USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 989 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 64 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 135 HIS : no HD1:sc=-0.00686 X(o=-0.0069,f=-0.31) USER MOD Set 2.1: A 16 THR OG1 : rot 180:sc=-0.00419 USER MOD Set 2.2: A 27 SER OG : rot 139:sc= 0.313 USER MOD Set 2.3: A 30 ASN : amide:sc= 0.0902 K(o=0.4,f=-1.1) USER MOD Single : A 2 SER OG : rot 32:sc= -0.762 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 180:sc=0.000274 USER MOD Single : A 8 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.2) USER MOD Single : A 9 SER OG : rot -120:sc= -3.06! USER MOD Single : A 14 HIS : no HE2:sc= -4.78! C(o=-4.8!,f=-10!) USER MOD Single : A 18 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.1) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 152:sc= 0.427 USER MOD Single : A 31 ASN : amide:sc= -5.97! C(o=-6!,f=-13!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 51 HIS : no HD1:sc= -0.875 K(o=-0.88,f=0.085) USER MOD Single : A 56 LYS NZ :NH3+ -159:sc= -0.156 (180deg=-0.689) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 32:sc= 0.23 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0.233 USER MOD Single : A 88 MET CE :methyl 163:sc= -0.0738 (180deg=-0.5) USER MOD Single : A 99 MET CE :methyl -168:sc= -1.9 (180deg=-2.1) USER MOD Single : A 102 THR OG1 : rot -108:sc= 1.26 USER MOD Single : A 104 MET CE :methyl 161:sc= -0.0752 (180deg=-0.569) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -145:sc= 0 (180deg=-0.186) USER MOD Single : A 117 ASN : amide:sc= -2.14! K(o=-2.1!,f=-0.054) USER MOD Single : A 120 SER OG : rot 28:sc= 0.402 USER MOD Single : A 122 THR OG1 : rot 92:sc= 0.17 USER MOD Single : A 126 ASN : amide:sc= 1.14 K(o=1.1,f=-0.34) USER MOD Single : A 133 THR OG1 : rot 21:sc= 0.19 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 23.270 -3.795 8.858 1.00 0.00 N ATOM 21 CA SER A 2 22.682 -3.469 7.568 1.00 0.00 C ATOM 22 C SER A 2 22.243 -2.011 7.555 1.00 0.00 C ATOM 23 O SER A 2 21.080 -1.692 7.806 1.00 0.00 O ATOM 24 CB SER A 2 21.495 -4.385 7.255 1.00 0.00 C ATOM 25 OG SER A 2 21.928 -5.725 7.079 1.00 0.00 O ATOM 0 HA SER A 2 23.436 -3.624 6.797 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.768 -4.336 8.066 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.990 -4.039 6.353 1.00 0.00 H new ATOM 0 HG SER A 2 22.702 -5.897 7.655 1.00 0.00 H new ATOM 31 N GLU A 3 23.189 -1.128 7.286 1.00 0.00 N ATOM 32 CA GLU A 3 22.912 0.298 7.239 1.00 0.00 C ATOM 33 C GLU A 3 22.424 0.706 5.859 1.00 0.00 C ATOM 34 O GLU A 3 21.782 1.741 5.696 1.00 0.00 O ATOM 35 CB GLU A 3 24.154 1.102 7.611 1.00 0.00 C ATOM 36 CG GLU A 3 24.605 0.907 9.044 1.00 0.00 C ATOM 37 CD GLU A 3 25.819 1.744 9.386 1.00 0.00 C ATOM 38 OE1 GLU A 3 25.676 2.977 9.525 1.00 0.00 O ATOM 39 OE2 GLU A 3 26.921 1.173 9.517 1.00 0.00 O ATOM 0 H GLU A 3 24.160 -1.375 7.096 1.00 0.00 H new ATOM 0 HA GLU A 3 22.127 0.511 7.965 1.00 0.00 H new ATOM 0 HB2 GLU A 3 24.969 0.823 6.943 1.00 0.00 H new ATOM 0 HB3 GLU A 3 23.953 2.160 7.444 1.00 0.00 H new ATOM 0 HG2 GLU A 3 23.788 1.165 9.718 1.00 0.00 H new ATOM 0 HG3 GLU A 3 24.834 -0.146 9.210 1.00 0.00 H new ATOM 46 N SER A 4 22.758 -0.098 4.867 1.00 0.00 N ATOM 47 CA SER A 4 22.364 0.175 3.497 1.00 0.00 C ATOM 48 C SER A 4 21.318 -0.824 3.023 1.00 0.00 C ATOM 49 O SER A 4 21.458 -2.034 3.219 1.00 0.00 O ATOM 50 CB SER A 4 23.588 0.129 2.585 1.00 0.00 C ATOM 51 OG SER A 4 24.603 0.997 3.060 1.00 0.00 O ATOM 0 H SER A 4 23.305 -0.951 4.986 1.00 0.00 H new ATOM 0 HA SER A 4 21.924 1.172 3.457 1.00 0.00 H new ATOM 0 HB2 SER A 4 23.970 -0.890 2.533 1.00 0.00 H new ATOM 0 HB3 SER A 4 23.303 0.415 1.572 1.00 0.00 H new ATOM 0 HG SER A 4 25.379 0.951 2.463 1.00 0.00 H new ATOM 57 N VAL A 5 20.265 -0.305 2.406 1.00 0.00 N ATOM 58 CA VAL A 5 19.214 -1.139 1.853 1.00 0.00 C ATOM 59 C VAL A 5 19.704 -1.807 0.583 1.00 0.00 C ATOM 60 O VAL A 5 20.433 -1.208 -0.202 1.00 0.00 O ATOM 61 CB VAL A 5 17.914 -0.338 1.553 1.00 0.00 C ATOM 62 CG1 VAL A 5 18.172 0.830 0.628 1.00 0.00 C ATOM 63 CG2 VAL A 5 16.838 -1.242 0.966 1.00 0.00 C ATOM 0 H VAL A 5 20.118 0.696 2.277 1.00 0.00 H new ATOM 0 HA VAL A 5 18.969 -1.890 2.604 1.00 0.00 H new ATOM 0 HB VAL A 5 17.560 0.059 2.504 1.00 0.00 H new ATOM 0 HG11 VAL A 5 17.238 1.362 0.445 1.00 0.00 H new ATOM 0 HG12 VAL A 5 18.891 1.507 1.089 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.573 0.464 -0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 5 15.940 -0.657 0.766 1.00 0.00 H new ATOM 0 HG22 VAL A 5 17.199 -1.681 0.036 1.00 0.00 H new ATOM 0 HG23 VAL A 5 16.603 -2.036 1.675 1.00 0.00 H new ATOM 73 N GLN A 6 19.324 -3.048 0.400 1.00 0.00 N ATOM 74 CA GLN A 6 19.647 -3.768 -0.809 1.00 0.00 C ATOM 75 C GLN A 6 18.409 -4.492 -1.291 1.00 0.00 C ATOM 76 O GLN A 6 17.407 -4.556 -0.573 1.00 0.00 O ATOM 77 CB GLN A 6 20.805 -4.740 -0.582 1.00 0.00 C ATOM 78 CG GLN A 6 20.535 -5.750 0.502 1.00 0.00 C ATOM 79 CD GLN A 6 21.768 -6.036 1.330 1.00 0.00 C ATOM 80 OE1 GLN A 6 22.542 -6.944 1.027 1.00 0.00 O ATOM 81 NE2 GLN A 6 21.975 -5.244 2.368 1.00 0.00 N ATOM 0 H GLN A 6 18.786 -3.585 1.080 1.00 0.00 H new ATOM 0 HA GLN A 6 19.973 -3.063 -1.573 1.00 0.00 H new ATOM 0 HB2 GLN A 6 21.016 -5.265 -1.513 1.00 0.00 H new ATOM 0 HB3 GLN A 6 21.700 -4.173 -0.326 1.00 0.00 H new ATOM 0 HG2 GLN A 6 19.740 -5.382 1.151 1.00 0.00 H new ATOM 0 HG3 GLN A 6 20.177 -6.676 0.053 1.00 0.00 H new ATOM 0 HE21 GLN A 6 21.309 -4.503 2.585 1.00 0.00 H new ATOM 0 HE22 GLN A 6 22.801 -5.374 2.952 1.00 0.00 H new ATOM 90 N SER A 7 18.450 -4.991 -2.505 1.00 0.00 N ATOM 91 CA SER A 7 17.342 -5.757 -3.029 1.00 0.00 C ATOM 92 C SER A 7 17.049 -6.939 -2.101 1.00 0.00 C ATOM 93 O SER A 7 17.973 -7.631 -1.660 1.00 0.00 O ATOM 94 CB SER A 7 17.667 -6.215 -4.451 1.00 0.00 C ATOM 95 OG SER A 7 18.952 -6.812 -4.508 1.00 0.00 O ATOM 0 H SER A 7 19.235 -4.881 -3.146 1.00 0.00 H new ATOM 0 HA SER A 7 16.445 -5.140 -3.073 1.00 0.00 H new ATOM 0 HB2 SER A 7 16.915 -6.928 -4.789 1.00 0.00 H new ATOM 0 HB3 SER A 7 17.627 -5.363 -5.130 1.00 0.00 H new ATOM 0 HG SER A 7 19.139 -7.099 -5.426 1.00 0.00 H new ATOM 101 N ASN A 8 15.768 -7.110 -1.766 1.00 0.00 N ATOM 102 CA ASN A 8 15.295 -8.172 -0.866 1.00 0.00 C ATOM 103 C ASN A 8 15.592 -7.840 0.612 1.00 0.00 C ATOM 104 O ASN A 8 15.787 -8.730 1.437 1.00 0.00 O ATOM 105 CB ASN A 8 15.886 -9.536 -1.268 1.00 0.00 C ATOM 106 CG ASN A 8 15.224 -10.710 -0.567 1.00 0.00 C ATOM 107 OD1 ASN A 8 14.062 -10.640 -0.163 1.00 0.00 O ATOM 108 ND2 ASN A 8 15.954 -11.807 -0.433 1.00 0.00 N ATOM 0 H ASN A 8 15.020 -6.510 -2.114 1.00 0.00 H new ATOM 0 HA ASN A 8 14.212 -8.234 -0.968 1.00 0.00 H new ATOM 0 HB2 ASN A 8 15.787 -9.663 -2.346 1.00 0.00 H new ATOM 0 HB3 ASN A 8 16.952 -9.542 -1.043 1.00 0.00 H new ATOM 0 HD21 ASN A 8 15.557 -12.632 0.017 1.00 0.00 H new ATOM 0 HD22 ASN A 8 16.913 -11.827 -0.780 1.00 0.00 H new ATOM 115 N SER A 9 15.631 -6.546 0.940 1.00 0.00 N ATOM 116 CA SER A 9 15.716 -6.111 2.333 1.00 0.00 C ATOM 117 C SER A 9 14.358 -5.614 2.832 1.00 0.00 C ATOM 118 O SER A 9 13.429 -5.424 2.048 1.00 0.00 O ATOM 119 CB SER A 9 16.753 -5.000 2.486 1.00 0.00 C ATOM 120 OG SER A 9 18.028 -5.436 2.061 1.00 0.00 O ATOM 0 H SER A 9 15.605 -5.785 0.261 1.00 0.00 H new ATOM 0 HA SER A 9 16.020 -6.970 2.932 1.00 0.00 H new ATOM 0 HB2 SER A 9 16.449 -4.131 1.903 1.00 0.00 H new ATOM 0 HB3 SER A 9 16.801 -4.684 3.528 1.00 0.00 H new ATOM 0 HG SER A 9 18.661 -5.373 2.807 1.00 0.00 H new ATOM 126 N ALA A 10 14.245 -5.431 4.139 1.00 0.00 N ATOM 127 CA ALA A 10 13.042 -4.874 4.740 1.00 0.00 C ATOM 128 C ALA A 10 13.388 -3.573 5.445 1.00 0.00 C ATOM 129 O ALA A 10 14.146 -3.573 6.405 1.00 0.00 O ATOM 130 CB ALA A 10 12.448 -5.868 5.726 1.00 0.00 C ATOM 0 H ALA A 10 14.979 -5.662 4.809 1.00 0.00 H new ATOM 0 HA ALA A 10 12.304 -4.674 3.963 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.548 -5.445 6.172 1.00 0.00 H new ATOM 0 HB2 ALA A 10 12.195 -6.791 5.204 1.00 0.00 H new ATOM 0 HB3 ALA A 10 13.175 -6.082 6.509 1.00 0.00 H new ATOM 136 N VAL A 11 12.852 -2.458 4.979 1.00 0.00 N ATOM 137 CA VAL A 11 13.252 -1.173 5.534 1.00 0.00 C ATOM 138 C VAL A 11 12.080 -0.419 6.150 1.00 0.00 C ATOM 139 O VAL A 11 10.957 -0.466 5.650 1.00 0.00 O ATOM 140 CB VAL A 11 13.950 -0.283 4.481 1.00 0.00 C ATOM 141 CG1 VAL A 11 15.028 -1.072 3.760 1.00 0.00 C ATOM 142 CG2 VAL A 11 12.958 0.304 3.485 1.00 0.00 C ATOM 0 H VAL A 11 12.155 -2.413 4.236 1.00 0.00 H new ATOM 0 HA VAL A 11 13.965 -1.399 6.327 1.00 0.00 H new ATOM 0 HB VAL A 11 14.412 0.552 5.007 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.513 -0.434 3.021 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.768 -1.419 4.481 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.578 -1.930 3.260 1.00 0.00 H new ATOM 0 HG21 VAL A 11 13.491 0.923 2.763 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.446 -0.504 2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.227 0.914 4.016 1.00 0.00 H new ATOM 152 N LEU A 12 12.357 0.249 7.257 1.00 0.00 N ATOM 153 CA LEU A 12 11.400 1.117 7.908 1.00 0.00 C ATOM 154 C LEU A 12 11.524 2.515 7.318 1.00 0.00 C ATOM 155 O LEU A 12 12.639 3.000 7.108 1.00 0.00 O ATOM 156 CB LEU A 12 11.687 1.148 9.410 1.00 0.00 C ATOM 157 CG LEU A 12 10.693 1.939 10.252 1.00 0.00 C ATOM 158 CD1 LEU A 12 9.323 1.289 10.190 1.00 0.00 C ATOM 159 CD2 LEU A 12 11.185 2.043 11.689 1.00 0.00 C ATOM 0 H LEU A 12 13.260 0.202 7.730 1.00 0.00 H new ATOM 0 HA LEU A 12 10.386 0.748 7.751 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.713 0.122 9.778 1.00 0.00 H new ATOM 0 HB3 LEU A 12 12.681 1.567 9.564 1.00 0.00 H new ATOM 0 HG LEU A 12 10.610 2.948 9.849 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.621 1.862 10.795 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.977 1.266 9.156 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.386 0.271 10.574 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.466 2.610 12.280 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.292 1.043 12.110 1.00 0.00 H new ATOM 0 HD23 LEU A 12 12.150 2.550 11.707 1.00 0.00 H new ATOM 171 N VAL A 13 10.404 3.178 7.067 1.00 0.00 N ATOM 172 CA VAL A 13 10.424 4.452 6.365 1.00 0.00 C ATOM 173 C VAL A 13 9.346 5.380 6.897 1.00 0.00 C ATOM 174 O VAL A 13 8.360 4.932 7.490 1.00 0.00 O ATOM 175 CB VAL A 13 10.159 4.295 4.850 1.00 0.00 C ATOM 176 CG1 VAL A 13 11.321 3.645 4.133 1.00 0.00 C ATOM 177 CG2 VAL A 13 8.885 3.500 4.603 1.00 0.00 C ATOM 0 H VAL A 13 9.475 2.856 7.338 1.00 0.00 H new ATOM 0 HA VAL A 13 11.421 4.860 6.529 1.00 0.00 H new ATOM 0 HB VAL A 13 10.038 5.299 4.444 1.00 0.00 H new ATOM 0 HG11 VAL A 13 11.090 3.555 3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 13 12.214 4.256 4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.498 2.654 4.551 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.719 3.403 3.530 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.983 2.509 5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.039 4.018 5.055 1.00 0.00 H new ATOM 187 N HIS A 14 9.535 6.669 6.689 1.00 0.00 N ATOM 188 CA HIS A 14 8.453 7.629 6.787 1.00 0.00 C ATOM 189 C HIS A 14 8.279 8.260 5.420 1.00 0.00 C ATOM 190 O HIS A 14 9.217 8.856 4.889 1.00 0.00 O ATOM 191 CB HIS A 14 8.755 8.720 7.817 1.00 0.00 C ATOM 192 CG HIS A 14 8.169 8.486 9.176 1.00 0.00 C ATOM 193 ND1 HIS A 14 6.858 8.106 9.384 1.00 0.00 N ATOM 194 CD2 HIS A 14 8.718 8.610 10.405 1.00 0.00 C ATOM 195 CE1 HIS A 14 6.632 8.014 10.682 1.00 0.00 C ATOM 196 NE2 HIS A 14 7.743 8.312 11.319 1.00 0.00 N ATOM 0 H HIS A 14 10.438 7.078 6.449 1.00 0.00 H new ATOM 0 HA HIS A 14 7.546 7.118 7.111 1.00 0.00 H new ATOM 0 HB2 HIS A 14 9.836 8.817 7.916 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.383 9.671 7.436 1.00 0.00 H new ATOM 0 HD1 HIS A 14 6.172 7.925 8.651 1.00 0.00 H new ATOM 0 HD2 HIS A 14 9.737 8.892 10.625 1.00 0.00 H new ATOM 0 HE1 HIS A 14 5.694 7.740 11.142 1.00 0.00 H new ATOM 205 N PHE A 15 7.107 8.114 4.832 1.00 0.00 N ATOM 206 CA PHE A 15 6.895 8.599 3.480 1.00 0.00 C ATOM 207 C PHE A 15 5.533 9.252 3.347 1.00 0.00 C ATOM 208 O PHE A 15 4.566 8.803 3.953 1.00 0.00 O ATOM 209 CB PHE A 15 7.041 7.457 2.459 1.00 0.00 C ATOM 210 CG PHE A 15 5.958 6.412 2.530 1.00 0.00 C ATOM 211 CD1 PHE A 15 4.779 6.576 1.815 1.00 0.00 C ATOM 212 CD2 PHE A 15 6.114 5.272 3.302 1.00 0.00 C ATOM 213 CE1 PHE A 15 3.779 5.627 1.870 1.00 0.00 C ATOM 214 CE2 PHE A 15 5.114 4.321 3.357 1.00 0.00 C ATOM 215 CZ PHE A 15 3.947 4.498 2.641 1.00 0.00 C ATOM 0 H PHE A 15 6.296 7.669 5.262 1.00 0.00 H new ATOM 0 HA PHE A 15 7.658 9.349 3.271 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.052 7.883 1.456 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.006 6.973 2.610 1.00 0.00 H new ATOM 0 HD1 PHE A 15 4.643 7.459 1.208 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.024 5.126 3.865 1.00 0.00 H new ATOM 0 HE1 PHE A 15 2.867 5.769 1.310 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.245 3.436 3.962 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.167 3.752 2.685 1.00 0.00 H new ATOM 225 N THR A 16 5.460 10.323 2.583 1.00 0.00 N ATOM 226 CA THR A 16 4.185 10.946 2.294 1.00 0.00 C ATOM 227 C THR A 16 3.917 10.926 0.791 1.00 0.00 C ATOM 228 O THR A 16 4.714 11.434 0.002 1.00 0.00 O ATOM 229 CB THR A 16 4.138 12.395 2.812 1.00 0.00 C ATOM 230 OG1 THR A 16 4.537 12.438 4.190 1.00 0.00 O ATOM 231 CG2 THR A 16 2.737 12.970 2.677 1.00 0.00 C ATOM 0 H THR A 16 6.265 10.778 2.153 1.00 0.00 H new ATOM 0 HA THR A 16 3.412 10.375 2.808 1.00 0.00 H new ATOM 0 HB THR A 16 4.825 12.992 2.213 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.506 13.363 4.511 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.727 13.995 3.049 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.440 12.962 1.628 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.039 12.367 3.257 1.00 0.00 H new ATOM 239 N LEU A 17 2.810 10.310 0.405 1.00 0.00 N ATOM 240 CA LEU A 17 2.426 10.215 -0.995 1.00 0.00 C ATOM 241 C LEU A 17 1.514 11.354 -1.414 1.00 0.00 C ATOM 242 O LEU A 17 0.478 11.601 -0.793 1.00 0.00 O ATOM 243 CB LEU A 17 1.734 8.878 -1.251 1.00 0.00 C ATOM 244 CG LEU A 17 2.661 7.763 -1.703 1.00 0.00 C ATOM 245 CD1 LEU A 17 2.053 6.410 -1.421 1.00 0.00 C ATOM 246 CD2 LEU A 17 2.934 7.899 -3.183 1.00 0.00 C ATOM 0 H LEU A 17 2.156 9.864 1.049 1.00 0.00 H new ATOM 0 HA LEU A 17 3.335 10.284 -1.592 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.229 8.565 -0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 17 0.963 9.022 -2.008 1.00 0.00 H new ATOM 0 HG LEU A 17 3.595 7.844 -1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.736 5.628 -1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.876 6.306 -0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.107 6.318 -1.955 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.599 7.098 -3.505 1.00 0.00 H new ATOM 0 HD22 LEU A 17 1.995 7.835 -3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.404 8.862 -3.379 1.00 0.00 H new ATOM 258 N LYS A 18 1.905 12.029 -2.483 1.00 0.00 N ATOM 259 CA LYS A 18 1.145 13.154 -3.025 1.00 0.00 C ATOM 260 C LYS A 18 0.833 12.920 -4.497 1.00 0.00 C ATOM 261 O LYS A 18 1.547 12.204 -5.181 1.00 0.00 O ATOM 262 CB LYS A 18 1.942 14.460 -2.877 1.00 0.00 C ATOM 263 CG LYS A 18 1.497 15.351 -1.722 1.00 0.00 C ATOM 264 CD LYS A 18 1.456 14.596 -0.407 1.00 0.00 C ATOM 265 CE LYS A 18 1.181 15.520 0.771 1.00 0.00 C ATOM 266 NZ LYS A 18 2.333 16.416 1.057 1.00 0.00 N ATOM 0 H LYS A 18 2.757 11.816 -3.002 1.00 0.00 H new ATOM 0 HA LYS A 18 0.213 13.236 -2.466 1.00 0.00 H new ATOM 0 HB2 LYS A 18 2.995 14.214 -2.743 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.863 15.025 -3.806 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.178 16.197 -1.633 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.509 15.758 -1.938 1.00 0.00 H new ATOM 0 HD2 LYS A 18 0.684 13.828 -0.454 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.406 14.084 -0.253 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.297 16.122 0.561 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.958 14.923 1.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 2.184 16.893 1.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.207 15.855 1.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.414 17.128 0.303 1.00 0.00 H new ATOM 280 N LEU A 19 -0.252 13.497 -4.968 1.00 0.00 N ATOM 281 CA LEU A 19 -0.553 13.501 -6.392 1.00 0.00 C ATOM 282 C LEU A 19 0.089 14.716 -7.049 1.00 0.00 C ATOM 283 O LEU A 19 0.647 15.564 -6.352 1.00 0.00 O ATOM 284 CB LEU A 19 -2.063 13.506 -6.645 1.00 0.00 C ATOM 285 CG LEU A 19 -2.816 12.257 -6.189 1.00 0.00 C ATOM 286 CD1 LEU A 19 -4.315 12.478 -6.319 1.00 0.00 C ATOM 287 CD2 LEU A 19 -2.391 11.045 -7.009 1.00 0.00 C ATOM 0 H LEU A 19 -0.944 13.971 -4.388 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.144 12.589 -6.828 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.494 14.372 -6.142 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.233 13.641 -7.713 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.573 12.067 -5.143 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.844 11.583 -5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.613 13.323 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.563 12.686 -7.360 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.938 10.166 -6.669 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.609 11.224 -8.062 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.321 10.878 -6.883 1.00 0.00 H new ATOM 299 N ASP A 20 0.033 14.795 -8.374 1.00 0.00 N ATOM 300 CA ASP A 20 0.624 15.918 -9.107 1.00 0.00 C ATOM 301 C ASP A 20 0.104 17.256 -8.572 1.00 0.00 C ATOM 302 O ASP A 20 0.847 18.233 -8.476 1.00 0.00 O ATOM 303 CB ASP A 20 0.314 15.800 -10.603 1.00 0.00 C ATOM 304 CG ASP A 20 0.974 16.887 -11.428 1.00 0.00 C ATOM 305 OD1 ASP A 20 2.121 16.681 -11.881 1.00 0.00 O ATOM 306 OD2 ASP A 20 0.350 17.951 -11.636 1.00 0.00 O ATOM 0 H ASP A 20 -0.415 14.096 -8.966 1.00 0.00 H new ATOM 0 HA ASP A 20 1.704 15.884 -8.962 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.646 14.826 -10.962 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.765 15.843 -10.750 1.00 0.00 H new ATOM 311 N ASP A 21 -1.166 17.270 -8.184 1.00 0.00 N ATOM 312 CA ASP A 21 -1.824 18.481 -7.690 1.00 0.00 C ATOM 313 C ASP A 21 -1.549 18.719 -6.207 1.00 0.00 C ATOM 314 O ASP A 21 -2.195 19.556 -5.576 1.00 0.00 O ATOM 315 CB ASP A 21 -3.334 18.407 -7.926 1.00 0.00 C ATOM 316 CG ASP A 21 -3.685 18.336 -9.394 1.00 0.00 C ATOM 317 OD1 ASP A 21 -3.513 19.350 -10.101 1.00 0.00 O ATOM 318 OD2 ASP A 21 -4.124 17.261 -9.853 1.00 0.00 O ATOM 0 H ASP A 21 -1.769 16.448 -8.201 1.00 0.00 H new ATOM 0 HA ASP A 21 -1.408 19.319 -8.249 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.736 17.531 -7.416 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.811 19.281 -7.483 1.00 0.00 H new ATOM 323 N GLY A 22 -0.598 17.978 -5.651 1.00 0.00 N ATOM 324 CA GLY A 22 -0.280 18.101 -4.240 1.00 0.00 C ATOM 325 C GLY A 22 -1.337 17.505 -3.333 1.00 0.00 C ATOM 326 O GLY A 22 -1.325 17.725 -2.121 1.00 0.00 O ATOM 0 H GLY A 22 -0.038 17.290 -6.155 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.674 17.611 -4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -0.153 19.155 -3.994 1.00 0.00 H new ATOM 330 N THR A 23 -2.253 16.751 -3.917 1.00 0.00 N ATOM 331 CA THR A 23 -3.283 16.073 -3.150 1.00 0.00 C ATOM 332 C THR A 23 -2.677 14.885 -2.410 1.00 0.00 C ATOM 333 O THR A 23 -1.979 14.068 -3.006 1.00 0.00 O ATOM 334 CB THR A 23 -4.413 15.580 -4.071 1.00 0.00 C ATOM 335 OG1 THR A 23 -4.863 16.659 -4.904 1.00 0.00 O ATOM 336 CG2 THR A 23 -5.582 15.031 -3.264 1.00 0.00 C ATOM 0 H THR A 23 -2.304 16.593 -4.923 1.00 0.00 H new ATOM 0 HA THR A 23 -3.699 16.780 -2.433 1.00 0.00 H new ATOM 0 HB THR A 23 -4.020 14.774 -4.692 1.00 0.00 H new ATOM 0 HG1 THR A 23 -5.581 16.342 -5.491 1.00 0.00 H new ATOM 0 HG21 THR A 23 -6.364 14.691 -3.942 1.00 0.00 H new ATOM 0 HG22 THR A 23 -5.242 14.195 -2.654 1.00 0.00 H new ATOM 0 HG23 THR A 23 -5.978 15.814 -2.618 1.00 0.00 H new ATOM 344 N THR A 24 -2.926 14.806 -1.116 1.00 0.00 N ATOM 345 CA THR A 24 -2.368 13.741 -0.304 1.00 0.00 C ATOM 346 C THR A 24 -3.029 12.405 -0.628 1.00 0.00 C ATOM 347 O THR A 24 -4.234 12.226 -0.438 1.00 0.00 O ATOM 348 CB THR A 24 -2.521 14.052 1.198 1.00 0.00 C ATOM 349 OG1 THR A 24 -1.959 15.339 1.481 1.00 0.00 O ATOM 350 CG2 THR A 24 -1.825 12.999 2.047 1.00 0.00 C ATOM 0 H THR A 24 -3.511 15.467 -0.605 1.00 0.00 H new ATOM 0 HA THR A 24 -1.306 13.672 -0.538 1.00 0.00 H new ATOM 0 HB THR A 24 -3.583 14.047 1.443 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.058 15.537 2.436 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.948 13.243 3.102 1.00 0.00 H new ATOM 0 HG22 THR A 24 -2.264 12.022 1.846 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.763 12.977 1.801 1.00 0.00 H new ATOM 358 N ALA A 25 -2.231 11.480 -1.140 1.00 0.00 N ATOM 359 CA ALA A 25 -2.706 10.147 -1.462 1.00 0.00 C ATOM 360 C ALA A 25 -2.675 9.272 -0.219 1.00 0.00 C ATOM 361 O ALA A 25 -3.655 8.603 0.113 1.00 0.00 O ATOM 362 CB ALA A 25 -1.852 9.537 -2.561 1.00 0.00 C ATOM 0 H ALA A 25 -1.243 11.633 -1.342 1.00 0.00 H new ATOM 0 HA ALA A 25 -3.734 10.213 -1.819 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.218 8.537 -2.794 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -1.907 10.161 -3.453 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -0.817 9.475 -2.225 1.00 0.00 H new ATOM 368 N GLU A 26 -1.534 9.289 0.460 1.00 0.00 N ATOM 369 CA GLU A 26 -1.357 8.560 1.705 1.00 0.00 C ATOM 370 C GLU A 26 -0.207 9.171 2.493 1.00 0.00 C ATOM 371 O GLU A 26 0.908 9.273 1.982 1.00 0.00 O ATOM 372 CB GLU A 26 -1.065 7.085 1.423 1.00 0.00 C ATOM 373 CG GLU A 26 -0.951 6.240 2.678 1.00 0.00 C ATOM 374 CD GLU A 26 -2.259 6.146 3.433 1.00 0.00 C ATOM 375 OE1 GLU A 26 -2.601 7.092 4.172 1.00 0.00 O ATOM 376 OE2 GLU A 26 -2.958 5.121 3.283 1.00 0.00 O ATOM 0 H GLU A 26 -0.708 9.808 0.162 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.276 8.628 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.857 6.680 0.793 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.136 7.008 0.857 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.618 5.238 2.408 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -0.188 6.665 3.330 1.00 0.00 H new ATOM 383 N SER A 27 -0.466 9.596 3.717 1.00 0.00 N ATOM 384 CA SER A 27 0.582 10.164 4.539 1.00 0.00 C ATOM 385 C SER A 27 1.036 9.156 5.582 1.00 0.00 C ATOM 386 O SER A 27 0.280 8.781 6.475 1.00 0.00 O ATOM 387 CB SER A 27 0.111 11.449 5.216 1.00 0.00 C ATOM 388 OG SER A 27 1.172 12.056 5.932 1.00 0.00 O ATOM 0 H SER A 27 -1.385 9.558 4.159 1.00 0.00 H new ATOM 0 HA SER A 27 1.425 10.410 3.893 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.271 12.142 4.466 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.712 11.227 5.895 1.00 0.00 H new ATOM 0 HG SER A 27 1.145 13.026 5.797 1.00 0.00 H new ATOM 394 N THR A 28 2.270 8.709 5.445 1.00 0.00 N ATOM 395 CA THR A 28 2.854 7.769 6.368 1.00 0.00 C ATOM 396 C THR A 28 4.089 8.390 7.045 1.00 0.00 C ATOM 397 O THR A 28 5.116 7.745 7.281 1.00 0.00 O ATOM 398 CB THR A 28 3.225 6.466 5.637 1.00 0.00 C ATOM 399 OG1 THR A 28 2.069 5.929 4.974 1.00 0.00 O ATOM 400 CG2 THR A 28 3.755 5.453 6.615 1.00 0.00 C ATOM 0 H THR A 28 2.892 8.991 4.688 1.00 0.00 H new ATOM 0 HA THR A 28 2.124 7.529 7.141 1.00 0.00 H new ATOM 0 HB THR A 28 3.996 6.689 4.899 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.352 5.407 4.194 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.014 4.536 6.085 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.643 5.851 7.106 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.993 5.237 7.364 1.00 0.00 H new ATOM 408 N ARG A 29 4.009 9.674 7.321 1.00 0.00 N ATOM 409 CA ARG A 29 5.053 10.362 8.062 1.00 0.00 C ATOM 410 C ARG A 29 4.445 11.207 9.180 1.00 0.00 C ATOM 411 O ARG A 29 4.676 10.941 10.358 1.00 0.00 O ATOM 412 CB ARG A 29 5.894 11.229 7.119 1.00 0.00 C ATOM 413 CG ARG A 29 6.981 12.027 7.823 1.00 0.00 C ATOM 414 CD ARG A 29 7.941 12.663 6.830 1.00 0.00 C ATOM 415 NE ARG A 29 7.251 13.521 5.869 1.00 0.00 N ATOM 416 CZ ARG A 29 7.795 13.955 4.731 1.00 0.00 C ATOM 417 NH1 ARG A 29 9.044 13.623 4.418 1.00 0.00 N ATOM 418 NH2 ARG A 29 7.090 14.729 3.910 1.00 0.00 N ATOM 0 H ARG A 29 3.228 10.269 7.043 1.00 0.00 H new ATOM 0 HA ARG A 29 5.707 9.618 8.516 1.00 0.00 H new ATOM 0 HB2 ARG A 29 6.356 10.589 6.367 1.00 0.00 H new ATOM 0 HB3 ARG A 29 5.235 11.918 6.590 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.524 12.804 8.436 1.00 0.00 H new ATOM 0 HG3 ARG A 29 7.534 11.373 8.497 1.00 0.00 H new ATOM 0 HD2 ARG A 29 8.684 13.249 7.370 1.00 0.00 H new ATOM 0 HD3 ARG A 29 8.479 11.881 6.295 1.00 0.00 H new ATOM 0 HE ARG A 29 6.295 13.805 6.081 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.589 13.035 5.049 1.00 0.00 H new ATOM 0 HH12 ARG A 29 9.457 13.956 3.547 1.00 0.00 H new ATOM 0 HH21 ARG A 29 6.134 14.990 4.151 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.506 15.061 3.040 1.00 0.00 H new ATOM 432 N ASN A 30 3.632 12.193 8.811 1.00 0.00 N ATOM 433 CA ASN A 30 3.000 13.076 9.799 1.00 0.00 C ATOM 434 C ASN A 30 1.739 12.441 10.377 1.00 0.00 C ATOM 435 O ASN A 30 0.919 13.112 11.003 1.00 0.00 O ATOM 436 CB ASN A 30 2.672 14.449 9.197 1.00 0.00 C ATOM 437 CG ASN A 30 1.829 14.368 7.938 1.00 0.00 C ATOM 438 OD1 ASN A 30 2.360 14.361 6.827 1.00 0.00 O ATOM 439 ND2 ASN A 30 0.516 14.294 8.092 1.00 0.00 N ATOM 0 H ASN A 30 3.393 12.404 7.842 1.00 0.00 H new ATOM 0 HA ASN A 30 3.718 13.221 10.607 1.00 0.00 H new ATOM 0 HB2 ASN A 30 2.145 15.047 9.940 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.602 14.970 8.970 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.090 14.229 7.275 1.00 0.00 H new ATOM 0 HD22 ASN A 30 0.111 14.302 9.028 1.00 0.00 H new ATOM 446 N ASN A 31 1.593 11.147 10.158 1.00 0.00 N ATOM 447 CA ASN A 31 0.493 10.380 10.729 1.00 0.00 C ATOM 448 C ASN A 31 0.878 9.858 12.104 1.00 0.00 C ATOM 449 O ASN A 31 0.024 9.494 12.908 1.00 0.00 O ATOM 450 CB ASN A 31 0.116 9.214 9.816 1.00 0.00 C ATOM 451 CG ASN A 31 1.274 8.289 9.539 1.00 0.00 C ATOM 452 OD1 ASN A 31 2.438 8.627 9.764 1.00 0.00 O ATOM 453 ND2 ASN A 31 0.972 7.135 8.998 1.00 0.00 N ATOM 0 H ASN A 31 2.230 10.596 9.582 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.371 11.038 10.825 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -0.694 8.647 10.275 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -0.264 9.606 8.872 1.00 0.00 H new ATOM 0 HD21 ASN A 31 1.713 6.480 8.747 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -0.004 6.891 8.827 1.00 0.00 H new ATOM 460 N GLY A 32 2.177 9.840 12.364 1.00 0.00 N ATOM 461 CA GLY A 32 2.678 9.345 13.625 1.00 0.00 C ATOM 462 C GLY A 32 2.920 7.853 13.592 1.00 0.00 C ATOM 463 O GLY A 32 3.151 7.232 14.630 1.00 0.00 O ATOM 0 H GLY A 32 2.896 10.163 11.717 1.00 0.00 H new ATOM 0 HA2 GLY A 32 3.608 9.858 13.872 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.965 9.579 14.415 1.00 0.00 H new ATOM 467 N LYS A 33 2.863 7.275 12.399 1.00 0.00 N ATOM 468 CA LYS A 33 3.077 5.846 12.238 1.00 0.00 C ATOM 469 C LYS A 33 3.888 5.577 10.964 1.00 0.00 C ATOM 470 O LYS A 33 3.496 5.958 9.861 1.00 0.00 O ATOM 471 CB LYS A 33 1.728 5.103 12.246 1.00 0.00 C ATOM 472 CG LYS A 33 1.113 4.921 10.884 1.00 0.00 C ATOM 473 CD LYS A 33 -0.064 3.958 10.887 1.00 0.00 C ATOM 474 CE LYS A 33 0.349 2.537 11.233 1.00 0.00 C ATOM 475 NZ LYS A 33 -0.801 1.596 11.151 1.00 0.00 N ATOM 0 H LYS A 33 2.671 7.775 11.531 1.00 0.00 H new ATOM 0 HA LYS A 33 3.658 5.464 13.078 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.869 4.123 12.702 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.028 5.651 12.877 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.782 5.889 10.509 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.873 4.555 10.194 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.809 4.302 11.605 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.539 3.966 9.906 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.136 2.211 10.553 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.767 2.514 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.482 0.636 11.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.541 1.894 11.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.184 1.600 10.184 1.00 0.00 H new ATOM 489 N PRO A 34 5.089 5.000 11.107 1.00 0.00 N ATOM 490 CA PRO A 34 5.922 4.646 9.970 1.00 0.00 C ATOM 491 C PRO A 34 5.532 3.300 9.376 1.00 0.00 C ATOM 492 O PRO A 34 4.764 2.543 9.975 1.00 0.00 O ATOM 493 CB PRO A 34 7.316 4.600 10.580 1.00 0.00 C ATOM 494 CG PRO A 34 7.094 4.117 11.968 1.00 0.00 C ATOM 495 CD PRO A 34 5.744 4.657 12.387 1.00 0.00 C ATOM 0 HA PRO A 34 5.832 5.348 9.141 1.00 0.00 H new ATOM 0 HB2 PRO A 34 7.971 3.928 10.025 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.787 5.583 10.571 1.00 0.00 H new ATOM 0 HG2 PRO A 34 7.108 3.028 12.009 1.00 0.00 H new ATOM 0 HG3 PRO A 34 7.880 4.471 12.635 1.00 0.00 H new ATOM 0 HD2 PRO A 34 5.171 3.915 12.943 1.00 0.00 H new ATOM 0 HD3 PRO A 34 5.845 5.530 13.031 1.00 0.00 H new ATOM 503 N ALA A 35 6.066 3.003 8.207 1.00 0.00 N ATOM 504 CA ALA A 35 5.734 1.778 7.508 1.00 0.00 C ATOM 505 C ALA A 35 6.994 1.020 7.138 1.00 0.00 C ATOM 506 O ALA A 35 8.081 1.594 7.091 1.00 0.00 O ATOM 507 CB ALA A 35 4.926 2.094 6.264 1.00 0.00 C ATOM 0 H ALA A 35 6.736 3.598 7.719 1.00 0.00 H new ATOM 0 HA ALA A 35 5.136 1.150 8.168 1.00 0.00 H new ATOM 0 HB1 ALA A 35 4.681 1.168 5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.006 2.605 6.548 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.510 2.736 5.604 1.00 0.00 H new ATOM 513 N LEU A 36 6.848 -0.269 6.905 1.00 0.00 N ATOM 514 CA LEU A 36 7.950 -1.085 6.447 1.00 0.00 C ATOM 515 C LEU A 36 7.782 -1.400 4.973 1.00 0.00 C ATOM 516 O LEU A 36 6.679 -1.697 4.511 1.00 0.00 O ATOM 517 CB LEU A 36 8.038 -2.388 7.241 1.00 0.00 C ATOM 518 CG LEU A 36 9.219 -3.283 6.864 1.00 0.00 C ATOM 519 CD1 LEU A 36 10.156 -3.435 8.048 1.00 0.00 C ATOM 520 CD2 LEU A 36 8.732 -4.640 6.372 1.00 0.00 C ATOM 0 H LEU A 36 5.971 -0.775 7.027 1.00 0.00 H new ATOM 0 HA LEU A 36 8.872 -0.524 6.600 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.105 -2.148 8.302 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.114 -2.948 7.099 1.00 0.00 H new ATOM 0 HG LEU A 36 9.769 -2.813 6.049 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.994 -4.074 7.769 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.530 -2.455 8.344 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.618 -3.885 8.882 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.589 -5.261 6.109 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.158 -5.128 7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.100 -4.503 5.494 1.00 0.00 H new ATOM 532 N PHE A 37 8.874 -1.329 4.238 1.00 0.00 N ATOM 533 CA PHE A 37 8.872 -1.689 2.840 1.00 0.00 C ATOM 534 C PHE A 37 9.597 -3.007 2.665 1.00 0.00 C ATOM 535 O PHE A 37 10.818 -3.084 2.811 1.00 0.00 O ATOM 536 CB PHE A 37 9.530 -0.609 1.979 1.00 0.00 C ATOM 537 CG PHE A 37 8.663 0.595 1.711 1.00 0.00 C ATOM 538 CD1 PHE A 37 7.308 0.594 2.018 1.00 0.00 C ATOM 539 CD2 PHE A 37 9.209 1.725 1.130 1.00 0.00 C ATOM 540 CE1 PHE A 37 6.524 1.696 1.749 1.00 0.00 C ATOM 541 CE2 PHE A 37 8.427 2.831 0.862 1.00 0.00 C ATOM 542 CZ PHE A 37 7.085 2.816 1.170 1.00 0.00 C ATOM 0 H PHE A 37 9.780 -1.022 4.593 1.00 0.00 H new ATOM 0 HA PHE A 37 7.838 -1.786 2.510 1.00 0.00 H new ATOM 0 HB2 PHE A 37 10.445 -0.279 2.470 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.821 -1.050 1.026 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.864 -0.279 2.472 1.00 0.00 H new ATOM 0 HD2 PHE A 37 10.260 1.743 0.883 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.472 1.683 1.991 1.00 0.00 H new ATOM 0 HE2 PHE A 37 8.868 3.708 0.411 1.00 0.00 H new ATOM 0 HZ PHE A 37 6.472 3.680 0.959 1.00 0.00 H new ATOM 552 N ARG A 38 8.835 -4.045 2.390 1.00 0.00 N ATOM 553 CA ARG A 38 9.395 -5.357 2.161 1.00 0.00 C ATOM 554 C ARG A 38 9.717 -5.517 0.684 1.00 0.00 C ATOM 555 O ARG A 38 8.830 -5.430 -0.169 1.00 0.00 O ATOM 556 CB ARG A 38 8.420 -6.445 2.612 1.00 0.00 C ATOM 557 CG ARG A 38 9.002 -7.847 2.545 1.00 0.00 C ATOM 558 CD ARG A 38 10.023 -8.084 3.644 1.00 0.00 C ATOM 559 NE ARG A 38 10.779 -9.317 3.424 1.00 0.00 N ATOM 560 CZ ARG A 38 11.495 -9.931 4.363 1.00 0.00 C ATOM 561 NH1 ARG A 38 11.545 -9.440 5.594 1.00 0.00 N ATOM 562 NH2 ARG A 38 12.157 -11.043 4.074 1.00 0.00 N ATOM 0 H ARG A 38 7.818 -4.003 2.320 1.00 0.00 H new ATOM 0 HA ARG A 38 10.310 -5.460 2.744 1.00 0.00 H new ATOM 0 HB2 ARG A 38 8.106 -6.239 3.635 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.526 -6.401 1.990 1.00 0.00 H new ATOM 0 HG2 ARG A 38 8.199 -8.579 2.630 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.471 -8.000 1.573 1.00 0.00 H new ATOM 0 HD2 ARG A 38 10.710 -7.239 3.690 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.515 -8.135 4.607 1.00 0.00 H new ATOM 0 HE ARG A 38 10.756 -9.732 2.493 1.00 0.00 H new ATOM 0 HH11 ARG A 38 11.033 -8.588 5.825 1.00 0.00 H new ATOM 0 HH12 ARG A 38 12.095 -9.914 6.310 1.00 0.00 H new ATOM 0 HH21 ARG A 38 12.118 -11.429 3.131 1.00 0.00 H new ATOM 0 HH22 ARG A 38 12.705 -11.512 4.795 1.00 0.00 H new ATOM 576 N LEU A 39 10.981 -5.757 0.396 1.00 0.00 N ATOM 577 CA LEU A 39 11.446 -5.879 -0.977 1.00 0.00 C ATOM 578 C LEU A 39 11.113 -7.251 -1.533 1.00 0.00 C ATOM 579 O LEU A 39 11.070 -8.239 -0.794 1.00 0.00 O ATOM 580 CB LEU A 39 12.952 -5.655 -1.039 1.00 0.00 C ATOM 581 CG LEU A 39 13.409 -4.213 -1.266 1.00 0.00 C ATOM 582 CD1 LEU A 39 13.319 -3.851 -2.735 1.00 0.00 C ATOM 583 CD2 LEU A 39 12.606 -3.232 -0.421 1.00 0.00 C ATOM 0 H LEU A 39 11.711 -5.873 1.098 1.00 0.00 H new ATOM 0 HA LEU A 39 10.942 -5.123 -1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.390 -6.011 -0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 39 13.358 -6.274 -1.839 1.00 0.00 H new ATOM 0 HG LEU A 39 14.451 -4.142 -0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 39 13.648 -2.822 -2.877 1.00 0.00 H new ATOM 0 HD12 LEU A 39 13.957 -4.519 -3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 39 12.287 -3.952 -3.072 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.958 -2.218 -0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.551 -3.304 -0.684 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.734 -3.472 0.635 1.00 0.00 H new ATOM 595 N GLY A 40 10.868 -7.308 -2.830 1.00 0.00 N ATOM 596 CA GLY A 40 10.581 -8.571 -3.471 1.00 0.00 C ATOM 597 C GLY A 40 9.104 -8.798 -3.716 1.00 0.00 C ATOM 598 O GLY A 40 8.614 -9.910 -3.522 1.00 0.00 O ATOM 0 H GLY A 40 10.863 -6.500 -3.452 1.00 0.00 H new ATOM 0 HA2 GLY A 40 11.111 -8.616 -4.422 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.968 -9.381 -2.852 1.00 0.00 H new ATOM 602 N ASP A 41 8.389 -7.738 -4.112 1.00 0.00 N ATOM 603 CA ASP A 41 6.992 -7.849 -4.562 1.00 0.00 C ATOM 604 C ASP A 41 6.048 -8.267 -3.424 1.00 0.00 C ATOM 605 O ASP A 41 4.862 -8.515 -3.640 1.00 0.00 O ATOM 606 CB ASP A 41 6.909 -8.840 -5.739 1.00 0.00 C ATOM 607 CG ASP A 41 5.515 -8.993 -6.322 1.00 0.00 C ATOM 608 OD1 ASP A 41 5.042 -8.064 -7.007 1.00 0.00 O ATOM 609 OD2 ASP A 41 4.899 -10.062 -6.123 1.00 0.00 O ATOM 0 H ASP A 41 8.756 -6.787 -4.131 1.00 0.00 H new ATOM 0 HA ASP A 41 6.663 -6.864 -4.893 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.587 -8.510 -6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.261 -9.816 -5.404 1.00 0.00 H new ATOM 614 N ALA A 42 6.574 -8.313 -2.206 1.00 0.00 N ATOM 615 CA ALA A 42 5.800 -8.741 -1.045 1.00 0.00 C ATOM 616 C ALA A 42 4.526 -7.919 -0.871 1.00 0.00 C ATOM 617 O ALA A 42 3.421 -8.466 -0.865 1.00 0.00 O ATOM 618 CB ALA A 42 6.652 -8.662 0.206 1.00 0.00 C ATOM 0 H ALA A 42 7.539 -8.058 -1.995 1.00 0.00 H new ATOM 0 HA ALA A 42 5.499 -9.775 -1.213 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.065 -8.983 1.067 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.521 -9.311 0.096 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.984 -7.635 0.356 1.00 0.00 H new ATOM 624 N SER A 43 4.679 -6.612 -0.723 1.00 0.00 N ATOM 625 CA SER A 43 3.533 -5.724 -0.567 1.00 0.00 C ATOM 626 C SER A 43 3.775 -4.396 -1.277 1.00 0.00 C ATOM 627 O SER A 43 3.012 -3.446 -1.122 1.00 0.00 O ATOM 628 CB SER A 43 3.260 -5.476 0.918 1.00 0.00 C ATOM 629 OG SER A 43 3.057 -6.699 1.611 1.00 0.00 O ATOM 0 H SER A 43 5.584 -6.141 -0.707 1.00 0.00 H new ATOM 0 HA SER A 43 2.665 -6.204 -1.018 1.00 0.00 H new ATOM 0 HB2 SER A 43 4.099 -4.938 1.360 1.00 0.00 H new ATOM 0 HB3 SER A 43 2.381 -4.841 1.028 1.00 0.00 H new ATOM 0 HG SER A 43 2.886 -6.514 2.558 1.00 0.00 H new ATOM 635 N LEU A 44 4.845 -4.335 -2.054 1.00 0.00 N ATOM 636 CA LEU A 44 5.220 -3.109 -2.738 1.00 0.00 C ATOM 637 C LEU A 44 5.121 -3.277 -4.242 1.00 0.00 C ATOM 638 O LEU A 44 5.317 -4.374 -4.770 1.00 0.00 O ATOM 639 CB LEU A 44 6.648 -2.687 -2.364 1.00 0.00 C ATOM 640 CG LEU A 44 6.795 -1.926 -1.041 1.00 0.00 C ATOM 641 CD1 LEU A 44 5.907 -0.690 -1.036 1.00 0.00 C ATOM 642 CD2 LEU A 44 6.473 -2.822 0.145 1.00 0.00 C ATOM 0 H LEU A 44 5.470 -5.123 -2.226 1.00 0.00 H new ATOM 0 HA LEU A 44 4.526 -2.331 -2.421 1.00 0.00 H new ATOM 0 HB2 LEU A 44 7.270 -3.581 -2.318 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.044 -2.064 -3.166 1.00 0.00 H new ATOM 0 HG LEU A 44 7.833 -1.608 -0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.024 -0.162 -0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.194 -0.032 -1.856 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.866 -0.989 -1.158 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.586 -2.256 1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.447 -3.181 0.062 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.155 -3.672 0.155 1.00 0.00 H new ATOM 654 N SER A 45 4.805 -2.186 -4.920 1.00 0.00 N ATOM 655 CA SER A 45 4.809 -2.160 -6.365 1.00 0.00 C ATOM 656 C SER A 45 6.250 -2.202 -6.857 1.00 0.00 C ATOM 657 O SER A 45 7.091 -1.455 -6.351 1.00 0.00 O ATOM 658 CB SER A 45 4.102 -0.898 -6.865 1.00 0.00 C ATOM 659 OG SER A 45 2.830 -0.751 -6.247 1.00 0.00 O ATOM 0 H SER A 45 4.541 -1.302 -4.484 1.00 0.00 H new ATOM 0 HA SER A 45 4.274 -3.026 -6.754 1.00 0.00 H new ATOM 0 HB2 SER A 45 4.717 -0.023 -6.653 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.981 -0.948 -7.947 1.00 0.00 H new ATOM 0 HG SER A 45 2.397 0.063 -6.580 1.00 0.00 H new ATOM 665 N GLU A 46 6.530 -3.082 -7.817 1.00 0.00 N ATOM 666 CA GLU A 46 7.906 -3.390 -8.227 1.00 0.00 C ATOM 667 C GLU A 46 8.736 -2.130 -8.456 1.00 0.00 C ATOM 668 O GLU A 46 9.881 -2.045 -8.011 1.00 0.00 O ATOM 669 CB GLU A 46 7.914 -4.239 -9.498 1.00 0.00 C ATOM 670 CG GLU A 46 7.154 -5.546 -9.373 1.00 0.00 C ATOM 671 CD GLU A 46 7.201 -6.362 -10.647 1.00 0.00 C ATOM 672 OE1 GLU A 46 6.803 -5.836 -11.712 1.00 0.00 O ATOM 673 OE2 GLU A 46 7.648 -7.528 -10.593 1.00 0.00 O ATOM 0 H GLU A 46 5.818 -3.600 -8.331 1.00 0.00 H new ATOM 0 HA GLU A 46 8.358 -3.950 -7.408 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.484 -3.657 -10.314 1.00 0.00 H new ATOM 0 HB3 GLU A 46 8.947 -4.456 -9.771 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.573 -6.131 -8.554 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.116 -5.337 -9.116 1.00 0.00 H new ATOM 680 N GLY A 47 8.146 -1.150 -9.130 1.00 0.00 N ATOM 681 CA GLY A 47 8.864 0.068 -9.441 1.00 0.00 C ATOM 682 C GLY A 47 9.313 0.815 -8.201 1.00 0.00 C ATOM 683 O GLY A 47 10.457 1.255 -8.120 1.00 0.00 O ATOM 0 H GLY A 47 7.183 -1.179 -9.466 1.00 0.00 H new ATOM 0 HA2 GLY A 47 9.735 -0.174 -10.050 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.227 0.718 -10.041 1.00 0.00 H new ATOM 687 N LEU A 48 8.420 0.944 -7.231 1.00 0.00 N ATOM 688 CA LEU A 48 8.715 1.680 -6.008 1.00 0.00 C ATOM 689 C LEU A 48 9.900 1.058 -5.271 1.00 0.00 C ATOM 690 O LEU A 48 10.889 1.733 -4.977 1.00 0.00 O ATOM 691 CB LEU A 48 7.459 1.687 -5.112 1.00 0.00 C ATOM 692 CG LEU A 48 7.506 2.573 -3.858 1.00 0.00 C ATOM 693 CD1 LEU A 48 8.306 1.927 -2.744 1.00 0.00 C ATOM 694 CD2 LEU A 48 8.105 3.918 -4.192 1.00 0.00 C ATOM 0 H LEU A 48 7.481 0.547 -7.267 1.00 0.00 H new ATOM 0 HA LEU A 48 8.987 2.705 -6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 48 6.611 2.003 -5.719 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.261 0.663 -4.797 1.00 0.00 H new ATOM 0 HG LEU A 48 6.481 2.701 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.316 2.584 -1.875 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.850 0.975 -2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.328 1.757 -3.082 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.133 4.537 -3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 48 9.118 3.781 -4.570 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.497 4.408 -4.952 1.00 0.00 H new ATOM 706 N GLU A 49 9.788 -0.231 -5.001 1.00 0.00 N ATOM 707 CA GLU A 49 10.827 -0.947 -4.267 1.00 0.00 C ATOM 708 C GLU A 49 12.174 -0.877 -4.994 1.00 0.00 C ATOM 709 O GLU A 49 13.214 -0.682 -4.362 1.00 0.00 O ATOM 710 CB GLU A 49 10.424 -2.402 -3.985 1.00 0.00 C ATOM 711 CG GLU A 49 10.304 -3.283 -5.216 1.00 0.00 C ATOM 712 CD GLU A 49 10.162 -4.753 -4.869 1.00 0.00 C ATOM 713 OE1 GLU A 49 9.094 -5.152 -4.370 1.00 0.00 O ATOM 714 OE2 GLU A 49 11.127 -5.520 -5.087 1.00 0.00 O ATOM 0 H GLU A 49 8.992 -0.806 -5.277 1.00 0.00 H new ATOM 0 HA GLU A 49 10.942 -0.448 -3.305 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.158 -2.843 -3.311 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.469 -2.404 -3.460 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.441 -2.967 -5.802 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.184 -3.145 -5.844 1.00 0.00 H new ATOM 721 N GLN A 50 12.155 -0.998 -6.321 1.00 0.00 N ATOM 722 CA GLN A 50 13.375 -0.952 -7.120 1.00 0.00 C ATOM 723 C GLN A 50 14.026 0.433 -7.152 1.00 0.00 C ATOM 724 O GLN A 50 15.131 0.591 -7.663 1.00 0.00 O ATOM 725 CB GLN A 50 13.099 -1.430 -8.539 1.00 0.00 C ATOM 726 CG GLN A 50 12.789 -2.913 -8.615 1.00 0.00 C ATOM 727 CD GLN A 50 12.752 -3.434 -10.035 1.00 0.00 C ATOM 728 OE1 GLN A 50 12.403 -2.712 -10.973 1.00 0.00 O ATOM 729 NE2 GLN A 50 13.129 -4.686 -10.203 1.00 0.00 N ATOM 0 H GLN A 50 11.303 -1.129 -6.866 1.00 0.00 H new ATOM 0 HA GLN A 50 14.084 -1.622 -6.634 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.260 -0.868 -8.949 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.965 -1.213 -9.165 1.00 0.00 H new ATOM 0 HG2 GLN A 50 13.540 -3.466 -8.050 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.827 -3.103 -8.138 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.410 -5.246 -9.398 1.00 0.00 H new ATOM 0 HE22 GLN A 50 13.140 -5.094 -11.138 1.00 0.00 H new ATOM 738 N HIS A 51 13.353 1.431 -6.605 1.00 0.00 N ATOM 739 CA HIS A 51 13.903 2.782 -6.586 1.00 0.00 C ATOM 740 C HIS A 51 14.433 3.108 -5.201 1.00 0.00 C ATOM 741 O HIS A 51 15.202 4.054 -5.018 1.00 0.00 O ATOM 742 CB HIS A 51 12.854 3.816 -7.009 1.00 0.00 C ATOM 743 CG HIS A 51 12.668 3.908 -8.492 1.00 0.00 C ATOM 744 ND1 HIS A 51 12.782 5.087 -9.197 1.00 0.00 N ATOM 745 CD2 HIS A 51 12.365 2.957 -9.404 1.00 0.00 C ATOM 746 CE1 HIS A 51 12.556 4.855 -10.477 1.00 0.00 C ATOM 747 NE2 HIS A 51 12.302 3.571 -10.627 1.00 0.00 N ATOM 0 H HIS A 51 12.434 1.337 -6.172 1.00 0.00 H new ATOM 0 HA HIS A 51 14.723 2.824 -7.303 1.00 0.00 H new ATOM 0 HB2 HIS A 51 11.900 3.564 -6.546 1.00 0.00 H new ATOM 0 HB3 HIS A 51 13.145 4.794 -6.626 1.00 0.00 H new ATOM 0 HD2 HIS A 51 12.203 1.908 -9.205 1.00 0.00 H new ATOM 0 HE1 HIS A 51 12.576 5.592 -11.266 1.00 0.00 H new ATOM 0 HE2 HIS A 51 12.092 3.108 -11.512 1.00 0.00 H new ATOM 756 N LEU A 52 14.011 2.317 -4.229 1.00 0.00 N ATOM 757 CA LEU A 52 14.372 2.553 -2.844 1.00 0.00 C ATOM 758 C LEU A 52 15.428 1.583 -2.329 1.00 0.00 C ATOM 759 O LEU A 52 15.706 1.548 -1.134 1.00 0.00 O ATOM 760 CB LEU A 52 13.125 2.504 -1.975 1.00 0.00 C ATOM 761 CG LEU A 52 12.311 3.790 -1.975 1.00 0.00 C ATOM 762 CD1 LEU A 52 11.009 3.567 -1.248 1.00 0.00 C ATOM 763 CD2 LEU A 52 13.097 4.908 -1.312 1.00 0.00 C ATOM 0 H LEU A 52 13.415 1.502 -4.376 1.00 0.00 H new ATOM 0 HA LEU A 52 14.820 3.545 -2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.490 1.686 -2.316 1.00 0.00 H new ATOM 0 HB3 LEU A 52 13.419 2.274 -0.951 1.00 0.00 H new ATOM 0 HG LEU A 52 12.099 4.078 -3.005 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.429 4.490 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.443 2.781 -1.748 1.00 0.00 H new ATOM 0 HD13 LEU A 52 11.213 3.269 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.504 5.823 -1.318 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.326 4.631 -0.283 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.025 5.074 -1.858 1.00 0.00 H new ATOM 775 N LEU A 53 15.998 0.778 -3.209 1.00 0.00 N ATOM 776 CA LEU A 53 17.098 -0.089 -2.812 1.00 0.00 C ATOM 777 C LEU A 53 18.445 0.599 -3.071 1.00 0.00 C ATOM 778 O LEU A 53 18.543 1.495 -3.911 1.00 0.00 O ATOM 779 CB LEU A 53 17.007 -1.452 -3.519 1.00 0.00 C ATOM 780 CG LEU A 53 17.155 -1.448 -5.040 1.00 0.00 C ATOM 781 CD1 LEU A 53 18.528 -1.957 -5.446 1.00 0.00 C ATOM 782 CD2 LEU A 53 16.069 -2.303 -5.661 1.00 0.00 C ATOM 0 H LEU A 53 15.724 0.705 -4.189 1.00 0.00 H new ATOM 0 HA LEU A 53 17.023 -0.277 -1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.777 -2.103 -3.104 1.00 0.00 H new ATOM 0 HB3 LEU A 53 16.044 -1.900 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 53 17.053 -0.425 -5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.613 -1.946 -6.533 1.00 0.00 H new ATOM 0 HD12 LEU A 53 19.296 -1.315 -5.015 1.00 0.00 H new ATOM 0 HD13 LEU A 53 18.661 -2.976 -5.082 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.178 -2.298 -6.746 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.155 -3.325 -5.292 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.092 -1.902 -5.392 1.00 0.00 H new ATOM 794 N GLY A 54 19.474 0.181 -2.339 1.00 0.00 N ATOM 795 CA GLY A 54 20.815 0.701 -2.549 1.00 0.00 C ATOM 796 C GLY A 54 21.224 1.879 -1.659 1.00 0.00 C ATOM 797 O GLY A 54 22.410 2.206 -1.604 1.00 0.00 O ATOM 0 H GLY A 54 19.402 -0.515 -1.597 1.00 0.00 H new ATOM 0 HA2 GLY A 54 21.526 -0.110 -2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 54 20.905 1.009 -3.591 1.00 0.00 H new ATOM 801 N LEU A 55 20.294 2.516 -0.949 1.00 0.00 N ATOM 802 CA LEU A 55 20.657 3.702 -0.158 1.00 0.00 C ATOM 803 C LEU A 55 20.826 3.373 1.326 1.00 0.00 C ATOM 804 O LEU A 55 20.434 2.309 1.793 1.00 0.00 O ATOM 805 CB LEU A 55 19.674 4.869 -0.347 1.00 0.00 C ATOM 806 CG LEU A 55 18.217 4.612 0.023 1.00 0.00 C ATOM 807 CD1 LEU A 55 17.564 5.903 0.497 1.00 0.00 C ATOM 808 CD2 LEU A 55 17.461 4.065 -1.173 1.00 0.00 C ATOM 0 H LEU A 55 19.312 2.246 -0.901 1.00 0.00 H new ATOM 0 HA LEU A 55 21.623 4.029 -0.544 1.00 0.00 H new ATOM 0 HB2 LEU A 55 20.031 5.712 0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 55 19.709 5.176 -1.392 1.00 0.00 H new ATOM 0 HG LEU A 55 18.186 3.878 0.828 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.524 5.710 0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.095 6.279 1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.605 6.646 -0.300 1.00 0.00 H new ATOM 0 HD21 LEU A 55 16.422 3.886 -0.896 1.00 0.00 H new ATOM 0 HD22 LEU A 55 17.500 4.787 -1.989 1.00 0.00 H new ATOM 0 HD23 LEU A 55 17.917 3.129 -1.495 1.00 0.00 H new ATOM 820 N LYS A 56 21.435 4.295 2.053 1.00 0.00 N ATOM 821 CA LYS A 56 21.758 4.097 3.459 1.00 0.00 C ATOM 822 C LYS A 56 20.686 4.710 4.371 1.00 0.00 C ATOM 823 O LYS A 56 19.942 5.599 3.958 1.00 0.00 O ATOM 824 CB LYS A 56 23.114 4.739 3.730 1.00 0.00 C ATOM 825 CG LYS A 56 23.678 4.445 5.103 1.00 0.00 C ATOM 826 CD LYS A 56 25.161 4.176 5.011 1.00 0.00 C ATOM 827 CE LYS A 56 25.822 4.168 6.381 1.00 0.00 C ATOM 828 NZ LYS A 56 25.601 5.443 7.116 1.00 0.00 N ATOM 0 H LYS A 56 21.720 5.203 1.686 1.00 0.00 H new ATOM 0 HA LYS A 56 21.792 3.029 3.675 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.823 4.395 2.977 1.00 0.00 H new ATOM 0 HB3 LYS A 56 23.022 5.819 3.611 1.00 0.00 H new ATOM 0 HG2 LYS A 56 23.495 5.289 5.768 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.171 3.583 5.536 1.00 0.00 H new ATOM 0 HD2 LYS A 56 25.326 3.216 4.523 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.630 4.936 4.386 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.428 3.338 6.968 1.00 0.00 H new ATOM 0 HE3 LYS A 56 26.892 3.997 6.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.327 5.549 7.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 25.662 6.241 6.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.659 5.431 7.557 1.00 0.00 H new ATOM 842 N VAL A 57 20.602 4.211 5.607 1.00 0.00 N ATOM 843 CA VAL A 57 19.760 4.820 6.631 1.00 0.00 C ATOM 844 C VAL A 57 20.206 6.254 6.864 1.00 0.00 C ATOM 845 O VAL A 57 21.405 6.545 6.844 1.00 0.00 O ATOM 846 CB VAL A 57 19.840 4.045 7.971 1.00 0.00 C ATOM 847 CG1 VAL A 57 19.190 4.822 9.108 1.00 0.00 C ATOM 848 CG2 VAL A 57 19.198 2.681 7.855 1.00 0.00 C ATOM 0 H VAL A 57 21.110 3.384 5.920 1.00 0.00 H new ATOM 0 HA VAL A 57 18.729 4.791 6.278 1.00 0.00 H new ATOM 0 HB VAL A 57 20.898 3.918 8.199 1.00 0.00 H new ATOM 0 HG11 VAL A 57 19.265 4.247 10.031 1.00 0.00 H new ATOM 0 HG12 VAL A 57 19.699 5.778 9.233 1.00 0.00 H new ATOM 0 HG13 VAL A 57 18.140 4.998 8.875 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.270 2.162 8.811 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.149 2.795 7.582 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.711 2.101 7.088 1.00 0.00 H new ATOM 858 N GLY A 58 19.253 7.148 7.085 1.00 0.00 N ATOM 859 CA GLY A 58 19.583 8.543 7.263 1.00 0.00 C ATOM 860 C GLY A 58 19.764 9.248 5.939 1.00 0.00 C ATOM 861 O GLY A 58 20.215 10.395 5.891 1.00 0.00 O ATOM 0 H GLY A 58 18.258 6.930 7.144 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.793 9.034 7.832 1.00 0.00 H new ATOM 0 HA3 GLY A 58 20.498 8.629 7.849 1.00 0.00 H new ATOM 865 N ASP A 59 19.414 8.562 4.861 1.00 0.00 N ATOM 866 CA ASP A 59 19.408 9.163 3.543 1.00 0.00 C ATOM 867 C ASP A 59 18.001 9.184 2.999 1.00 0.00 C ATOM 868 O ASP A 59 17.123 8.462 3.480 1.00 0.00 O ATOM 869 CB ASP A 59 20.345 8.442 2.570 1.00 0.00 C ATOM 870 CG ASP A 59 21.793 8.844 2.752 1.00 0.00 C ATOM 871 OD1 ASP A 59 22.101 10.044 2.594 1.00 0.00 O ATOM 872 OD2 ASP A 59 22.630 7.964 3.048 1.00 0.00 O ATOM 0 H ASP A 59 19.129 7.583 4.878 1.00 0.00 H new ATOM 0 HA ASP A 59 19.778 10.183 3.644 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.250 7.365 2.710 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.037 8.658 1.547 1.00 0.00 H new ATOM 877 N LYS A 60 17.795 10.011 1.994 1.00 0.00 N ATOM 878 CA LYS A 60 16.460 10.342 1.542 1.00 0.00 C ATOM 879 C LYS A 60 16.434 10.485 0.034 1.00 0.00 C ATOM 880 O LYS A 60 17.390 10.971 -0.570 1.00 0.00 O ATOM 881 CB LYS A 60 16.031 11.645 2.200 1.00 0.00 C ATOM 882 CG LYS A 60 16.239 11.630 3.703 1.00 0.00 C ATOM 883 CD LYS A 60 16.516 13.013 4.240 1.00 0.00 C ATOM 884 CE LYS A 60 15.342 13.957 4.008 1.00 0.00 C ATOM 885 NZ LYS A 60 15.589 15.305 4.584 1.00 0.00 N ATOM 0 H LYS A 60 18.542 10.469 1.472 1.00 0.00 H new ATOM 0 HA LYS A 60 15.771 9.544 1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.595 12.471 1.766 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.979 11.829 1.983 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.353 11.221 4.189 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.071 10.970 3.949 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.728 12.952 5.307 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.407 13.417 3.760 1.00 0.00 H new ATOM 0 HE2 LYS A 60 15.156 14.049 2.938 1.00 0.00 H new ATOM 0 HE3 LYS A 60 14.442 13.532 4.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 14.766 15.915 4.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.741 15.222 5.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.433 15.722 4.142 1.00 0.00 H new ATOM 899 N THR A 61 15.346 10.054 -0.566 1.00 0.00 N ATOM 900 CA THR A 61 15.184 10.153 -1.999 1.00 0.00 C ATOM 901 C THR A 61 13.738 10.469 -2.329 1.00 0.00 C ATOM 902 O THR A 61 12.811 9.866 -1.781 1.00 0.00 O ATOM 903 CB THR A 61 15.650 8.867 -2.729 1.00 0.00 C ATOM 904 OG1 THR A 61 15.422 8.975 -4.142 1.00 0.00 O ATOM 905 CG2 THR A 61 14.941 7.635 -2.191 1.00 0.00 C ATOM 0 H THR A 61 14.556 9.629 -0.080 1.00 0.00 H new ATOM 0 HA THR A 61 15.820 10.964 -2.355 1.00 0.00 H new ATOM 0 HB THR A 61 16.719 8.758 -2.545 1.00 0.00 H new ATOM 0 HG1 THR A 61 15.724 8.155 -4.586 1.00 0.00 H new ATOM 0 HG21 THR A 61 15.291 6.752 -2.725 1.00 0.00 H new ATOM 0 HG22 THR A 61 15.157 7.526 -1.128 1.00 0.00 H new ATOM 0 HG23 THR A 61 13.866 7.743 -2.334 1.00 0.00 H new ATOM 913 N THR A 62 13.544 11.450 -3.187 1.00 0.00 N ATOM 914 CA THR A 62 12.217 11.811 -3.624 1.00 0.00 C ATOM 915 C THR A 62 12.078 11.484 -5.103 1.00 0.00 C ATOM 916 O THR A 62 12.951 11.829 -5.902 1.00 0.00 O ATOM 917 CB THR A 62 11.983 13.314 -3.402 1.00 0.00 C ATOM 918 OG1 THR A 62 12.546 13.708 -2.143 1.00 0.00 O ATOM 919 CG2 THR A 62 10.503 13.658 -3.418 1.00 0.00 C ATOM 0 H THR A 62 14.292 12.011 -3.594 1.00 0.00 H new ATOM 0 HA THR A 62 11.478 11.251 -3.050 1.00 0.00 H new ATOM 0 HB THR A 62 12.467 13.852 -4.217 1.00 0.00 H new ATOM 0 HG1 THR A 62 12.397 14.667 -2.004 1.00 0.00 H new ATOM 0 HG21 THR A 62 10.377 14.729 -3.258 1.00 0.00 H new ATOM 0 HG22 THR A 62 10.076 13.382 -4.382 1.00 0.00 H new ATOM 0 HG23 THR A 62 9.994 13.110 -2.625 1.00 0.00 H new ATOM 927 N PHE A 63 11.008 10.803 -5.468 1.00 0.00 N ATOM 928 CA PHE A 63 10.784 10.449 -6.861 1.00 0.00 C ATOM 929 C PHE A 63 9.303 10.253 -7.145 1.00 0.00 C ATOM 930 O PHE A 63 8.527 9.929 -6.251 1.00 0.00 O ATOM 931 CB PHE A 63 11.570 9.176 -7.221 1.00 0.00 C ATOM 932 CG PHE A 63 11.317 7.995 -6.311 1.00 0.00 C ATOM 933 CD1 PHE A 63 12.090 7.796 -5.174 1.00 0.00 C ATOM 934 CD2 PHE A 63 10.314 7.081 -6.596 1.00 0.00 C ATOM 935 CE1 PHE A 63 11.866 6.716 -4.346 1.00 0.00 C ATOM 936 CE2 PHE A 63 10.090 5.999 -5.766 1.00 0.00 C ATOM 937 CZ PHE A 63 10.865 5.820 -4.643 1.00 0.00 C ATOM 0 H PHE A 63 10.283 10.484 -4.825 1.00 0.00 H new ATOM 0 HA PHE A 63 11.141 11.272 -7.481 1.00 0.00 H new ATOM 0 HB2 PHE A 63 11.321 8.889 -8.243 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.635 9.407 -7.205 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.877 8.496 -4.935 1.00 0.00 H new ATOM 0 HD2 PHE A 63 9.702 7.216 -7.475 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.475 6.574 -3.466 1.00 0.00 H new ATOM 0 HE2 PHE A 63 9.306 5.293 -5.999 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.687 4.975 -3.994 1.00 0.00 H new ATOM 947 N SER A 64 8.916 10.482 -8.387 1.00 0.00 N ATOM 948 CA SER A 64 7.553 10.239 -8.818 1.00 0.00 C ATOM 949 C SER A 64 7.482 8.926 -9.588 1.00 0.00 C ATOM 950 O SER A 64 8.483 8.467 -10.137 1.00 0.00 O ATOM 951 CB SER A 64 7.059 11.392 -9.688 1.00 0.00 C ATOM 952 OG SER A 64 7.182 12.631 -9.009 1.00 0.00 O ATOM 0 H SER A 64 9.531 10.838 -9.118 1.00 0.00 H new ATOM 0 HA SER A 64 6.910 10.170 -7.940 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.631 11.423 -10.615 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.017 11.225 -9.962 1.00 0.00 H new ATOM 0 HG SER A 64 6.861 13.354 -9.587 1.00 0.00 H new ATOM 958 N LEU A 65 6.301 8.329 -9.625 1.00 0.00 N ATOM 959 CA LEU A 65 6.110 7.052 -10.300 1.00 0.00 C ATOM 960 C LEU A 65 4.772 7.020 -11.017 1.00 0.00 C ATOM 961 O LEU A 65 3.784 7.583 -10.538 1.00 0.00 O ATOM 962 CB LEU A 65 6.178 5.888 -9.305 1.00 0.00 C ATOM 963 CG LEU A 65 7.559 5.567 -8.732 1.00 0.00 C ATOM 964 CD1 LEU A 65 7.441 4.464 -7.702 1.00 0.00 C ATOM 965 CD2 LEU A 65 8.535 5.153 -9.827 1.00 0.00 C ATOM 0 H LEU A 65 5.458 8.708 -9.195 1.00 0.00 H new ATOM 0 HA LEU A 65 6.913 6.943 -11.029 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.506 6.107 -8.475 1.00 0.00 H new ATOM 0 HB3 LEU A 65 5.796 4.994 -9.797 1.00 0.00 H new ATOM 0 HG LEU A 65 7.948 6.470 -8.261 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.427 4.238 -7.296 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.782 4.788 -6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.028 3.571 -8.171 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.506 4.932 -9.384 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.157 4.265 -10.334 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.640 5.965 -10.546 1.00 0.00 H new ATOM 977 N GLU A 66 4.753 6.371 -12.169 1.00 0.00 N ATOM 978 CA GLU A 66 3.525 6.158 -12.908 1.00 0.00 C ATOM 979 C GLU A 66 2.771 4.976 -12.306 1.00 0.00 C ATOM 980 O GLU A 66 3.378 4.165 -11.609 1.00 0.00 O ATOM 981 CB GLU A 66 3.824 5.903 -14.387 1.00 0.00 C ATOM 982 CG GLU A 66 4.644 6.999 -15.044 1.00 0.00 C ATOM 983 CD GLU A 66 4.874 6.744 -16.519 1.00 0.00 C ATOM 984 OE1 GLU A 66 5.690 5.859 -16.853 1.00 0.00 O ATOM 985 OE2 GLU A 66 4.236 7.421 -17.356 1.00 0.00 O ATOM 0 H GLU A 66 5.583 5.980 -12.614 1.00 0.00 H new ATOM 0 HA GLU A 66 2.907 7.053 -12.838 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.357 4.957 -14.483 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.882 5.794 -14.925 1.00 0.00 H new ATOM 0 HG2 GLU A 66 4.135 7.955 -14.919 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.606 7.082 -14.538 1.00 0.00 H new ATOM 992 N PRO A 67 1.458 4.863 -12.535 1.00 0.00 N ATOM 993 CA PRO A 67 0.640 3.804 -11.928 1.00 0.00 C ATOM 994 C PRO A 67 1.230 2.404 -12.093 1.00 0.00 C ATOM 995 O PRO A 67 1.144 1.571 -11.188 1.00 0.00 O ATOM 996 CB PRO A 67 -0.683 3.904 -12.680 1.00 0.00 C ATOM 997 CG PRO A 67 -0.759 5.314 -13.151 1.00 0.00 C ATOM 998 CD PRO A 67 0.657 5.769 -13.379 1.00 0.00 C ATOM 0 HA PRO A 67 0.560 3.942 -10.850 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.713 3.207 -13.517 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -1.524 3.660 -12.031 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -1.341 5.385 -14.070 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.254 5.943 -12.411 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.938 5.690 -14.429 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.794 6.811 -13.089 1.00 0.00 H new ATOM 1006 N ASP A 68 1.842 2.150 -13.243 1.00 0.00 N ATOM 1007 CA ASP A 68 2.429 0.839 -13.527 1.00 0.00 C ATOM 1008 C ASP A 68 3.611 0.545 -12.602 1.00 0.00 C ATOM 1009 O ASP A 68 4.054 -0.598 -12.491 1.00 0.00 O ATOM 1010 CB ASP A 68 2.885 0.750 -14.989 1.00 0.00 C ATOM 1011 CG ASP A 68 4.077 1.638 -15.295 1.00 0.00 C ATOM 1012 OD1 ASP A 68 3.872 2.818 -15.645 1.00 0.00 O ATOM 1013 OD2 ASP A 68 5.226 1.157 -15.198 1.00 0.00 O ATOM 0 H ASP A 68 1.947 2.831 -13.995 1.00 0.00 H new ATOM 0 HA ASP A 68 1.655 0.093 -13.349 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.140 -0.284 -15.222 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.056 1.028 -15.640 1.00 0.00 H new ATOM 1018 N ALA A 69 4.120 1.577 -11.943 1.00 0.00 N ATOM 1019 CA ALA A 69 5.237 1.423 -11.026 1.00 0.00 C ATOM 1020 C ALA A 69 4.803 1.649 -9.581 1.00 0.00 C ATOM 1021 O ALA A 69 5.518 1.277 -8.647 1.00 0.00 O ATOM 1022 CB ALA A 69 6.351 2.389 -11.396 1.00 0.00 C ATOM 0 H ALA A 69 3.774 2.533 -12.028 1.00 0.00 H new ATOM 0 HA ALA A 69 5.605 0.400 -11.110 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.184 2.266 -10.703 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.690 2.182 -12.411 1.00 0.00 H new ATOM 0 HB3 ALA A 69 5.979 3.412 -11.339 1.00 0.00 H new ATOM 1028 N ALA A 70 3.634 2.255 -9.404 1.00 0.00 N ATOM 1029 CA ALA A 70 3.131 2.584 -8.077 1.00 0.00 C ATOM 1030 C ALA A 70 1.618 2.417 -7.991 1.00 0.00 C ATOM 1031 O ALA A 70 0.887 2.933 -8.838 1.00 0.00 O ATOM 1032 CB ALA A 70 3.506 4.011 -7.728 1.00 0.00 C ATOM 0 H ALA A 70 3.015 2.529 -10.167 1.00 0.00 H new ATOM 0 HA ALA A 70 3.586 1.894 -7.366 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.128 4.254 -6.735 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.591 4.115 -7.739 1.00 0.00 H new ATOM 0 HB3 ALA A 70 3.069 4.691 -8.459 1.00 0.00 H new ATOM 1095 N SER A 75 -7.968 -1.895 -13.424 1.00 0.00 N ATOM 1096 CA SER A 75 -8.501 -2.996 -14.184 1.00 0.00 C ATOM 1097 C SER A 75 -9.944 -2.716 -14.618 1.00 0.00 C ATOM 1098 O SER A 75 -10.838 -2.613 -13.778 1.00 0.00 O ATOM 1099 CB SER A 75 -8.444 -4.240 -13.309 1.00 0.00 C ATOM 1100 OG SER A 75 -7.138 -4.436 -12.784 1.00 0.00 O ATOM 0 HA SER A 75 -7.911 -3.139 -15.089 1.00 0.00 H new ATOM 0 HB2 SER A 75 -9.158 -4.146 -12.491 1.00 0.00 H new ATOM 0 HB3 SER A 75 -8.740 -5.112 -13.892 1.00 0.00 H new ATOM 0 HG SER A 75 -6.708 -3.567 -12.644 1.00 0.00 H new ATOM 1106 N PRO A 76 -10.191 -2.578 -15.933 1.00 0.00 N ATOM 1107 CA PRO A 76 -11.543 -2.368 -16.470 1.00 0.00 C ATOM 1108 C PRO A 76 -12.444 -3.586 -16.261 1.00 0.00 C ATOM 1109 O PRO A 76 -13.672 -3.483 -16.301 1.00 0.00 O ATOM 1110 CB PRO A 76 -11.309 -2.123 -17.963 1.00 0.00 C ATOM 1111 CG PRO A 76 -9.983 -2.734 -18.254 1.00 0.00 C ATOM 1112 CD PRO A 76 -9.173 -2.589 -16.996 1.00 0.00 C ATOM 0 HA PRO A 76 -12.054 -1.545 -15.970 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -12.094 -2.580 -18.565 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -11.311 -1.057 -18.193 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.089 -3.783 -18.530 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -9.497 -2.232 -19.091 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.472 -3.414 -16.872 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -8.586 -1.670 -17.000 1.00 0.00 H new ATOM 1120 N ASP A 77 -11.821 -4.735 -16.024 1.00 0.00 N ATOM 1121 CA ASP A 77 -12.553 -5.968 -15.745 1.00 0.00 C ATOM 1122 C ASP A 77 -13.087 -5.957 -14.317 1.00 0.00 C ATOM 1123 O ASP A 77 -13.826 -6.851 -13.902 1.00 0.00 O ATOM 1124 CB ASP A 77 -11.653 -7.189 -15.962 1.00 0.00 C ATOM 1125 CG ASP A 77 -10.421 -7.178 -15.077 1.00 0.00 C ATOM 1126 OD1 ASP A 77 -9.489 -6.394 -15.360 1.00 0.00 O ATOM 1127 OD2 ASP A 77 -10.368 -7.962 -14.106 1.00 0.00 O ATOM 0 H ASP A 77 -10.806 -4.840 -16.019 1.00 0.00 H new ATOM 0 HA ASP A 77 -13.395 -6.030 -16.434 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -12.226 -8.096 -15.768 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -11.344 -7.225 -17.007 1.00 0.00 H new ATOM 1132 N LEU A 78 -12.703 -4.933 -13.572 1.00 0.00 N ATOM 1133 CA LEU A 78 -13.185 -4.732 -12.218 1.00 0.00 C ATOM 1134 C LEU A 78 -14.463 -3.905 -12.226 1.00 0.00 C ATOM 1135 O LEU A 78 -14.936 -3.458 -11.188 1.00 0.00 O ATOM 1136 CB LEU A 78 -12.105 -4.060 -11.370 1.00 0.00 C ATOM 1137 CG LEU A 78 -11.575 -4.896 -10.201 1.00 0.00 C ATOM 1138 CD1 LEU A 78 -11.241 -6.312 -10.642 1.00 0.00 C ATOM 1139 CD2 LEU A 78 -10.355 -4.231 -9.588 1.00 0.00 C ATOM 0 H LEU A 78 -12.048 -4.219 -13.890 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.414 -5.702 -11.777 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.268 -3.799 -12.018 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.505 -3.126 -10.975 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.360 -4.957 -9.448 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.867 -6.880 -9.790 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -12.138 -6.792 -11.033 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.478 -6.280 -11.420 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.989 -4.836 -8.758 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.573 -4.139 -10.342 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.626 -3.240 -9.223 1.00 0.00 H new ATOM 1151 N ILE A 79 -15.022 -3.702 -13.406 1.00 0.00 N ATOM 1152 CA ILE A 79 -16.272 -2.975 -13.521 1.00 0.00 C ATOM 1153 C ILE A 79 -17.314 -3.908 -14.092 1.00 0.00 C ATOM 1154 O ILE A 79 -17.272 -4.260 -15.273 1.00 0.00 O ATOM 1155 CB ILE A 79 -16.151 -1.724 -14.407 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -14.963 -0.880 -13.945 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -17.447 -0.911 -14.364 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -14.822 0.421 -14.690 1.00 0.00 C ATOM 0 H ILE A 79 -14.633 -4.028 -14.291 1.00 0.00 H new ATOM 0 HA ILE A 79 -16.557 -2.628 -12.528 1.00 0.00 H new ATOM 0 HB ILE A 79 -15.982 -2.031 -15.439 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -15.069 -0.670 -12.881 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -14.048 -1.459 -14.066 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -17.344 -0.029 -14.996 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -18.273 -1.523 -14.726 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -17.648 -0.601 -13.339 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -13.959 0.967 -14.309 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -14.684 0.219 -15.752 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -15.721 1.021 -14.549 1.00 0.00 H new ATOM 1170 N GLN A 80 -18.233 -4.324 -13.252 1.00 0.00 N ATOM 1171 CA GLN A 80 -19.183 -5.349 -13.628 1.00 0.00 C ATOM 1172 C GLN A 80 -20.607 -4.837 -13.551 1.00 0.00 C ATOM 1173 O GLN A 80 -20.956 -4.074 -12.662 1.00 0.00 O ATOM 1174 CB GLN A 80 -19.021 -6.561 -12.713 1.00 0.00 C ATOM 1175 CG GLN A 80 -17.636 -7.186 -12.772 1.00 0.00 C ATOM 1176 CD GLN A 80 -17.419 -8.227 -11.689 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -18.359 -8.892 -11.255 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -16.181 -8.381 -11.241 1.00 0.00 N ATOM 0 H GLN A 80 -18.344 -3.969 -12.302 1.00 0.00 H new ATOM 0 HA GLN A 80 -18.982 -5.636 -14.660 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -19.232 -6.262 -11.686 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -19.762 -7.313 -12.985 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -17.491 -7.648 -13.749 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -16.884 -6.403 -12.674 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -15.426 -7.812 -11.624 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.984 -9.068 -10.514 1.00 0.00 H new ATOM 1187 N TYR A 81 -21.413 -5.234 -14.509 1.00 0.00 N ATOM 1188 CA TYR A 81 -22.832 -4.940 -14.486 1.00 0.00 C ATOM 1189 C TYR A 81 -23.588 -6.128 -13.911 1.00 0.00 C ATOM 1190 O TYR A 81 -23.120 -7.266 -13.995 1.00 0.00 O ATOM 1191 CB TYR A 81 -23.308 -4.559 -15.881 1.00 0.00 C ATOM 1192 CG TYR A 81 -22.558 -3.358 -16.413 1.00 0.00 C ATOM 1193 CD1 TYR A 81 -22.774 -2.093 -15.881 1.00 0.00 C ATOM 1194 CD2 TYR A 81 -21.616 -3.491 -17.426 1.00 0.00 C ATOM 1195 CE1 TYR A 81 -22.077 -0.995 -16.342 1.00 0.00 C ATOM 1196 CE2 TYR A 81 -20.916 -2.394 -17.895 1.00 0.00 C ATOM 1197 CZ TYR A 81 -21.151 -1.149 -17.348 1.00 0.00 C ATOM 1198 OH TYR A 81 -20.451 -0.055 -17.802 1.00 0.00 O ATOM 0 H TYR A 81 -21.108 -5.767 -15.323 1.00 0.00 H new ATOM 0 HA TYR A 81 -23.029 -4.085 -13.840 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -23.171 -5.403 -16.557 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -24.376 -4.341 -15.855 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -23.501 -1.967 -15.092 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -21.428 -4.465 -17.853 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -22.257 -0.019 -15.915 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -20.189 -2.511 -18.685 1.00 0.00 H new ATOM 0 HH TYR A 81 -19.836 -0.332 -18.513 1.00 0.00 H new ATOM 1208 N PHE A 82 -24.764 -5.887 -13.356 1.00 0.00 N ATOM 1209 CA PHE A 82 -25.363 -6.835 -12.424 1.00 0.00 C ATOM 1210 C PHE A 82 -26.878 -6.757 -12.544 1.00 0.00 C ATOM 1211 O PHE A 82 -27.400 -5.828 -13.161 1.00 0.00 O ATOM 1212 CB PHE A 82 -24.932 -6.530 -10.987 1.00 0.00 C ATOM 1213 CG PHE A 82 -23.799 -7.388 -10.492 1.00 0.00 C ATOM 1214 CD1 PHE A 82 -22.481 -7.008 -10.686 1.00 0.00 C ATOM 1215 CD2 PHE A 82 -24.058 -8.572 -9.820 1.00 0.00 C ATOM 1216 CE1 PHE A 82 -21.443 -7.793 -10.222 1.00 0.00 C ATOM 1217 CE2 PHE A 82 -23.025 -9.362 -9.352 1.00 0.00 C ATOM 1218 CZ PHE A 82 -21.714 -8.972 -9.553 1.00 0.00 C ATOM 0 H PHE A 82 -25.321 -5.051 -13.531 1.00 0.00 H new ATOM 0 HA PHE A 82 -25.024 -7.841 -12.670 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -24.636 -5.483 -10.922 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -25.789 -6.661 -10.326 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -22.262 -6.087 -11.206 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -25.080 -8.881 -9.660 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -20.420 -7.486 -10.382 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -23.242 -10.282 -8.830 1.00 0.00 H new ATOM 0 HZ PHE A 82 -20.904 -9.586 -9.189 1.00 0.00 H new ATOM 1228 N SER A 83 -27.586 -7.711 -11.966 1.00 0.00 N ATOM 1229 CA SER A 83 -29.039 -7.654 -11.954 1.00 0.00 C ATOM 1230 C SER A 83 -29.531 -7.130 -10.612 1.00 0.00 C ATOM 1231 O SER A 83 -29.138 -7.624 -9.553 1.00 0.00 O ATOM 1232 CB SER A 83 -29.643 -9.028 -12.223 1.00 0.00 C ATOM 1233 OG SER A 83 -31.037 -8.926 -12.468 1.00 0.00 O ATOM 0 H SER A 83 -27.185 -8.527 -11.503 1.00 0.00 H new ATOM 0 HA SER A 83 -29.357 -6.976 -12.746 1.00 0.00 H new ATOM 0 HB2 SER A 83 -29.151 -9.485 -13.081 1.00 0.00 H new ATOM 0 HB3 SER A 83 -29.466 -9.682 -11.369 1.00 0.00 H new ATOM 0 HG SER A 83 -31.405 -9.818 -12.640 1.00 0.00 H new ATOM 1239 N ARG A 84 -30.384 -6.113 -10.679 1.00 0.00 N ATOM 1240 CA ARG A 84 -30.932 -5.446 -9.496 1.00 0.00 C ATOM 1241 C ARG A 84 -31.582 -6.415 -8.506 1.00 0.00 C ATOM 1242 O ARG A 84 -31.719 -6.091 -7.329 1.00 0.00 O ATOM 1243 CB ARG A 84 -31.967 -4.402 -9.932 1.00 0.00 C ATOM 1244 CG ARG A 84 -33.354 -4.984 -10.145 1.00 0.00 C ATOM 1245 CD ARG A 84 -34.195 -4.151 -11.092 1.00 0.00 C ATOM 1246 NE ARG A 84 -35.567 -4.668 -11.176 1.00 0.00 N ATOM 1247 CZ ARG A 84 -36.600 -4.020 -11.723 1.00 0.00 C ATOM 1248 NH1 ARG A 84 -36.451 -2.800 -12.213 1.00 0.00 N ATOM 1249 NH2 ARG A 84 -37.793 -4.601 -11.773 1.00 0.00 N ATOM 0 H ARG A 84 -30.719 -5.723 -11.560 1.00 0.00 H new ATOM 0 HA ARG A 84 -30.094 -4.975 -8.982 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -32.022 -3.617 -9.177 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -31.632 -3.932 -10.857 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -33.263 -5.996 -10.540 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -33.863 -5.061 -9.184 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -34.214 -3.116 -10.752 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -33.741 -4.153 -12.083 1.00 0.00 H new ATOM 0 HE ARG A 84 -35.745 -5.594 -10.787 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -35.540 -2.343 -12.176 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -37.247 -2.316 -12.628 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -37.919 -5.540 -11.394 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -38.583 -4.109 -12.190 1.00 0.00 H new ATOM 1263 N ARG A 85 -31.959 -7.603 -8.967 1.00 0.00 N ATOM 1264 CA ARG A 85 -32.713 -8.530 -8.131 1.00 0.00 C ATOM 1265 C ARG A 85 -31.834 -9.105 -7.037 1.00 0.00 C ATOM 1266 O ARG A 85 -32.271 -9.274 -5.897 1.00 0.00 O ATOM 1267 CB ARG A 85 -33.322 -9.660 -8.968 1.00 0.00 C ATOM 1268 CG ARG A 85 -34.430 -9.200 -9.901 1.00 0.00 C ATOM 1269 CD ARG A 85 -33.895 -8.738 -11.249 1.00 0.00 C ATOM 1270 NE ARG A 85 -34.930 -8.106 -12.063 1.00 0.00 N ATOM 1271 CZ ARG A 85 -34.686 -7.389 -13.161 1.00 0.00 C ATOM 1272 NH1 ARG A 85 -33.449 -7.282 -13.631 1.00 0.00 N ATOM 1273 NH2 ARG A 85 -35.685 -6.792 -13.796 1.00 0.00 N ATOM 0 H ARG A 85 -31.757 -7.945 -9.907 1.00 0.00 H new ATOM 0 HA ARG A 85 -33.526 -7.971 -7.668 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -32.534 -10.129 -9.557 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -33.717 -10.424 -8.298 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -35.136 -10.016 -10.053 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -34.981 -8.385 -9.433 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -33.077 -8.034 -11.092 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -33.482 -9.592 -11.787 1.00 0.00 H new ATOM 0 HE ARG A 85 -35.901 -8.220 -11.773 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -32.679 -7.749 -13.152 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -33.268 -6.732 -14.471 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -36.638 -6.881 -13.445 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -35.500 -6.243 -14.636 1.00 0.00 H new ATOM 1287 N GLU A 86 -30.583 -9.362 -7.382 1.00 0.00 N ATOM 1288 CA GLU A 86 -29.624 -9.914 -6.439 1.00 0.00 C ATOM 1289 C GLU A 86 -29.372 -8.941 -5.303 1.00 0.00 C ATOM 1290 O GLU A 86 -29.151 -9.341 -4.160 1.00 0.00 O ATOM 1291 CB GLU A 86 -28.313 -10.241 -7.145 1.00 0.00 C ATOM 1292 CG GLU A 86 -28.351 -11.558 -7.893 1.00 0.00 C ATOM 1293 CD GLU A 86 -28.488 -12.739 -6.958 1.00 0.00 C ATOM 1294 OE1 GLU A 86 -27.482 -13.125 -6.329 1.00 0.00 O ATOM 1295 OE2 GLU A 86 -29.606 -13.281 -6.835 1.00 0.00 O ATOM 0 H GLU A 86 -30.206 -9.196 -8.315 1.00 0.00 H new ATOM 0 HA GLU A 86 -30.041 -10.832 -6.026 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -28.075 -9.440 -7.845 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -27.509 -10.271 -6.409 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -29.186 -11.552 -8.594 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -27.440 -11.666 -8.482 1.00 0.00 H new ATOM 1302 N PHE A 87 -29.413 -7.658 -5.620 1.00 0.00 N ATOM 1303 CA PHE A 87 -29.153 -6.637 -4.626 1.00 0.00 C ATOM 1304 C PHE A 87 -30.411 -6.275 -3.875 1.00 0.00 C ATOM 1305 O PHE A 87 -30.379 -6.095 -2.665 1.00 0.00 O ATOM 1306 CB PHE A 87 -28.548 -5.386 -5.269 1.00 0.00 C ATOM 1307 CG PHE A 87 -27.173 -5.596 -5.834 1.00 0.00 C ATOM 1308 CD1 PHE A 87 -26.984 -6.360 -6.974 1.00 0.00 C ATOM 1309 CD2 PHE A 87 -26.068 -5.031 -5.220 1.00 0.00 C ATOM 1310 CE1 PHE A 87 -25.718 -6.555 -7.490 1.00 0.00 C ATOM 1311 CE2 PHE A 87 -24.802 -5.222 -5.732 1.00 0.00 C ATOM 1312 CZ PHE A 87 -24.626 -5.985 -6.869 1.00 0.00 C ATOM 0 H PHE A 87 -29.623 -7.302 -6.553 1.00 0.00 H new ATOM 0 HA PHE A 87 -28.433 -7.047 -3.917 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -29.209 -5.043 -6.065 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -28.507 -4.591 -4.525 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -27.836 -6.808 -7.464 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -26.199 -4.434 -4.330 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -25.583 -7.153 -8.379 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -23.949 -4.775 -5.244 1.00 0.00 H new ATOM 0 HZ PHE A 87 -23.635 -6.135 -7.272 1.00 0.00 H new ATOM 1322 N MET A 88 -31.521 -6.201 -4.589 1.00 0.00 N ATOM 1323 CA MET A 88 -32.781 -5.800 -3.985 1.00 0.00 C ATOM 1324 C MET A 88 -33.182 -6.764 -2.879 1.00 0.00 C ATOM 1325 O MET A 88 -33.765 -6.353 -1.875 1.00 0.00 O ATOM 1326 CB MET A 88 -33.898 -5.698 -5.020 1.00 0.00 C ATOM 1327 CG MET A 88 -35.235 -5.313 -4.404 1.00 0.00 C ATOM 1328 SD MET A 88 -36.543 -5.090 -5.624 1.00 0.00 S ATOM 1329 CE MET A 88 -36.604 -6.719 -6.365 1.00 0.00 C ATOM 0 H MET A 88 -31.576 -6.413 -5.585 1.00 0.00 H new ATOM 0 HA MET A 88 -32.630 -4.810 -3.555 1.00 0.00 H new ATOM 0 HB2 MET A 88 -33.624 -4.960 -5.773 1.00 0.00 H new ATOM 0 HB3 MET A 88 -34.001 -6.654 -5.533 1.00 0.00 H new ATOM 0 HG2 MET A 88 -35.536 -6.084 -3.695 1.00 0.00 H new ATOM 0 HG3 MET A 88 -35.114 -4.389 -3.838 1.00 0.00 H new ATOM 0 HE1 MET A 88 -37.541 -6.836 -6.910 1.00 0.00 H new ATOM 0 HE2 MET A 88 -35.767 -6.838 -7.053 1.00 0.00 H new ATOM 0 HE3 MET A 88 -36.542 -7.477 -5.584 1.00 0.00 H new ATOM 1339 N ASP A 89 -32.871 -8.044 -3.061 1.00 0.00 N ATOM 1340 CA ASP A 89 -33.115 -9.058 -2.036 1.00 0.00 C ATOM 1341 C ASP A 89 -32.456 -8.677 -0.712 1.00 0.00 C ATOM 1342 O ASP A 89 -32.962 -8.997 0.364 1.00 0.00 O ATOM 1343 CB ASP A 89 -32.580 -10.402 -2.522 1.00 0.00 C ATOM 1344 CG ASP A 89 -32.859 -11.545 -1.565 1.00 0.00 C ATOM 1345 OD1 ASP A 89 -33.952 -12.141 -1.643 1.00 0.00 O ATOM 1346 OD2 ASP A 89 -31.971 -11.872 -0.750 1.00 0.00 O ATOM 0 H ASP A 89 -32.446 -8.407 -3.914 1.00 0.00 H new ATOM 0 HA ASP A 89 -34.189 -9.128 -1.863 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -33.024 -10.632 -3.490 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -31.504 -10.322 -2.676 1.00 0.00 H new ATOM 1351 N ALA A 90 -31.338 -7.971 -0.801 1.00 0.00 N ATOM 1352 CA ALA A 90 -30.620 -7.515 0.382 1.00 0.00 C ATOM 1353 C ALA A 90 -30.918 -6.045 0.662 1.00 0.00 C ATOM 1354 O ALA A 90 -30.310 -5.430 1.542 1.00 0.00 O ATOM 1355 CB ALA A 90 -29.125 -7.725 0.198 1.00 0.00 C ATOM 0 H ALA A 90 -30.906 -7.700 -1.685 1.00 0.00 H new ATOM 0 HA ALA A 90 -30.957 -8.100 1.238 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -28.597 -7.381 1.087 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -28.923 -8.785 0.043 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -28.782 -7.160 -0.669 1.00 0.00 H new ATOM 1361 N GLY A 91 -31.863 -5.494 -0.085 1.00 0.00 N ATOM 1362 CA GLY A 91 -32.168 -4.085 0.011 1.00 0.00 C ATOM 1363 C GLY A 91 -31.625 -3.336 -1.180 1.00 0.00 C ATOM 1364 O GLY A 91 -30.496 -3.578 -1.606 1.00 0.00 O ATOM 0 H GLY A 91 -32.429 -6.006 -0.762 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -33.247 -3.946 0.073 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -31.741 -3.678 0.928 1.00 0.00 H new ATOM 1368 N GLU A 92 -32.421 -2.430 -1.721 1.00 0.00 N ATOM 1369 CA GLU A 92 -32.033 -1.701 -2.918 1.00 0.00 C ATOM 1370 C GLU A 92 -30.771 -0.886 -2.681 1.00 0.00 C ATOM 1371 O GLU A 92 -30.668 -0.131 -1.711 1.00 0.00 O ATOM 1372 CB GLU A 92 -33.167 -0.806 -3.404 1.00 0.00 C ATOM 1373 CG GLU A 92 -34.329 -1.585 -3.991 1.00 0.00 C ATOM 1374 CD GLU A 92 -35.371 -0.686 -4.620 1.00 0.00 C ATOM 1375 OE1 GLU A 92 -36.250 -0.183 -3.888 1.00 0.00 O ATOM 1376 OE2 GLU A 92 -35.307 -0.468 -5.847 1.00 0.00 O ATOM 0 H GLU A 92 -33.339 -2.181 -1.352 1.00 0.00 H new ATOM 0 HA GLU A 92 -31.820 -2.434 -3.696 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -33.526 -0.201 -2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -32.782 -0.117 -4.156 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -33.954 -2.281 -4.741 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -34.795 -2.182 -3.207 1.00 0.00 H new ATOM 1383 N PRO A 93 -29.790 -1.056 -3.576 1.00 0.00 N ATOM 1384 CA PRO A 93 -28.474 -0.430 -3.454 1.00 0.00 C ATOM 1385 C PRO A 93 -28.512 1.072 -3.713 1.00 0.00 C ATOM 1386 O PRO A 93 -29.488 1.598 -4.256 1.00 0.00 O ATOM 1387 CB PRO A 93 -27.644 -1.141 -4.522 1.00 0.00 C ATOM 1388 CG PRO A 93 -28.632 -1.598 -5.537 1.00 0.00 C ATOM 1389 CD PRO A 93 -29.906 -1.878 -4.795 1.00 0.00 C ATOM 0 HA PRO A 93 -28.070 -0.527 -2.446 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -26.908 -0.468 -4.963 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -27.094 -1.982 -4.100 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -28.787 -0.834 -6.299 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -28.277 -2.492 -6.049 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -30.781 -1.601 -5.383 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -30.005 -2.937 -4.556 1.00 0.00 H new ATOM 1397 N GLU A 94 -27.442 1.756 -3.336 1.00 0.00 N ATOM 1398 CA GLU A 94 -27.395 3.205 -3.436 1.00 0.00 C ATOM 1399 C GLU A 94 -26.310 3.646 -4.409 1.00 0.00 C ATOM 1400 O GLU A 94 -25.347 2.918 -4.653 1.00 0.00 O ATOM 1401 CB GLU A 94 -27.136 3.821 -2.062 1.00 0.00 C ATOM 1402 CG GLU A 94 -27.958 3.191 -0.952 1.00 0.00 C ATOM 1403 CD GLU A 94 -27.906 3.987 0.332 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -26.886 3.912 1.047 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -28.884 4.703 0.627 1.00 0.00 O ATOM 0 H GLU A 94 -26.596 1.330 -2.958 1.00 0.00 H new ATOM 0 HA GLU A 94 -28.359 3.550 -3.809 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -26.078 3.721 -1.821 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -27.354 4.888 -2.104 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -28.994 3.101 -1.278 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -27.594 2.181 -0.764 1.00 0.00 H new ATOM 1412 N ILE A 95 -26.478 4.839 -4.961 1.00 0.00 N ATOM 1413 CA ILE A 95 -25.537 5.380 -5.930 1.00 0.00 C ATOM 1414 C ILE A 95 -24.339 6.015 -5.226 1.00 0.00 C ATOM 1415 O ILE A 95 -24.496 6.746 -4.245 1.00 0.00 O ATOM 1416 CB ILE A 95 -26.232 6.405 -6.855 1.00 0.00 C ATOM 1417 CG1 ILE A 95 -27.373 5.711 -7.596 1.00 0.00 C ATOM 1418 CG2 ILE A 95 -25.250 7.027 -7.839 1.00 0.00 C ATOM 1419 CD1 ILE A 95 -28.016 6.544 -8.676 1.00 0.00 C ATOM 0 H ILE A 95 -27.264 5.455 -4.752 1.00 0.00 H new ATOM 0 HA ILE A 95 -25.174 4.557 -6.545 1.00 0.00 H new ATOM 0 HB ILE A 95 -26.629 7.216 -6.245 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -26.994 4.791 -8.042 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -28.137 5.424 -6.873 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -25.774 7.742 -8.473 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -24.460 7.539 -7.290 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -24.812 6.245 -8.459 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -28.815 5.973 -9.149 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -28.430 7.452 -8.237 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -27.269 6.810 -9.424 1.00 0.00 H new ATOM 1431 N GLY A 96 -23.151 5.729 -5.740 1.00 0.00 N ATOM 1432 CA GLY A 96 -21.918 6.185 -5.128 1.00 0.00 C ATOM 1433 C GLY A 96 -21.587 5.432 -3.854 1.00 0.00 C ATOM 1434 O GLY A 96 -20.798 5.900 -3.033 1.00 0.00 O ATOM 0 H GLY A 96 -23.018 5.178 -6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -21.099 6.068 -5.838 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -21.998 7.249 -4.906 1.00 0.00 H new ATOM 1438 N ALA A 97 -22.186 4.257 -3.695 1.00 0.00 N ATOM 1439 CA ALA A 97 -21.960 3.450 -2.509 1.00 0.00 C ATOM 1440 C ALA A 97 -20.898 2.384 -2.721 1.00 0.00 C ATOM 1441 O ALA A 97 -21.038 1.494 -3.558 1.00 0.00 O ATOM 1442 CB ALA A 97 -23.249 2.812 -2.028 1.00 0.00 C ATOM 0 H ALA A 97 -22.829 3.846 -4.372 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.592 4.131 -1.741 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -23.049 2.214 -1.139 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -23.972 3.591 -1.786 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -23.653 2.172 -2.812 1.00 0.00 H new ATOM 1448 N ILE A 98 -19.847 2.480 -1.927 1.00 0.00 N ATOM 1449 CA ILE A 98 -18.791 1.482 -1.911 1.00 0.00 C ATOM 1450 C ILE A 98 -19.167 0.414 -0.911 1.00 0.00 C ATOM 1451 O ILE A 98 -19.113 0.660 0.295 1.00 0.00 O ATOM 1452 CB ILE A 98 -17.428 2.075 -1.487 1.00 0.00 C ATOM 1453 CG1 ILE A 98 -17.221 3.457 -2.114 1.00 0.00 C ATOM 1454 CG2 ILE A 98 -16.290 1.127 -1.872 1.00 0.00 C ATOM 1455 CD1 ILE A 98 -15.890 4.091 -1.769 1.00 0.00 C ATOM 0 H ILE A 98 -19.701 3.251 -1.275 1.00 0.00 H new ATOM 0 HA ILE A 98 -18.689 1.085 -2.921 1.00 0.00 H new ATOM 0 HB ILE A 98 -17.424 2.192 -0.403 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -17.301 3.370 -3.198 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -18.024 4.118 -1.787 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -15.337 1.559 -1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -16.430 0.168 -1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -16.291 0.977 -2.952 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -15.817 5.067 -2.249 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -15.814 4.211 -0.688 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -15.080 3.452 -2.121 1.00 0.00 H new ATOM 1467 N MET A 99 -19.550 -0.767 -1.368 1.00 0.00 N ATOM 1468 CA MET A 99 -20.010 -1.792 -0.462 1.00 0.00 C ATOM 1469 C MET A 99 -19.212 -3.051 -0.749 1.00 0.00 C ATOM 1470 O MET A 99 -18.856 -3.315 -1.897 1.00 0.00 O ATOM 1471 CB MET A 99 -21.502 -2.081 -0.648 1.00 0.00 C ATOM 1472 CG MET A 99 -22.330 -0.883 -1.109 1.00 0.00 C ATOM 1473 SD MET A 99 -24.102 -1.131 -0.876 1.00 0.00 S ATOM 1474 CE MET A 99 -24.344 -2.667 -1.760 1.00 0.00 C ATOM 0 H MET A 99 -19.550 -1.033 -2.353 1.00 0.00 H new ATOM 0 HA MET A 99 -19.868 -1.455 0.565 1.00 0.00 H new ATOM 0 HB2 MET A 99 -21.615 -2.885 -1.375 1.00 0.00 H new ATOM 0 HB3 MET A 99 -21.908 -2.445 0.296 1.00 0.00 H new ATOM 0 HG2 MET A 99 -22.016 0.004 -0.559 1.00 0.00 H new ATOM 0 HG3 MET A 99 -22.129 -0.692 -2.163 1.00 0.00 H new ATOM 0 HE1 MET A 99 -25.411 -2.846 -1.893 1.00 0.00 H new ATOM 0 HE2 MET A 99 -23.862 -2.605 -2.736 1.00 0.00 H new ATOM 0 HE3 MET A 99 -23.906 -3.487 -1.191 1.00 0.00 H new ATOM 1484 N LEU A 100 -18.912 -3.801 0.283 1.00 0.00 N ATOM 1485 CA LEU A 100 -18.093 -4.998 0.140 1.00 0.00 C ATOM 1486 C LEU A 100 -18.899 -6.138 -0.478 1.00 0.00 C ATOM 1487 O LEU A 100 -19.727 -6.755 0.190 1.00 0.00 O ATOM 1488 CB LEU A 100 -17.509 -5.426 1.494 1.00 0.00 C ATOM 1489 CG LEU A 100 -16.298 -4.624 1.999 1.00 0.00 C ATOM 1490 CD1 LEU A 100 -15.158 -4.675 0.997 1.00 0.00 C ATOM 1491 CD2 LEU A 100 -16.677 -3.183 2.297 1.00 0.00 C ATOM 0 H LEU A 100 -19.220 -3.610 1.237 1.00 0.00 H new ATOM 0 HA LEU A 100 -17.267 -4.760 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -18.298 -5.361 2.243 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -17.220 -6.475 1.426 1.00 0.00 H new ATOM 0 HG LEU A 100 -15.962 -5.085 2.928 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -14.313 -4.100 1.377 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -14.853 -5.710 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -15.488 -4.251 0.049 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -15.800 -2.642 2.652 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -17.052 -2.710 1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -17.451 -3.162 3.064 1.00 0.00 H new ATOM 1503 N PHE A 101 -18.642 -6.417 -1.755 1.00 0.00 N ATOM 1504 CA PHE A 101 -19.369 -7.465 -2.461 1.00 0.00 C ATOM 1505 C PHE A 101 -18.632 -8.787 -2.375 1.00 0.00 C ATOM 1506 O PHE A 101 -17.575 -8.976 -2.970 1.00 0.00 O ATOM 1507 CB PHE A 101 -19.571 -7.092 -3.927 1.00 0.00 C ATOM 1508 CG PHE A 101 -20.264 -5.780 -4.120 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -21.533 -5.573 -3.612 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -19.640 -4.749 -4.803 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -22.169 -4.364 -3.782 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -20.274 -3.537 -4.975 1.00 0.00 C ATOM 1513 CZ PHE A 101 -21.539 -3.344 -4.464 1.00 0.00 C ATOM 0 H PHE A 101 -17.940 -5.935 -2.317 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.342 -7.569 -1.982 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.600 -7.057 -4.422 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -20.150 -7.875 -4.416 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -22.030 -6.368 -3.076 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -18.648 -4.896 -5.204 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -23.161 -4.214 -3.382 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -19.780 -2.740 -5.510 1.00 0.00 H new ATOM 0 HZ PHE A 101 -22.037 -2.395 -4.597 1.00 0.00 H new ATOM 1523 N THR A 102 -19.218 -9.686 -1.622 1.00 0.00 N ATOM 1524 CA THR A 102 -18.620 -10.996 -1.427 1.00 0.00 C ATOM 1525 C THR A 102 -18.518 -11.809 -2.725 1.00 0.00 C ATOM 1526 O THR A 102 -19.511 -12.220 -3.328 1.00 0.00 O ATOM 1527 CB THR A 102 -19.391 -11.814 -0.387 1.00 0.00 C ATOM 1528 OG1 THR A 102 -19.639 -11.008 0.772 1.00 0.00 O ATOM 1529 CG2 THR A 102 -18.586 -13.036 0.007 1.00 0.00 C ATOM 0 H THR A 102 -20.102 -9.542 -1.135 1.00 0.00 H new ATOM 0 HA THR A 102 -17.609 -10.803 -1.069 1.00 0.00 H new ATOM 0 HB THR A 102 -20.341 -12.134 -0.816 1.00 0.00 H new ATOM 0 HG1 THR A 102 -19.070 -11.312 1.510 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.140 -13.614 0.747 1.00 0.00 H new ATOM 0 HG22 THR A 102 -18.406 -13.652 -0.874 1.00 0.00 H new ATOM 0 HG23 THR A 102 -17.632 -12.722 0.431 1.00 0.00 H new ATOM 1537 N ALA A 103 -17.271 -11.995 -3.127 1.00 0.00 N ATOM 1538 CA ALA A 103 -16.885 -12.708 -4.332 1.00 0.00 C ATOM 1539 C ALA A 103 -17.035 -14.217 -4.202 1.00 0.00 C ATOM 1540 O ALA A 103 -17.316 -14.731 -3.120 1.00 0.00 O ATOM 1541 CB ALA A 103 -15.452 -12.343 -4.681 1.00 0.00 C ATOM 0 H ALA A 103 -16.471 -11.640 -2.603 1.00 0.00 H new ATOM 0 HA ALA A 103 -17.560 -12.404 -5.132 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -15.151 -12.873 -5.585 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -15.381 -11.268 -4.850 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -14.794 -12.625 -3.859 1.00 0.00 H new ATOM 1547 N MET A 104 -16.876 -14.914 -5.324 1.00 0.00 N ATOM 1548 CA MET A 104 -16.970 -16.375 -5.362 1.00 0.00 C ATOM 1549 C MET A 104 -15.978 -17.029 -4.400 1.00 0.00 C ATOM 1550 O MET A 104 -16.265 -18.071 -3.812 1.00 0.00 O ATOM 1551 CB MET A 104 -16.728 -16.892 -6.780 1.00 0.00 C ATOM 1552 CG MET A 104 -17.844 -16.548 -7.759 1.00 0.00 C ATOM 1553 SD MET A 104 -17.958 -14.780 -8.129 1.00 0.00 S ATOM 1554 CE MET A 104 -16.392 -14.497 -8.951 1.00 0.00 C ATOM 0 H MET A 104 -16.679 -14.487 -6.229 1.00 0.00 H new ATOM 0 HA MET A 104 -17.978 -16.643 -5.047 1.00 0.00 H new ATOM 0 HB2 MET A 104 -15.791 -16.479 -7.152 1.00 0.00 H new ATOM 0 HB3 MET A 104 -16.608 -17.975 -6.746 1.00 0.00 H new ATOM 0 HG2 MET A 104 -17.684 -17.096 -8.687 1.00 0.00 H new ATOM 0 HG3 MET A 104 -18.795 -16.887 -7.348 1.00 0.00 H new ATOM 0 HE1 MET A 104 -16.445 -13.573 -9.527 1.00 0.00 H new ATOM 0 HE2 MET A 104 -15.600 -14.415 -8.207 1.00 0.00 H new ATOM 0 HE3 MET A 104 -16.177 -15.330 -9.620 1.00 0.00 H new ATOM 1564 N ASP A 105 -14.817 -16.404 -4.227 1.00 0.00 N ATOM 1565 CA ASP A 105 -13.798 -16.895 -3.292 1.00 0.00 C ATOM 1566 C ASP A 105 -14.178 -16.557 -1.845 1.00 0.00 C ATOM 1567 O ASP A 105 -13.335 -16.533 -0.946 1.00 0.00 O ATOM 1568 CB ASP A 105 -12.407 -16.360 -3.643 1.00 0.00 C ATOM 1569 CG ASP A 105 -12.237 -14.884 -3.368 1.00 0.00 C ATOM 1570 OD1 ASP A 105 -13.050 -14.084 -3.867 1.00 0.00 O ATOM 1571 OD2 ASP A 105 -11.267 -14.519 -2.672 1.00 0.00 O ATOM 0 H ASP A 105 -14.554 -15.552 -4.723 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.758 -17.980 -3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.660 -16.915 -3.075 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.210 -16.549 -4.698 1.00 0.00 H new ATOM 1576 N GLY A 106 -15.478 -16.334 -1.649 1.00 0.00 N ATOM 1577 CA GLY A 106 -15.985 -15.966 -0.333 1.00 0.00 C ATOM 1578 C GLY A 106 -15.518 -14.617 0.170 1.00 0.00 C ATOM 1579 O GLY A 106 -15.982 -14.148 1.208 1.00 0.00 O ATOM 0 H GLY A 106 -16.189 -16.401 -2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -17.075 -15.970 -0.364 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -15.684 -16.730 0.384 1.00 0.00 H new ATOM 1583 N SER A 107 -14.597 -13.999 -0.539 1.00 0.00 N ATOM 1584 CA SER A 107 -13.970 -12.794 -0.053 1.00 0.00 C ATOM 1585 C SER A 107 -14.772 -11.585 -0.440 1.00 0.00 C ATOM 1586 O SER A 107 -15.351 -11.520 -1.516 1.00 0.00 O ATOM 1587 CB SER A 107 -12.560 -12.668 -0.604 1.00 0.00 C ATOM 1588 OG SER A 107 -11.855 -11.587 -0.015 1.00 0.00 O ATOM 0 H SER A 107 -14.268 -14.313 -1.452 1.00 0.00 H new ATOM 0 HA SER A 107 -13.924 -12.854 1.034 1.00 0.00 H new ATOM 0 HB2 SER A 107 -12.017 -13.596 -0.425 1.00 0.00 H new ATOM 0 HB3 SER A 107 -12.604 -12.527 -1.684 1.00 0.00 H new ATOM 0 HG SER A 107 -10.952 -11.540 -0.394 1.00 0.00 H new ATOM 1594 N GLU A 108 -14.778 -10.628 0.441 1.00 0.00 N ATOM 1595 CA GLU A 108 -15.459 -9.400 0.168 1.00 0.00 C ATOM 1596 C GLU A 108 -14.600 -8.526 -0.697 1.00 0.00 C ATOM 1597 O GLU A 108 -13.377 -8.651 -0.727 1.00 0.00 O ATOM 1598 CB GLU A 108 -15.783 -8.674 1.466 1.00 0.00 C ATOM 1599 CG GLU A 108 -17.149 -9.000 2.046 1.00 0.00 C ATOM 1600 CD GLU A 108 -17.130 -10.232 2.923 1.00 0.00 C ATOM 1601 OE1 GLU A 108 -16.471 -10.198 3.978 1.00 0.00 O ATOM 1602 OE2 GLU A 108 -17.787 -11.230 2.571 1.00 0.00 O ATOM 0 H GLU A 108 -14.320 -10.675 1.351 1.00 0.00 H new ATOM 0 HA GLU A 108 -16.390 -9.624 -0.352 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -15.020 -8.920 2.205 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -15.723 -7.600 1.291 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -17.505 -8.150 2.628 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -17.859 -9.149 1.232 1.00 0.00 H new ATOM 1609 N MET A 109 -15.261 -7.633 -1.398 1.00 0.00 N ATOM 1610 CA MET A 109 -14.627 -6.951 -2.509 1.00 0.00 C ATOM 1611 C MET A 109 -15.001 -5.484 -2.419 1.00 0.00 C ATOM 1612 O MET A 109 -16.191 -5.175 -2.345 1.00 0.00 O ATOM 1613 CB MET A 109 -15.077 -7.519 -3.852 1.00 0.00 C ATOM 1614 CG MET A 109 -14.593 -8.926 -4.120 1.00 0.00 C ATOM 1615 SD MET A 109 -12.804 -9.025 -4.300 1.00 0.00 S ATOM 1616 CE MET A 109 -12.600 -8.304 -5.925 1.00 0.00 C ATOM 0 H MET A 109 -16.229 -7.362 -1.223 1.00 0.00 H new ATOM 0 HA MET A 109 -13.547 -7.088 -2.449 1.00 0.00 H new ATOM 0 HB2 MET A 109 -16.166 -7.507 -3.893 1.00 0.00 H new ATOM 0 HB3 MET A 109 -14.721 -6.866 -4.648 1.00 0.00 H new ATOM 0 HG2 MET A 109 -14.908 -9.576 -3.303 1.00 0.00 H new ATOM 0 HG3 MET A 109 -15.066 -9.302 -5.027 1.00 0.00 H new ATOM 0 HE1 MET A 109 -11.780 -8.801 -6.443 1.00 0.00 H new ATOM 0 HE2 MET A 109 -13.520 -8.429 -6.497 1.00 0.00 H new ATOM 0 HE3 MET A 109 -12.376 -7.242 -5.826 1.00 0.00 H new ATOM 1626 N PRO A 110 -14.051 -4.551 -2.390 1.00 0.00 N ATOM 1627 CA PRO A 110 -14.405 -3.142 -2.410 1.00 0.00 C ATOM 1628 C PRO A 110 -14.974 -2.751 -3.766 1.00 0.00 C ATOM 1629 O PRO A 110 -14.310 -2.869 -4.795 1.00 0.00 O ATOM 1630 CB PRO A 110 -13.100 -2.420 -2.108 1.00 0.00 C ATOM 1631 CG PRO A 110 -12.014 -3.388 -2.458 1.00 0.00 C ATOM 1632 CD PRO A 110 -12.598 -4.775 -2.338 1.00 0.00 C ATOM 0 HA PRO A 110 -15.180 -2.888 -1.687 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.013 -1.505 -2.694 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.045 -2.132 -1.058 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -11.651 -3.210 -3.470 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -11.162 -3.270 -1.788 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -12.264 -5.421 -3.150 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -12.301 -5.255 -1.406 1.00 0.00 H new ATOM 1640 N GLY A 111 -16.212 -2.298 -3.748 1.00 0.00 N ATOM 1641 CA GLY A 111 -16.932 -2.049 -4.973 1.00 0.00 C ATOM 1642 C GLY A 111 -17.831 -0.853 -4.836 1.00 0.00 C ATOM 1643 O GLY A 111 -18.708 -0.841 -3.973 1.00 0.00 O ATOM 0 H GLY A 111 -16.737 -2.096 -2.897 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.226 -1.886 -5.787 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -17.524 -2.926 -5.235 1.00 0.00 H new ATOM 1647 N VAL A 112 -17.638 0.156 -5.659 1.00 0.00 N ATOM 1648 CA VAL A 112 -18.473 1.328 -5.564 1.00 0.00 C ATOM 1649 C VAL A 112 -19.527 1.320 -6.649 1.00 0.00 C ATOM 1650 O VAL A 112 -19.240 1.445 -7.840 1.00 0.00 O ATOM 1651 CB VAL A 112 -17.663 2.646 -5.598 1.00 0.00 C ATOM 1652 CG1 VAL A 112 -16.833 2.783 -6.862 1.00 0.00 C ATOM 1653 CG2 VAL A 112 -18.604 3.829 -5.438 1.00 0.00 C ATOM 0 H VAL A 112 -16.924 0.187 -6.387 1.00 0.00 H new ATOM 0 HA VAL A 112 -18.963 1.287 -4.591 1.00 0.00 H new ATOM 0 HB VAL A 112 -16.960 2.626 -4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -16.284 3.724 -6.837 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -16.129 1.954 -6.926 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -17.490 2.770 -7.732 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -18.031 4.756 -5.462 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -19.329 3.830 -6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -19.128 3.751 -4.485 1.00 0.00 H new ATOM 1663 N ILE A 113 -20.748 1.081 -6.227 1.00 0.00 N ATOM 1664 CA ILE A 113 -21.871 1.219 -7.120 1.00 0.00 C ATOM 1665 C ILE A 113 -21.974 2.644 -7.616 1.00 0.00 C ATOM 1666 O ILE A 113 -22.316 3.553 -6.873 1.00 0.00 O ATOM 1667 CB ILE A 113 -23.178 0.816 -6.428 1.00 0.00 C ATOM 1668 CG1 ILE A 113 -23.022 -0.554 -5.772 1.00 0.00 C ATOM 1669 CG2 ILE A 113 -24.303 0.786 -7.438 1.00 0.00 C ATOM 1670 CD1 ILE A 113 -24.282 -1.063 -5.114 1.00 0.00 C ATOM 0 H ILE A 113 -20.986 0.792 -5.278 1.00 0.00 H new ATOM 0 HA ILE A 113 -21.709 0.553 -7.968 1.00 0.00 H new ATOM 0 HB ILE A 113 -23.414 1.548 -5.656 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -22.701 -1.273 -6.526 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -22.230 -0.501 -5.025 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -25.230 0.499 -6.942 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -24.420 1.775 -7.882 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -24.071 0.063 -8.220 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -24.092 -2.040 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -24.593 -0.366 -4.336 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -25.072 -1.150 -5.860 1.00 0.00 H new ATOM 1682 N ARG A 114 -21.679 2.816 -8.886 1.00 0.00 N ATOM 1683 CA ARG A 114 -21.601 4.130 -9.483 1.00 0.00 C ATOM 1684 C ARG A 114 -22.992 4.690 -9.756 1.00 0.00 C ATOM 1685 O ARG A 114 -23.199 5.899 -9.680 1.00 0.00 O ATOM 1686 CB ARG A 114 -20.754 4.050 -10.758 1.00 0.00 C ATOM 1687 CG ARG A 114 -20.675 5.348 -11.558 1.00 0.00 C ATOM 1688 CD ARG A 114 -21.804 5.456 -12.570 1.00 0.00 C ATOM 1689 NE ARG A 114 -21.646 4.499 -13.663 1.00 0.00 N ATOM 1690 CZ ARG A 114 -22.538 4.315 -14.637 1.00 0.00 C ATOM 1691 NH1 ARG A 114 -23.660 5.025 -14.664 1.00 0.00 N ATOM 1692 NH2 ARG A 114 -22.296 3.424 -15.592 1.00 0.00 N ATOM 0 H ARG A 114 -21.487 2.050 -9.532 1.00 0.00 H new ATOM 0 HA ARG A 114 -21.120 4.819 -8.789 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -19.743 3.745 -10.487 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -21.162 3.269 -11.400 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -20.715 6.198 -10.877 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -19.717 5.399 -12.075 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -22.757 5.283 -12.071 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -21.834 6.468 -12.974 1.00 0.00 H new ATOM 0 HE ARG A 114 -20.797 3.934 -13.682 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -23.844 5.716 -13.937 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -24.338 4.879 -15.412 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -21.431 2.884 -15.578 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -22.975 3.280 -16.339 1.00 0.00 H new ATOM 1706 N GLU A 115 -23.942 3.816 -10.071 1.00 0.00 N ATOM 1707 CA GLU A 115 -25.311 4.244 -10.315 1.00 0.00 C ATOM 1708 C GLU A 115 -26.265 3.070 -10.165 1.00 0.00 C ATOM 1709 O GLU A 115 -25.847 1.913 -10.217 1.00 0.00 O ATOM 1710 CB GLU A 115 -25.467 4.856 -11.711 1.00 0.00 C ATOM 1711 CG GLU A 115 -26.580 5.885 -11.781 1.00 0.00 C ATOM 1712 CD GLU A 115 -27.024 6.188 -13.195 1.00 0.00 C ATOM 1713 OE1 GLU A 115 -26.352 6.988 -13.875 1.00 0.00 O ATOM 1714 OE2 GLU A 115 -28.053 5.632 -13.630 1.00 0.00 O ATOM 0 H GLU A 115 -23.789 2.812 -10.163 1.00 0.00 H new ATOM 0 HA GLU A 115 -25.553 5.008 -9.576 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -24.527 5.323 -12.005 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -25.667 4.062 -12.431 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -27.435 5.526 -11.208 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -26.244 6.807 -11.307 1.00 0.00 H new ATOM 1721 N ILE A 116 -27.541 3.366 -9.971 1.00 0.00 N ATOM 1722 CA ILE A 116 -28.557 2.333 -9.945 1.00 0.00 C ATOM 1723 C ILE A 116 -29.386 2.403 -11.214 1.00 0.00 C ATOM 1724 O ILE A 116 -30.189 3.319 -11.398 1.00 0.00 O ATOM 1725 CB ILE A 116 -29.509 2.438 -8.734 1.00 0.00 C ATOM 1726 CG1 ILE A 116 -28.731 2.561 -7.421 1.00 0.00 C ATOM 1727 CG2 ILE A 116 -30.425 1.221 -8.695 1.00 0.00 C ATOM 1728 CD1 ILE A 116 -27.702 1.478 -7.206 1.00 0.00 C ATOM 0 H ILE A 116 -27.894 4.312 -9.830 1.00 0.00 H new ATOM 0 HA ILE A 116 -28.027 1.384 -9.865 1.00 0.00 H new ATOM 0 HB ILE A 116 -30.110 3.340 -8.847 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -28.232 3.530 -7.397 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -29.437 2.545 -6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -31.096 1.298 -7.839 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -31.011 1.177 -9.613 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -29.824 0.316 -8.605 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -27.197 1.640 -6.254 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -28.194 0.505 -7.195 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -26.971 1.505 -8.014 1.00 0.00 H new ATOM 1740 N ASN A 117 -29.175 1.443 -12.085 1.00 0.00 N ATOM 1741 CA ASN A 117 -29.923 1.361 -13.331 1.00 0.00 C ATOM 1742 C ASN A 117 -31.249 0.674 -13.064 1.00 0.00 C ATOM 1743 O ASN A 117 -31.373 -0.050 -12.077 1.00 0.00 O ATOM 1744 CB ASN A 117 -29.140 0.614 -14.421 1.00 0.00 C ATOM 1745 CG ASN A 117 -27.982 1.419 -14.992 1.00 0.00 C ATOM 1746 OD1 ASN A 117 -27.591 1.233 -16.145 1.00 0.00 O ATOM 1747 ND2 ASN A 117 -27.426 2.314 -14.192 1.00 0.00 N ATOM 0 H ASN A 117 -28.488 0.700 -11.957 1.00 0.00 H new ATOM 0 HA ASN A 117 -30.094 2.372 -13.700 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -28.756 -0.318 -14.008 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -29.821 0.347 -15.229 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -26.645 2.879 -14.524 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -27.779 2.439 -13.243 1.00 0.00 H new ATOM 1754 N GLY A 118 -32.235 0.908 -13.913 1.00 0.00 N ATOM 1755 CA GLY A 118 -33.569 0.411 -13.642 1.00 0.00 C ATOM 1756 C GLY A 118 -33.608 -1.095 -13.455 1.00 0.00 C ATOM 1757 O GLY A 118 -34.158 -1.579 -12.473 1.00 0.00 O ATOM 0 H GLY A 118 -32.138 1.431 -14.783 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -33.957 0.894 -12.745 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -34.229 0.688 -14.464 1.00 0.00 H new ATOM 1761 N ASP A 119 -32.988 -1.822 -14.369 1.00 0.00 N ATOM 1762 CA ASP A 119 -32.979 -3.279 -14.339 1.00 0.00 C ATOM 1763 C ASP A 119 -31.610 -3.817 -13.943 1.00 0.00 C ATOM 1764 O ASP A 119 -31.470 -4.979 -13.559 1.00 0.00 O ATOM 1765 CB ASP A 119 -33.366 -3.852 -15.702 1.00 0.00 C ATOM 1766 CG ASP A 119 -34.863 -3.897 -15.907 1.00 0.00 C ATOM 1767 OD1 ASP A 119 -35.457 -2.848 -16.238 1.00 0.00 O ATOM 1768 OD2 ASP A 119 -35.450 -4.986 -15.739 1.00 0.00 O ATOM 0 H ASP A 119 -32.476 -1.421 -15.154 1.00 0.00 H new ATOM 0 HA ASP A 119 -33.710 -3.590 -13.593 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -32.913 -3.248 -16.488 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -32.959 -4.859 -15.798 1.00 0.00 H new ATOM 1773 N SER A 120 -30.611 -2.953 -14.003 1.00 0.00 N ATOM 1774 CA SER A 120 -29.219 -3.368 -13.874 1.00 0.00 C ATOM 1775 C SER A 120 -28.526 -2.626 -12.733 1.00 0.00 C ATOM 1776 O SER A 120 -28.967 -1.560 -12.314 1.00 0.00 O ATOM 1777 CB SER A 120 -28.484 -3.107 -15.197 1.00 0.00 C ATOM 1778 OG SER A 120 -27.146 -3.582 -15.159 1.00 0.00 O ATOM 0 H SER A 120 -30.737 -1.950 -14.141 1.00 0.00 H new ATOM 0 HA SER A 120 -29.194 -4.433 -13.644 1.00 0.00 H new ATOM 0 HB2 SER A 120 -29.019 -3.593 -16.012 1.00 0.00 H new ATOM 0 HB3 SER A 120 -28.484 -2.038 -15.408 1.00 0.00 H new ATOM 0 HG SER A 120 -27.083 -4.332 -14.531 1.00 0.00 H new ATOM 1784 N ILE A 121 -27.451 -3.204 -12.220 1.00 0.00 N ATOM 1785 CA ILE A 121 -26.659 -2.554 -11.192 1.00 0.00 C ATOM 1786 C ILE A 121 -25.276 -2.211 -11.730 1.00 0.00 C ATOM 1787 O ILE A 121 -24.656 -3.000 -12.441 1.00 0.00 O ATOM 1788 CB ILE A 121 -26.524 -3.427 -9.922 1.00 0.00 C ATOM 1789 CG1 ILE A 121 -27.905 -3.751 -9.346 1.00 0.00 C ATOM 1790 CG2 ILE A 121 -25.666 -2.726 -8.872 1.00 0.00 C ATOM 1791 CD1 ILE A 121 -28.705 -2.530 -8.935 1.00 0.00 C ATOM 0 H ILE A 121 -27.108 -4.123 -12.500 1.00 0.00 H new ATOM 0 HA ILE A 121 -27.182 -1.639 -10.912 1.00 0.00 H new ATOM 0 HB ILE A 121 -26.033 -4.359 -10.201 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -28.474 -4.312 -10.087 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -27.782 -4.401 -8.479 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -25.585 -3.358 -7.988 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -24.672 -2.541 -9.279 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -26.128 -1.777 -8.599 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -29.670 -2.844 -8.537 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -28.159 -1.978 -8.170 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -28.861 -1.889 -9.802 1.00 0.00 H new ATOM 1803 N THR A 122 -24.825 -1.018 -11.397 1.00 0.00 N ATOM 1804 CA THR A 122 -23.509 -0.564 -11.797 1.00 0.00 C ATOM 1805 C THR A 122 -22.497 -0.857 -10.696 1.00 0.00 C ATOM 1806 O THR A 122 -22.793 -0.716 -9.514 1.00 0.00 O ATOM 1807 CB THR A 122 -23.483 0.925 -12.158 1.00 0.00 C ATOM 1808 OG1 THR A 122 -24.653 1.267 -12.915 1.00 0.00 O ATOM 1809 CG2 THR A 122 -22.240 1.236 -12.979 1.00 0.00 C ATOM 0 H THR A 122 -25.355 -0.342 -10.847 1.00 0.00 H new ATOM 0 HA THR A 122 -23.240 -1.115 -12.699 1.00 0.00 H new ATOM 0 HB THR A 122 -23.466 1.510 -11.238 1.00 0.00 H new ATOM 0 HG1 THR A 122 -25.356 1.579 -12.308 1.00 0.00 H new ATOM 0 HG21 THR A 122 -22.227 2.296 -13.233 1.00 0.00 H new ATOM 0 HG22 THR A 122 -21.350 0.991 -12.399 1.00 0.00 H new ATOM 0 HG23 THR A 122 -22.251 0.644 -13.894 1.00 0.00 H new ATOM 1817 N VAL A 123 -21.288 -1.243 -11.098 1.00 0.00 N ATOM 1818 CA VAL A 123 -20.410 -1.845 -10.090 1.00 0.00 C ATOM 1819 C VAL A 123 -18.955 -1.499 -10.379 1.00 0.00 C ATOM 1820 O VAL A 123 -18.384 -2.023 -11.337 1.00 0.00 O ATOM 1821 CB VAL A 123 -20.558 -3.371 -9.921 1.00 0.00 C ATOM 1822 CG1 VAL A 123 -19.702 -3.831 -8.755 1.00 0.00 C ATOM 1823 CG2 VAL A 123 -22.007 -3.770 -9.691 1.00 0.00 C ATOM 0 H VAL A 123 -20.911 -1.161 -12.042 1.00 0.00 H new ATOM 0 HA VAL A 123 -20.731 -1.411 -9.143 1.00 0.00 H new ATOM 0 HB VAL A 123 -20.225 -3.852 -10.841 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -19.804 -4.909 -8.632 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -18.658 -3.585 -8.951 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -20.028 -3.330 -7.844 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -22.073 -4.852 -9.576 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -22.379 -3.286 -8.788 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -22.610 -3.458 -10.544 1.00 0.00 H new ATOM 1833 N ASP A 124 -18.347 -0.641 -9.593 1.00 0.00 N ATOM 1834 CA ASP A 124 -16.917 -0.393 -9.771 1.00 0.00 C ATOM 1835 C ASP A 124 -16.074 -0.997 -8.650 1.00 0.00 C ATOM 1836 O ASP A 124 -15.967 -0.433 -7.567 1.00 0.00 O ATOM 1837 CB ASP A 124 -16.657 1.104 -9.895 1.00 0.00 C ATOM 1838 CG ASP A 124 -15.201 1.424 -10.132 1.00 0.00 C ATOM 1839 OD1 ASP A 124 -14.600 0.813 -11.034 1.00 0.00 O ATOM 1840 OD2 ASP A 124 -14.651 2.297 -9.425 1.00 0.00 O ATOM 0 H ASP A 124 -18.794 -0.113 -8.844 1.00 0.00 H new ATOM 0 HA ASP A 124 -16.613 -0.889 -10.693 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -17.251 1.505 -10.716 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -16.991 1.603 -8.986 1.00 0.00 H new ATOM 1845 N PHE A 125 -15.451 -2.142 -8.931 1.00 0.00 N ATOM 1846 CA PHE A 125 -14.580 -2.818 -7.959 1.00 0.00 C ATOM 1847 C PHE A 125 -13.187 -2.195 -7.951 1.00 0.00 C ATOM 1848 O PHE A 125 -12.266 -2.726 -7.324 1.00 0.00 O ATOM 1849 CB PHE A 125 -14.434 -4.312 -8.276 1.00 0.00 C ATOM 1850 CG PHE A 125 -15.651 -5.159 -8.026 1.00 0.00 C ATOM 1851 CD1 PHE A 125 -15.885 -5.714 -6.775 1.00 0.00 C ATOM 1852 CD2 PHE A 125 -16.539 -5.432 -9.051 1.00 0.00 C ATOM 1853 CE1 PHE A 125 -16.984 -6.525 -6.554 1.00 0.00 C ATOM 1854 CE2 PHE A 125 -17.641 -6.238 -8.834 1.00 0.00 C ATOM 1855 CZ PHE A 125 -17.862 -6.786 -7.584 1.00 0.00 C ATOM 0 H PHE A 125 -15.532 -2.625 -9.826 1.00 0.00 H new ATOM 0 HA PHE A 125 -15.050 -2.699 -6.983 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -14.152 -4.415 -9.324 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -13.610 -4.710 -7.684 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -15.201 -5.510 -5.965 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -16.370 -5.011 -10.031 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -17.153 -6.953 -5.577 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -18.330 -6.440 -9.641 1.00 0.00 H new ATOM 0 HZ PHE A 125 -18.721 -7.418 -7.415 1.00 0.00 H new ATOM 1865 N ASN A 126 -13.029 -1.098 -8.680 1.00 0.00 N ATOM 1866 CA ASN A 126 -11.741 -0.418 -8.737 1.00 0.00 C ATOM 1867 C ASN A 126 -11.275 -0.015 -7.347 1.00 0.00 C ATOM 1868 O ASN A 126 -12.044 0.470 -6.514 1.00 0.00 O ATOM 1869 CB ASN A 126 -11.772 0.792 -9.665 1.00 0.00 C ATOM 1870 CG ASN A 126 -11.309 0.439 -11.063 1.00 0.00 C ATOM 1871 OD1 ASN A 126 -10.115 0.478 -11.360 1.00 0.00 O ATOM 1872 ND2 ASN A 126 -12.245 0.111 -11.933 1.00 0.00 N ATOM 0 H ASN A 126 -13.767 -0.664 -9.234 1.00 0.00 H new ATOM 0 HA ASN A 126 -11.025 -1.128 -9.151 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -12.785 1.192 -9.708 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.136 1.578 -9.259 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.990 -0.122 -12.893 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -13.224 0.091 -11.646 1.00 0.00 H new ATOM 1964 N THR A 133 -0.739 9.108 -11.269 1.00 0.00 N ATOM 1965 CA THR A 133 0.647 9.442 -10.999 1.00 0.00 C ATOM 1966 C THR A 133 0.818 9.944 -9.570 1.00 0.00 C ATOM 1967 O THR A 133 0.331 11.019 -9.211 1.00 0.00 O ATOM 1968 CB THR A 133 1.149 10.518 -11.978 1.00 0.00 C ATOM 1969 OG1 THR A 133 0.835 10.137 -13.326 1.00 0.00 O ATOM 1970 CG2 THR A 133 2.650 10.717 -11.845 1.00 0.00 C ATOM 0 HA THR A 133 1.235 8.534 -11.130 1.00 0.00 H new ATOM 0 HB THR A 133 0.651 11.457 -11.736 1.00 0.00 H new ATOM 0 HG1 THR A 133 0.106 9.482 -13.319 1.00 0.00 H new ATOM 0 HG21 THR A 133 2.979 11.482 -12.548 1.00 0.00 H new ATOM 0 HG22 THR A 133 2.887 11.032 -10.829 1.00 0.00 H new ATOM 0 HG23 THR A 133 3.162 9.780 -12.063 1.00 0.00 H new ATOM 1978 N VAL A 134 1.520 9.165 -8.765 1.00 0.00 N ATOM 1979 CA VAL A 134 1.768 9.522 -7.384 1.00 0.00 C ATOM 1980 C VAL A 134 3.188 10.048 -7.202 1.00 0.00 C ATOM 1981 O VAL A 134 4.017 9.996 -8.113 1.00 0.00 O ATOM 1982 CB VAL A 134 1.498 8.361 -6.396 1.00 0.00 C ATOM 1983 CG1 VAL A 134 0.022 8.000 -6.380 1.00 0.00 C ATOM 1984 CG2 VAL A 134 2.339 7.138 -6.717 1.00 0.00 C ATOM 0 H VAL A 134 1.930 8.275 -9.049 1.00 0.00 H new ATOM 0 HA VAL A 134 1.057 10.313 -7.146 1.00 0.00 H new ATOM 0 HB VAL A 134 1.786 8.708 -5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -0.145 7.182 -5.679 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -0.561 8.867 -6.071 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -0.288 7.691 -7.378 1.00 0.00 H new ATOM 0 HG21 VAL A 134 2.119 6.347 -6.000 1.00 0.00 H new ATOM 0 HG22 VAL A 134 2.106 6.791 -7.724 1.00 0.00 H new ATOM 0 HG23 VAL A 134 3.396 7.398 -6.658 1.00 0.00 H new ATOM 1994 N HIS A 135 3.448 10.557 -6.014 1.00 0.00 N ATOM 1995 CA HIS A 135 4.685 11.252 -5.704 1.00 0.00 C ATOM 1996 C HIS A 135 5.203 10.699 -4.396 1.00 0.00 C ATOM 1997 O HIS A 135 4.422 10.460 -3.477 1.00 0.00 O ATOM 1998 CB HIS A 135 4.474 12.765 -5.587 1.00 0.00 C ATOM 1999 CG HIS A 135 4.388 13.486 -6.897 1.00 0.00 C ATOM 2000 ND1 HIS A 135 5.278 14.470 -7.270 1.00 0.00 N ATOM 2001 CD2 HIS A 135 3.504 13.378 -7.916 1.00 0.00 C ATOM 2002 CE1 HIS A 135 4.945 14.935 -8.457 1.00 0.00 C ATOM 2003 NE2 HIS A 135 3.872 14.288 -8.873 1.00 0.00 N ATOM 0 H HIS A 135 2.801 10.500 -5.228 1.00 0.00 H new ATOM 0 HA HIS A 135 5.401 11.093 -6.510 1.00 0.00 H new ATOM 0 HB2 HIS A 135 3.558 12.948 -5.026 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.294 13.189 -5.007 1.00 0.00 H new ATOM 0 HD2 HIS A 135 2.664 12.701 -7.966 1.00 0.00 H new ATOM 0 HE1 HIS A 135 5.462 15.714 -8.998 1.00 0.00 H new ATOM 0 HE2 HIS A 135 3.395 14.440 -9.761 1.00 0.00 H new ATOM 2012 N PHE A 136 6.497 10.520 -4.291 1.00 0.00 N ATOM 2013 CA PHE A 136 7.048 9.792 -3.171 1.00 0.00 C ATOM 2014 C PHE A 136 8.101 10.590 -2.433 1.00 0.00 C ATOM 2015 O PHE A 136 9.104 11.001 -3.014 1.00 0.00 O ATOM 2016 CB PHE A 136 7.651 8.473 -3.641 1.00 0.00 C ATOM 2017 CG PHE A 136 6.694 7.324 -3.613 1.00 0.00 C ATOM 2018 CD1 PHE A 136 6.451 6.655 -2.428 1.00 0.00 C ATOM 2019 CD2 PHE A 136 6.047 6.910 -4.763 1.00 0.00 C ATOM 2020 CE1 PHE A 136 5.574 5.589 -2.386 1.00 0.00 C ATOM 2021 CE2 PHE A 136 5.169 5.844 -4.733 1.00 0.00 C ATOM 2022 CZ PHE A 136 4.932 5.180 -3.541 1.00 0.00 C ATOM 0 H PHE A 136 7.185 10.865 -4.961 1.00 0.00 H new ATOM 0 HA PHE A 136 6.226 9.600 -2.481 1.00 0.00 H new ATOM 0 HB2 PHE A 136 8.024 8.597 -4.658 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.509 8.233 -3.013 1.00 0.00 H new ATOM 0 HD1 PHE A 136 6.953 6.970 -1.525 1.00 0.00 H new ATOM 0 HD2 PHE A 136 6.230 7.425 -5.694 1.00 0.00 H new ATOM 0 HE1 PHE A 136 5.390 5.076 -1.454 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.669 5.529 -5.637 1.00 0.00 H new ATOM 0 HZ PHE A 136 4.248 4.345 -3.513 1.00 0.00 H new ATOM 2032 N ASP A 137 7.871 10.783 -1.146 1.00 0.00 N ATOM 2033 CA ASP A 137 8.873 11.362 -0.269 1.00 0.00 C ATOM 2034 C ASP A 137 9.266 10.323 0.764 1.00 0.00 C ATOM 2035 O ASP A 137 8.549 10.117 1.736 1.00 0.00 O ATOM 2036 CB ASP A 137 8.349 12.611 0.454 1.00 0.00 C ATOM 2037 CG ASP A 137 8.129 13.802 -0.454 1.00 0.00 C ATOM 2038 OD1 ASP A 137 7.066 13.882 -1.098 1.00 0.00 O ATOM 2039 OD2 ASP A 137 9.005 14.690 -0.497 1.00 0.00 O ATOM 0 H ASP A 137 6.994 10.546 -0.683 1.00 0.00 H new ATOM 0 HA ASP A 137 9.728 11.661 -0.875 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.409 12.365 0.947 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.056 12.889 1.236 1.00 0.00 H new ATOM 2044 N ILE A 138 10.399 9.676 0.556 1.00 0.00 N ATOM 2045 CA ILE A 138 10.835 8.621 1.465 1.00 0.00 C ATOM 2046 C ILE A 138 12.055 9.035 2.272 1.00 0.00 C ATOM 2047 O ILE A 138 13.054 9.508 1.724 1.00 0.00 O ATOM 2048 CB ILE A 138 11.149 7.291 0.741 1.00 0.00 C ATOM 2049 CG1 ILE A 138 9.895 6.706 0.101 1.00 0.00 C ATOM 2050 CG2 ILE A 138 11.759 6.279 1.702 1.00 0.00 C ATOM 2051 CD1 ILE A 138 9.732 7.081 -1.348 1.00 0.00 C ATOM 0 H ILE A 138 11.031 9.857 -0.224 1.00 0.00 H new ATOM 0 HA ILE A 138 9.990 8.459 2.135 1.00 0.00 H new ATOM 0 HB ILE A 138 11.872 7.509 -0.045 1.00 0.00 H new ATOM 0 HG12 ILE A 138 9.926 5.620 0.186 1.00 0.00 H new ATOM 0 HG13 ILE A 138 9.021 7.045 0.657 1.00 0.00 H new ATOM 0 HG21 ILE A 138 11.971 5.352 1.168 1.00 0.00 H new ATOM 0 HG22 ILE A 138 12.685 6.680 2.114 1.00 0.00 H new ATOM 0 HG23 ILE A 138 11.058 6.079 2.513 1.00 0.00 H new ATOM 0 HD11 ILE A 138 8.820 6.631 -1.740 1.00 0.00 H new ATOM 0 HD12 ILE A 138 9.670 8.165 -1.438 1.00 0.00 H new ATOM 0 HD13 ILE A 138 10.589 6.718 -1.916 1.00 0.00 H new ATOM 2063 N GLU A 139 11.958 8.847 3.578 1.00 0.00 N ATOM 2064 CA GLU A 139 13.080 9.031 4.473 1.00 0.00 C ATOM 2065 C GLU A 139 13.329 7.737 5.226 1.00 0.00 C ATOM 2066 O GLU A 139 12.517 7.327 6.059 1.00 0.00 O ATOM 2067 CB GLU A 139 12.808 10.174 5.445 1.00 0.00 C ATOM 2068 CG GLU A 139 12.745 11.524 4.764 1.00 0.00 C ATOM 2069 CD GLU A 139 12.122 12.596 5.628 1.00 0.00 C ATOM 2070 OE1 GLU A 139 10.929 12.479 5.976 1.00 0.00 O ATOM 2071 OE2 GLU A 139 12.822 13.572 5.964 1.00 0.00 O ATOM 0 H GLU A 139 11.097 8.562 4.044 1.00 0.00 H new ATOM 0 HA GLU A 139 13.967 9.290 3.895 1.00 0.00 H new ATOM 0 HB2 GLU A 139 11.866 9.989 5.961 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.590 10.192 6.205 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.753 11.831 4.485 1.00 0.00 H new ATOM 0 HG3 GLU A 139 12.173 11.432 3.841 1.00 0.00 H new ATOM 2078 N VAL A 140 14.425 7.075 4.887 1.00 0.00 N ATOM 2079 CA VAL A 140 14.794 5.804 5.511 1.00 0.00 C ATOM 2080 C VAL A 140 14.974 5.968 7.015 1.00 0.00 C ATOM 2081 O VAL A 140 15.828 6.739 7.466 1.00 0.00 O ATOM 2082 CB VAL A 140 16.106 5.249 4.919 1.00 0.00 C ATOM 2083 CG1 VAL A 140 16.473 3.918 5.557 1.00 0.00 C ATOM 2084 CG2 VAL A 140 15.993 5.103 3.415 1.00 0.00 C ATOM 0 H VAL A 140 15.083 7.397 4.177 1.00 0.00 H new ATOM 0 HA VAL A 140 13.982 5.105 5.310 1.00 0.00 H new ATOM 0 HB VAL A 140 16.902 5.961 5.139 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.402 3.549 5.121 1.00 0.00 H new ATOM 0 HG12 VAL A 140 16.604 4.053 6.631 1.00 0.00 H new ATOM 0 HG13 VAL A 140 15.676 3.196 5.377 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.928 4.710 3.016 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.180 4.417 3.176 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.789 6.077 2.969 1.00 0.00 H new ATOM 2094 N LEU A 141 14.176 5.243 7.786 1.00 0.00 N ATOM 2095 CA LEU A 141 14.267 5.313 9.234 1.00 0.00 C ATOM 2096 C LEU A 141 15.242 4.274 9.756 1.00 0.00 C ATOM 2097 O LEU A 141 16.142 4.594 10.529 1.00 0.00 O ATOM 2098 CB LEU A 141 12.903 5.080 9.882 1.00 0.00 C ATOM 2099 CG LEU A 141 11.787 6.034 9.466 1.00 0.00 C ATOM 2100 CD1 LEU A 141 10.567 5.825 10.348 1.00 0.00 C ATOM 2101 CD2 LEU A 141 12.253 7.484 9.521 1.00 0.00 C ATOM 0 H LEU A 141 13.463 4.604 7.434 1.00 0.00 H new ATOM 0 HA LEU A 141 14.620 6.312 9.492 1.00 0.00 H new ATOM 0 HB2 LEU A 141 12.586 4.062 9.655 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.022 5.143 10.964 1.00 0.00 H new ATOM 0 HG LEU A 141 11.515 5.815 8.434 1.00 0.00 H new ATOM 0 HD11 LEU A 141 9.776 6.510 10.043 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.216 4.798 10.246 1.00 0.00 H new ATOM 0 HD13 LEU A 141 10.833 6.017 11.388 1.00 0.00 H new ATOM 0 HD21 LEU A 141 11.437 8.140 9.219 1.00 0.00 H new ATOM 0 HD22 LEU A 141 12.559 7.729 10.538 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.097 7.621 8.845 1.00 0.00 H new ATOM 2113 N GLU A 142 15.077 3.031 9.304 1.00 0.00 N ATOM 2114 CA GLU A 142 15.892 1.911 9.759 1.00 0.00 C ATOM 2115 C GLU A 142 15.866 0.823 8.699 1.00 0.00 C ATOM 2116 O GLU A 142 14.956 0.787 7.871 1.00 0.00 O ATOM 2117 CB GLU A 142 15.364 1.335 11.077 1.00 0.00 C ATOM 2118 CG GLU A 142 15.536 2.259 12.261 1.00 0.00 C ATOM 2119 CD GLU A 142 14.894 1.729 13.519 1.00 0.00 C ATOM 2120 OE1 GLU A 142 15.398 0.731 14.072 1.00 0.00 O ATOM 2121 OE2 GLU A 142 13.889 2.309 13.974 1.00 0.00 O ATOM 0 H GLU A 142 14.373 2.775 8.612 1.00 0.00 H new ATOM 0 HA GLU A 142 16.908 2.269 9.924 1.00 0.00 H new ATOM 0 HB2 GLU A 142 14.306 1.101 10.962 1.00 0.00 H new ATOM 0 HB3 GLU A 142 15.878 0.396 11.284 1.00 0.00 H new ATOM 0 HG2 GLU A 142 16.599 2.416 12.441 1.00 0.00 H new ATOM 0 HG3 GLU A 142 15.106 3.231 12.022 1.00 0.00 H new ATOM 2128 N ILE A 143 16.848 -0.054 8.719 1.00 0.00 N ATOM 2129 CA ILE A 143 16.906 -1.139 7.749 1.00 0.00 C ATOM 2130 C ILE A 143 17.083 -2.497 8.425 1.00 0.00 C ATOM 2131 O ILE A 143 18.091 -2.752 9.092 1.00 0.00 O ATOM 2132 CB ILE A 143 18.033 -0.897 6.722 1.00 0.00 C ATOM 2133 CG1 ILE A 143 17.686 0.319 5.862 1.00 0.00 C ATOM 2134 CG2 ILE A 143 18.260 -2.125 5.846 1.00 0.00 C ATOM 2135 CD1 ILE A 143 18.838 0.826 5.035 1.00 0.00 C ATOM 0 H ILE A 143 17.615 -0.041 9.391 1.00 0.00 H new ATOM 0 HA ILE A 143 15.951 -1.154 7.224 1.00 0.00 H new ATOM 0 HB ILE A 143 18.960 -0.706 7.263 1.00 0.00 H new ATOM 0 HG12 ILE A 143 16.861 0.060 5.199 1.00 0.00 H new ATOM 0 HG13 ILE A 143 17.334 1.122 6.510 1.00 0.00 H new ATOM 0 HG21 ILE A 143 19.060 -1.921 5.134 1.00 0.00 H new ATOM 0 HG22 ILE A 143 18.539 -2.972 6.472 1.00 0.00 H new ATOM 0 HG23 ILE A 143 17.344 -2.360 5.305 1.00 0.00 H new ATOM 0 HD11 ILE A 143 18.516 1.689 4.452 1.00 0.00 H new ATOM 0 HD12 ILE A 143 19.657 1.118 5.692 1.00 0.00 H new ATOM 0 HD13 ILE A 143 19.176 0.039 4.361 1.00 0.00 H new ATOM 2147 N ASP A 144 16.070 -3.345 8.275 1.00 0.00 N ATOM 2148 CA ASP A 144 16.139 -4.730 8.717 1.00 0.00 C ATOM 2149 C ASP A 144 16.944 -5.534 7.708 1.00 0.00 C ATOM 2150 O ASP A 144 16.668 -5.490 6.505 1.00 0.00 O ATOM 2151 CB ASP A 144 14.737 -5.329 8.873 1.00 0.00 C ATOM 2152 CG ASP A 144 13.985 -4.771 10.066 1.00 0.00 C ATOM 2153 OD1 ASP A 144 13.692 -3.560 10.080 1.00 0.00 O ATOM 2154 OD2 ASP A 144 13.685 -5.542 11.005 1.00 0.00 O ATOM 0 H ASP A 144 15.181 -3.090 7.844 1.00 0.00 H new ATOM 0 HA ASP A 144 16.626 -4.766 9.691 1.00 0.00 H new ATOM 0 HB2 ASP A 144 14.163 -5.138 7.966 1.00 0.00 H new ATOM 0 HB3 ASP A 144 14.819 -6.411 8.976 1.00 0.00 H new ATOM 2159 N PRO A 145 17.946 -6.277 8.188 1.00 0.00 N ATOM 2160 CA PRO A 145 18.908 -6.975 7.330 1.00 0.00 C ATOM 2161 C PRO A 145 18.282 -8.000 6.398 1.00 0.00 C ATOM 2162 O PRO A 145 17.233 -8.581 6.683 1.00 0.00 O ATOM 2163 CB PRO A 145 19.833 -7.688 8.312 1.00 0.00 C ATOM 2164 CG PRO A 145 19.083 -7.731 9.595 1.00 0.00 C ATOM 2165 CD PRO A 145 18.227 -6.500 9.613 1.00 0.00 C ATOM 0 HA PRO A 145 19.403 -6.262 6.670 1.00 0.00 H new ATOM 0 HB2 PRO A 145 20.077 -8.692 7.965 1.00 0.00 H new ATOM 0 HB3 PRO A 145 20.775 -7.152 8.425 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.473 -8.632 9.661 1.00 0.00 H new ATOM 0 HG3 PRO A 145 19.765 -7.745 10.445 1.00 0.00 H new ATOM 0 HD2 PRO A 145 17.313 -6.652 10.187 1.00 0.00 H new ATOM 0 HD3 PRO A 145 18.747 -5.653 10.060 1.00 0.00 H new