.00 H new ATOM 0 HG LEU A 112 120.853 -13.933 -5.848 1.00 0.00 H new ATOM 0 HD11 LEU A 112 121.479 -13.584 -8.223 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.783 -14.405 -7.333 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.722 -15.336 -8.416 1.00 0.00 H new ATOM 0 HD21 LEU A 112 119.095 -13.982 -7.596 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.338 -15.735 -7.791 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.699 -15.090 -6.260 1.00 0.00 H new ATOM 1743 N VAL A 113 118.431 -16.211 -3.817 1.00 0.00 N ATOM 1744 CA VAL A 113 117.178 -16.927 -3.590 1.00 0.00 C ATOM 1745 C VAL A 113 116.188 -16.630 -4.711 1.00 0.00 C ATOM 1746 O VAL A 113 115.567 -15.568 -4.735 1.00 0.00 O ATOM 1747 CB VAL A 113 116.577 -16.507 -2.246 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.055 -16.670 -2.282 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.152 -17.383 -1.133 1.00 0.00 C ATOM 0 H VAL A 113 118.372 -15.200 -3.692 1.00 0.00 H new ATOM 0 HA VAL A 113 117.383 -17.997 -3.576 1.00 0.00 H new ATOM 0 HB VAL A 113 116.824 -15.462 -2.056 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.634 -16.369 -1.323 1.00 0.00 H new ATOM 0 HG12 VAL A 113 114.641 -16.044 -3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 113 114.805 -17.713 -2.477 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.724 -17.084 -0.176 1.00 0.00 H new ATOM 0 HG22 VAL A 113 116.908 -18.427 -1.329 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.235 -17.264 -1.099 1.00 0.00 H new ATOM 1759 N ILE A 114 116.044 -17.569 -5.640 1.00 0.00 N ATOM 1760 CA ILE A 114 115.125 -17.382 -6.756 1.00 0.00 C ATOM 1761 C ILE A 114 113.763 -17.996 -6.452 1.00 0.00 C ATOM 1762 O ILE A 114 113.665 -19.163 -6.077 1.00 0.00 O ATOM 1763 CB ILE A 114 115.699 -18.020 -8.024 1.00 0.00 C ATOM 1764 CG1 ILE A 114 117.107 -17.477 -8.274 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.803 -17.678 -9.218 1.00 0.00 C ATOM 1766 CD1 ILE A 114 117.043 -15.961 -8.461 1.00 0.00 C ATOM 0 H ILE A 114 116.546 -18.457 -5.643 1.00 0.00 H new ATOM 0 HA ILE A 114 114.998 -16.310 -6.911 1.00 0.00 H new ATOM 0 HB ILE A 114 115.742 -19.102 -7.899 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.758 -17.723 -7.435 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.537 -17.945 -9.159 1.00 0.00 H new ATOM 0 HG21 ILE A 114 115.211 -18.132 -10.121 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.798 -18.062 -9.041 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.761 -16.596 -9.343 1.00 0.00 H new ATOM 0 HD11 ILE A 114 118.046 -15.574 -8.639 1.00 0.00 H new ATOM 0 HD12 ILE A 114 116.407 -15.726 -9.314 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.631 -15.501 -7.563 1.00 0.00 H new ATOM 1778 N VAL A 115 112.714 -17.197 -6.617 1.00 0.00 N ATOM 1779 CA VAL A 115 111.358 -17.667 -6.361 1.00 0.00 C ATOM 1780 C VAL A 115 110.392 -17.118 -7.405 1.00 0.00 C ATOM 1781 O VAL A 115 110.578 -16.014 -7.917 1.00 0.00 O ATOM 1782 CB VAL A 115 110.901 -17.233 -4.969 1.00 0.00 C ATOM 1783 CG1 VAL A 115 112.095 -17.239 -4.012 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.316 -15.821 -5.042 1.00 0.00 C ATOM 0 H VAL A 115 112.776 -16.227 -6.925 1.00 0.00 H new ATOM 0 HA VAL A 115 111.361 -18.756 -6.418 1.00 0.00 H new ATOM 0 HB VAL A 115 110.141 -17.925 -4.606 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.767 -16.929 -3.020 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.514 -18.244 -3.959 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.856 -16.548 -4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.990 -15.511 -4.049 1.00 0.00 H new ATOM 0 HG22 VAL A 115 111.077 -15.130 -5.406 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.464 -15.815 -5.722 1.00 0.00 H new ATOM 1794 N LYS A 116 109.364 -17.897 -7.717 1.00 0.00 N ATOM 1795 CA LYS A 116 108.374 -17.486 -8.699 1.00 0.00 C ATOM 1796 C LYS A 116 107.520 -16.340 -8.163 1.00 0.00 C ATOM 1797 O LYS A 116 107.360 -16.188 -6.952 1.00 0.00 O ATOM 1798 CB LYS A 116 107.486 -18.678 -9.046 1.00 0.00 C ATOM 1799 CG LYS A 116 108.313 -19.708 -9.816 1.00 0.00 C ATOM 1800 CD LYS A 116 107.376 -20.695 -10.505 1.00 0.00 C ATOM 1801 CE LYS A 116 108.026 -22.081 -10.539 1.00 0.00 C ATOM 1802 NZ LYS A 116 107.109 -23.043 -11.213 1.00 0.00 N ATOM 0 H LYS A 116 109.196 -18.814 -7.304 1.00 0.00 H new ATOM 0 HA LYS A 116 108.889 -17.136 -9.594 1.00 0.00 H new ATOM 0 HB2 LYS A 116 107.082 -19.123 -8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.637 -18.352 -9.646 1.00 0.00 H new ATOM 0 HG2 LYS A 116 108.940 -19.209 -10.554 1.00 0.00 H new ATOM 0 HG3 LYS A 116 108.981 -20.237 -9.136 1.00 0.00 H new ATOM 0 HD2 LYS A 116 106.425 -20.741 -9.974 1.00 0.00 H new ATOM 0 HD3 LYS A 116 107.159 -20.359 -11.519 1.00 0.00 H new ATOM 0 HE2 LYS A 116 108.977 -22.036 -11.070 1.00 0.00 H new ATOM 0 HE3 LYS A 116 108.243 -22.418 -9.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 107.550 -23.985 -11.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 106.212 -23.093 -10.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 106.924 -22.723 -12.185 1.00 0.00 H new ATOM 1816 N LYS A 117 106.976 -15.536 -9.072 1.00 0.00 N ATOM 1817 CA LYS A 117 106.143 -14.405 -8.675 1.00 0.00 C ATOM 1818 C LYS A 117 105.126 -14.830 -7.621 1.00 0.00 C ATOM 1819 O LYS A 117 104.991 -14.186 -6.581 1.00 0.00 O ATOM 1820 CB LYS A 117 105.409 -13.842 -9.893 1.00 0.00 C ATOM 1821 CG LYS A 117 104.269 -12.932 -9.427 1.00 0.00 C ATOM 1822 CD LYS A 117 103.633 -12.244 -10.635 1.00 0.00 C ATOM 1823 CE LYS A 117 102.237 -12.819 -10.875 1.00 0.00 C ATOM 1824 NZ LYS A 117 101.342 -12.438 -9.745 1.00 0.00 N ATOM 0 H LYS A 117 107.095 -15.645 -10.079 1.00 0.00 H new ATOM 0 HA LYS A 117 106.789 -13.636 -8.252 1.00 0.00 H new ATOM 0 HB2 LYS A 117 106.102 -13.282 -10.521 1.00 0.00 H new ATOM 0 HB3 LYS A 117 105.014 -14.656 -10.501 1.00 0.00 H new ATOM 0 HG2 LYS A 117 103.520 -13.516 -8.893 1.00 0.00 H new ATOM 0 HG3 LYS A 117 104.649 -12.186 -8.729 1.00 0.00 H new ATOM 0 HD2 LYS A 117 103.570 -11.169 -10.463 1.00 0.00 H new ATOM 0 HD3 LYS A 117 104.254 -12.390 -11.519 1.00 0.00 H new ATOM 0 HE2 LYS A 117 101.834 -12.443 -11.815 1.00 0.00 H new ATOM 0 HE3 LYS A 117 102.289 -13.904 -10.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 100.364 -12.356 -10.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 101.388 -13.167 -9.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 101.648 -11.525 -9.352 1.00 0.00 H new ATOM 1838 N ASP A 118 104.415 -15.918 -7.896 1.00 0.00 N ATOM 1839 CA ASP A 118 103.414 -16.419 -6.962 1.00 0.00 C ATOM 1840 C ASP A 118 104.074 -16.846 -5.656 1.00 0.00 C ATOM 1841 O ASP A 118 103.397 -17.107 -4.662 1.00 0.00 O ATOM 1842 CB ASP A 118 102.674 -17.609 -7.576 1.00 0.00 C ATOM 1843 CG ASP A 118 101.638 -18.142 -6.591 1.00 0.00 C ATOM 1844 OD1 ASP A 118 102.029 -18.838 -5.669 1.00 0.00 O ATOM 1845 OD2 ASP A 118 100.469 -17.846 -6.774 1.00 0.00 O ATOM 0 H ASP A 118 104.512 -16.466 -8.751 1.00 0.00 H new ATOM 0 HA ASP A 118 102.702 -15.620 -6.755 1.00 0.00 H new ATOM 0 HB2 ASP A 118 102.186 -17.306 -8.502 1.00 0.00 H new ATOM 0 HB3 ASP A 118 103.383 -18.396 -7.832 1.00 0.00 H new ATOM 1850 N GLY A 119 105.401 -16.916 -5.669 1.00 0.00 N ATOM 1851 CA GLY A 119 106.147 -17.314 -4.482 1.00 0.00 C ATOM 1852 C GLY A 119 106.527 -18.787 -4.556 1.00 0.00 C ATOM 1853 O GLY A 119 106.808 -19.419 -3.536 1.00 0.00 O ATOM 0 H GLY A 119 105.978 -16.704 -6.483 1.00 0.00 H new ATOM 0 HA2 GLY A 119 107.046 -16.705 -4.390 1.00 0.00 H new ATOM 0 HA3 GLY A 119 105.547 -17.132 -3.591 1.00 0.00 H new ATOM 1857 N THR A 120 106.533 -19.328 -5.770 1.00 0.00 N ATOM 1858 CA THR A 120 106.878 -20.730 -5.966 1.00 0.00 C ATOM 1859 C THR A 120 108.392 -20.915 -5.984 1.00 0.00 C ATOM 1860 O THR A 120 109.099 -20.250 -6.741 1.00 0.00 O ATOM 1861 CB THR A 120 106.286 -21.236 -7.282 1.00 0.00 C ATOM 1862 OG1 THR A 120 105.303 -20.319 -7.741 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.647 -22.608 -7.064 1.00 0.00 C ATOM 0 H THR A 120 106.305 -18.822 -6.626 1.00 0.00 H new ATOM 0 HA THR A 120 106.464 -21.303 -5.137 1.00 0.00 H new ATOM 0 HB THR A 120 107.077 -21.323 -8.027 1.00 0.00 H new ATOM 0 HG1 THR A 120 104.814 -20.713 -8.493 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.226 -22.967 -8.003 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.404 -23.310 -6.714 1.00 0.00 H new ATOM 0 HG23 THR A 120 104.855 -22.526 -6.319 1.00 0.00 H new ATOM 1871 N LEU A 121 108.881 -21.824 -5.147 1.00 0.00 N ATOM 1872 CA LEU A 121 110.313 -22.091 -5.076 1.00 0.00 C ATOM 1873 C LEU A 121 110.785 -22.792 -6.341 1.00 0.00 C ATOM 1874 O LEU A 121 110.085 -23.638 -6.897 1.00 0.00 O ATOM 1875 CB LEU A 121 110.621 -22.964 -3.855 1.00 0.00 C ATOM 1876 CG LEU A 121 112.033 -22.665 -3.342 1.00 0.00 C ATOM 1877 CD1 LEU A 121 113.059 -23.021 -4.420 1.00 0.00 C ATOM 1878 CD2 LEU A 121 112.150 -21.179 -2.996 1.00 0.00 C ATOM 0 H LEU A 121 108.312 -22.384 -4.513 1.00 0.00 H new ATOM 0 HA LEU A 121 110.840 -21.142 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 121 109.891 -22.774 -3.068 1.00 0.00 H new ATOM 0 HB3 LEU A 121 110.537 -24.018 -4.120 1.00 0.00 H new ATOM 0 HG LEU A 121 112.225 -23.261 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU A 121 114.062 -22.807 -4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 121 112.979 -24.081 -4.662 1.00 0.00 H new ATOM 0 HD13 LEU A 121 112.867 -22.429 -5.315 1.00 0.00 H new ATOM 0 HD21 LEU A 121 113.155 -20.968 -2.631 1.00 0.00 H new ATOM 0 HD22 LEU A 121 111.955 -20.582 -3.887 1.00 0.00 H new ATOM 0 HD23 LEU A 121 111.424 -20.927 -2.223 1.00 0.00 H new ATOM 1890 N ILE A 122 111.976 -22.423 -6.791 1.00 0.00 N ATOM 1891 CA ILE A 122 112.545 -23.007 -7.996 1.00 0.00 C ATOM 1892 C ILE A 122 113.976 -23.454 -7.744 1.00 0.00 C ATOM 1893 O ILE A 122 114.291 -24.643 -7.791 1.00 0.00 O ATOM 1894 CB ILE A 122 112.533 -21.963 -9.108 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.391 -22.449 -10.274 1.00 0.00 C ATOM 1896 CG2 ILE A 122 113.096 -20.644 -8.573 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.677 -22.135 -11.589 1.00 0.00 C ATOM 0 H ILE A 122 112.566 -21.723 -6.340 1.00 0.00 H new ATOM 0 HA ILE A 122 111.951 -23.874 -8.286 1.00 0.00 H new ATOM 0 HB ILE A 122 111.510 -21.809 -9.452 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.366 -21.963 -10.251 1.00 0.00 H new ATOM 0 HG13 ILE A 122 113.567 -23.521 -10.189 1.00 0.00 H new ATOM 0 HG21 ILE A 122 113.088 -19.897 -9.366 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.482 -20.297 -7.742 1.00 0.00 H new ATOM 0 HG23 ILE A 122 114.119 -20.798 -8.229 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.286 -22.480 -12.425 1.00 0.00 H new ATOM 0 HD12 ILE A 122 111.712 -22.642 -11.609 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.524 -21.059 -11.672 1.00 0.00 H new ATOM 1909 N SER A 123 114.832 -22.483 -7.472 1.00 0.00 N ATOM 1910 CA SER A 123 116.238 -22.761 -7.204 1.00 0.00 C ATOM 1911 C SER A 123 116.794 -21.758 -6.199 1.00 0.00 C ATOM 1912 O SER A 123 116.817 -20.554 -6.459 1.00 0.00 O ATOM 1913 CB SER A 123 117.043 -22.687 -8.501 1.00 0.00 C ATOM 1914 OG SER A 123 117.831 -23.864 -8.633 1.00 0.00 O ATOM 0 H SER A 123 114.581 -21.495 -7.430 1.00 0.00 H new ATOM 0 HA SER A 123 116.320 -23.764 -6.786 1.00 0.00 H new ATOM 0 HB2 SER A 123 116.372 -22.587 -9.354 1.00 0.00 H new ATOM 0 HB3 SER A 123 117.684 -21.805 -8.495 1.00 0.00 H new ATOM 0 HG SER A 123 118.347 -23.820 -9.465 1.00 0.00 H new ATOM 1920 N MET A 124 117.237 -22.257 -5.050 1.00 0.00 N ATOM 1921 CA MET A 124 117.785 -21.387 -4.017 1.00 0.00 C ATOM 1922 C MET A 124 119.193 -20.936 -4.388 1.00 0.00 C ATOM 1923 O MET A 124 119.363 -19.980 -5.142 1.00 0.00 O ATOM 1924 CB MET A 124 117.810 -22.116 -2.672 1.00 0.00 C ATOM 1925 CG MET A 124 116.689 -21.579 -1.780 1.00 0.00 C ATOM 1926 SD MET A 124 115.119 -21.640 -2.681 1.00 0.00 S ATOM 1927 CE MET A 124 114.927 -19.862 -2.977 1.00 0.00 C ATOM 0 H MET A 124 117.228 -23.249 -4.812 1.00 0.00 H new ATOM 0 HA MET A 124 117.147 -20.507 -3.934 1.00 0.00 H new ATOM 0 HB2 MET A 124 117.686 -23.188 -2.825 1.00 0.00 H new ATOM 0 HB3 MET A 124 118.775 -21.973 -2.187 1.00 0.00 H new ATOM 0 HG2 MET A 124 116.620 -22.171 -0.868 1.00 0.00 H new ATOM 0 HG3 MET A 124 116.908 -20.555 -1.479 1.00 0.00 H new ATOM 0 HE1 MET A 124 114.625 -19.696 -4.011 1.00 0.00 H new ATOM 0 HE2 MET A 124 114.165 -19.462 -2.308 1.00 0.00 H new ATOM 0 HE3 MET A 124 115.875 -19.358 -2.790 1.00 0.00 H new ATOM 1937 N ASN A 125 120.195 -21.628 -3.856 1.00 0.00 N ATOM 1938 CA ASN A 125 121.582 -21.285 -4.145 1.00 0.00 C ATOM 1939 C ASN A 125 121.855 -21.406 -5.638 1.00 0.00 C ATOM 1940 O ASN A 125 122.860 -21.985 -6.051 1.00 0.00 O ATOM 1941 CB ASN A 125 122.522 -22.212 -3.373 1.00 0.00 C ATOM 1942 CG ASN A 125 123.957 -21.706 -3.482 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.898 -22.499 -3.464 1.00 0.00 O ATOM 1944 ND2 ASN A 125 124.182 -20.426 -3.594 1.00 0.00 N ATOM 0 H ASN A 125 120.074 -22.423 -3.228 1.00 0.00 H new ATOM 0 HA ASN A 125 121.758 -20.255 -3.835 1.00 0.00 H new ATOM 0 HB2 ASN A 125 122.222 -22.258 -2.326 1.00 0.00 H new ATOM 0 HB3 ASN A 125 122.454 -23.225 -3.769 1.00 0.00 H new ATOM 0 HD21 ASN A 125 125.139 -20.081 -3.667 1.00 0.00 H new ATOM 0 HD22 ASN A 125 123.401 -19.770 -3.609 1.00 0.00 H new ATOM 1951 N GLY A 126 120.953 -20.856 -6.443 1.00 0.00 N ATOM 1952 CA GLY A 126 121.102 -20.907 -7.888 1.00 0.00 C ATOM 1953 C GLY A 126 122.209 -19.970 -8.347 1.00 0.00 C ATOM 1954 O GLY A 126 122.415 -19.777 -9.543 1.00 0.00 O ATOM 0 H GLY A 126 120.115 -20.372 -6.119 1.00 0.00 H new ATOM 0 HA2 GLY A 126 121.329 -21.927 -8.200 1.00 0.00 H new ATOM 0 HA3 GLY A 126 120.162 -20.630 -8.366 1.00 0.00 H new ATOM 1958 N ARG A 127 122.917 -19.381 -7.391 1.00 0.00 N ATOM 1959 CA ARG A 127 123.993 -18.463 -7.726 1.00 0.00 C ATOM 1960 C ARG A 127 124.848 -19.028 -8.850 1.00 0.00 C ATOM 1961 O ARG A 127 124.598 -18.753 -10.023 1.00 0.00 O ATOM 1962 CB ARG A 127 124.860 -18.192 -6.495 1.00 0.00 C ATOM 1963 CG ARG A 127 125.853 -17.069 -6.803 1.00 0.00 C ATOM 1964 CD ARG A 127 125.692 -15.948 -5.775 1.00 0.00 C ATOM 1965 NE ARG A 127 126.885 -15.109 -5.754 1.00 0.00 N ATOM 1966 CZ ARG A 127 127.952 -15.450 -5.040 1.00 0.00 C ATOM 1967 NH1 ARG A 127 127.945 -16.553 -4.342 1.00 0.00 N ATOM 1968 NH2 ARG A 127 129.008 -14.682 -5.038 1.00 0.00 N ATOM 0 H ARG A 127 122.767 -19.521 -6.392 1.00 0.00 H new ATOM 0 HA ARG A 127 123.552 -17.525 -8.062 1.00 0.00 H new ATOM 0 HB2 ARG A 127 124.231 -17.913 -5.649 1.00 0.00 H new ATOM 0 HB3 ARG A 127 125.396 -19.097 -6.209 1.00 0.00 H new ATOM 0 HG2 ARG A 127 126.872 -17.454 -6.780 1.00 0.00 H new ATOM 0 HG3 ARG A 127 125.681 -16.683 -7.808 1.00 0.00 H new ATOM 0 HD2 ARG A 127 124.818 -15.344 -6.019 1.00 0.00 H new ATOM 0 HD3 ARG A 127 125.520 -16.373 -4.786 1.00 0.00 H new ATOM 0 HE ARG A 127 126.900 -14.246 -6.297 1.00 0.00 H new ATOM 0 HH11 ARG A 127 127.120 -17.153 -4.345 1.00 0.00 H new ATOM 0 HH12 ARG A 127 128.764 -16.815 -3.794 1.00 0.00 H new ATOM 0 HH21 ARG A 127 129.013 -13.821 -5.584 1.00 0.00 H new ATOM 0 HH22 ARG A 127 129.828 -14.943 -4.490 1.00 0.00 H new ATOM 1982 N GLY A 128 125.859 -19.812 -8.498 1.00 0.00 N ATOM 1983 CA GLY A 128 126.735 -20.393 -9.505 1.00 0.00 C ATOM 1984 C GLY A 128 125.930 -20.926 -10.681 1.00 0.00 C ATOM 1985 O GLY A 128 126.410 -20.938 -11.814 1.00 0.00 O ATOM 0 H GLY A 128 126.090 -20.057 -7.535 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.443 -19.642 -9.854 1.00 0.00 H new ATOM 0 HA3 GLY A 128 127.319 -21.200 -9.063 1.00 0.00 H new ATOM 1989 N GLU A 129 124.707 -21.368 -10.410 1.00 0.00 N ATOM 1990 CA GLU A 129 123.859 -21.898 -11.469 1.00 0.00 C ATOM 1991 C GLU A 129 123.624 -20.837 -12.534 1.00 0.00 C ATOM 1992 O GLU A 129 123.786 -21.100 -13.726 1.00 0.00 O ATOM 1993 CB GLU A 129 122.522 -22.376 -10.898 1.00 0.00 C ATOM 1994 CG GLU A 129 122.777 -23.288 -9.697 1.00 0.00 C ATOM 1995 CD GLU A 129 123.700 -24.433 -10.100 1.00 0.00 C ATOM 1996 OE1 GLU A 129 124.897 -24.207 -10.171 1.00 0.00 O ATOM 1997 OE2 GLU A 129 123.196 -25.520 -10.331 1.00 0.00 O ATOM 0 H GLU A 129 124.286 -21.370 -9.481 1.00 0.00 H new ATOM 0 HA GLU A 129 124.366 -22.749 -11.924 1.00 0.00 H new ATOM 0 HB2 GLU A 129 121.917 -21.521 -10.597 1.00 0.00 H new ATOM 0 HB3 GLU A 129 121.959 -22.912 -11.662 1.00 0.00 H new ATOM 0 HG2 GLU A 129 123.226 -22.717 -8.885 1.00 0.00 H new ATOM 0 HG3 GLU A 129 121.833 -23.685 -9.324 1.00 0.00 H new ATOM 2004 N VAL A 130 123.251 -19.636 -12.107 1.00 0.00 N ATOM 2005 CA VAL A 130 123.016 -18.557 -13.057 1.00 0.00 C ATOM 2006 C VAL A 130 124.334 -18.132 -13.695 1.00 0.00 C ATOM 2007 O VAL A 130 124.446 -18.041 -14.917 1.00 0.00 O ATOM 2008 CB VAL A 130 122.350 -17.367 -12.352 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.276 -16.146 -12.373 1.00 0.00 C ATOM 2010 CG2 VAL A 130 121.043 -17.021 -13.069 1.00 0.00 C ATOM 0 H VAL A 130 123.107 -19.388 -11.128 1.00 0.00 H new ATOM 0 HA VAL A 130 122.346 -18.911 -13.841 1.00 0.00 H new ATOM 0 HB VAL A 130 122.148 -17.639 -11.316 1.00 0.00 H new ATOM 0 HG11 VAL A 130 122.789 -15.311 -11.869 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.207 -16.386 -11.859 1.00 0.00 H new ATOM 0 HG13 VAL A 130 123.492 -15.871 -13.405 1.00 0.00 H new ATOM 0 HG21 VAL A 130 120.567 -16.176 -12.571 1.00 0.00 H new ATOM 0 HG22 VAL A 130 121.255 -16.759 -14.105 1.00 0.00 H new ATOM 0 HG23 VAL A 130 120.374 -17.881 -13.042 1.00 0.00 H new ATOM 2020 N GLN A 131 125.329 -17.880 -12.855 1.00 0.00 N ATOM 2021 CA GLN A 131 126.643 -17.472 -13.339 1.00 0.00 C ATOM 2022 C GLN A 131 127.282 -18.596 -14.147 1.00 0.00 C ATOM 2023 O GLN A 131 128.172 -18.357 -14.964 1.00 0.00 O ATOM 2024 CB GLN A 131 127.546 -17.108 -12.160 1.00 0.00 C ATOM 2025 CG GLN A 131 127.062 -15.799 -11.533 1.00 0.00 C ATOM 2026 CD GLN A 131 128.250 -15.010 -10.992 1.00 0.00 C ATOM 2027 OE1 GLN A 131 129.393 -15.447 -11.115 1.00 0.00 O ATOM 2028 NE2 GLN A 131 128.045 -13.867 -10.398 1.00 0.00 N ATOM 0 H GLN A 131 125.253 -17.950 -11.840 1.00 0.00 H new ATOM 0 HA GLN A 131 126.521 -16.599 -13.981 1.00 0.00 H new ATOM 0 HB2 GLN A 131 127.533 -17.906 -11.418 1.00 0.00 H new ATOM 0 HB3 GLN A 131 128.577 -17.003 -12.497 1.00 0.00 H new ATOM 0 HG2 GLN A 131 126.529 -15.206 -12.276 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.358 -16.010 -10.728 1.00 0.00 H new ATOM 0 HE21 GLN A 131 127.096 -13.507 -10.298 1.00 0.00 H new ATOM 0 HE22 GLN A 131 128.834 -13.333 -10.034 1.00 0.00 H new ATOM 2037 N SER A 132 126.820 -19.822 -13.918 1.00 0.00 N ATOM 2038 CA SER A 132 127.354 -20.972 -14.636 1.00 0.00 C ATOM 2039 C SER A 132 126.682 -21.099 -15.998 1.00 0.00 C ATOM 2040 O SER A 132 127.352 -21.199 -17.026 1.00 0.00 O ATOM 2041 CB SER A 132 127.124 -22.249 -13.830 1.00 0.00 C ATOM 2042 OG SER A 132 127.968 -22.242 -12.687 1.00 0.00 O ATOM 0 H SER A 132 126.084 -20.042 -13.247 1.00 0.00 H new ATOM 0 HA SER A 132 128.425 -20.827 -14.778 1.00 0.00 H new ATOM 0 HB2 SER A 132 126.080 -22.317 -13.525 1.00 0.00 H new ATOM 0 HB3 SER A 132 127.334 -23.124 -14.446 1.00 0.00 H new ATOM 0 HG SER A 132 127.668 -21.549 -12.063 1.00 0.00 H new ATOM 2048 N LEU A 133 125.354 -21.090 -15.996 1.00 0.00 N ATOM 2049 CA LEU A 133 124.599 -21.204 -17.236 1.00 0.00 C ATOM 2050 C LEU A 133 124.326 -19.827 -17.825 1.00 0.00 C ATOM 2051 O LEU A 133 123.689 -19.708 -18.870 1.00 0.00 O ATOM 2052 CB LEU A 133 123.270 -21.914 -16.979 1.00 0.00 C ATOM 2053 CG LEU A 133 123.407 -23.397 -17.323 1.00 0.00 C ATOM 2054 CD1 LEU A 133 122.094 -24.115 -17.009 1.00 0.00 C ATOM 2055 CD2 LEU A 133 123.726 -23.545 -18.812 1.00 0.00 C ATOM 0 H LEU A 133 124.782 -21.006 -15.156 1.00 0.00 H new ATOM 0 HA LEU A 133 125.192 -21.784 -17.944 1.00 0.00 H new ATOM 0 HB2 LEU A 133 122.980 -21.798 -15.935 1.00 0.00 H new ATOM 0 HB3 LEU A 133 122.482 -21.462 -17.581 1.00 0.00 H new ATOM 0 HG LEU A 133 124.211 -23.836 -16.733 1.00 0.00 H new ATOM 0 HD11 LEU A 133 122.190 -25.173 -17.254 1.00 0.00 H new ATOM 0 HD12 LEU A 133 121.865 -24.007 -15.949 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.290 -23.677 -17.600 1.00 0.00 H new ATOM 0 HD21 LEU A 133 123.824 -24.602 -19.060 1.00 0.00 H new ATOM 0 HD22 LEU A 133 122.921 -23.107 -19.402 1.00 0.00 H new ATOM 0 HD23 LEU A 133 124.661 -23.031 -19.037 1.00 0.00 H new ATOM 2067 N GLY A 134 124.801 -18.787 -17.149 1.00 0.00 N ATOM 2068 CA GLY A 134 124.585 -17.428 -17.630 1.00 0.00 C ATOM 2069 C GLY A 134 123.096 -17.167 -17.821 1.00 0.00 C ATOM 2070 O GLY A 134 122.264 -17.696 -17.084 1.00 0.00 O ATOM 0 H GLY A 134 125.330 -18.856 -16.280 1.00 0.00 H new ATOM 0 HA2 GLY A 134 124.999 -16.713 -16.919 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.111 -17.280 -18.573 1.00 0.00 H new ATOM 2074 N PRO A 135 122.747 -16.373 -18.796 1.00 0.00 N ATOM 2075 CA PRO A 135 121.326 -16.043 -19.091 1.00 0.00 C ATOM 2076 C PRO A 135 120.544 -17.273 -19.546 1.00 0.00 C ATOM 2077 O PRO A 135 119.314 -17.252 -19.604 1.00 0.00 O ATOM 2078 CB PRO A 135 121.393 -14.999 -20.212 1.00 0.00 C ATOM 2079 CG PRO A 135 122.827 -14.589 -20.333 1.00 0.00 C ATOM 2080 CD PRO A 135 123.669 -15.705 -19.718 1.00 0.00 C ATOM 0 HA PRO A 135 120.808 -15.674 -18.206 1.00 0.00 H new ATOM 0 HB2 PRO A 135 121.029 -15.416 -21.151 1.00 0.00 H new ATOM 0 HB3 PRO A 135 120.763 -14.140 -19.979 1.00 0.00 H new ATOM 0 HG2 PRO A 135 123.096 -14.435 -21.378 1.00 0.00 H new ATOM 0 HG3 PRO A 135 123.002 -13.645 -19.816 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.040 -16.391 -20.479 1.00 0.00 H new ATOM 0 HD3 PRO A 135 124.539 -15.308 -19.195 1.00 0.00 H new ATOM 2088 N ARG A 136 121.265 -18.345 -19.862 1.00 0.00 N ATOM 2089 CA ARG A 136 120.626 -19.578 -20.304 1.00 0.00 C ATOM 2090 C ARG A 136 120.094 -20.341 -19.101 1.00 0.00 C ATOM 2091 O ARG A 136 119.358 -21.317 -19.241 1.00 0.00 O ATOM 2092 CB ARG A 136 121.631 -20.447 -21.062 1.00 0.00 C ATOM 2093 CG ARG A 136 122.730 -19.559 -21.643 1.00 0.00 C ATOM 2094 CD ARG A 136 123.163 -20.106 -23.004 1.00 0.00 C ATOM 2095 NE ARG A 136 124.223 -19.276 -23.567 1.00 0.00 N ATOM 2096 CZ ARG A 136 123.985 -18.027 -23.955 1.00 0.00 C ATOM 2097 NH1 ARG A 136 122.788 -17.523 -23.834 1.00 0.00 N ATOM 2098 NH2 ARG A 136 124.950 -17.304 -24.456 1.00 0.00 N ATOM 0 H ARG A 136 122.283 -18.384 -19.821 1.00 0.00 H new ATOM 0 HA ARG A 136 119.799 -19.330 -20.969 1.00 0.00 H new ATOM 0 HB2 ARG A 136 122.064 -21.190 -20.392 1.00 0.00 H new ATOM 0 HB3 ARG A 136 121.128 -20.992 -21.861 1.00 0.00 H new ATOM 0 HG2 ARG A 136 122.368 -18.536 -21.749 1.00 0.00 H new ATOM 0 HG3 ARG A 136 123.582 -19.527 -20.964 1.00 0.00 H new ATOM 0 HD2 ARG A 136 123.513 -21.133 -22.897 1.00 0.00 H new ATOM 0 HD3 ARG A 136 122.310 -20.129 -23.683 1.00 0.00 H new ATOM 0 HE ARG A 136 125.163 -19.661 -23.664 1.00 0.00 H new ATOM 0 HH11 ARG A 136 122.034 -18.087 -23.442 1.00 0.00 H new ATOM 0 HH12 ARG A 136 122.606 -16.565 -24.132 1.00 0.00 H new ATOM 0 HH21 ARG A 136 125.886 -17.698 -24.550 1.00 0.00 H new ATOM 0 HH22 ARG A 136 124.767 -16.346 -24.754 1.00 0.00 H new ATOM 2112 N ALA A 137 120.466 -19.871 -17.918 1.00 0.00 N ATOM 2113 CA ALA A 137 120.014 -20.497 -16.682 1.00 0.00 C ATOM 2114 C ALA A 137 118.523 -20.252 -16.491 1.00 0.00 C ATOM 2115 O ALA A 137 117.852 -20.973 -15.753 1.00 0.00 O ATOM 2116 CB ALA A 137 120.787 -19.928 -15.490 1.00 0.00 C ATOM 0 H ALA A 137 121.076 -19.064 -17.788 1.00 0.00 H new ATOM 0 HA ALA A 137 120.197 -21.570 -16.745 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.441 -20.403 -14.572 1.00 0.00 H new ATOM 0 HB2 ALA A 137 121.852 -20.123 -15.620 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.620 -18.853 -15.428 1.00 0.00 H new ATOM 2122 N PHE A 138 118.011 -19.229 -17.170 1.00 0.00 N ATOM 2123 CA PHE A 138 116.596 -18.896 -17.075 1.00 0.00 C ATOM 2124 C PHE A 138 115.761 -20.167 -16.981 1.00 0.00 C ATOM 2125 O PHE A 138 114.645 -20.152 -16.461 1.00 0.00 O ATOM 2126 CB PHE A 138 116.165 -18.088 -18.301 1.00 0.00 C ATOM 2127 CG PHE A 138 114.670 -18.202 -18.479 1.00 0.00 C ATOM 2128 CD1 PHE A 138 113.812 -17.384 -17.735 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.142 -19.126 -19.388 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.426 -17.490 -17.900 1.00 0.00 C ATOM 2131 CE2 PHE A 138 112.756 -19.232 -19.553 1.00 0.00 C ATOM 2132 CZ PHE A 138 111.898 -18.414 -18.809 1.00 0.00 C ATOM 0 H PHE A 138 118.551 -18.622 -17.787 1.00 0.00 H new ATOM 0 HA PHE A 138 116.438 -18.299 -16.177 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.449 -17.043 -18.179 1.00 0.00 H new ATOM 0 HB3 PHE A 138 116.677 -18.456 -19.190 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.219 -16.671 -17.034 1.00 0.00 H new ATOM 0 HD2 PHE A 138 114.804 -19.757 -19.962 1.00 0.00 H new ATOM 0 HE1 PHE A 138 111.764 -16.859 -17.326 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.349 -19.945 -20.254 1.00 0.00 H new ATOM 0 HZ PHE A 138 110.829 -18.496 -18.936 1.00 0.00 H new ATOM 2142 N GLN A 139 116.314 -21.268 -17.482 1.00 0.00 N ATOM 2143 CA GLN A 139 115.613 -22.544 -17.443 1.00 0.00 C ATOM 2144 C GLN A 139 115.586 -23.084 -16.019 1.00 0.00 C ATOM 2145 O GLN A 139 114.547 -23.531 -15.533 1.00 0.00 O ATOM 2146 CB GLN A 139 116.304 -23.552 -18.365 1.00 0.00 C ATOM 2147 CG GLN A 139 117.429 -24.256 -17.605 1.00 0.00 C ATOM 2148 CD GLN A 139 118.255 -25.105 -18.565 1.00 0.00 C ATOM 2149 OE1 GLN A 139 119.479 -24.989 -18.601 1.00 0.00 O ATOM 2150 NE2 GLN A 139 117.653 -25.958 -19.349 1.00 0.00 N ATOM 0 H GLN A 139 117.237 -21.301 -17.916 1.00 0.00 H new ATOM 0 HA GLN A 139 114.589 -22.391 -17.785 1.00 0.00 H new ATOM 0 HB2 GLN A 139 115.582 -24.284 -18.726 1.00 0.00 H new ATOM 0 HB3 GLN A 139 116.706 -23.043 -19.241 1.00 0.00 H new ATOM 0 HG2 GLN A 139 118.067 -23.519 -17.118 1.00 0.00 H new ATOM 0 HG3 GLN A 139 117.010 -24.884 -16.819 1.00 0.00 H new ATOM 0 HE21 GLN A 139 116.638 -26.052 -19.317 1.00 0.00 H new ATOM 0 HE22 GLN A 139 118.198 -26.531 -19.994 1.00 0.00 H new ATOM 2159 N ASN A 140 116.733 -23.028 -15.354 1.00 0.00 N ATOM 2160 CA ASN A 140 116.829 -23.502 -13.979 1.00 0.00 C ATOM 2161 C ASN A 140 116.183 -22.492 -13.039 1.00 0.00 C ATOM 2162 O ASN A 140 115.542 -22.860 -12.055 1.00 0.00 O ATOM 2163 CB ASN A 140 118.296 -23.701 -13.593 1.00 0.00 C ATOM 2164 CG ASN A 140 119.092 -24.183 -14.801 1.00 0.00 C ATOM 2165 OD1 ASN A 140 119.614 -23.372 -15.565 1.00 0.00 O ATOM 2166 ND2 ASN A 140 119.216 -25.464 -15.021 1.00 0.00 N ATOM 0 H ASN A 140 117.603 -22.662 -15.740 1.00 0.00 H new ATOM 0 HA ASN A 140 116.308 -24.456 -13.897 1.00 0.00 H new ATOM 0 HB2 ASN A 140 118.713 -22.765 -13.222 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.372 -24.427 -12.783 1.00 0.00 H new ATOM 0 HD21 ASN A 140 119.746 -25.794 -15.827 1.00 0.00 H new ATOM 0 HD22 ASN A 140 118.783 -26.135 -14.386 1.00 0.00 H new ATOM 2173 N TRP A 141 116.350 -21.214 -13.363 1.00 0.00 N ATOM 2174 CA TRP A 141 115.774 -20.146 -12.556 1.00 0.00 C ATOM 2175 C TRP A 141 114.282 -20.022 -12.845 1.00 0.00 C ATOM 2176 O TRP A 141 113.537 -19.416 -12.075 1.00 0.00 O ATOM 2177 CB TRP A 141 116.459 -18.817 -12.879 1.00 0.00 C ATOM 2178 CG TRP A 141 117.668 -18.637 -12.015 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.418 -19.636 -11.495 1.00 0.00 C ATOM 2180 CD2 TRP A 141 118.281 -17.392 -11.568 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.447 -19.083 -10.753 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.405 -17.705 -10.768 1.00 0.00 C ATOM 2183 CE3 TRP A 141 117.973 -16.035 -11.776 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 120.194 -16.709 -10.195 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.766 -15.030 -11.200 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.875 -15.367 -10.411 1.00 0.00 C ATOM 0 H TRP A 141 116.877 -20.894 -14.175 1.00 0.00 H new ATOM 0 HA TRP A 141 115.923 -20.386 -11.503 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.747 -18.794 -13.930 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.764 -17.993 -12.721 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.242 -20.692 -11.636 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.151 -19.628 -10.256 1.00 0.00 H new ATOM 0 HE3 TRP A 141 117.121 -15.765 -12.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 121.047 -16.974 -9.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 118.520 -13.991 -11.366 1.00 0.00 H new ATOM 0 HH2 TRP A 141 120.482 -14.589 -9.971 1.00 0.00 H new ATOM 2197 N ALA A 142 113.853 -20.598 -13.967 1.00 0.00 N ATOM 2198 CA ALA A 142 112.450 -20.545 -14.358 1.00 0.00 C ATOM 2199 C ALA A 142 111.914 -21.938 -14.640 1.00 0.00 C ATOM 2200 O ALA A 142 110.786 -22.107 -15.102 1.00 0.00 O ATOM 2201 CB ALA A 142 112.279 -19.663 -15.596 1.00 0.00 C ATOM 0 H ALA A 142 114.455 -21.104 -14.617 1.00 0.00 H new ATOM 0 HA ALA A 142 111.883 -20.116 -13.531 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.227 -19.632 -15.878 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.625 -18.654 -15.374 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.863 -20.074 -16.419 1.00 0.00 H new ATOM 2207 N ARG A 143 112.737 -22.926 -14.355 1.00 0.00 N ATOM 2208 CA ARG A 143 112.362 -24.318 -14.572 1.00 0.00 C ATOM 2209 C ARG A 143 110.864 -24.509 -14.355 1.00 0.00 C ATOM 2210 O ARG A 143 110.395 -24.181 -13.278 1.00 0.00 O ATOM 2211 CB ARG A 143 113.138 -25.224 -13.613 1.00 0.00 C ATOM 2212 CG ARG A 143 113.979 -26.221 -14.417 1.00 0.00 C ATOM 2213 CD ARG A 143 113.074 -26.993 -15.378 1.00 0.00 C ATOM 2214 NE ARG A 143 113.427 -28.408 -15.375 1.00 0.00 N ATOM 2215 CZ ARG A 143 112.874 -29.252 -14.511 1.00 0.00 C ATOM 2216 NH1 ARG A 143 112.001 -28.821 -13.644 1.00 0.00 N ATOM 2217 NH2 ARG A 143 113.206 -30.515 -14.530 1.00 0.00 N ATOM 2218 OXT ARG A 143 110.209 -24.981 -15.270 1.00 0.00 O ATOM 0 H ARG A 143 113.673 -22.796 -13.971 1.00 0.00 H new ATOM 0 HA ARG A 143 112.606 -24.584 -15.600 1.00 0.00 H new ATOM 0 HB2 ARG A 143 113.782 -24.624 -12.971 1.00 0.00 H new ATOM 0 HB3 ARG A 143 112.447 -25.758 -12.961 1.00 0.00 H new ATOM 0 HG2 ARG A 143 114.753 -25.694 -14.974 1.00 0.00 H new ATOM 0 HG3 ARG A 143 114.486 -26.912 -13.743 1.00 0.00 H new ATOM 0 HD2 ARG A 143 112.031 -26.870 -15.085 1.00 0.00 H new ATOM 0 HD3 ARG A 143 113.172 -26.588 -16.385 1.00 0.00 H new ATOM 0 HE ARG A 143 114.110 -28.756 -16.048 1.00 0.00 H new ATOM 0 HH11 ARG A 143 111.742 -27.835 -13.629 1.00 0.00 H new ATOM 0 HH12 ARG A 143 111.577 -29.470 -12.981 1.00 0.00 H new ATOM 0 HH21 ARG A 143 113.889 -30.853 -15.208 1.00 0.00 H new ATOM 0 HH22 ARG A 143 112.782 -31.164 -13.867 1.00 0.00 H new TER 2232 ARG A 143