USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1316 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 114 LYS NZ :NH3+ 157:sc= 1.19 (180deg=0) USER MOD Set 1.2: A 171 HIS : no HD1:sc= 0.346 K(o=1.5,f=-4.2!) USER MOD Set 2.1: A 105 HIS : no HE2:sc= 0.536 K(o=1.5,f=-1.9) USER MOD Set 2.2: A 118 TYR OH : rot -46:sc= 0.985 USER MOD Set 3.1: A 90 GLN : amide:sc= 0.669 K(o=0.67,f=-5.8!) USER MOD Set 3.2: A 124 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 7 TYR OH : rot 154:sc= 0.0942 USER MOD Set 4.2: A 10 SER OG : rot 180:sc= 0.101 USER MOD Set 4.3: A 34 ASN : amide:sc= -1.68 K(o=-1.5,f=-7.9!) USER MOD Single : A 1 MET CE :methyl -179:sc= 0 (180deg=-0.000247) USER MOD Single : A 1 MET N :NH3+ -115:sc= 0.0812 (180deg=0.00764) USER MOD Single : A 2 ASN : amide:sc=-0.00597 K(o=-0.006,f=-2.8!) USER MOD Single : A 3 MET CE :methyl -156:sc= -1.95 (180deg=-3.86!) USER MOD Single : A 9 SER OG : rot 180:sc= 0.0417 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -150:sc= -0.109 USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -176:sc= 1.28 (180deg=1.26) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HD1:sc= -0.155 K(o=-0.16,f=-4.1!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= 2.48 (180deg=2.4) USER MOD Single : A 43 MET CE :methyl -173:sc= -1.46 (180deg=-1.82) USER MOD Single : A 45 GLN : amide:sc= 0.26 X(o=0.26,f=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.0815 USER MOD Single : A 62 GLN : amide:sc= -1.93! C(o=-1.9!,f=-3.1!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.199 X(o=-0.2,f=-0.0021) USER MOD Single : A 80 LYS NZ :NH3+ -159:sc= 2.19 (180deg=1.42) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 5:sc= 0.213 USER MOD Single : A 103 MET CE :methyl -178:sc= -0.38 (180deg=-0.421) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 60:sc= 1.22 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 111 LYS NZ :NH3+ 171:sc= 1.37 (180deg=1.19) USER MOD Single : A 121 THR OG1 : rot 165:sc= 0.809 USER MOD Single : A 127 THR OG1 : rot -30:sc= 0.00097 USER MOD Single : A 128 SER OG : rot -125:sc= 0.158 USER MOD Single : A 130 LYS NZ :NH3+ 166:sc= 1.26 (180deg=1.17) USER MOD Single : A 137 GLN : amide:sc= 0.806 K(o=0.81,f=-0.023) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 1.1 K(o=1.1,f=-1.1) USER MOD Single : A 149 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 171:sc= 1.23 USER MOD Single : A 158 GLN : amide:sc= 0.0603 X(o=0.06,f=-0.24) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 83:sc= -1.16 USER MOD Single : A 163 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 ASN : amide:sc= 0.894 K(o=0.89,f=-0.0058) USER MOD Single : A 168 MET CE :methyl -168:sc= -0.609 (180deg=-1.19) USER MOD Single : A 172 TYR OH : rot 169:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.145 1.853 0.206 1.00 0.00 N ATOM 2 CA MET A 1 2.166 0.955 -0.992 1.00 0.00 C ATOM 3 C MET A 1 0.740 0.496 -1.371 1.00 0.00 C ATOM 4 O MET A 1 -0.203 0.754 -0.625 1.00 0.00 O ATOM 5 CB MET A 1 3.186 -0.208 -0.830 1.00 0.00 C ATOM 6 CG MET A 1 2.668 -1.510 -0.183 1.00 0.00 C ATOM 7 SD MET A 1 2.029 -1.354 1.503 1.00 0.00 S ATOM 8 CE MET A 1 1.228 -2.969 1.624 1.00 0.00 C ATOM 0 H1 MET A 1 2.466 2.804 -0.067 1.00 0.00 H new ATOM 0 H2 MET A 1 1.177 1.909 0.581 1.00 0.00 H new ATOM 0 H3 MET A 1 2.778 1.471 0.937 1.00 0.00 H new ATOM 0 HA MET A 1 2.529 1.530 -1.844 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.579 -0.453 -1.817 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.023 0.156 -0.235 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.878 -1.917 -0.814 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.479 -2.238 -0.178 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.750 -3.066 2.599 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.476 -3.062 0.840 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.974 -3.755 1.506 1.00 0.00 H new ATOM 20 N ASN A 2 0.559 -0.175 -2.521 1.00 0.00 N ATOM 21 CA ASN A 2 -0.758 -0.563 -3.052 1.00 0.00 C ATOM 22 C ASN A 2 -0.813 -2.041 -3.435 1.00 0.00 C ATOM 23 O ASN A 2 0.195 -2.629 -3.831 1.00 0.00 O ATOM 24 CB ASN A 2 -1.139 0.320 -4.256 1.00 0.00 C ATOM 25 CG ASN A 2 -0.326 0.045 -5.518 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.850 -0.295 -5.479 1.00 0.00 O ATOM 27 ND2 ASN A 2 -0.946 0.191 -6.673 1.00 0.00 N ATOM 0 H ASN A 2 1.334 -0.467 -3.116 1.00 0.00 H new ATOM 0 HA ASN A 2 -1.484 -0.408 -2.254 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -2.196 0.173 -4.479 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -1.014 1.367 -3.978 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -0.446 0.020 -7.545 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -1.926 0.475 -6.694 1.00 0.00 H new ATOM 34 N MET A 3 -2.002 -2.636 -3.314 1.00 0.00 N ATOM 35 CA MET A 3 -2.284 -4.055 -3.548 1.00 0.00 C ATOM 36 C MET A 3 -3.036 -4.155 -4.886 1.00 0.00 C ATOM 37 O MET A 3 -4.103 -3.551 -5.023 1.00 0.00 O ATOM 38 CB MET A 3 -3.232 -4.579 -2.447 1.00 0.00 C ATOM 39 CG MET A 3 -2.907 -4.116 -1.033 1.00 0.00 C ATOM 40 SD MET A 3 -3.747 -5.099 0.215 1.00 0.00 S ATOM 41 CE MET A 3 -3.216 -4.102 1.621 1.00 0.00 C ATOM 0 H MET A 3 -2.835 -2.117 -3.037 1.00 0.00 H new ATOM 0 HA MET A 3 -1.357 -4.629 -3.551 1.00 0.00 H new ATOM 0 HB2 MET A 3 -4.249 -4.269 -2.688 1.00 0.00 H new ATOM 0 HB3 MET A 3 -3.218 -5.669 -2.467 1.00 0.00 H new ATOM 0 HG2 MET A 3 -1.830 -4.172 -0.873 1.00 0.00 H new ATOM 0 HG3 MET A 3 -3.192 -3.070 -0.921 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.238 -4.709 2.526 1.00 0.00 H new ATOM 0 HE2 MET A 3 -2.202 -3.742 1.449 1.00 0.00 H new ATOM 0 HE3 MET A 3 -3.888 -3.252 1.738 1.00 0.00 H new ATOM 51 N GLY A 4 -2.536 -4.904 -5.862 1.00 0.00 N ATOM 52 CA GLY A 4 -3.297 -5.287 -7.050 1.00 0.00 C ATOM 53 C GLY A 4 -4.061 -6.565 -6.702 1.00 0.00 C ATOM 54 O GLY A 4 -3.624 -7.293 -5.812 1.00 0.00 O ATOM 0 H GLY A 4 -1.583 -5.267 -5.853 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.986 -4.493 -7.339 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.631 -5.455 -7.896 1.00 0.00 H new ATOM 58 N LEU A 5 -5.194 -6.862 -7.343 1.00 0.00 N ATOM 59 CA LEU A 5 -6.048 -7.999 -6.962 1.00 0.00 C ATOM 60 C LEU A 5 -6.589 -8.595 -8.252 1.00 0.00 C ATOM 61 O LEU A 5 -7.552 -8.064 -8.799 1.00 0.00 O ATOM 62 CB LEU A 5 -7.145 -7.458 -6.016 1.00 0.00 C ATOM 63 CG LEU A 5 -8.049 -8.468 -5.280 1.00 0.00 C ATOM 64 CD1 LEU A 5 -9.094 -7.658 -4.512 1.00 0.00 C ATOM 65 CD2 LEU A 5 -8.787 -9.447 -6.192 1.00 0.00 C ATOM 0 H LEU A 5 -5.547 -6.327 -8.137 1.00 0.00 H new ATOM 0 HA LEU A 5 -5.523 -8.789 -6.426 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -6.657 -6.840 -5.262 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.790 -6.800 -6.599 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.403 -9.073 -4.644 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -9.757 -8.336 -3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.594 -7.000 -3.801 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -9.677 -7.059 -5.212 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.397 -10.118 -5.587 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.428 -8.893 -6.878 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.063 -10.030 -6.762 1.00 0.00 H new ATOM 77 N PHE A 6 -5.953 -9.652 -8.764 1.00 0.00 N ATOM 78 CA PHE A 6 -6.251 -10.184 -10.089 1.00 0.00 C ATOM 79 C PHE A 6 -7.119 -11.432 -10.012 1.00 0.00 C ATOM 80 O PHE A 6 -6.949 -12.271 -9.124 1.00 0.00 O ATOM 81 CB PHE A 6 -4.987 -10.352 -10.945 1.00 0.00 C ATOM 82 CG PHE A 6 -4.339 -11.721 -10.995 1.00 0.00 C ATOM 83 CD1 PHE A 6 -4.825 -12.682 -11.903 1.00 0.00 C ATOM 84 CD2 PHE A 6 -3.179 -11.993 -10.250 1.00 0.00 C ATOM 85 CE1 PHE A 6 -4.142 -13.896 -12.090 1.00 0.00 C ATOM 86 CE2 PHE A 6 -2.485 -13.202 -10.446 1.00 0.00 C ATOM 87 CZ PHE A 6 -2.965 -14.152 -11.364 1.00 0.00 C ATOM 0 H PHE A 6 -5.219 -10.160 -8.270 1.00 0.00 H new ATOM 0 HA PHE A 6 -6.851 -9.443 -10.616 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.234 -10.062 -11.966 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.242 -9.643 -10.584 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -5.729 -12.484 -12.460 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -2.820 -11.275 -9.527 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -4.519 -14.629 -12.788 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.581 -13.400 -9.889 1.00 0.00 H new ATOM 0 HZ PHE A 6 -2.430 -15.078 -11.512 1.00 0.00 H new ATOM 97 N TYR A 7 -8.065 -11.521 -10.946 1.00 0.00 N ATOM 98 CA TYR A 7 -9.064 -12.573 -11.068 1.00 0.00 C ATOM 99 C TYR A 7 -9.653 -12.517 -12.488 1.00 0.00 C ATOM 100 O TYR A 7 -9.291 -11.640 -13.276 1.00 0.00 O ATOM 101 CB TYR A 7 -10.146 -12.391 -9.982 1.00 0.00 C ATOM 102 CG TYR A 7 -10.903 -11.074 -10.006 1.00 0.00 C ATOM 103 CD1 TYR A 7 -10.306 -9.898 -9.514 1.00 0.00 C ATOM 104 CD2 TYR A 7 -12.218 -11.027 -10.501 1.00 0.00 C ATOM 105 CE1 TYR A 7 -11.001 -8.676 -9.551 1.00 0.00 C ATOM 106 CE2 TYR A 7 -12.923 -9.815 -10.529 1.00 0.00 C ATOM 107 CZ TYR A 7 -12.316 -8.630 -10.064 1.00 0.00 C ATOM 108 OH TYR A 7 -12.988 -7.447 -10.100 1.00 0.00 O ATOM 0 H TYR A 7 -8.157 -10.818 -11.679 1.00 0.00 H new ATOM 0 HA TYR A 7 -8.618 -13.556 -10.916 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -10.867 -13.203 -10.077 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -9.673 -12.497 -9.006 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.307 -9.934 -9.105 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -12.688 -11.930 -10.862 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.530 -7.774 -9.188 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -13.934 -9.789 -10.908 1.00 0.00 H new ATOM 0 HH TYR A 7 -13.655 -7.471 -10.818 1.00 0.00 H new ATOM 118 N GLY A 8 -10.522 -13.473 -12.839 1.00 0.00 N ATOM 119 CA GLY A 8 -11.188 -13.518 -14.146 1.00 0.00 C ATOM 120 C GLY A 8 -12.301 -12.466 -14.272 1.00 0.00 C ATOM 121 O GLY A 8 -12.396 -11.551 -13.459 1.00 0.00 O ATOM 0 H GLY A 8 -10.784 -14.241 -12.221 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.450 -13.359 -14.932 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.611 -14.511 -14.302 1.00 0.00 H new ATOM 125 N SER A 9 -13.152 -12.607 -15.291 1.00 0.00 N ATOM 126 CA SER A 9 -14.235 -11.671 -15.592 1.00 0.00 C ATOM 127 C SER A 9 -15.197 -11.524 -14.403 1.00 0.00 C ATOM 128 O SER A 9 -15.784 -12.517 -13.960 1.00 0.00 O ATOM 129 CB SER A 9 -14.966 -12.140 -16.858 1.00 0.00 C ATOM 130 OG SER A 9 -14.028 -12.650 -17.801 1.00 0.00 O ATOM 0 H SER A 9 -13.106 -13.391 -15.942 1.00 0.00 H new ATOM 0 HA SER A 9 -13.814 -10.682 -15.772 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.694 -12.910 -16.603 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.520 -11.310 -17.296 1.00 0.00 H new ATOM 0 HG SER A 9 -14.502 -12.949 -18.605 1.00 0.00 H new ATOM 136 N SER A 10 -15.389 -10.293 -13.909 1.00 0.00 N ATOM 137 CA SER A 10 -16.321 -9.975 -12.831 1.00 0.00 C ATOM 138 C SER A 10 -17.737 -10.463 -13.159 1.00 0.00 C ATOM 139 O SER A 10 -18.134 -10.498 -14.329 1.00 0.00 O ATOM 140 CB SER A 10 -16.341 -8.457 -12.601 1.00 0.00 C ATOM 141 OG SER A 10 -15.024 -7.930 -12.519 1.00 0.00 O ATOM 0 H SER A 10 -14.887 -9.477 -14.259 1.00 0.00 H new ATOM 0 HA SER A 10 -15.985 -10.484 -11.928 1.00 0.00 H new ATOM 0 HB2 SER A 10 -16.880 -7.971 -13.414 1.00 0.00 H new ATOM 0 HB3 SER A 10 -16.882 -8.233 -11.682 1.00 0.00 H new ATOM 0 HG SER A 10 -15.068 -6.962 -12.374 1.00 0.00 H new ATOM 147 N THR A 11 -18.502 -10.804 -12.117 1.00 0.00 N ATOM 148 CA THR A 11 -19.887 -11.294 -12.157 1.00 0.00 C ATOM 149 C THR A 11 -20.017 -12.693 -12.790 1.00 0.00 C ATOM 150 O THR A 11 -20.754 -13.530 -12.262 1.00 0.00 O ATOM 151 CB THR A 11 -20.816 -10.227 -12.784 1.00 0.00 C ATOM 152 OG1 THR A 11 -20.496 -8.935 -12.277 1.00 0.00 O ATOM 153 CG2 THR A 11 -22.295 -10.502 -12.486 1.00 0.00 C ATOM 0 H THR A 11 -18.150 -10.742 -11.162 1.00 0.00 H new ATOM 0 HA THR A 11 -20.222 -11.444 -11.131 1.00 0.00 H new ATOM 0 HB THR A 11 -20.659 -10.270 -13.862 1.00 0.00 H new ATOM 0 HG1 THR A 11 -21.089 -8.268 -12.682 1.00 0.00 H new ATOM 0 HG21 THR A 11 -22.909 -9.728 -12.946 1.00 0.00 H new ATOM 0 HG22 THR A 11 -22.573 -11.474 -12.892 1.00 0.00 H new ATOM 0 HG23 THR A 11 -22.455 -10.500 -11.408 1.00 0.00 H new ATOM 161 N CYS A 12 -19.280 -12.996 -13.862 1.00 0.00 N ATOM 162 CA CYS A 12 -19.207 -14.332 -14.434 1.00 0.00 C ATOM 163 C CYS A 12 -18.452 -15.270 -13.482 1.00 0.00 C ATOM 164 O CYS A 12 -18.872 -16.414 -13.293 1.00 0.00 O ATOM 165 CB CYS A 12 -18.499 -14.280 -15.797 1.00 0.00 C ATOM 166 SG CYS A 12 -19.315 -13.100 -16.917 1.00 0.00 S ATOM 0 H CYS A 12 -18.713 -12.309 -14.359 1.00 0.00 H new ATOM 0 HA CYS A 12 -20.218 -14.714 -14.576 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -17.457 -13.992 -15.658 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -18.498 -15.272 -16.248 1.00 0.00 H new ATOM 0 HG CYS A 12 -18.690 -13.080 -18.057 1.00 0.00 H new ATOM 172 N TYR A 13 -17.358 -14.784 -12.879 1.00 0.00 N ATOM 173 CA TYR A 13 -16.436 -15.570 -12.068 1.00 0.00 C ATOM 174 C TYR A 13 -15.994 -14.757 -10.844 1.00 0.00 C ATOM 175 O TYR A 13 -16.103 -13.531 -10.841 1.00 0.00 O ATOM 176 CB TYR A 13 -15.216 -15.979 -12.921 1.00 0.00 C ATOM 177 CG TYR A 13 -15.552 -16.529 -14.300 1.00 0.00 C ATOM 178 CD1 TYR A 13 -16.106 -17.813 -14.441 1.00 0.00 C ATOM 179 CD2 TYR A 13 -15.334 -15.737 -15.443 1.00 0.00 C ATOM 180 CE1 TYR A 13 -16.440 -18.307 -15.714 1.00 0.00 C ATOM 181 CE2 TYR A 13 -15.657 -16.223 -16.722 1.00 0.00 C ATOM 182 CZ TYR A 13 -16.216 -17.516 -16.863 1.00 0.00 C ATOM 183 OH TYR A 13 -16.549 -18.004 -18.094 1.00 0.00 O ATOM 0 H TYR A 13 -17.088 -13.803 -12.948 1.00 0.00 H new ATOM 0 HA TYR A 13 -16.937 -16.473 -11.719 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -14.567 -15.111 -13.040 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -14.645 -16.731 -12.375 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -16.276 -18.423 -13.566 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -14.915 -14.747 -15.337 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -16.869 -19.293 -15.814 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -15.479 -15.612 -17.594 1.00 0.00 H new ATOM 0 HH TYR A 13 -16.333 -17.338 -18.779 1.00 0.00 H new ATOM 193 N THR A 14 -15.457 -15.449 -9.827 1.00 0.00 N ATOM 194 CA THR A 14 -14.875 -14.857 -8.613 1.00 0.00 C ATOM 195 C THR A 14 -15.848 -13.849 -7.966 1.00 0.00 C ATOM 196 O THR A 14 -15.472 -12.733 -7.601 1.00 0.00 O ATOM 197 CB THR A 14 -13.459 -14.318 -8.919 1.00 0.00 C ATOM 198 OG1 THR A 14 -12.770 -15.204 -9.786 1.00 0.00 O ATOM 199 CG2 THR A 14 -12.580 -14.210 -7.673 1.00 0.00 C ATOM 0 H THR A 14 -15.415 -16.468 -9.827 1.00 0.00 H new ATOM 0 HA THR A 14 -14.735 -15.618 -7.846 1.00 0.00 H new ATOM 0 HB THR A 14 -13.617 -13.333 -9.357 1.00 0.00 H new ATOM 0 HG1 THR A 14 -11.808 -15.152 -9.609 1.00 0.00 H new ATOM 0 HG21 THR A 14 -11.599 -13.826 -7.952 1.00 0.00 H new ATOM 0 HG22 THR A 14 -13.045 -13.532 -6.957 1.00 0.00 H new ATOM 0 HG23 THR A 14 -12.469 -15.195 -7.220 1.00 0.00 H new ATOM 207 N GLU A 15 -17.129 -14.236 -7.873 1.00 0.00 N ATOM 208 CA GLU A 15 -18.200 -13.337 -7.449 1.00 0.00 C ATOM 209 C GLU A 15 -17.949 -12.839 -6.019 1.00 0.00 C ATOM 210 O GLU A 15 -17.528 -13.609 -5.154 1.00 0.00 O ATOM 211 CB GLU A 15 -19.568 -14.027 -7.566 1.00 0.00 C ATOM 212 CG GLU A 15 -19.990 -14.241 -9.027 1.00 0.00 C ATOM 213 CD GLU A 15 -21.394 -14.871 -9.110 1.00 0.00 C ATOM 214 OE1 GLU A 15 -22.404 -14.131 -9.015 1.00 0.00 O ATOM 215 OE2 GLU A 15 -21.500 -16.115 -9.252 1.00 0.00 O ATOM 0 H GLU A 15 -17.446 -15.181 -8.090 1.00 0.00 H new ATOM 0 HA GLU A 15 -18.207 -12.471 -8.111 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -19.532 -14.990 -7.056 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -20.321 -13.425 -7.057 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -19.984 -13.287 -9.554 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.268 -14.886 -9.527 1.00 0.00 H new ATOM 222 N MET A 16 -18.216 -11.547 -5.796 1.00 0.00 N ATOM 223 CA MET A 16 -18.093 -10.746 -4.574 1.00 0.00 C ATOM 224 C MET A 16 -16.741 -10.734 -3.837 1.00 0.00 C ATOM 225 O MET A 16 -16.486 -9.772 -3.119 1.00 0.00 O ATOM 226 CB MET A 16 -19.282 -10.969 -3.626 1.00 0.00 C ATOM 227 CG MET A 16 -19.228 -12.287 -2.849 1.00 0.00 C ATOM 228 SD MET A 16 -20.357 -12.342 -1.438 1.00 0.00 S ATOM 229 CE MET A 16 -19.439 -13.552 -0.456 1.00 0.00 C ATOM 0 H MET A 16 -18.565 -10.970 -6.561 1.00 0.00 H new ATOM 0 HA MET A 16 -18.123 -9.729 -4.964 1.00 0.00 H new ATOM 0 HB2 MET A 16 -19.325 -10.143 -2.916 1.00 0.00 H new ATOM 0 HB3 MET A 16 -20.205 -10.940 -4.206 1.00 0.00 H new ATOM 0 HG2 MET A 16 -19.465 -13.108 -3.526 1.00 0.00 H new ATOM 0 HG3 MET A 16 -18.210 -12.449 -2.496 1.00 0.00 H new ATOM 0 HE1 MET A 16 -19.968 -13.739 0.479 1.00 0.00 H new ATOM 0 HE2 MET A 16 -19.351 -14.483 -1.016 1.00 0.00 H new ATOM 0 HE3 MET A 16 -18.444 -13.164 -0.238 1.00 0.00 H new ATOM 239 N ALA A 17 -15.864 -11.732 -3.981 1.00 0.00 N ATOM 240 CA ALA A 17 -14.643 -11.831 -3.177 1.00 0.00 C ATOM 241 C ALA A 17 -13.737 -10.628 -3.415 1.00 0.00 C ATOM 242 O ALA A 17 -13.269 -10.020 -2.458 1.00 0.00 O ATOM 243 CB ALA A 17 -13.907 -13.142 -3.484 1.00 0.00 C ATOM 0 H ALA A 17 -15.979 -12.490 -4.654 1.00 0.00 H new ATOM 0 HA ALA A 17 -14.923 -11.834 -2.124 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -13.002 -13.201 -2.879 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -14.555 -13.987 -3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.640 -13.171 -4.540 1.00 0.00 H new ATOM 249 N ALA A 18 -13.529 -10.242 -4.676 1.00 0.00 N ATOM 250 CA ALA A 18 -12.599 -9.176 -5.027 1.00 0.00 C ATOM 251 C ALA A 18 -13.066 -7.834 -4.467 1.00 0.00 C ATOM 252 O ALA A 18 -12.299 -7.128 -3.816 1.00 0.00 O ATOM 253 CB ALA A 18 -12.433 -9.149 -6.551 1.00 0.00 C ATOM 0 H ALA A 18 -14.001 -10.661 -5.478 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.625 -9.368 -4.577 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.739 -8.355 -6.827 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.042 -10.108 -6.891 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.400 -8.965 -7.019 1.00 0.00 H new ATOM 259 N GLU A 19 -14.346 -7.506 -4.650 1.00 0.00 N ATOM 260 CA GLU A 19 -14.918 -6.259 -4.147 1.00 0.00 C ATOM 261 C GLU A 19 -14.939 -6.251 -2.619 1.00 0.00 C ATOM 262 O GLU A 19 -14.655 -5.207 -2.031 1.00 0.00 O ATOM 263 CB GLU A 19 -16.298 -5.991 -4.780 1.00 0.00 C ATOM 264 CG GLU A 19 -17.317 -7.123 -4.591 1.00 0.00 C ATOM 265 CD GLU A 19 -18.673 -6.783 -5.236 1.00 0.00 C ATOM 266 OE1 GLU A 19 -19.450 -5.992 -4.648 1.00 0.00 O ATOM 267 OE2 GLU A 19 -18.975 -7.318 -6.330 1.00 0.00 O ATOM 0 H GLU A 19 -15.012 -8.096 -5.149 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.280 -5.428 -4.449 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -16.708 -5.076 -4.353 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -16.166 -5.813 -5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -16.926 -8.041 -5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.458 -7.312 -3.527 1.00 0.00 H new ATOM 274 N LYS A 20 -15.179 -7.402 -1.974 1.00 0.00 N ATOM 275 CA LYS A 20 -15.131 -7.516 -0.516 1.00 0.00 C ATOM 276 C LYS A 20 -13.719 -7.287 -0.009 1.00 0.00 C ATOM 277 O LYS A 20 -13.545 -6.451 0.862 1.00 0.00 O ATOM 278 CB LYS A 20 -15.670 -8.868 -0.028 1.00 0.00 C ATOM 279 CG LYS A 20 -17.193 -8.818 0.096 1.00 0.00 C ATOM 280 CD LYS A 20 -17.709 -10.097 0.761 1.00 0.00 C ATOM 281 CE LYS A 20 -19.219 -10.007 1.006 1.00 0.00 C ATOM 282 NZ LYS A 20 -19.586 -9.149 2.169 1.00 0.00 N ATOM 0 H LYS A 20 -15.411 -8.274 -2.449 1.00 0.00 H new ATOM 0 HA LYS A 20 -15.780 -6.742 -0.107 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -15.381 -9.655 -0.724 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -15.228 -9.117 0.937 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -17.490 -7.949 0.683 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -17.642 -8.705 -0.891 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -17.489 -10.957 0.128 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.191 -10.256 1.707 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -19.701 -9.616 0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -19.613 -11.011 1.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -20.615 -9.187 2.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -19.100 -9.493 3.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -19.300 -8.167 1.980 1.00 0.00 H new ATOM 296 N ILE A 21 -12.704 -7.954 -0.564 1.00 0.00 N ATOM 297 CA ILE A 21 -11.307 -7.780 -0.156 1.00 0.00 C ATOM 298 C ILE A 21 -10.964 -6.288 -0.197 1.00 0.00 C ATOM 299 O ILE A 21 -10.479 -5.725 0.784 1.00 0.00 O ATOM 300 CB ILE A 21 -10.392 -8.595 -1.103 1.00 0.00 C ATOM 301 CG1 ILE A 21 -10.470 -10.123 -0.922 1.00 0.00 C ATOM 302 CG2 ILE A 21 -8.921 -8.172 -0.933 1.00 0.00 C ATOM 303 CD1 ILE A 21 -10.029 -10.890 -2.180 1.00 0.00 C ATOM 0 H ILE A 21 -12.829 -8.634 -1.314 1.00 0.00 H new ATOM 0 HA ILE A 21 -11.154 -8.145 0.860 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.765 -8.368 -2.102 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.842 -10.418 -0.082 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -11.493 -10.404 -0.669 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.294 -8.756 -1.607 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.818 -7.113 -1.168 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -8.609 -8.347 0.096 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.104 -11.962 -1.997 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.673 -10.619 -3.016 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.997 -10.634 -2.419 1.00 0.00 H new ATOM 315 N ARG A 22 -11.240 -5.645 -1.335 1.00 0.00 N ATOM 316 CA ARG A 22 -10.919 -4.240 -1.554 1.00 0.00 C ATOM 317 C ARG A 22 -11.681 -3.364 -0.566 1.00 0.00 C ATOM 318 O ARG A 22 -11.105 -2.420 -0.044 1.00 0.00 O ATOM 319 CB ARG A 22 -11.179 -3.945 -3.051 1.00 0.00 C ATOM 320 CG ARG A 22 -11.242 -2.458 -3.451 1.00 0.00 C ATOM 321 CD ARG A 22 -12.545 -2.018 -4.143 1.00 0.00 C ATOM 322 NE ARG A 22 -13.776 -2.433 -3.424 1.00 0.00 N ATOM 323 CZ ARG A 22 -15.030 -2.057 -3.724 1.00 0.00 C ATOM 324 NH1 ARG A 22 -15.265 -1.150 -4.665 1.00 0.00 N ATOM 325 NH2 ARG A 22 -16.051 -2.617 -3.082 1.00 0.00 N ATOM 0 H ARG A 22 -11.695 -6.091 -2.132 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.873 -4.006 -1.355 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -10.394 -4.424 -3.636 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.120 -4.416 -3.335 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -11.103 -1.852 -2.556 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -10.406 -2.242 -4.116 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.543 -0.933 -4.244 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.567 -2.432 -5.151 1.00 0.00 H new ATOM 0 HE ARG A 22 -13.659 -3.061 -2.629 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.487 -0.728 -5.172 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -16.223 -0.875 -4.881 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -15.878 -3.325 -2.369 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -17.007 -2.338 -3.303 1.00 0.00 H new ATOM 339 N ASP A 23 -12.941 -3.677 -0.285 1.00 0.00 N ATOM 340 CA ASP A 23 -13.757 -2.882 0.627 1.00 0.00 C ATOM 341 C ASP A 23 -13.239 -2.993 2.060 1.00 0.00 C ATOM 342 O ASP A 23 -13.140 -2.000 2.781 1.00 0.00 O ATOM 343 CB ASP A 23 -15.212 -3.344 0.575 1.00 0.00 C ATOM 344 CG ASP A 23 -16.059 -2.565 1.597 1.00 0.00 C ATOM 345 OD1 ASP A 23 -16.365 -1.378 1.336 1.00 0.00 O ATOM 346 OD2 ASP A 23 -16.436 -3.142 2.644 1.00 0.00 O ATOM 0 H ASP A 23 -13.424 -4.484 -0.680 1.00 0.00 H new ATOM 0 HA ASP A 23 -13.695 -1.841 0.311 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.612 -3.194 -0.428 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -15.269 -4.412 0.785 1.00 0.00 H new ATOM 351 N ILE A 24 -12.874 -4.214 2.447 1.00 0.00 N ATOM 352 CA ILE A 24 -12.542 -4.588 3.806 1.00 0.00 C ATOM 353 C ILE A 24 -11.185 -4.008 4.179 1.00 0.00 C ATOM 354 O ILE A 24 -11.058 -3.328 5.200 1.00 0.00 O ATOM 355 CB ILE A 24 -12.638 -6.128 3.923 1.00 0.00 C ATOM 356 CG1 ILE A 24 -14.124 -6.556 3.931 1.00 0.00 C ATOM 357 CG2 ILE A 24 -11.897 -6.643 5.163 1.00 0.00 C ATOM 358 CD1 ILE A 24 -14.338 -8.062 3.743 1.00 0.00 C ATOM 0 H ILE A 24 -12.801 -4.993 1.793 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.244 -4.172 4.529 1.00 0.00 H new ATOM 0 HB ILE A 24 -12.151 -6.577 3.057 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -14.575 -6.250 4.875 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -14.650 -6.023 3.139 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.985 -7.728 5.215 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.845 -6.366 5.099 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -12.334 -6.201 6.058 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -15.405 -8.283 3.760 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.919 -8.372 2.786 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -13.843 -8.603 4.549 1.00 0.00 H new ATOM 370 N ILE A 25 -10.173 -4.270 3.351 1.00 0.00 N ATOM 371 CA ILE A 25 -8.834 -3.753 3.567 1.00 0.00 C ATOM 372 C ILE A 25 -8.856 -2.226 3.422 1.00 0.00 C ATOM 373 O ILE A 25 -8.310 -1.513 4.265 1.00 0.00 O ATOM 374 CB ILE A 25 -7.879 -4.420 2.562 1.00 0.00 C ATOM 375 CG1 ILE A 25 -7.804 -5.940 2.824 1.00 0.00 C ATOM 376 CG2 ILE A 25 -6.485 -3.781 2.593 1.00 0.00 C ATOM 377 CD1 ILE A 25 -6.895 -6.693 1.853 1.00 0.00 C ATOM 0 H ILE A 25 -10.265 -4.847 2.515 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.480 -3.984 4.572 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.279 -4.261 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.449 -6.106 3.841 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.809 -6.359 2.764 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.840 -4.280 1.870 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.564 -2.724 2.341 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.059 -3.885 3.591 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.895 -7.754 2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.260 -6.560 0.835 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -5.880 -6.303 1.928 1.00 0.00 H new ATOM 389 N GLY A 26 -9.501 -1.742 2.359 1.00 0.00 N ATOM 390 CA GLY A 26 -9.733 -0.326 2.100 1.00 0.00 C ATOM 391 C GLY A 26 -9.539 0.017 0.621 1.00 0.00 C ATOM 392 O GLY A 26 -8.463 -0.239 0.071 1.00 0.00 O ATOM 0 H GLY A 26 -9.887 -2.347 1.634 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.745 -0.061 2.405 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.051 0.271 2.705 1.00 0.00 H new ATOM 396 N PRO A 27 -10.529 0.644 -0.037 1.00 0.00 N ATOM 397 CA PRO A 27 -10.512 0.893 -1.478 1.00 0.00 C ATOM 398 C PRO A 27 -9.525 1.986 -1.918 1.00 0.00 C ATOM 399 O PRO A 27 -9.343 2.180 -3.120 1.00 0.00 O ATOM 400 CB PRO A 27 -11.967 1.220 -1.842 1.00 0.00 C ATOM 401 CG PRO A 27 -12.521 1.831 -0.558 1.00 0.00 C ATOM 402 CD PRO A 27 -11.828 1.008 0.518 1.00 0.00 C ATOM 0 HA PRO A 27 -10.144 0.018 -2.014 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -12.026 1.918 -2.677 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -12.519 0.327 -2.133 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -12.282 2.891 -0.476 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -13.606 1.744 -0.501 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -11.714 1.583 1.437 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.410 0.120 0.767 1.00 0.00 H new ATOM 410 N GLU A 28 -8.864 2.688 -0.986 1.00 0.00 N ATOM 411 CA GLU A 28 -7.863 3.692 -1.320 1.00 0.00 C ATOM 412 C GLU A 28 -6.511 3.041 -1.654 1.00 0.00 C ATOM 413 O GLU A 28 -5.674 3.670 -2.304 1.00 0.00 O ATOM 414 CB GLU A 28 -7.763 4.755 -0.211 1.00 0.00 C ATOM 415 CG GLU A 28 -7.235 4.229 1.132 1.00 0.00 C ATOM 416 CD GLU A 28 -7.128 5.354 2.178 1.00 0.00 C ATOM 417 OE1 GLU A 28 -6.065 6.019 2.253 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -8.101 5.573 2.941 1.00 0.00 O ATOM 0 H GLU A 28 -9.013 2.571 0.016 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.180 4.213 -2.223 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.111 5.558 -0.553 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.750 5.191 -0.053 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.898 3.448 1.504 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.256 3.773 0.985 1.00 0.00 H new ATOM 425 N LEU A 29 -6.293 1.793 -1.208 1.00 0.00 N ATOM 426 CA LEU A 29 -5.013 1.092 -1.284 1.00 0.00 C ATOM 427 C LEU A 29 -5.104 -0.298 -1.926 1.00 0.00 C ATOM 428 O LEU A 29 -4.075 -0.955 -2.088 1.00 0.00 O ATOM 429 CB LEU A 29 -4.372 1.069 0.113 1.00 0.00 C ATOM 430 CG LEU A 29 -5.084 0.204 1.178 1.00 0.00 C ATOM 431 CD1 LEU A 29 -4.044 -0.457 2.091 1.00 0.00 C ATOM 432 CD2 LEU A 29 -6.040 1.003 2.069 1.00 0.00 C ATOM 0 H LEU A 29 -7.027 1.233 -0.773 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.364 1.645 -1.963 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -3.346 0.714 0.013 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -4.320 2.093 0.483 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.667 -0.533 0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.551 -1.065 2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.386 -1.089 1.495 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -3.454 0.313 2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.506 0.335 2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.484 1.779 2.595 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.812 1.465 1.453 1.00 0.00 H new ATOM 444 N VAL A 30 -6.297 -0.752 -2.314 1.00 0.00 N ATOM 445 CA VAL A 30 -6.498 -1.977 -3.091 1.00 0.00 C ATOM 446 C VAL A 30 -7.122 -1.581 -4.435 1.00 0.00 C ATOM 447 O VAL A 30 -7.903 -0.630 -4.498 1.00 0.00 O ATOM 448 CB VAL A 30 -7.354 -2.993 -2.307 1.00 0.00 C ATOM 449 CG1 VAL A 30 -7.426 -4.359 -3.012 1.00 0.00 C ATOM 450 CG2 VAL A 30 -6.808 -3.220 -0.890 1.00 0.00 C ATOM 0 H VAL A 30 -7.168 -0.269 -2.093 1.00 0.00 H new ATOM 0 HA VAL A 30 -5.549 -2.479 -3.278 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.352 -2.558 -2.257 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.039 -5.041 -2.423 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -7.868 -4.235 -4.000 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.421 -4.770 -3.113 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.437 -3.942 -0.369 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.789 -3.603 -0.950 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.809 -2.277 -0.344 1.00 0.00 H new ATOM 460 N THR A 31 -6.806 -2.328 -5.491 1.00 0.00 N ATOM 461 CA THR A 31 -7.271 -2.070 -6.854 1.00 0.00 C ATOM 462 C THR A 31 -7.803 -3.386 -7.420 1.00 0.00 C ATOM 463 O THR A 31 -7.140 -4.413 -7.285 1.00 0.00 O ATOM 464 CB THR A 31 -6.108 -1.503 -7.693 1.00 0.00 C ATOM 465 OG1 THR A 31 -5.444 -0.447 -7.012 1.00 0.00 O ATOM 466 CG2 THR A 31 -6.576 -0.968 -9.053 1.00 0.00 C ATOM 0 H THR A 31 -6.205 -3.149 -5.422 1.00 0.00 H new ATOM 0 HA THR A 31 -8.071 -1.330 -6.873 1.00 0.00 H new ATOM 0 HB THR A 31 -5.425 -2.338 -7.851 1.00 0.00 H new ATOM 0 HG1 THR A 31 -4.711 -0.109 -7.568 1.00 0.00 H new ATOM 0 HG21 THR A 31 -5.720 -0.580 -9.605 1.00 0.00 H new ATOM 0 HG22 THR A 31 -7.039 -1.774 -9.621 1.00 0.00 H new ATOM 0 HG23 THR A 31 -7.301 -0.169 -8.900 1.00 0.00 H new ATOM 474 N LEU A 32 -8.988 -3.373 -8.040 1.00 0.00 N ATOM 475 CA LEU A 32 -9.527 -4.559 -8.702 1.00 0.00 C ATOM 476 C LEU A 32 -8.832 -4.693 -10.057 1.00 0.00 C ATOM 477 O LEU A 32 -8.726 -3.709 -10.792 1.00 0.00 O ATOM 478 CB LEU A 32 -11.059 -4.481 -8.872 1.00 0.00 C ATOM 479 CG LEU A 32 -11.882 -4.256 -7.588 1.00 0.00 C ATOM 480 CD1 LEU A 32 -13.365 -4.544 -7.835 1.00 0.00 C ATOM 481 CD2 LEU A 32 -11.401 -5.126 -6.422 1.00 0.00 C ATOM 0 H LEU A 32 -9.590 -2.552 -8.095 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.335 -5.437 -8.086 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.285 -3.673 -9.568 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -11.398 -5.406 -9.337 1.00 0.00 H new ATOM 0 HG LEU A 32 -11.742 -3.210 -7.317 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -13.926 -4.379 -6.915 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -13.740 -3.879 -8.613 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -13.487 -5.580 -8.153 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -12.015 -4.928 -5.543 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.485 -6.178 -6.694 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.360 -4.892 -6.198 1.00 0.00 H new ATOM 493 N HIS A 33 -8.372 -5.897 -10.396 1.00 0.00 N ATOM 494 CA HIS A 33 -7.641 -6.191 -11.625 1.00 0.00 C ATOM 495 C HIS A 33 -8.307 -7.387 -12.316 1.00 0.00 C ATOM 496 O HIS A 33 -7.714 -8.446 -12.512 1.00 0.00 O ATOM 497 CB HIS A 33 -6.143 -6.347 -11.304 1.00 0.00 C ATOM 498 CG HIS A 33 -5.280 -6.522 -12.516 1.00 0.00 C ATOM 499 ND1 HIS A 33 -4.527 -7.653 -12.836 1.00 0.00 N ATOM 500 CD2 HIS A 33 -5.106 -5.575 -13.478 1.00 0.00 C ATOM 501 CE1 HIS A 33 -3.960 -7.378 -14.018 1.00 0.00 C ATOM 502 NE2 HIS A 33 -4.303 -6.151 -14.438 1.00 0.00 N ATOM 0 H HIS A 33 -8.502 -6.718 -9.805 1.00 0.00 H new ATOM 0 HA HIS A 33 -7.686 -5.374 -12.345 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -5.806 -5.469 -10.753 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -6.009 -7.206 -10.647 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -5.514 -4.575 -13.487 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -3.314 -8.053 -14.560 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -4.018 -5.719 -15.317 1.00 0.00 H new ATOM 510 N ASN A 34 -9.597 -7.230 -12.636 1.00 0.00 N ATOM 511 CA ASN A 34 -10.311 -8.165 -13.508 1.00 0.00 C ATOM 512 C ASN A 34 -9.509 -8.239 -14.813 1.00 0.00 C ATOM 513 O ASN A 34 -9.276 -7.213 -15.457 1.00 0.00 O ATOM 514 CB ASN A 34 -11.747 -7.662 -13.747 1.00 0.00 C ATOM 515 CG ASN A 34 -12.473 -8.300 -14.932 1.00 0.00 C ATOM 516 OD1 ASN A 34 -11.977 -9.177 -15.626 1.00 0.00 O ATOM 517 ND2 ASN A 34 -13.681 -7.843 -15.223 1.00 0.00 N ATOM 0 H ASN A 34 -10.170 -6.456 -12.300 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.396 -9.157 -13.064 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.332 -7.840 -12.845 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -11.716 -6.583 -13.899 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -14.191 -8.222 -16.021 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -14.102 -7.112 -14.649 1.00 0.00 H new ATOM 524 N LEU A 35 -9.071 -9.436 -15.195 1.00 0.00 N ATOM 525 CA LEU A 35 -8.182 -9.615 -16.334 1.00 0.00 C ATOM 526 C LEU A 35 -8.845 -9.248 -17.664 1.00 0.00 C ATOM 527 O LEU A 35 -8.193 -8.665 -18.537 1.00 0.00 O ATOM 528 CB LEU A 35 -7.674 -11.054 -16.358 1.00 0.00 C ATOM 529 CG LEU A 35 -6.602 -11.326 -15.291 1.00 0.00 C ATOM 530 CD1 LEU A 35 -6.357 -12.837 -15.259 1.00 0.00 C ATOM 531 CD2 LEU A 35 -5.305 -10.571 -15.604 1.00 0.00 C ATOM 0 H LEU A 35 -9.323 -10.305 -14.724 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.343 -8.930 -16.213 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -8.513 -11.733 -16.205 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -7.263 -11.273 -17.343 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.944 -10.974 -14.318 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.599 -13.067 -14.510 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.285 -13.351 -15.006 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.013 -13.171 -16.238 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -4.565 -10.783 -14.832 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.921 -10.893 -16.572 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.505 -9.500 -15.631 1.00 0.00 H new ATOM 543 N LYS A 36 -10.147 -9.519 -17.809 1.00 0.00 N ATOM 544 CA LYS A 36 -10.909 -9.064 -18.963 1.00 0.00 C ATOM 545 C LYS A 36 -10.989 -7.530 -19.016 1.00 0.00 C ATOM 546 O LYS A 36 -11.284 -6.983 -20.081 1.00 0.00 O ATOM 547 CB LYS A 36 -12.283 -9.746 -18.980 1.00 0.00 C ATOM 548 CG LYS A 36 -12.980 -9.546 -20.339 1.00 0.00 C ATOM 549 CD LYS A 36 -13.967 -10.681 -20.613 1.00 0.00 C ATOM 550 CE LYS A 36 -14.631 -10.590 -21.999 1.00 0.00 C ATOM 551 NZ LYS A 36 -15.565 -9.437 -22.138 1.00 0.00 N ATOM 0 H LYS A 36 -10.692 -10.055 -17.134 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.391 -9.358 -19.876 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.167 -10.811 -18.780 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.906 -9.338 -18.184 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -13.505 -8.591 -20.347 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.234 -9.506 -21.133 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.446 -11.635 -20.530 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -14.741 -10.673 -19.846 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.855 -10.512 -22.760 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.176 -11.514 -22.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -15.976 -9.436 -23.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -16.326 -9.520 -21.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -15.046 -8.549 -21.984 1.00 0.00 H new ATOM 565 N ASP A 37 -10.739 -6.828 -17.904 1.00 0.00 N ATOM 566 CA ASP A 37 -10.844 -5.372 -17.825 1.00 0.00 C ATOM 567 C ASP A 37 -9.490 -4.675 -17.990 1.00 0.00 C ATOM 568 O ASP A 37 -9.437 -3.604 -18.605 1.00 0.00 O ATOM 569 CB ASP A 37 -11.519 -4.935 -16.524 1.00 0.00 C ATOM 570 CG ASP A 37 -11.690 -3.407 -16.492 1.00 0.00 C ATOM 571 OD1 ASP A 37 -12.536 -2.879 -17.256 1.00 0.00 O ATOM 572 OD2 ASP A 37 -11.015 -2.737 -15.675 1.00 0.00 O ATOM 0 H ASP A 37 -10.455 -7.263 -17.026 1.00 0.00 H new ATOM 0 HA ASP A 37 -11.469 -5.062 -18.662 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -12.492 -5.418 -16.432 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -10.922 -5.258 -15.671 1.00 0.00 H new ATOM 577 N ASP A 38 -8.395 -5.273 -17.507 1.00 0.00 N ATOM 578 CA ASP A 38 -7.049 -4.719 -17.680 1.00 0.00 C ATOM 579 C ASP A 38 -5.990 -5.809 -17.856 1.00 0.00 C ATOM 580 O ASP A 38 -6.079 -6.886 -17.261 1.00 0.00 O ATOM 581 CB ASP A 38 -6.649 -3.768 -16.535 1.00 0.00 C ATOM 582 CG ASP A 38 -5.876 -2.536 -17.053 1.00 0.00 C ATOM 583 OD1 ASP A 38 -5.285 -2.579 -18.159 1.00 0.00 O ATOM 584 OD2 ASP A 38 -5.874 -1.503 -16.339 1.00 0.00 O1- ATOM 0 H ASP A 38 -8.417 -6.151 -16.988 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.090 -4.135 -18.600 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -7.544 -3.439 -16.007 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -6.033 -4.306 -15.814 1.00 0.00 H new ATOM 589 N SER A 39 -4.980 -5.509 -18.674 1.00 0.00 N ATOM 590 CA SER A 39 -3.971 -6.438 -19.176 1.00 0.00 C ATOM 591 C SER A 39 -3.052 -6.964 -18.055 1.00 0.00 C ATOM 592 O SER A 39 -2.911 -6.316 -17.015 1.00 0.00 O ATOM 593 CB SER A 39 -3.205 -5.726 -20.307 1.00 0.00 C ATOM 594 OG SER A 39 -4.116 -5.147 -21.235 1.00 0.00 O ATOM 0 H SER A 39 -4.838 -4.561 -19.022 1.00 0.00 H new ATOM 0 HA SER A 39 -4.447 -7.334 -19.574 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.562 -4.952 -19.888 1.00 0.00 H new ATOM 0 HB3 SER A 39 -2.557 -6.437 -20.819 1.00 0.00 H new ATOM 0 HG SER A 39 -3.616 -4.697 -21.947 1.00 0.00 H new ATOM 600 N PRO A 40 -2.374 -8.118 -18.231 1.00 0.00 N ATOM 601 CA PRO A 40 -1.639 -8.774 -17.146 1.00 0.00 C ATOM 602 C PRO A 40 -0.341 -8.062 -16.783 1.00 0.00 C ATOM 603 O PRO A 40 0.075 -8.124 -15.635 1.00 0.00 O ATOM 604 CB PRO A 40 -1.392 -10.208 -17.630 1.00 0.00 C ATOM 605 CG PRO A 40 -1.300 -10.034 -19.147 1.00 0.00 C ATOM 606 CD PRO A 40 -2.359 -8.963 -19.422 1.00 0.00 C ATOM 0 HA PRO A 40 -2.217 -8.751 -16.222 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -0.475 -10.625 -17.213 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -2.204 -10.877 -17.347 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -0.307 -9.712 -19.459 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -1.515 -10.963 -19.676 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -2.111 -8.384 -20.311 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -3.336 -9.413 -19.597 1.00 0.00 H new ATOM 614 N LYS A 41 0.301 -7.330 -17.697 1.00 0.00 N ATOM 615 CA LYS A 41 1.588 -6.688 -17.399 1.00 0.00 C ATOM 616 C LYS A 41 1.424 -5.515 -16.418 1.00 0.00 C ATOM 617 O LYS A 41 2.394 -5.095 -15.798 1.00 0.00 O ATOM 618 CB LYS A 41 2.315 -6.336 -18.715 1.00 0.00 C ATOM 619 CG LYS A 41 2.692 -7.603 -19.526 1.00 0.00 C ATOM 620 CD LYS A 41 3.992 -8.288 -19.077 1.00 0.00 C ATOM 621 CE LYS A 41 5.251 -7.591 -19.618 1.00 0.00 C ATOM 622 NZ LYS A 41 6.492 -8.140 -19.014 1.00 0.00 N1+ ATOM 0 H LYS A 41 -0.044 -7.167 -18.643 1.00 0.00 H new ATOM 0 HA LYS A 41 2.236 -7.388 -16.871 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.676 -5.694 -19.322 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.217 -5.767 -18.490 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.875 -8.321 -19.454 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.785 -7.331 -20.577 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.031 -8.304 -17.988 1.00 0.00 H new ATOM 0 HD3 LYS A 41 3.985 -9.325 -19.411 1.00 0.00 H new ATOM 0 HE2 LYS A 41 5.293 -7.707 -20.701 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.190 -6.522 -19.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 7.315 -7.620 -19.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 6.449 -8.038 -17.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 6.581 -9.147 -19.259 1.00 0.00 H new ATOM 636 N LEU A 42 0.184 -5.082 -16.161 1.00 0.00 N ATOM 637 CA LEU A 42 -0.190 -4.143 -15.103 1.00 0.00 C ATOM 638 C LEU A 42 0.148 -4.729 -13.738 1.00 0.00 C ATOM 639 O LEU A 42 0.455 -3.967 -12.825 1.00 0.00 O ATOM 640 CB LEU A 42 -1.709 -3.857 -15.145 1.00 0.00 C ATOM 641 CG LEU A 42 -2.297 -2.955 -16.254 1.00 0.00 C ATOM 642 CD1 LEU A 42 -2.134 -1.473 -15.911 1.00 0.00 C ATOM 643 CD2 LEU A 42 -1.700 -3.177 -17.648 1.00 0.00 C ATOM 0 H LEU A 42 -0.619 -5.391 -16.709 1.00 0.00 H new ATOM 0 HA LEU A 42 0.365 -3.218 -15.263 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.218 -4.819 -15.206 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.981 -3.413 -14.188 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.348 -3.243 -16.292 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.558 -0.866 -16.711 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.653 -1.256 -14.977 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.075 -1.240 -15.800 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.174 -2.500 -18.359 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.628 -2.981 -17.620 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.873 -4.208 -17.958 1.00 0.00 H new ATOM 655 N MET A 43 0.130 -6.063 -13.589 1.00 0.00 N ATOM 656 CA MET A 43 0.474 -6.745 -12.335 1.00 0.00 C ATOM 657 C MET A 43 1.867 -6.349 -11.847 1.00 0.00 C ATOM 658 O MET A 43 2.130 -6.409 -10.650 1.00 0.00 O ATOM 659 CB MET A 43 0.485 -8.263 -12.524 1.00 0.00 C ATOM 660 CG MET A 43 -0.891 -8.887 -12.736 1.00 0.00 C ATOM 661 SD MET A 43 -0.803 -10.690 -12.630 1.00 0.00 S ATOM 662 CE MET A 43 -2.295 -11.106 -13.548 1.00 0.00 C ATOM 0 H MET A 43 -0.126 -6.702 -14.342 1.00 0.00 H new ATOM 0 HA MET A 43 -0.282 -6.448 -11.608 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.115 -8.505 -13.380 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.946 -8.721 -11.649 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.586 -8.508 -11.987 1.00 0.00 H new ATOM 0 HG3 MET A 43 -1.282 -8.594 -13.711 1.00 0.00 H new ATOM 0 HE1 MET A 43 -2.475 -12.179 -13.482 1.00 0.00 H new ATOM 0 HE2 MET A 43 -3.144 -10.569 -13.125 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.170 -10.822 -14.593 1.00 0.00 H new ATOM 672 N GLU A 44 2.767 -5.954 -12.756 1.00 0.00 N ATOM 673 CA GLU A 44 4.138 -5.627 -12.400 1.00 0.00 C ATOM 674 C GLU A 44 4.174 -4.384 -11.501 1.00 0.00 C ATOM 675 O GLU A 44 5.029 -4.306 -10.619 1.00 0.00 O ATOM 676 CB GLU A 44 4.996 -5.449 -13.667 1.00 0.00 C ATOM 677 CG GLU A 44 5.067 -6.740 -14.503 1.00 0.00 C ATOM 678 CD GLU A 44 5.967 -6.652 -15.749 1.00 0.00 C ATOM 679 OE1 GLU A 44 6.315 -5.545 -16.225 1.00 0.00 O ATOM 680 OE2 GLU A 44 6.329 -7.736 -16.267 1.00 0.00 O1- ATOM 0 H GLU A 44 2.560 -5.855 -13.750 1.00 0.00 H new ATOM 0 HA GLU A 44 4.566 -6.453 -11.832 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.581 -4.646 -14.276 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.004 -5.146 -13.383 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.428 -7.549 -13.867 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.059 -7.008 -14.818 1.00 0.00 H new ATOM 687 N GLN A 45 3.222 -3.452 -11.673 1.00 0.00 N ATOM 688 CA GLN A 45 3.255 -2.133 -11.037 1.00 0.00 C ATOM 689 C GLN A 45 3.032 -2.201 -9.521 1.00 0.00 C ATOM 690 O GLN A 45 3.679 -1.482 -8.758 1.00 0.00 O ATOM 691 CB GLN A 45 2.133 -1.243 -11.597 1.00 0.00 C ATOM 692 CG GLN A 45 2.024 -1.123 -13.127 1.00 0.00 C ATOM 693 CD GLN A 45 0.678 -0.489 -13.487 1.00 0.00 C ATOM 694 OE1 GLN A 45 0.612 0.598 -14.056 1.00 0.00 O ATOM 695 NE2 GLN A 45 -0.423 -1.150 -13.143 1.00 0.00 N ATOM 0 H GLN A 45 2.403 -3.598 -12.263 1.00 0.00 H new ATOM 0 HA GLN A 45 4.245 -1.729 -11.247 1.00 0.00 H new ATOM 0 HB2 GLN A 45 1.183 -1.621 -11.220 1.00 0.00 H new ATOM 0 HB3 GLN A 45 2.262 -0.241 -11.188 1.00 0.00 H new ATOM 0 HG2 GLN A 45 2.841 -0.515 -13.515 1.00 0.00 H new ATOM 0 HG3 GLN A 45 2.111 -2.107 -13.588 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.350 -2.051 -12.671 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -1.340 -0.756 -13.351 1.00 0.00 H new ATOM 704 N TYR A 46 2.052 -3.013 -9.114 1.00 0.00 N ATOM 705 CA TYR A 46 1.528 -3.032 -7.751 1.00 0.00 C ATOM 706 C TYR A 46 2.596 -3.580 -6.813 1.00 0.00 C ATOM 707 O TYR A 46 3.370 -4.448 -7.216 1.00 0.00 O ATOM 708 CB TYR A 46 0.238 -3.860 -7.680 1.00 0.00 C ATOM 709 CG TYR A 46 -0.852 -3.461 -8.661 1.00 0.00 C ATOM 710 CD1 TYR A 46 -0.905 -4.056 -9.934 1.00 0.00 C ATOM 711 CD2 TYR A 46 -1.832 -2.519 -8.299 1.00 0.00 C ATOM 712 CE1 TYR A 46 -1.916 -3.704 -10.842 1.00 0.00 C ATOM 713 CE2 TYR A 46 -2.810 -2.118 -9.228 1.00 0.00 C ATOM 714 CZ TYR A 46 -2.861 -2.714 -10.509 1.00 0.00 C ATOM 715 OH TYR A 46 -3.792 -2.342 -11.432 1.00 0.00 O ATOM 0 H TYR A 46 1.596 -3.684 -9.733 1.00 0.00 H new ATOM 0 HA TYR A 46 1.277 -2.018 -7.440 1.00 0.00 H new ATOM 0 HB2 TYR A 46 0.489 -4.907 -7.850 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -0.164 -3.788 -6.669 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -0.163 -4.789 -10.215 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -1.834 -2.101 -7.303 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -1.970 -4.195 -11.802 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -3.524 -1.353 -8.962 1.00 0.00 H new ATOM 0 HH TYR A 46 -4.372 -1.650 -11.051 1.00 0.00 H new ATOM 725 N ASP A 47 2.654 -3.126 -5.560 1.00 0.00 N ATOM 726 CA ASP A 47 3.685 -3.618 -4.644 1.00 0.00 C ATOM 727 C ASP A 47 3.250 -4.964 -4.087 1.00 0.00 C ATOM 728 O ASP A 47 4.052 -5.891 -3.963 1.00 0.00 O ATOM 729 CB ASP A 47 3.926 -2.628 -3.515 1.00 0.00 C ATOM 730 CG ASP A 47 5.107 -3.122 -2.668 1.00 0.00 C ATOM 731 OD1 ASP A 47 6.262 -2.757 -2.988 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 4.879 -3.864 -1.687 1.00 0.00 O ATOM 0 H ASP A 47 2.017 -2.436 -5.163 1.00 0.00 H new ATOM 0 HA ASP A 47 4.622 -3.732 -5.188 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.139 -1.639 -3.920 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.032 -2.534 -2.898 1.00 0.00 H new ATOM 737 N VAL A 48 1.945 -5.089 -3.840 1.00 0.00 N ATOM 738 CA VAL A 48 1.311 -6.345 -3.520 1.00 0.00 C ATOM 739 C VAL A 48 0.525 -6.817 -4.727 1.00 0.00 C ATOM 740 O VAL A 48 -0.006 -6.002 -5.472 1.00 0.00 O ATOM 741 CB VAL A 48 0.504 -6.271 -2.213 1.00 0.00 C ATOM 742 CG1 VAL A 48 0.536 -4.952 -1.436 1.00 0.00 C ATOM 743 CG2 VAL A 48 -0.791 -7.094 -2.207 1.00 0.00 C ATOM 0 H VAL A 48 1.298 -4.300 -3.860 1.00 0.00 H new ATOM 0 HA VAL A 48 2.065 -7.103 -3.310 1.00 0.00 H new ATOM 0 HB VAL A 48 1.118 -6.841 -1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.075 -5.044 -0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.563 -4.721 -1.153 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.143 -4.151 -2.062 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -1.291 -6.979 -1.245 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.449 -6.743 -3.002 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.555 -8.146 -2.370 1.00 0.00 H new ATOM 753 N LEU A 49 0.367 -8.127 -4.878 1.00 0.00 N ATOM 754 CA LEU A 49 -0.448 -8.717 -5.919 1.00 0.00 C ATOM 755 C LEU A 49 -1.190 -9.913 -5.345 1.00 0.00 C ATOM 756 O LEU A 49 -0.611 -10.960 -5.068 1.00 0.00 O ATOM 757 CB LEU A 49 0.510 -9.096 -7.035 1.00 0.00 C ATOM 758 CG LEU A 49 -0.130 -9.824 -8.230 1.00 0.00 C ATOM 759 CD1 LEU A 49 -1.099 -8.903 -8.979 1.00 0.00 C ATOM 760 CD2 LEU A 49 0.989 -10.289 -9.166 1.00 0.00 C ATOM 0 H LEU A 49 0.810 -8.814 -4.269 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.208 -8.040 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.994 -8.190 -7.399 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.293 -9.731 -6.620 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.701 -10.680 -7.871 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.537 -9.442 -9.819 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.890 -8.580 -8.302 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.560 -8.031 -9.349 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.556 -10.808 -10.021 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.554 -9.425 -9.515 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.654 -10.965 -8.630 1.00 0.00 H new ATOM 772 N ILE A 50 -2.482 -9.748 -5.134 1.00 0.00 N ATOM 773 CA ILE A 50 -3.384 -10.775 -4.668 1.00 0.00 C ATOM 774 C ILE A 50 -3.819 -11.562 -5.918 1.00 0.00 C ATOM 775 O ILE A 50 -4.226 -10.936 -6.897 1.00 0.00 O ATOM 776 CB ILE A 50 -4.530 -10.047 -3.921 1.00 0.00 C ATOM 777 CG1 ILE A 50 -4.092 -9.388 -2.592 1.00 0.00 C ATOM 778 CG2 ILE A 50 -5.720 -10.982 -3.718 1.00 0.00 C ATOM 779 CD1 ILE A 50 -4.938 -8.153 -2.247 1.00 0.00 C ATOM 0 H ILE A 50 -2.948 -8.854 -5.291 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.958 -11.494 -3.968 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.836 -9.221 -4.563 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.170 -10.116 -1.785 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.043 -9.100 -2.660 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -6.514 -10.452 -3.192 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.089 -11.318 -4.687 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.408 -11.845 -3.130 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.592 -7.726 -1.306 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.839 -7.411 -3.040 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.984 -8.444 -2.150 1.00 0.00 H new ATOM 791 N LEU A 51 -3.777 -12.901 -5.905 1.00 0.00 N ATOM 792 CA LEU A 51 -4.354 -13.768 -6.927 1.00 0.00 C ATOM 793 C LEU A 51 -5.603 -14.407 -6.327 1.00 0.00 C ATOM 794 O LEU A 51 -5.521 -14.942 -5.219 1.00 0.00 O ATOM 795 CB LEU A 51 -3.299 -14.801 -7.372 1.00 0.00 C ATOM 796 CG LEU A 51 -3.768 -15.917 -8.311 1.00 0.00 C ATOM 797 CD1 LEU A 51 -4.127 -17.183 -7.524 1.00 0.00 C ATOM 798 CD2 LEU A 51 -4.886 -15.580 -9.297 1.00 0.00 C ATOM 0 H LEU A 51 -3.324 -13.423 -5.155 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.644 -13.218 -7.822 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.487 -14.265 -7.863 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.881 -15.264 -6.478 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.897 -16.080 -8.946 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -4.457 -17.959 -8.214 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -3.251 -17.532 -6.977 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -4.929 -16.959 -6.820 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.118 -16.459 -9.898 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -5.775 -15.271 -8.747 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.563 -14.769 -9.950 1.00 0.00 H new ATOM 810 N GLY A 52 -6.726 -14.387 -7.047 1.00 0.00 N ATOM 811 CA GLY A 52 -7.942 -15.111 -6.689 1.00 0.00 C ATOM 812 C GLY A 52 -8.399 -15.961 -7.865 1.00 0.00 C ATOM 813 O GLY A 52 -8.384 -15.476 -8.998 1.00 0.00 O ATOM 0 H GLY A 52 -6.815 -13.855 -7.913 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.758 -15.744 -5.821 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.727 -14.408 -6.410 1.00 0.00 H new ATOM 817 N ILE A 53 -8.787 -17.218 -7.631 1.00 0.00 N ATOM 818 CA ILE A 53 -9.363 -18.059 -8.681 1.00 0.00 C ATOM 819 C ILE A 53 -10.320 -19.113 -8.106 1.00 0.00 C ATOM 820 O ILE A 53 -9.977 -19.771 -7.126 1.00 0.00 O ATOM 821 CB ILE A 53 -8.246 -18.713 -9.541 1.00 0.00 C ATOM 822 CG1 ILE A 53 -8.850 -19.742 -10.523 1.00 0.00 C ATOM 823 CG2 ILE A 53 -7.139 -19.388 -8.702 1.00 0.00 C ATOM 824 CD1 ILE A 53 -8.078 -19.969 -11.809 1.00 0.00 C ATOM 0 H ILE A 53 -8.712 -17.675 -6.722 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.954 -17.415 -9.332 1.00 0.00 H new ATOM 0 HB ILE A 53 -7.777 -17.898 -10.092 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -8.943 -20.697 -10.005 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.859 -19.419 -10.781 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -6.393 -19.823 -9.367 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -6.664 -18.645 -8.061 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -7.577 -20.173 -8.085 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -8.596 -20.710 -12.418 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -8.006 -19.032 -12.361 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -7.076 -20.329 -11.573 1.00 0.00 H new ATOM 836 N PRO A 54 -11.506 -19.319 -8.701 1.00 0.00 N ATOM 837 CA PRO A 54 -12.319 -20.494 -8.423 1.00 0.00 C ATOM 838 C PRO A 54 -11.710 -21.720 -9.123 1.00 0.00 C ATOM 839 O PRO A 54 -11.364 -21.664 -10.303 1.00 0.00 O ATOM 840 CB PRO A 54 -13.705 -20.169 -8.986 1.00 0.00 C ATOM 841 CG PRO A 54 -13.406 -19.201 -10.123 1.00 0.00 C ATOM 842 CD PRO A 54 -12.238 -18.399 -9.567 1.00 0.00 C ATOM 0 HA PRO A 54 -12.371 -20.727 -7.359 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.213 -21.064 -9.344 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.349 -19.717 -8.232 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.140 -19.723 -11.042 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.262 -18.567 -10.353 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.602 -18.026 -10.369 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -12.589 -17.531 -9.009 1.00 0.00 H new ATOM 850 N THR A 55 -11.596 -22.833 -8.405 1.00 0.00 N ATOM 851 CA THR A 55 -11.282 -24.137 -8.971 1.00 0.00 C ATOM 852 C THR A 55 -12.609 -24.901 -9.071 1.00 0.00 C ATOM 853 O THR A 55 -13.372 -24.958 -8.101 1.00 0.00 O ATOM 854 CB THR A 55 -10.252 -24.873 -8.106 1.00 0.00 C ATOM 855 OG1 THR A 55 -9.049 -24.133 -7.997 1.00 0.00 O ATOM 856 CG2 THR A 55 -9.859 -26.211 -8.724 1.00 0.00 C ATOM 0 H THR A 55 -11.722 -22.852 -7.393 1.00 0.00 H new ATOM 0 HA THR A 55 -10.828 -24.046 -9.958 1.00 0.00 H new ATOM 0 HB THR A 55 -10.726 -25.009 -7.134 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.158 -23.428 -7.325 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.128 -26.706 -8.085 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.743 -26.841 -8.819 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.425 -26.043 -9.710 1.00 0.00 H new ATOM 864 N TRP A 56 -12.851 -25.523 -10.225 1.00 0.00 N ATOM 865 CA TRP A 56 -13.929 -26.472 -10.470 1.00 0.00 C ATOM 866 C TRP A 56 -13.315 -27.590 -11.320 1.00 0.00 C ATOM 867 O TRP A 56 -12.449 -27.299 -12.153 1.00 0.00 O ATOM 868 CB TRP A 56 -15.083 -25.780 -11.210 1.00 0.00 C ATOM 869 CG TRP A 56 -15.760 -24.628 -10.523 1.00 0.00 C ATOM 870 CD1 TRP A 56 -16.513 -24.709 -9.404 1.00 0.00 C ATOM 871 CD2 TRP A 56 -15.824 -23.226 -10.935 1.00 0.00 C ATOM 872 NE1 TRP A 56 -17.031 -23.471 -9.089 1.00 0.00 N ATOM 873 CE2 TRP A 56 -16.662 -22.520 -10.015 1.00 0.00 C ATOM 874 CE3 TRP A 56 -15.287 -22.479 -12.008 1.00 0.00 C ATOM 875 CZ2 TRP A 56 -16.962 -21.158 -10.164 1.00 0.00 C ATOM 876 CZ3 TRP A 56 -15.585 -21.111 -12.169 1.00 0.00 C ATOM 877 CH2 TRP A 56 -16.423 -20.452 -11.252 1.00 0.00 C ATOM 0 H TRP A 56 -12.272 -25.369 -11.051 1.00 0.00 H new ATOM 0 HA TRP A 56 -14.344 -26.869 -9.544 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -14.702 -25.423 -12.167 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -15.841 -26.532 -11.429 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -16.684 -25.613 -8.838 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -17.614 -23.283 -8.273 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -14.636 -22.966 -12.718 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -17.600 -20.658 -9.450 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -15.167 -20.565 -13.002 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -16.652 -19.405 -11.384 1.00 0.00 H new ATOM 888 N ASP A 57 -13.712 -28.852 -11.115 1.00 0.00 N ATOM 889 CA ASP A 57 -13.148 -29.967 -11.889 1.00 0.00 C ATOM 890 C ASP A 57 -13.558 -29.861 -13.359 1.00 0.00 C ATOM 891 O ASP A 57 -12.714 -29.983 -14.253 1.00 0.00 O ATOM 892 CB ASP A 57 -13.581 -31.318 -11.324 1.00 0.00 C ATOM 893 CG ASP A 57 -13.142 -32.450 -12.274 1.00 0.00 C ATOM 894 OD1 ASP A 57 -11.922 -32.718 -12.382 1.00 0.00 O ATOM 895 OD2 ASP A 57 -14.021 -33.076 -12.915 1.00 0.00 O ATOM 0 H ASP A 57 -14.414 -29.126 -10.428 1.00 0.00 H new ATOM 0 HA ASP A 57 -12.063 -29.901 -11.814 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.141 -31.468 -10.338 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.663 -31.338 -11.196 1.00 0.00 H new ATOM 900 N PHE A 58 -14.841 -29.587 -13.609 1.00 0.00 N ATOM 901 CA PHE A 58 -15.333 -29.224 -14.931 1.00 0.00 C ATOM 902 C PHE A 58 -15.110 -27.722 -15.126 1.00 0.00 C ATOM 903 O PHE A 58 -15.156 -26.952 -14.166 1.00 0.00 O ATOM 904 CB PHE A 58 -16.802 -29.644 -15.110 1.00 0.00 C ATOM 905 CG PHE A 58 -17.761 -29.183 -14.022 1.00 0.00 C ATOM 906 CD1 PHE A 58 -18.310 -27.886 -14.056 1.00 0.00 C ATOM 907 CD2 PHE A 58 -18.123 -30.064 -12.982 1.00 0.00 C ATOM 908 CE1 PHE A 58 -19.209 -27.472 -13.054 1.00 0.00 C ATOM 909 CE2 PHE A 58 -19.026 -29.650 -11.985 1.00 0.00 C ATOM 910 CZ PHE A 58 -19.570 -28.356 -12.021 1.00 0.00 C ATOM 0 H PHE A 58 -15.567 -29.612 -12.893 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.783 -29.759 -15.705 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -17.156 -29.259 -16.067 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -16.845 -30.732 -15.168 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -18.041 -27.208 -14.852 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -17.706 -31.060 -12.951 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -19.622 -26.474 -13.079 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -19.301 -30.329 -11.191 1.00 0.00 H new ATOM 0 HZ PHE A 58 -20.265 -28.040 -11.257 1.00 0.00 H new ATOM 920 N GLY A 59 -14.869 -27.289 -16.365 1.00 0.00 N ATOM 921 CA GLY A 59 -14.614 -25.891 -16.701 1.00 0.00 C ATOM 922 C GLY A 59 -13.177 -25.473 -16.368 1.00 0.00 C ATOM 923 O GLY A 59 -12.481 -24.974 -17.257 1.00 0.00 O ATOM 0 H GLY A 59 -14.846 -27.911 -17.173 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.800 -25.734 -17.763 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.312 -25.254 -16.157 1.00 0.00 H new ATOM 927 N GLU A 60 -12.709 -25.737 -15.140 1.00 0.00 N ATOM 928 CA GLU A 60 -11.391 -25.336 -14.633 1.00 0.00 C ATOM 929 C GLU A 60 -11.201 -23.810 -14.779 1.00 0.00 C ATOM 930 O GLU A 60 -12.177 -23.052 -14.830 1.00 0.00 O ATOM 931 CB GLU A 60 -10.312 -26.213 -15.310 1.00 0.00 C ATOM 932 CG GLU A 60 -9.052 -26.438 -14.461 1.00 0.00 C ATOM 933 CD GLU A 60 -8.053 -27.341 -15.209 1.00 0.00 C ATOM 934 OE1 GLU A 60 -7.209 -26.804 -15.965 1.00 0.00 O ATOM 935 OE2 GLU A 60 -8.107 -28.586 -15.051 1.00 0.00 O1- ATOM 0 H GLU A 60 -13.256 -26.252 -14.450 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.297 -25.516 -13.562 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.749 -27.181 -15.554 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.022 -25.748 -16.252 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.585 -25.480 -14.232 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.324 -26.896 -13.510 1.00 0.00 H new ATOM 942 N ILE A 61 -9.946 -23.346 -14.769 1.00 0.00 N ATOM 943 CA ILE A 61 -9.521 -21.997 -15.123 1.00 0.00 C ATOM 944 C ILE A 61 -10.353 -21.486 -16.314 1.00 0.00 C ATOM 945 O ILE A 61 -10.367 -22.097 -17.388 1.00 0.00 O ATOM 946 CB ILE A 61 -8.008 -22.066 -15.452 1.00 0.00 C ATOM 947 CG1 ILE A 61 -7.185 -22.233 -14.156 1.00 0.00 C ATOM 948 CG2 ILE A 61 -7.505 -20.819 -16.188 1.00 0.00 C ATOM 949 CD1 ILE A 61 -5.841 -22.921 -14.326 1.00 0.00 C ATOM 0 H ILE A 61 -9.161 -23.938 -14.498 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.680 -21.294 -14.305 1.00 0.00 H new ATOM 0 HB ILE A 61 -7.876 -22.927 -16.108 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.018 -21.247 -13.721 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.778 -22.801 -13.439 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -6.439 -20.922 -16.393 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -8.046 -20.708 -17.128 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -7.672 -19.938 -15.568 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.342 -22.989 -13.359 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.993 -23.923 -14.727 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.222 -22.345 -15.014 1.00 0.00 H new ATOM 961 N GLN A 62 -11.024 -20.346 -16.110 1.00 0.00 N ATOM 962 CA GLN A 62 -11.798 -19.667 -17.145 1.00 0.00 C ATOM 963 C GLN A 62 -10.865 -19.062 -18.194 1.00 0.00 C ATOM 964 O GLN A 62 -9.710 -18.742 -17.907 1.00 0.00 O ATOM 965 CB GLN A 62 -12.787 -18.638 -16.556 1.00 0.00 C ATOM 966 CG GLN A 62 -12.209 -17.680 -15.497 1.00 0.00 C ATOM 967 CD GLN A 62 -12.138 -18.311 -14.102 1.00 0.00 C ATOM 968 OE1 GLN A 62 -13.104 -18.847 -13.582 1.00 0.00 O ATOM 969 NE2 GLN A 62 -10.974 -18.311 -13.471 1.00 0.00 N ATOM 0 H GLN A 62 -11.042 -19.867 -15.210 1.00 0.00 H new ATOM 0 HA GLN A 62 -12.419 -20.409 -17.647 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -13.192 -18.043 -17.374 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -13.622 -19.179 -16.111 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -11.210 -17.369 -15.802 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.823 -16.781 -15.453 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -10.162 -17.865 -13.899 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -10.889 -18.757 -12.557 1.00 0.00 H new ATOM 978 N GLU A 63 -11.402 -18.862 -19.401 1.00 0.00 N ATOM 979 CA GLU A 63 -10.644 -18.528 -20.598 1.00 0.00 C ATOM 980 C GLU A 63 -9.764 -17.295 -20.406 1.00 0.00 C ATOM 981 O GLU A 63 -8.582 -17.356 -20.730 1.00 0.00 O ATOM 982 CB GLU A 63 -11.622 -18.356 -21.773 1.00 0.00 C ATOM 983 CG GLU A 63 -10.912 -18.057 -23.099 1.00 0.00 C ATOM 984 CD GLU A 63 -11.905 -18.035 -24.275 1.00 0.00 C ATOM 985 OE1 GLU A 63 -12.473 -16.957 -24.578 1.00 0.00 O ATOM 986 OE2 GLU A 63 -12.118 -19.094 -24.918 1.00 0.00 O ATOM 0 H GLU A 63 -12.405 -18.931 -19.571 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.957 -19.345 -20.816 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.216 -19.263 -21.881 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.315 -17.546 -21.547 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.403 -17.095 -23.032 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.146 -18.811 -23.281 1.00 0.00 H new ATOM 993 N ASP A 64 -10.284 -16.194 -19.849 1.00 0.00 N ATOM 994 CA ASP A 64 -9.504 -14.948 -19.813 1.00 0.00 C ATOM 995 C ASP A 64 -8.285 -15.075 -18.894 1.00 0.00 C ATOM 996 O ASP A 64 -7.223 -14.505 -19.146 1.00 0.00 O ATOM 997 CB ASP A 64 -10.349 -13.738 -19.395 1.00 0.00 C ATOM 998 CG ASP A 64 -9.725 -12.483 -20.029 1.00 0.00 C ATOM 999 OD1 ASP A 64 -10.105 -12.145 -21.177 1.00 0.00 O ATOM 1000 OD2 ASP A 64 -8.845 -11.857 -19.401 1.00 0.00 O1- ATOM 0 H ASP A 64 -11.212 -16.137 -19.429 1.00 0.00 H new ATOM 0 HA ASP A 64 -9.160 -14.778 -20.833 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.380 -13.860 -19.726 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -10.372 -13.646 -18.309 1.00 0.00 H new ATOM 1005 N TRP A 65 -8.422 -15.888 -17.843 1.00 0.00 N ATOM 1006 CA TRP A 65 -7.357 -16.148 -16.887 1.00 0.00 C ATOM 1007 C TRP A 65 -6.321 -17.063 -17.540 1.00 0.00 C ATOM 1008 O TRP A 65 -5.128 -16.777 -17.472 1.00 0.00 O ATOM 1009 CB TRP A 65 -7.992 -16.734 -15.622 1.00 0.00 C ATOM 1010 CG TRP A 65 -7.202 -16.737 -14.342 1.00 0.00 C ATOM 1011 CD1 TRP A 65 -7.450 -15.945 -13.271 1.00 0.00 C ATOM 1012 CD2 TRP A 65 -6.159 -17.662 -13.903 1.00 0.00 C ATOM 1013 NE1 TRP A 65 -6.686 -16.350 -12.198 1.00 0.00 N ATOM 1014 CE2 TRP A 65 -5.931 -17.460 -12.510 1.00 0.00 C ATOM 1015 CE3 TRP A 65 -5.443 -18.711 -14.515 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 -5.143 -18.334 -11.747 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 -4.641 -19.589 -13.763 1.00 0.00 C ATOM 1018 CH2 TRP A 65 -4.532 -19.430 -12.373 1.00 0.00 C ATOM 0 H TRP A 65 -9.287 -16.387 -17.635 1.00 0.00 H new ATOM 0 HA TRP A 65 -6.827 -15.241 -16.595 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -8.917 -16.189 -15.436 1.00 0.00 H new ATOM 0 HB3 TRP A 65 -8.268 -17.766 -15.840 1.00 0.00 H new ATOM 0 HD1 TRP A 65 -8.144 -15.118 -13.260 1.00 0.00 H new ATOM 0 HE1 TRP A 65 -6.680 -15.887 -11.289 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -5.512 -18.844 -15.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 -5.008 -18.165 -10.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -4.108 -20.388 -14.257 1.00 0.00 H new ATOM 0 HH2 TRP A 65 -3.979 -20.150 -11.787 1.00 0.00 H new ATOM 1029 N GLU A 66 -6.745 -18.119 -18.241 1.00 0.00 N ATOM 1030 CA GLU A 66 -5.843 -19.001 -18.964 1.00 0.00 C ATOM 1031 C GLU A 66 -5.099 -18.213 -20.054 1.00 0.00 C ATOM 1032 O GLU A 66 -3.913 -18.452 -20.291 1.00 0.00 O ATOM 1033 CB GLU A 66 -6.645 -20.198 -19.510 1.00 0.00 C ATOM 1034 CG GLU A 66 -6.138 -20.657 -20.868 1.00 0.00 C ATOM 1035 CD GLU A 66 -6.841 -21.941 -21.338 1.00 0.00 C ATOM 1036 OE1 GLU A 66 -7.951 -21.858 -21.919 1.00 0.00 O ATOM 1037 OE2 GLU A 66 -6.279 -23.045 -21.143 1.00 0.00 O1- ATOM 0 H GLU A 66 -7.728 -18.381 -18.319 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.075 -19.401 -18.302 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.586 -21.026 -18.803 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.696 -19.922 -19.591 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.298 -19.866 -21.601 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.063 -20.830 -20.815 1.00 0.00 H new ATOM 1044 N ALA A 67 -5.779 -17.260 -20.693 1.00 0.00 N ATOM 1045 CA ALA A 67 -5.245 -16.521 -21.828 1.00 0.00 C ATOM 1046 C ALA A 67 -3.998 -15.728 -21.432 1.00 0.00 C ATOM 1047 O ALA A 67 -3.148 -15.452 -22.279 1.00 0.00 O ATOM 1048 CB ALA A 67 -6.310 -15.574 -22.382 1.00 0.00 C ATOM 0 H ALA A 67 -6.724 -16.980 -20.431 1.00 0.00 H new ATOM 0 HA ALA A 67 -4.962 -17.239 -22.598 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -5.903 -15.025 -23.231 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.177 -16.150 -22.705 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.611 -14.871 -21.606 1.00 0.00 H new ATOM 1054 N VAL A 68 -3.882 -15.392 -20.145 1.00 0.00 N ATOM 1055 CA VAL A 68 -2.713 -14.728 -19.588 1.00 0.00 C ATOM 1056 C VAL A 68 -1.887 -15.644 -18.702 1.00 0.00 C ATOM 1057 O VAL A 68 -0.752 -15.278 -18.427 1.00 0.00 O ATOM 1058 CB VAL A 68 -3.106 -13.435 -18.861 1.00 0.00 C ATOM 1059 CG1 VAL A 68 -3.836 -12.482 -19.813 1.00 0.00 C ATOM 1060 CG2 VAL A 68 -3.953 -13.683 -17.614 1.00 0.00 C ATOM 0 H VAL A 68 -4.610 -15.578 -19.456 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.072 -14.458 -20.427 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.176 -12.975 -18.526 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.107 -11.571 -19.279 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.183 -12.232 -20.649 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.739 -12.964 -20.189 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.198 -12.730 -17.145 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.873 -14.196 -17.895 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.393 -14.300 -16.911 1.00 0.00 H new ATOM 1070 N TRP A 69 -2.392 -16.808 -18.279 1.00 0.00 N ATOM 1071 CA TRP A 69 -1.698 -17.754 -17.400 1.00 0.00 C ATOM 1072 C TRP A 69 -0.303 -18.059 -17.953 1.00 0.00 C ATOM 1073 O TRP A 69 0.678 -18.053 -17.214 1.00 0.00 O ATOM 1074 CB TRP A 69 -2.560 -19.018 -17.247 1.00 0.00 C ATOM 1075 CG TRP A 69 -2.105 -20.110 -16.327 1.00 0.00 C ATOM 1076 CD1 TRP A 69 -1.328 -19.975 -15.225 1.00 0.00 C ATOM 1077 CD2 TRP A 69 -2.458 -21.528 -16.386 1.00 0.00 C ATOM 1078 NE1 TRP A 69 -1.159 -21.208 -14.620 1.00 0.00 N ATOM 1079 CE2 TRP A 69 -1.821 -22.200 -15.305 1.00 0.00 C ATOM 1080 CE3 TRP A 69 -3.264 -22.321 -17.237 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 -1.948 -23.578 -15.090 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 -3.400 -23.710 -17.034 1.00 0.00 C ATOM 1083 CH2 TRP A 69 -2.738 -24.340 -15.965 1.00 0.00 C ATOM 0 H TRP A 69 -3.323 -17.127 -18.547 1.00 0.00 H new ATOM 0 HA TRP A 69 -1.557 -17.322 -16.409 1.00 0.00 H new ATOM 0 HB2 TRP A 69 -3.549 -18.702 -16.916 1.00 0.00 H new ATOM 0 HB3 TRP A 69 -2.680 -19.454 -18.239 1.00 0.00 H new ATOM 0 HD1 TRP A 69 -0.905 -19.046 -14.872 1.00 0.00 H new ATOM 0 HE1 TRP A 69 -0.612 -21.362 -13.773 1.00 0.00 H new ATOM 0 HE3 TRP A 69 -3.786 -21.853 -18.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 -1.443 -24.049 -14.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 -4.016 -24.293 -17.703 1.00 0.00 H new ATOM 0 HH2 TRP A 69 -2.837 -25.405 -15.818 1.00 0.00 H new ATOM 1094 N ASP A 70 -0.217 -18.188 -19.275 1.00 0.00 N ATOM 1095 CA ASP A 70 1.006 -18.432 -20.028 1.00 0.00 C ATOM 1096 C ASP A 70 2.002 -17.256 -19.984 1.00 0.00 C ATOM 1097 O ASP A 70 3.211 -17.468 -20.089 1.00 0.00 O ATOM 1098 CB ASP A 70 0.593 -18.755 -21.468 1.00 0.00 C ATOM 1099 CG ASP A 70 1.815 -19.059 -22.352 1.00 0.00 C ATOM 1100 OD1 ASP A 70 2.408 -20.157 -22.211 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 2.158 -18.219 -23.218 1.00 0.00 O ATOM 0 H ASP A 70 -1.038 -18.122 -19.876 1.00 0.00 H new ATOM 0 HA ASP A 70 1.542 -19.265 -19.572 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.081 -19.612 -21.471 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.041 -17.914 -21.886 1.00 0.00 H new ATOM 1106 N GLN A 71 1.525 -16.022 -19.764 1.00 0.00 N ATOM 1107 CA GLN A 71 2.329 -14.808 -19.630 1.00 0.00 C ATOM 1108 C GLN A 71 2.695 -14.513 -18.182 1.00 0.00 C ATOM 1109 O GLN A 71 3.624 -13.751 -17.932 1.00 0.00 O ATOM 1110 CB GLN A 71 1.593 -13.583 -20.202 1.00 0.00 C ATOM 1111 CG GLN A 71 1.374 -13.710 -21.720 1.00 0.00 C ATOM 1112 CD GLN A 71 1.180 -12.343 -22.372 1.00 0.00 C ATOM 1113 OE1 GLN A 71 2.066 -11.817 -23.041 1.00 0.00 O ATOM 1114 NE2 GLN A 71 0.026 -11.721 -22.173 1.00 0.00 N ATOM 0 H GLN A 71 0.526 -15.840 -19.671 1.00 0.00 H new ATOM 0 HA GLN A 71 3.242 -14.993 -20.196 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.630 -13.471 -19.703 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.168 -12.681 -19.991 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.230 -14.212 -22.172 1.00 0.00 H new ATOM 0 HG3 GLN A 71 0.501 -14.333 -21.912 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.704 -12.166 -21.616 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.132 -10.798 -22.577 1.00 0.00 H new ATOM 1123 N LEU A 72 1.982 -15.082 -17.210 1.00 0.00 N ATOM 1124 CA LEU A 72 2.207 -14.759 -15.798 1.00 0.00 C ATOM 1125 C LEU A 72 3.619 -15.138 -15.358 1.00 0.00 C ATOM 1126 O LEU A 72 4.150 -14.529 -14.436 1.00 0.00 O ATOM 1127 CB LEU A 72 1.161 -15.414 -14.882 1.00 0.00 C ATOM 1128 CG LEU A 72 -0.293 -15.027 -15.180 1.00 0.00 C ATOM 1129 CD1 LEU A 72 -1.191 -15.620 -14.102 1.00 0.00 C ATOM 1130 CD2 LEU A 72 -0.543 -13.522 -15.277 1.00 0.00 C ATOM 0 H LEU A 72 1.245 -15.768 -17.372 1.00 0.00 H new ATOM 0 HA LEU A 72 2.097 -13.679 -15.703 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.257 -16.497 -14.962 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.388 -15.149 -13.849 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.522 -15.430 -16.166 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.228 -15.351 -14.304 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.091 -16.705 -14.102 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.898 -15.228 -13.128 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.597 -13.341 -15.490 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.277 -13.047 -14.333 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.066 -13.103 -16.078 1.00 0.00 H new ATOM 1142 N ASP A 73 4.244 -16.117 -16.024 1.00 0.00 N ATOM 1143 CA ASP A 73 5.623 -16.501 -15.729 1.00 0.00 C ATOM 1144 C ASP A 73 6.632 -15.484 -16.295 1.00 0.00 C ATOM 1145 O ASP A 73 7.734 -15.362 -15.764 1.00 0.00 O ATOM 1146 CB ASP A 73 5.909 -17.939 -16.182 1.00 0.00 C ATOM 1147 CG ASP A 73 7.419 -18.262 -16.204 1.00 0.00 C ATOM 1148 OD1 ASP A 73 7.990 -18.540 -15.123 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 8.017 -18.292 -17.307 1.00 0.00 O ATOM 0 H ASP A 73 3.811 -16.657 -16.773 1.00 0.00 H new ATOM 0 HA ASP A 73 5.751 -16.483 -14.647 1.00 0.00 H new ATOM 0 HB2 ASP A 73 5.401 -18.635 -15.514 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.493 -18.092 -17.178 1.00 0.00 H new ATOM 1154 N ASP A 74 6.264 -14.684 -17.303 1.00 0.00 N ATOM 1155 CA ASP A 74 7.138 -13.647 -17.863 1.00 0.00 C ATOM 1156 C ASP A 74 7.273 -12.443 -16.920 1.00 0.00 C ATOM 1157 O ASP A 74 8.315 -11.783 -16.903 1.00 0.00 O ATOM 1158 CB ASP A 74 6.609 -13.175 -19.225 1.00 0.00 C ATOM 1159 CG ASP A 74 7.413 -11.976 -19.760 1.00 0.00 C ATOM 1160 OD1 ASP A 74 8.513 -12.189 -20.322 1.00 0.00 O ATOM 1161 OD2 ASP A 74 6.926 -10.823 -19.639 1.00 0.00 O1- ATOM 0 H ASP A 74 5.351 -14.738 -17.754 1.00 0.00 H new ATOM 0 HA ASP A 74 8.125 -14.093 -17.989 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.660 -13.996 -19.940 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.559 -12.898 -19.132 1.00 0.00 H new ATOM 1166 N LEU A 75 6.232 -12.181 -16.119 1.00 0.00 N ATOM 1167 CA LEU A 75 6.072 -10.965 -15.327 1.00 0.00 C ATOM 1168 C LEU A 75 7.268 -10.683 -14.424 1.00 0.00 C ATOM 1169 O LEU A 75 7.768 -11.575 -13.740 1.00 0.00 O ATOM 1170 CB LEU A 75 4.792 -11.033 -14.469 1.00 0.00 C ATOM 1171 CG LEU A 75 3.474 -11.206 -15.242 1.00 0.00 C ATOM 1172 CD1 LEU A 75 2.309 -11.235 -14.255 1.00 0.00 C ATOM 1173 CD2 LEU A 75 3.248 -10.112 -16.278 1.00 0.00 C ATOM 0 H LEU A 75 5.456 -12.833 -16.004 1.00 0.00 H new ATOM 0 HA LEU A 75 5.996 -10.147 -16.043 1.00 0.00 H new ATOM 0 HB2 LEU A 75 4.891 -11.862 -13.768 1.00 0.00 H new ATOM 0 HB3 LEU A 75 4.726 -10.121 -13.876 1.00 0.00 H new ATOM 0 HG LEU A 75 3.537 -12.148 -15.786 1.00 0.00 H new ATOM 0 HD11 LEU A 75 1.373 -11.358 -14.800 1.00 0.00 H new ATOM 0 HD12 LEU A 75 2.438 -12.068 -13.564 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.283 -10.300 -13.695 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.303 -10.287 -16.792 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.217 -9.142 -15.782 1.00 0.00 H new ATOM 0 HD23 LEU A 75 4.062 -10.123 -17.003 1.00 0.00 H new ATOM 1185 N ASN A 76 7.670 -9.420 -14.352 1.00 0.00 N ATOM 1186 CA ASN A 76 8.656 -8.930 -13.390 1.00 0.00 C ATOM 1187 C ASN A 76 8.001 -8.835 -12.011 1.00 0.00 C ATOM 1188 O ASN A 76 7.290 -7.866 -11.747 1.00 0.00 O ATOM 1189 CB ASN A 76 9.203 -7.570 -13.867 1.00 0.00 C ATOM 1190 CG ASN A 76 10.278 -7.036 -12.923 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.470 -7.201 -13.168 1.00 0.00 O ATOM 1192 ND2 ASN A 76 9.891 -6.419 -11.815 1.00 0.00 N ATOM 0 H ASN A 76 7.314 -8.692 -14.971 1.00 0.00 H new ATOM 0 HA ASN A 76 9.499 -9.617 -13.316 1.00 0.00 H new ATOM 0 HB2 ASN A 76 9.618 -7.675 -14.870 1.00 0.00 H new ATOM 0 HB3 ASN A 76 8.386 -6.851 -13.933 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.587 -6.075 -11.153 1.00 0.00 H new ATOM 0 HD22 ASN A 76 8.897 -6.289 -11.624 1.00 0.00 H new ATOM 1199 N LEU A 77 8.204 -9.828 -11.133 1.00 0.00 N ATOM 1200 CA LEU A 77 7.558 -9.887 -9.809 1.00 0.00 C ATOM 1201 C LEU A 77 8.548 -9.975 -8.642 1.00 0.00 C ATOM 1202 O LEU A 77 8.097 -10.067 -7.503 1.00 0.00 O ATOM 1203 CB LEU A 77 6.597 -11.094 -9.717 1.00 0.00 C ATOM 1204 CG LEU A 77 5.515 -11.264 -10.793 1.00 0.00 C ATOM 1205 CD1 LEU A 77 4.676 -12.496 -10.458 1.00 0.00 C ATOM 1206 CD2 LEU A 77 4.569 -10.060 -10.851 1.00 0.00 C ATOM 0 H LEU A 77 8.823 -10.617 -11.320 1.00 0.00 H new ATOM 0 HA LEU A 77 7.014 -8.947 -9.718 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.204 -11.999 -9.714 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.096 -11.043 -8.750 1.00 0.00 H new ATOM 0 HG LEU A 77 6.018 -11.362 -11.755 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.904 -12.627 -11.216 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.317 -13.378 -10.436 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.208 -12.363 -9.482 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.820 -10.223 -11.626 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.074 -9.939 -9.887 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.139 -9.160 -11.081 1.00 0.00 H new ATOM 1218 N GLU A 78 9.859 -9.994 -8.887 1.00 0.00 N ATOM 1219 CA GLU A 78 10.845 -10.311 -7.855 1.00 0.00 C ATOM 1220 C GLU A 78 10.696 -9.400 -6.636 1.00 0.00 C ATOM 1221 O GLU A 78 10.654 -8.172 -6.743 1.00 0.00 O ATOM 1222 CB GLU A 78 12.277 -10.257 -8.409 1.00 0.00 C ATOM 1223 CG GLU A 78 12.650 -11.593 -9.056 1.00 0.00 C ATOM 1224 CD GLU A 78 14.081 -11.568 -9.626 1.00 0.00 C ATOM 1225 OE1 GLU A 78 15.047 -11.859 -8.877 1.00 0.00 O ATOM 1226 OE2 GLU A 78 14.253 -11.267 -10.832 1.00 0.00 O1- ATOM 0 H GLU A 78 10.265 -9.791 -9.801 1.00 0.00 H new ATOM 0 HA GLU A 78 10.652 -11.333 -7.530 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.360 -9.455 -9.142 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.976 -10.027 -7.605 1.00 0.00 H new ATOM 0 HG2 GLU A 78 12.566 -12.391 -8.318 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.944 -11.821 -9.854 1.00 0.00 H new ATOM 1233 N GLY A 79 10.617 -10.044 -5.471 1.00 0.00 N ATOM 1234 CA GLY A 79 10.532 -9.415 -4.163 1.00 0.00 C ATOM 1235 C GLY A 79 9.168 -8.805 -3.826 1.00 0.00 C ATOM 1236 O GLY A 79 9.016 -8.289 -2.716 1.00 0.00 O ATOM 0 H GLY A 79 10.611 -11.063 -5.417 1.00 0.00 H new ATOM 0 HA2 GLY A 79 10.779 -10.156 -3.403 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.288 -8.632 -4.103 1.00 0.00 H new ATOM 1240 N LYS A 80 8.170 -8.840 -4.728 1.00 0.00 N ATOM 1241 CA LYS A 80 6.886 -8.196 -4.477 1.00 0.00 C ATOM 1242 C LYS A 80 6.062 -9.039 -3.510 1.00 0.00 C ATOM 1243 O LYS A 80 6.230 -10.259 -3.449 1.00 0.00 O ATOM 1244 CB LYS A 80 6.180 -7.800 -5.791 1.00 0.00 C ATOM 1245 CG LYS A 80 5.126 -8.765 -6.352 1.00 0.00 C ATOM 1246 CD LYS A 80 4.094 -8.089 -7.273 1.00 0.00 C ATOM 1247 CE LYS A 80 4.614 -7.402 -8.563 1.00 0.00 C ATOM 1248 NZ LYS A 80 5.257 -6.066 -8.358 1.00 0.00 N1+ ATOM 0 H LYS A 80 8.236 -9.308 -5.632 1.00 0.00 H new ATOM 0 HA LYS A 80 7.038 -7.241 -3.973 1.00 0.00 H new ATOM 0 HB2 LYS A 80 5.701 -6.833 -5.637 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.946 -7.659 -6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.630 -9.557 -6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.603 -9.240 -5.522 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.363 -8.843 -7.567 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.562 -7.340 -6.686 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.334 -8.064 -9.043 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.780 -7.284 -9.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 5.249 -5.536 -9.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 4.731 -5.535 -7.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.239 -6.198 -8.043 1.00 0.00 H new ATOM 1262 N ILE A 81 5.135 -8.414 -2.794 1.00 0.00 N ATOM 1263 CA ILE A 81 4.258 -9.120 -1.872 1.00 0.00 C ATOM 1264 C ILE A 81 3.173 -9.773 -2.717 1.00 0.00 C ATOM 1265 O ILE A 81 2.705 -9.208 -3.702 1.00 0.00 O ATOM 1266 CB ILE A 81 3.726 -8.199 -0.741 1.00 0.00 C ATOM 1267 CG1 ILE A 81 4.909 -7.546 0.006 1.00 0.00 C ATOM 1268 CG2 ILE A 81 2.813 -9.021 0.199 1.00 0.00 C ATOM 1269 CD1 ILE A 81 4.538 -6.837 1.311 1.00 0.00 C ATOM 0 H ILE A 81 4.972 -7.408 -2.837 1.00 0.00 H new ATOM 0 HA ILE A 81 4.797 -9.893 -1.324 1.00 0.00 H new ATOM 0 HB ILE A 81 3.128 -7.390 -1.160 1.00 0.00 H new ATOM 0 HG12 ILE A 81 5.649 -8.315 0.226 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.386 -6.825 -0.659 1.00 0.00 H new ATOM 0 HG21 ILE A 81 2.437 -8.378 0.995 1.00 0.00 H new ATOM 0 HG22 ILE A 81 1.974 -9.424 -0.369 1.00 0.00 H new ATOM 0 HG23 ILE A 81 3.383 -9.841 0.634 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.435 -6.411 1.761 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.823 -6.041 1.102 1.00 0.00 H new ATOM 0 HD13 ILE A 81 4.091 -7.554 2.000 1.00 0.00 H new ATOM 1281 N VAL A 82 2.757 -10.971 -2.348 1.00 0.00 N ATOM 1282 CA VAL A 82 1.743 -11.727 -3.066 1.00 0.00 C ATOM 1283 C VAL A 82 0.798 -12.381 -2.062 1.00 0.00 C ATOM 1284 O VAL A 82 1.261 -12.926 -1.064 1.00 0.00 O ATOM 1285 CB VAL A 82 2.451 -12.717 -4.014 1.00 0.00 C ATOM 1286 CG1 VAL A 82 1.606 -13.938 -4.371 1.00 0.00 C ATOM 1287 CG2 VAL A 82 2.863 -12.030 -5.327 1.00 0.00 C ATOM 0 H VAL A 82 3.120 -11.455 -1.527 1.00 0.00 H new ATOM 0 HA VAL A 82 1.119 -11.087 -3.690 1.00 0.00 H new ATOM 0 HB VAL A 82 3.325 -13.056 -3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 82 2.170 -14.588 -5.040 1.00 0.00 H new ATOM 0 HG12 VAL A 82 1.354 -14.484 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.690 -13.615 -4.866 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.360 -12.752 -5.975 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.976 -11.642 -5.828 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.545 -11.208 -5.109 1.00 0.00 H new ATOM 1297 N ALA A 83 -0.506 -12.390 -2.351 1.00 0.00 N ATOM 1298 CA ALA A 83 -1.511 -13.138 -1.595 1.00 0.00 C ATOM 1299 C ALA A 83 -2.097 -14.152 -2.550 1.00 0.00 C ATOM 1300 O ALA A 83 -2.239 -13.838 -3.731 1.00 0.00 O ATOM 1301 CB ALA A 83 -2.652 -12.245 -1.079 1.00 0.00 C ATOM 0 H ALA A 83 -0.899 -11.867 -3.133 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.036 -13.589 -0.724 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -3.368 -12.853 -0.526 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.244 -11.477 -0.422 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.154 -11.772 -1.923 1.00 0.00 H new ATOM 1307 N LEU A 84 -2.502 -15.320 -2.071 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.255 -16.255 -2.891 1.00 0.00 C ATOM 1309 C LEU A 84 -4.503 -16.643 -2.137 1.00 0.00 C ATOM 1310 O LEU A 84 -4.454 -16.843 -0.924 1.00 0.00 O ATOM 1311 CB LEU A 84 -2.439 -17.508 -3.237 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.531 -17.324 -4.458 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -0.217 -16.637 -4.119 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -1.260 -18.680 -5.093 1.00 0.00 C ATOM 0 H LEU A 84 -2.321 -15.641 -1.120 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.505 -15.770 -3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.828 -17.784 -2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.121 -18.337 -3.422 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.054 -16.673 -5.159 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.384 -16.534 -5.023 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.419 -15.650 -3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.327 -17.234 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.614 -18.552 -5.962 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.769 -19.330 -4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.202 -19.131 -5.404 1.00 0.00 H new ATOM 1326 N TYR A 85 -5.606 -16.794 -2.849 1.00 0.00 N ATOM 1327 CA TYR A 85 -6.805 -17.407 -2.325 1.00 0.00 C ATOM 1328 C TYR A 85 -7.514 -18.069 -3.495 1.00 0.00 C ATOM 1329 O TYR A 85 -7.192 -17.821 -4.659 1.00 0.00 O ATOM 1330 CB TYR A 85 -7.690 -16.384 -1.604 1.00 0.00 C ATOM 1331 CG TYR A 85 -8.398 -15.399 -2.502 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -7.739 -14.227 -2.918 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -9.717 -15.659 -2.923 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -8.391 -13.333 -3.781 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -10.372 -14.763 -3.782 1.00 0.00 C ATOM 1336 CZ TYR A 85 -9.711 -13.599 -4.217 1.00 0.00 C ATOM 1337 OH TYR A 85 -10.353 -12.764 -5.083 1.00 0.00 O ATOM 0 H TYR A 85 -5.691 -16.489 -3.819 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.561 -18.155 -1.570 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -8.438 -16.922 -1.021 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -7.073 -15.829 -0.897 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.737 -14.017 -2.575 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -10.225 -16.550 -2.584 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -7.884 -12.439 -4.114 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.381 -14.966 -4.109 1.00 0.00 H new ATOM 0 HH TYR A 85 -11.250 -13.112 -5.268 1.00 0.00 H new ATOM 1347 N GLY A 86 -8.489 -18.912 -3.201 1.00 0.00 N ATOM 1348 CA GLY A 86 -9.325 -19.492 -4.225 1.00 0.00 C ATOM 1349 C GLY A 86 -10.574 -20.061 -3.606 1.00 0.00 C ATOM 1350 O GLY A 86 -10.672 -20.182 -2.386 1.00 0.00 O ATOM 0 H GLY A 86 -8.718 -19.209 -2.252 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -9.587 -18.735 -4.964 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -8.780 -20.276 -4.751 1.00 0.00 H new ATOM 1354 N LEU A 87 -11.536 -20.387 -4.457 1.00 0.00 N ATOM 1355 CA LEU A 87 -12.822 -20.943 -4.094 1.00 0.00 C ATOM 1356 C LEU A 87 -12.858 -22.356 -4.639 1.00 0.00 C ATOM 1357 O LEU A 87 -12.336 -22.616 -5.721 1.00 0.00 O ATOM 1358 CB LEU A 87 -13.896 -19.989 -4.644 1.00 0.00 C ATOM 1359 CG LEU A 87 -15.384 -20.372 -4.591 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -15.726 -21.505 -5.560 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -15.835 -20.657 -3.160 1.00 0.00 C ATOM 0 H LEU A 87 -11.432 -20.264 -5.464 1.00 0.00 H new ATOM 0 HA LEU A 87 -13.006 -21.022 -3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.789 -19.044 -4.112 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.651 -19.797 -5.689 1.00 0.00 H new ATOM 0 HG LEU A 87 -15.955 -19.509 -4.933 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -16.788 -21.739 -5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -15.493 -21.195 -6.579 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -15.141 -22.389 -5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -16.892 -20.925 -3.158 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -15.251 -21.482 -2.752 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -15.685 -19.768 -2.547 1.00 0.00 H new ATOM 1373 N GLY A 88 -13.456 -23.258 -3.884 1.00 0.00 N ATOM 1374 CA GLY A 88 -13.683 -24.638 -4.276 1.00 0.00 C ATOM 1375 C GLY A 88 -14.783 -25.235 -3.405 1.00 0.00 C ATOM 1376 O GLY A 88 -15.466 -24.512 -2.678 1.00 0.00 O ATOM 0 H GLY A 88 -13.809 -23.045 -2.951 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -13.968 -24.687 -5.327 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -12.764 -25.215 -4.168 1.00 0.00 H new ATOM 1380 N ASP A 89 -14.935 -26.558 -3.466 1.00 0.00 N ATOM 1381 CA ASP A 89 -15.806 -27.318 -2.578 1.00 0.00 C ATOM 1382 C ASP A 89 -15.209 -28.706 -2.389 1.00 0.00 C ATOM 1383 O ASP A 89 -14.962 -29.432 -3.356 1.00 0.00 O ATOM 1384 CB ASP A 89 -17.223 -27.429 -3.144 1.00 0.00 C ATOM 1385 CG ASP A 89 -18.011 -28.549 -2.441 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -17.898 -28.711 -1.200 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -18.696 -29.313 -3.157 1.00 0.00 O ATOM 0 H ASP A 89 -14.446 -27.139 -4.147 1.00 0.00 H new ATOM 0 HA ASP A 89 -15.877 -26.800 -1.621 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -17.744 -26.480 -3.019 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -17.176 -27.629 -4.215 1.00 0.00 H new ATOM 1392 N GLN A 90 -14.953 -29.067 -1.140 1.00 0.00 N ATOM 1393 CA GLN A 90 -14.361 -30.331 -0.755 1.00 0.00 C ATOM 1394 C GLN A 90 -15.344 -31.511 -0.827 1.00 0.00 C ATOM 1395 O GLN A 90 -14.900 -32.660 -0.792 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.723 -30.197 0.639 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.647 -29.719 1.780 1.00 0.00 C ATOM 1398 CD GLN A 90 -14.632 -28.196 2.005 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -14.564 -27.400 1.072 1.00 0.00 O ATOM 1400 NE2 GLN A 90 -14.713 -27.746 3.254 1.00 0.00 N ATOM 0 H GLN A 90 -15.160 -28.465 -0.343 1.00 0.00 H new ATOM 0 HA GLN A 90 -13.584 -30.567 -1.482 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.310 -31.166 0.919 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.886 -29.503 0.565 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -15.668 -30.033 1.562 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.351 -30.215 2.704 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -14.770 -28.405 4.031 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -14.719 -26.742 3.435 1.00 0.00 H new ATOM 1409 N LEU A 91 -16.656 -31.264 -0.915 1.00 0.00 N ATOM 1410 CA LEU A 91 -17.666 -32.319 -0.963 1.00 0.00 C ATOM 1411 C LEU A 91 -17.750 -32.880 -2.378 1.00 0.00 C ATOM 1412 O LEU A 91 -17.685 -34.094 -2.573 1.00 0.00 O ATOM 1413 CB LEU A 91 -19.038 -31.805 -0.479 1.00 0.00 C ATOM 1414 CG LEU A 91 -19.037 -31.303 0.975 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -20.419 -30.749 1.342 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -18.646 -32.389 1.987 1.00 0.00 C ATOM 0 H LEU A 91 -17.045 -30.322 -0.955 1.00 0.00 H new ATOM 0 HA LEU A 91 -17.371 -33.120 -0.285 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -19.363 -30.995 -1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -19.770 -32.606 -0.576 1.00 0.00 H new ATOM 0 HG LEU A 91 -18.282 -30.519 1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -20.407 -30.396 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -20.667 -29.921 0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -21.166 -31.535 1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -18.664 -31.972 2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -19.353 -33.216 1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -17.643 -32.751 1.763 1.00 0.00 H new ATOM 1428 N GLY A 92 -17.865 -31.989 -3.359 1.00 0.00 N ATOM 1429 CA GLY A 92 -17.971 -32.340 -4.763 1.00 0.00 C ATOM 1430 C GLY A 92 -16.630 -32.754 -5.352 1.00 0.00 C ATOM 1431 O GLY A 92 -16.561 -33.773 -6.045 1.00 0.00 O ATOM 0 H GLY A 92 -17.887 -30.983 -3.191 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -18.685 -33.155 -4.880 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -18.364 -31.490 -5.320 1.00 0.00 H new ATOM 1435 N TYR A 93 -15.573 -31.978 -5.079 1.00 0.00 N ATOM 1436 CA TYR A 93 -14.252 -32.221 -5.642 1.00 0.00 C ATOM 1437 C TYR A 93 -13.412 -32.958 -4.600 1.00 0.00 C ATOM 1438 O TYR A 93 -13.416 -34.188 -4.570 1.00 0.00 O ATOM 1439 CB TYR A 93 -13.651 -30.923 -6.216 1.00 0.00 C ATOM 1440 CG TYR A 93 -14.601 -30.140 -7.108 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -15.206 -30.745 -8.227 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -14.937 -28.818 -6.768 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -16.151 -30.038 -8.993 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -15.882 -28.106 -7.525 1.00 0.00 C ATOM 1445 CZ TYR A 93 -16.500 -28.715 -8.639 1.00 0.00 C ATOM 1446 OH TYR A 93 -17.416 -28.019 -9.367 1.00 0.00 O ATOM 0 H TYR A 93 -15.616 -31.167 -4.462 1.00 0.00 H new ATOM 0 HA TYR A 93 -14.293 -32.878 -6.511 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -13.336 -30.285 -5.390 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -12.756 -31.171 -6.786 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -14.943 -31.757 -8.498 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -14.465 -28.346 -5.919 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -16.610 -30.506 -9.851 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -16.136 -27.092 -7.255 1.00 0.00 H new ATOM 0 HH TYR A 93 -17.798 -28.602 -10.056 1.00 0.00 H new ATOM 1456 N GLY A 94 -12.716 -32.217 -3.728 1.00 0.00 N ATOM 1457 CA GLY A 94 -12.002 -32.765 -2.568 1.00 0.00 C ATOM 1458 C GLY A 94 -10.656 -33.388 -2.940 1.00 0.00 C ATOM 1459 O GLY A 94 -9.643 -33.107 -2.298 1.00 0.00 O ATOM 0 H GLY A 94 -12.632 -31.204 -3.810 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.840 -31.971 -1.839 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.625 -33.519 -2.086 1.00 0.00 H new ATOM 1463 N GLU A 95 -10.629 -34.158 -4.028 1.00 0.00 N ATOM 1464 CA GLU A 95 -9.430 -34.702 -4.671 1.00 0.00 C ATOM 1465 C GLU A 95 -8.801 -33.690 -5.637 1.00 0.00 C ATOM 1466 O GLU A 95 -7.639 -33.843 -6.016 1.00 0.00 O ATOM 1467 CB GLU A 95 -9.791 -36.009 -5.397 1.00 0.00 C ATOM 1468 CG GLU A 95 -10.162 -37.126 -4.413 1.00 0.00 C ATOM 1469 CD GLU A 95 -10.481 -38.443 -5.145 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -9.534 -39.191 -5.498 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -11.680 -38.757 -5.350 1.00 0.00 O ATOM 0 H GLU A 95 -11.485 -34.434 -4.510 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.685 -34.912 -3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.626 -35.829 -6.074 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.948 -36.329 -6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.339 -37.286 -3.716 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -11.025 -36.819 -3.822 1.00 0.00 H new ATOM 1478 N TRP A 96 -9.536 -32.626 -5.987 1.00 0.00 N ATOM 1479 CA TRP A 96 -9.115 -31.575 -6.918 1.00 0.00 C ATOM 1480 C TRP A 96 -9.319 -30.189 -6.289 1.00 0.00 C ATOM 1481 O TRP A 96 -9.619 -29.217 -6.982 1.00 0.00 O ATOM 1482 CB TRP A 96 -9.872 -31.760 -8.245 1.00 0.00 C ATOM 1483 CG TRP A 96 -9.909 -33.166 -8.775 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -8.834 -33.890 -9.163 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -11.057 -34.060 -8.925 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -9.233 -35.157 -9.539 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -10.592 -35.323 -9.399 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -12.444 -33.938 -8.695 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -11.448 -36.408 -9.622 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -13.317 -35.022 -8.916 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -12.822 -36.258 -9.373 1.00 0.00 C ATOM 0 H TRP A 96 -10.473 -32.470 -5.616 1.00 0.00 H new ATOM 0 HA TRP A 96 -8.049 -31.651 -7.131 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -10.897 -31.413 -8.111 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -9.414 -31.118 -8.998 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -7.816 -33.530 -9.177 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -8.599 -35.880 -9.878 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -12.843 -32.998 -8.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -11.057 -37.348 -9.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -14.375 -34.903 -8.733 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -13.496 -37.087 -9.531 1.00 0.00 H new ATOM 1502 N PHE A 97 -9.237 -30.103 -4.955 1.00 0.00 N ATOM 1503 CA PHE A 97 -9.491 -28.871 -4.220 1.00 0.00 C ATOM 1504 C PHE A 97 -8.405 -27.860 -4.574 1.00 0.00 C ATOM 1505 O PHE A 97 -7.225 -28.201 -4.524 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.476 -29.147 -2.705 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.097 -28.060 -1.846 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -11.450 -27.696 -2.019 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -9.329 -27.432 -0.846 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -12.012 -26.681 -1.222 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -9.899 -26.431 -0.041 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.233 -26.040 -0.245 1.00 0.00 C ATOM 0 H PHE A 97 -8.991 -30.893 -4.359 1.00 0.00 H new ATOM 0 HA PHE A 97 -10.470 -28.475 -4.490 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.003 -30.083 -2.517 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -8.443 -29.293 -2.388 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -12.053 -28.196 -2.762 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.299 -27.721 -0.697 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -13.044 -26.395 -1.362 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.312 -25.962 0.735 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.660 -25.246 0.350 1.00 0.00 H new ATOM 1522 N LEU A 98 -8.796 -26.617 -4.886 1.00 0.00 N ATOM 1523 CA LEU A 98 -7.893 -25.464 -5.036 1.00 0.00 C ATOM 1524 C LEU A 98 -6.704 -25.740 -5.966 1.00 0.00 C ATOM 1525 O LEU A 98 -5.647 -25.133 -5.827 1.00 0.00 O ATOM 1526 CB LEU A 98 -7.484 -24.955 -3.635 1.00 0.00 C ATOM 1527 CG LEU A 98 -8.640 -24.386 -2.793 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -8.132 -23.986 -1.407 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -9.344 -23.191 -3.436 1.00 0.00 C ATOM 0 H LEU A 98 -9.775 -26.378 -5.046 1.00 0.00 H new ATOM 0 HA LEU A 98 -8.431 -24.664 -5.544 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.023 -25.776 -3.086 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.724 -24.183 -3.752 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.378 -25.185 -2.720 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.957 -23.585 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.720 -24.861 -0.904 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.356 -23.227 -1.509 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -10.146 -22.847 -2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.627 -22.384 -3.586 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.762 -23.489 -4.398 1.00 0.00 H new ATOM 1541 N ASP A 99 -6.872 -26.629 -6.941 1.00 0.00 N ATOM 1542 CA ASP A 99 -5.830 -27.032 -7.885 1.00 0.00 C ATOM 1543 C ASP A 99 -5.284 -25.823 -8.640 1.00 0.00 C ATOM 1544 O ASP A 99 -4.070 -25.676 -8.781 1.00 0.00 O ATOM 1545 CB ASP A 99 -6.423 -28.063 -8.850 1.00 0.00 C ATOM 1546 CG ASP A 99 -5.449 -28.419 -9.979 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -4.381 -29.004 -9.688 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -5.779 -28.159 -11.159 1.00 0.00 O ATOM 0 H ASP A 99 -7.761 -27.103 -7.102 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.994 -27.476 -7.345 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -6.685 -28.966 -8.299 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.346 -27.671 -9.277 1.00 0.00 H new ATOM 1553 N ALA A 100 -6.156 -24.884 -9.030 1.00 0.00 N ATOM 1554 CA ALA A 100 -5.734 -23.685 -9.734 1.00 0.00 C ATOM 1555 C ALA A 100 -4.980 -22.717 -8.814 1.00 0.00 C ATOM 1556 O ALA A 100 -4.040 -22.058 -9.259 1.00 0.00 O ATOM 1557 CB ALA A 100 -6.949 -23.037 -10.403 1.00 0.00 C ATOM 0 H ALA A 100 -7.161 -24.940 -8.865 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.022 -23.961 -10.512 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.636 -22.137 -10.932 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.392 -23.738 -11.110 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.685 -22.774 -9.644 1.00 0.00 H new ATOM 1563 N LEU A 101 -5.327 -22.674 -7.518 1.00 0.00 N ATOM 1564 CA LEU A 101 -4.568 -21.919 -6.515 1.00 0.00 C ATOM 1565 C LEU A 101 -3.166 -22.519 -6.429 1.00 0.00 C ATOM 1566 O LEU A 101 -2.181 -21.787 -6.509 1.00 0.00 O ATOM 1567 CB LEU A 101 -5.311 -21.973 -5.159 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.849 -20.997 -4.061 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -5.796 -21.101 -2.862 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -3.459 -21.306 -3.505 1.00 0.00 C ATOM 0 H LEU A 101 -6.139 -23.161 -7.139 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.479 -20.869 -6.793 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.369 -21.793 -5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -5.225 -22.987 -4.767 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.839 -20.014 -4.533 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.473 -20.412 -2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.808 -20.846 -3.175 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.782 -22.120 -2.474 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.204 -20.576 -2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.455 -22.306 -3.071 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -2.726 -21.257 -4.310 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.065 -23.849 -6.325 1.00 0.00 N ATOM 1583 CA GLY A 102 -1.788 -24.528 -6.179 1.00 0.00 C ATOM 1584 C GLY A 102 -0.908 -24.313 -7.404 1.00 0.00 C ATOM 1585 O GLY A 102 0.282 -24.057 -7.261 1.00 0.00 O ATOM 0 H GLY A 102 -3.869 -24.477 -6.340 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.276 -24.159 -5.290 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -1.955 -25.595 -6.030 1.00 0.00 H new ATOM 1589 N MET A 103 -1.487 -24.324 -8.608 1.00 0.00 N ATOM 1590 CA MET A 103 -0.735 -24.055 -9.829 1.00 0.00 C ATOM 1591 C MET A 103 -0.207 -22.616 -9.855 1.00 0.00 C ATOM 1592 O MET A 103 0.946 -22.415 -10.232 1.00 0.00 O ATOM 1593 CB MET A 103 -1.591 -24.383 -11.058 1.00 0.00 C ATOM 1594 CG MET A 103 -1.736 -25.895 -11.257 1.00 0.00 C ATOM 1595 SD MET A 103 -2.534 -26.413 -12.799 1.00 0.00 S ATOM 1596 CE MET A 103 -4.135 -25.581 -12.608 1.00 0.00 C ATOM 0 H MET A 103 -2.477 -24.517 -8.760 1.00 0.00 H new ATOM 0 HA MET A 103 0.141 -24.704 -9.851 1.00 0.00 H new ATOM 0 HB2 MET A 103 -2.578 -23.934 -10.945 1.00 0.00 H new ATOM 0 HB3 MET A 103 -1.139 -23.940 -11.946 1.00 0.00 H new ATOM 0 HG2 MET A 103 -0.744 -26.345 -11.214 1.00 0.00 H new ATOM 0 HG3 MET A 103 -2.306 -26.300 -10.421 1.00 0.00 H new ATOM 0 HE1 MET A 103 -4.774 -25.821 -13.458 1.00 0.00 H new ATOM 0 HE2 MET A 103 -4.613 -25.918 -11.688 1.00 0.00 H new ATOM 0 HE3 MET A 103 -3.982 -24.503 -12.563 1.00 0.00 H new ATOM 1606 N LEU A 104 -0.984 -21.613 -9.415 1.00 0.00 N ATOM 1607 CA LEU A 104 -0.472 -20.238 -9.388 1.00 0.00 C ATOM 1608 C LEU A 104 0.567 -20.058 -8.291 1.00 0.00 C ATOM 1609 O LEU A 104 1.525 -19.318 -8.498 1.00 0.00 O ATOM 1610 CB LEU A 104 -1.614 -19.181 -9.368 1.00 0.00 C ATOM 1611 CG LEU A 104 -1.563 -18.213 -10.568 1.00 0.00 C ATOM 1612 CD1 LEU A 104 -0.454 -17.177 -10.403 1.00 0.00 C ATOM 1613 CD2 LEU A 104 -1.371 -18.907 -11.925 1.00 0.00 C ATOM 0 H LEU A 104 -1.942 -21.724 -9.082 1.00 0.00 H new ATOM 0 HA LEU A 104 0.052 -20.055 -10.326 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.576 -19.694 -9.363 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.554 -18.607 -8.443 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.542 -17.734 -10.571 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.447 -16.511 -11.266 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.631 -16.596 -9.498 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.508 -17.683 -10.327 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.346 -18.158 -12.716 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.433 -19.462 -11.920 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.198 -19.594 -12.102 1.00 0.00 H new ATOM 1625 N HIS A 105 0.459 -20.779 -7.174 1.00 0.00 N ATOM 1626 CA HIS A 105 1.512 -20.797 -6.160 1.00 0.00 C ATOM 1627 C HIS A 105 2.803 -21.375 -6.729 1.00 0.00 C ATOM 1628 O HIS A 105 3.869 -20.786 -6.563 1.00 0.00 O ATOM 1629 CB HIS A 105 1.071 -21.611 -4.941 1.00 0.00 C ATOM 1630 CG HIS A 105 2.068 -21.513 -3.818 1.00 0.00 C ATOM 1631 ND1 HIS A 105 2.969 -22.517 -3.456 1.00 0.00 N ATOM 1632 CD2 HIS A 105 2.263 -20.420 -3.022 1.00 0.00 C ATOM 1633 CE1 HIS A 105 3.698 -21.995 -2.454 1.00 0.00 C ATOM 1634 NE2 HIS A 105 3.291 -20.745 -2.170 1.00 0.00 N ATOM 0 H HIS A 105 -0.349 -21.359 -6.949 1.00 0.00 H new ATOM 0 HA HIS A 105 1.697 -19.768 -5.850 1.00 0.00 H new ATOM 0 HB2 HIS A 105 0.100 -21.255 -4.598 1.00 0.00 H new ATOM 0 HB3 HIS A 105 0.945 -22.655 -5.226 1.00 0.00 H new ATOM 0 HD1 HIS A 105 3.056 -23.448 -3.865 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.719 -19.488 -3.056 1.00 0.00 H new ATOM 0 HE1 HIS A 105 4.501 -22.509 -1.947 1.00 0.00 H new ATOM 1642 N ASP A 106 2.708 -22.492 -7.448 1.00 0.00 N ATOM 1643 CA ASP A 106 3.871 -23.184 -7.998 1.00 0.00 C ATOM 1644 C ASP A 106 4.597 -22.311 -9.018 1.00 0.00 C ATOM 1645 O ASP A 106 5.819 -22.154 -8.945 1.00 0.00 O ATOM 1646 CB ASP A 106 3.464 -24.519 -8.624 1.00 0.00 C ATOM 1647 CG ASP A 106 4.685 -25.195 -9.270 1.00 0.00 C ATOM 1648 OD1 ASP A 106 5.510 -25.778 -8.528 1.00 0.00 O ATOM 1649 OD2 ASP A 106 4.808 -25.167 -10.517 1.00 0.00 O1- ATOM 0 H ASP A 106 1.820 -22.943 -7.666 1.00 0.00 H new ATOM 0 HA ASP A 106 4.558 -23.387 -7.177 1.00 0.00 H new ATOM 0 HB2 ASP A 106 3.038 -25.172 -7.862 1.00 0.00 H new ATOM 0 HB3 ASP A 106 2.690 -24.357 -9.374 1.00 0.00 H new ATOM 1654 N LYS A 107 3.833 -21.657 -9.901 1.00 0.00 N ATOM 1655 CA LYS A 107 4.360 -20.661 -10.828 1.00 0.00 C ATOM 1656 C LYS A 107 5.043 -19.536 -10.052 1.00 0.00 C ATOM 1657 O LYS A 107 6.152 -19.141 -10.393 1.00 0.00 O ATOM 1658 CB LYS A 107 3.242 -20.140 -11.746 1.00 0.00 C ATOM 1659 CG LYS A 107 3.847 -19.199 -12.802 1.00 0.00 C ATOM 1660 CD LYS A 107 2.861 -18.712 -13.870 1.00 0.00 C ATOM 1661 CE LYS A 107 2.245 -19.762 -14.818 1.00 0.00 C ATOM 1662 NZ LYS A 107 3.215 -20.689 -15.484 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.828 -21.808 -9.989 1.00 0.00 H new ATOM 0 HA LYS A 107 5.112 -21.121 -11.469 1.00 0.00 H new ATOM 0 HB2 LYS A 107 2.737 -20.974 -12.233 1.00 0.00 H new ATOM 0 HB3 LYS A 107 2.491 -19.611 -11.159 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.270 -18.331 -12.295 1.00 0.00 H new ATOM 0 HG3 LYS A 107 4.672 -19.713 -13.296 1.00 0.00 H new ATOM 0 HD2 LYS A 107 2.044 -18.200 -13.362 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.371 -17.968 -14.482 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.531 -20.360 -14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.682 -19.239 -15.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.698 -21.351 -16.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 3.884 -20.137 -16.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 3.738 -21.223 -14.761 1.00 0.00 H new ATOM 1676 N LEU A 108 4.386 -18.991 -9.026 1.00 0.00 N ATOM 1677 CA LEU A 108 4.864 -17.788 -8.349 1.00 0.00 C ATOM 1678 C LEU A 108 6.057 -18.063 -7.442 1.00 0.00 C ATOM 1679 O LEU A 108 6.829 -17.141 -7.189 1.00 0.00 O ATOM 1680 CB LEU A 108 3.709 -17.122 -7.581 1.00 0.00 C ATOM 1681 CG LEU A 108 2.783 -16.306 -8.500 1.00 0.00 C ATOM 1682 CD1 LEU A 108 1.482 -15.960 -7.776 1.00 0.00 C ATOM 1683 CD2 LEU A 108 3.452 -15.010 -8.943 1.00 0.00 C ATOM 0 H LEU A 108 3.518 -19.367 -8.646 1.00 0.00 H new ATOM 0 HA LEU A 108 5.221 -17.097 -9.113 1.00 0.00 H new ATOM 0 HB2 LEU A 108 3.126 -17.889 -7.072 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.118 -16.469 -6.811 1.00 0.00 H new ATOM 0 HG LEU A 108 2.570 -16.919 -9.376 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.839 -15.383 -8.440 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.972 -16.878 -7.485 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.706 -15.372 -6.886 1.00 0.00 H new ATOM 0 HD21 LEU A 108 2.775 -14.454 -9.591 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.693 -14.407 -8.067 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.368 -15.241 -9.488 1.00 0.00 H new ATOM 1695 N SER A 109 6.253 -19.298 -6.974 1.00 0.00 N ATOM 1696 CA SER A 109 7.343 -19.625 -6.058 1.00 0.00 C ATOM 1697 C SER A 109 8.707 -19.341 -6.694 1.00 0.00 C ATOM 1698 O SER A 109 9.598 -18.804 -6.035 1.00 0.00 O ATOM 1699 CB SER A 109 7.241 -21.096 -5.639 1.00 0.00 C ATOM 1700 OG SER A 109 6.034 -21.350 -4.940 1.00 0.00 O ATOM 0 H SER A 109 5.663 -20.094 -7.219 1.00 0.00 H new ATOM 0 HA SER A 109 7.253 -18.993 -5.175 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.293 -21.732 -6.522 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.091 -21.356 -5.008 1.00 0.00 H new ATOM 0 HG SER A 109 5.271 -21.132 -5.515 1.00 0.00 H new ATOM 1706 N THR A 110 8.861 -19.615 -7.992 1.00 0.00 N ATOM 1707 CA THR A 110 10.114 -19.416 -8.716 1.00 0.00 C ATOM 1708 C THR A 110 10.254 -17.967 -9.224 1.00 0.00 C ATOM 1709 O THR A 110 11.330 -17.573 -9.683 1.00 0.00 O ATOM 1710 CB THR A 110 10.211 -20.492 -9.818 1.00 0.00 C ATOM 1711 OG1 THR A 110 9.017 -20.520 -10.582 1.00 0.00 O ATOM 1712 CG2 THR A 110 10.389 -21.883 -9.190 1.00 0.00 C ATOM 0 H THR A 110 8.110 -19.985 -8.574 1.00 0.00 H new ATOM 0 HA THR A 110 10.968 -19.545 -8.051 1.00 0.00 H new ATOM 0 HB THR A 110 11.065 -20.246 -10.450 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.091 -21.205 -11.279 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.456 -22.632 -9.979 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.302 -21.900 -8.595 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.535 -22.105 -8.550 1.00 0.00 H new ATOM 1720 N LYS A 111 9.206 -17.137 -9.083 1.00 0.00 N ATOM 1721 CA LYS A 111 9.246 -15.701 -9.353 1.00 0.00 C ATOM 1722 C LYS A 111 9.820 -14.916 -8.171 1.00 0.00 C ATOM 1723 O LYS A 111 10.033 -13.714 -8.302 1.00 0.00 O ATOM 1724 CB LYS A 111 7.845 -15.189 -9.756 1.00 0.00 C ATOM 1725 CG LYS A 111 7.253 -15.847 -11.015 1.00 0.00 C ATOM 1726 CD LYS A 111 8.103 -15.711 -12.282 1.00 0.00 C ATOM 1727 CE LYS A 111 8.328 -14.244 -12.686 1.00 0.00 C ATOM 1728 NZ LYS A 111 9.256 -14.100 -13.842 1.00 0.00 N1+ ATOM 0 H LYS A 111 8.290 -17.459 -8.771 1.00 0.00 H new ATOM 0 HA LYS A 111 9.921 -15.534 -10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 111 7.161 -15.351 -8.923 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.900 -14.112 -9.918 1.00 0.00 H new ATOM 0 HG2 LYS A 111 7.098 -16.907 -10.813 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.272 -15.412 -11.206 1.00 0.00 H new ATOM 0 HD2 LYS A 111 9.068 -16.192 -12.122 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.615 -16.239 -13.101 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.369 -13.790 -12.937 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.728 -13.694 -11.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.254 -13.112 -14.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.218 -14.366 -13.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 8.945 -14.721 -14.616 1.00 0.00 H new ATOM 1742 N GLY A 112 10.058 -15.561 -7.026 1.00 0.00 N ATOM 1743 CA GLY A 112 10.721 -14.938 -5.886 1.00 0.00 C ATOM 1744 C GLY A 112 9.843 -13.877 -5.231 1.00 0.00 C ATOM 1745 O GLY A 112 10.353 -12.843 -4.800 1.00 0.00 O ATOM 0 H GLY A 112 9.794 -16.533 -6.867 1.00 0.00 H new ATOM 0 HA2 GLY A 112 10.977 -15.702 -5.152 1.00 0.00 H new ATOM 0 HA3 GLY A 112 11.657 -14.484 -6.213 1.00 0.00 H new ATOM 1749 N VAL A 113 8.524 -14.082 -5.212 1.00 0.00 N ATOM 1750 CA VAL A 113 7.593 -13.206 -4.514 1.00 0.00 C ATOM 1751 C VAL A 113 7.637 -13.511 -3.008 1.00 0.00 C ATOM 1752 O VAL A 113 8.255 -14.488 -2.573 1.00 0.00 O ATOM 1753 CB VAL A 113 6.187 -13.302 -5.146 1.00 0.00 C ATOM 1754 CG1 VAL A 113 6.275 -13.106 -6.667 1.00 0.00 C ATOM 1755 CG2 VAL A 113 5.473 -14.618 -4.803 1.00 0.00 C ATOM 0 H VAL A 113 8.074 -14.866 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 113 7.887 -12.162 -4.625 1.00 0.00 H new ATOM 0 HB VAL A 113 5.584 -12.502 -4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.278 -13.176 -7.101 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.697 -12.125 -6.884 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.913 -13.878 -7.097 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.490 -14.632 -5.273 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.062 -15.458 -5.170 1.00 0.00 H new ATOM 0 HG23 VAL A 113 5.360 -14.699 -3.722 1.00 0.00 H new ATOM 1765 N LYS A 114 6.955 -12.689 -2.208 1.00 0.00 N ATOM 1766 CA LYS A 114 6.846 -12.863 -0.760 1.00 0.00 C ATOM 1767 C LYS A 114 5.402 -13.230 -0.493 1.00 0.00 C ATOM 1768 O LYS A 114 4.530 -12.418 -0.787 1.00 0.00 O ATOM 1769 CB LYS A 114 7.298 -11.574 -0.049 1.00 0.00 C ATOM 1770 CG LYS A 114 7.579 -11.799 1.448 1.00 0.00 C ATOM 1771 CD LYS A 114 6.365 -11.563 2.363 1.00 0.00 C ATOM 1772 CE LYS A 114 6.506 -12.276 3.723 1.00 0.00 C ATOM 1773 NZ LYS A 114 7.706 -11.851 4.504 1.00 0.00 N1+ ATOM 0 H LYS A 114 6.455 -11.870 -2.555 1.00 0.00 H new ATOM 0 HA LYS A 114 7.492 -13.650 -0.372 1.00 0.00 H new ATOM 0 HB2 LYS A 114 8.198 -11.192 -0.532 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.528 -10.811 -0.161 1.00 0.00 H new ATOM 0 HG2 LYS A 114 7.933 -12.820 1.590 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.387 -11.136 1.758 1.00 0.00 H new ATOM 0 HD2 LYS A 114 6.241 -10.493 2.528 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.463 -11.915 1.863 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.612 -12.086 4.317 1.00 0.00 H new ATOM 0 HE3 LYS A 114 6.555 -13.352 3.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.549 -12.045 5.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 8.539 -12.379 4.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 7.866 -10.832 4.368 1.00 0.00 H new ATOM 1787 N PHE A 115 5.130 -14.421 0.024 1.00 0.00 N ATOM 1788 CA PHE A 115 3.756 -14.879 0.179 1.00 0.00 C ATOM 1789 C PHE A 115 3.179 -14.372 1.497 1.00 0.00 C ATOM 1790 O PHE A 115 3.874 -14.343 2.514 1.00 0.00 O ATOM 1791 CB PHE A 115 3.670 -16.406 0.072 1.00 0.00 C ATOM 1792 CG PHE A 115 4.002 -16.954 -1.304 1.00 0.00 C ATOM 1793 CD1 PHE A 115 3.123 -16.719 -2.378 1.00 0.00 C ATOM 1794 CD2 PHE A 115 5.168 -17.716 -1.513 1.00 0.00 C ATOM 1795 CE1 PHE A 115 3.407 -17.235 -3.655 1.00 0.00 C ATOM 1796 CE2 PHE A 115 5.444 -18.245 -2.788 1.00 0.00 C ATOM 1797 CZ PHE A 115 4.564 -18.006 -3.857 1.00 0.00 C ATOM 0 H PHE A 115 5.838 -15.084 0.341 1.00 0.00 H new ATOM 0 HA PHE A 115 3.156 -14.467 -0.632 1.00 0.00 H new ATOM 0 HB2 PHE A 115 4.349 -16.849 0.800 1.00 0.00 H new ATOM 0 HB3 PHE A 115 2.662 -16.722 0.343 1.00 0.00 H new ATOM 0 HD1 PHE A 115 2.226 -16.139 -2.220 1.00 0.00 H new ATOM 0 HD2 PHE A 115 5.850 -17.894 -0.695 1.00 0.00 H new ATOM 0 HE1 PHE A 115 2.737 -17.039 -4.479 1.00 0.00 H new ATOM 0 HE2 PHE A 115 6.334 -18.836 -2.945 1.00 0.00 H new ATOM 0 HZ PHE A 115 4.777 -18.415 -4.834 1.00 0.00 H new ATOM 1807 N VAL A 116 1.900 -14.008 1.475 1.00 0.00 N ATOM 1808 CA VAL A 116 1.082 -13.714 2.643 1.00 0.00 C ATOM 1809 C VAL A 116 -0.237 -14.477 2.488 1.00 0.00 C ATOM 1810 O VAL A 116 -0.627 -14.828 1.371 1.00 0.00 O ATOM 1811 CB VAL A 116 0.902 -12.187 2.829 1.00 0.00 C ATOM 1812 CG1 VAL A 116 2.259 -11.481 3.007 1.00 0.00 C ATOM 1813 CG2 VAL A 116 0.154 -11.471 1.696 1.00 0.00 C ATOM 0 H VAL A 116 1.384 -13.906 0.601 1.00 0.00 H new ATOM 0 HA VAL A 116 1.568 -14.048 3.559 1.00 0.00 H new ATOM 0 HB VAL A 116 0.286 -12.113 3.725 1.00 0.00 H new ATOM 0 HG11 VAL A 116 2.098 -10.411 3.135 1.00 0.00 H new ATOM 0 HG12 VAL A 116 2.764 -11.880 3.887 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.877 -11.652 2.125 1.00 0.00 H new ATOM 0 HG21 VAL A 116 0.082 -10.407 1.923 1.00 0.00 H new ATOM 0 HG22 VAL A 116 0.696 -11.606 0.760 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -0.847 -11.890 1.599 1.00 0.00 H new ATOM 1823 N GLY A 117 -0.948 -14.715 3.587 1.00 0.00 N ATOM 1824 CA GLY A 117 -2.308 -15.232 3.537 1.00 0.00 C ATOM 1825 C GLY A 117 -2.415 -16.744 3.406 1.00 0.00 C ATOM 1826 O GLY A 117 -3.383 -17.220 2.816 1.00 0.00 O ATOM 0 H GLY A 117 -0.598 -14.555 4.532 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -2.832 -14.922 4.441 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -2.825 -14.772 2.695 1.00 0.00 H new ATOM 1830 N TYR A 118 -1.467 -17.507 3.949 1.00 0.00 N ATOM 1831 CA TYR A 118 -1.621 -18.956 4.069 1.00 0.00 C ATOM 1832 C TYR A 118 -2.773 -19.269 5.052 1.00 0.00 C ATOM 1833 O TYR A 118 -3.123 -18.415 5.875 1.00 0.00 O ATOM 1834 CB TYR A 118 -0.271 -19.558 4.485 1.00 0.00 C ATOM 1835 CG TYR A 118 0.836 -19.615 3.432 1.00 0.00 C ATOM 1836 CD1 TYR A 118 0.715 -19.043 2.144 1.00 0.00 C ATOM 1837 CD2 TYR A 118 2.017 -20.302 3.761 1.00 0.00 C ATOM 1838 CE1 TYR A 118 1.750 -19.190 1.201 1.00 0.00 C ATOM 1839 CE2 TYR A 118 3.070 -20.420 2.836 1.00 0.00 C ATOM 1840 CZ TYR A 118 2.940 -19.867 1.545 1.00 0.00 C ATOM 1841 OH TYR A 118 3.945 -19.984 0.629 1.00 0.00 O ATOM 0 H TYR A 118 -0.585 -17.146 4.312 1.00 0.00 H new ATOM 0 HA TYR A 118 -1.897 -19.413 3.119 1.00 0.00 H new ATOM 0 HB2 TYR A 118 0.103 -18.987 5.335 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -0.451 -20.573 4.838 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -0.176 -18.491 1.883 1.00 0.00 H new ATOM 0 HD2 TYR A 118 2.118 -20.747 4.740 1.00 0.00 H new ATOM 0 HE1 TYR A 118 1.633 -18.782 0.208 1.00 0.00 H new ATOM 0 HE2 TYR A 118 3.978 -20.934 3.114 1.00 0.00 H new ATOM 0 HH TYR A 118 3.570 -20.255 -0.235 1.00 0.00 H new ATOM 1851 N TRP A 119 -3.388 -20.461 4.965 1.00 0.00 N ATOM 1852 CA TRP A 119 -4.644 -20.778 5.672 1.00 0.00 C ATOM 1853 C TRP A 119 -4.586 -22.145 6.367 1.00 0.00 C ATOM 1854 O TRP A 119 -3.935 -23.041 5.829 1.00 0.00 O ATOM 1855 CB TRP A 119 -5.800 -20.714 4.662 1.00 0.00 C ATOM 1856 CG TRP A 119 -7.194 -20.638 5.202 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -8.116 -21.627 5.226 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -7.846 -19.493 5.808 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -9.293 -21.149 5.774 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -9.170 -19.840 6.189 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -7.417 -18.188 6.077 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -10.026 -18.925 6.826 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -8.246 -17.267 6.747 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -9.555 -17.631 7.113 1.00 0.00 C ATOM 0 H TRP A 119 -3.029 -21.233 4.403 1.00 0.00 H new ATOM 0 HA TRP A 119 -4.802 -20.044 6.463 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -5.640 -19.845 4.024 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -5.736 -21.595 4.023 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -7.958 -22.635 4.872 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -10.148 -21.698 5.860 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -6.430 -17.881 5.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -11.033 -19.212 7.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -7.876 -16.279 6.980 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -10.196 -16.919 7.612 1.00 0.00 H new ATOM 1875 N PRO A 120 -5.254 -22.350 7.522 1.00 0.00 N ATOM 1876 CA PRO A 120 -5.201 -23.609 8.261 1.00 0.00 C ATOM 1877 C PRO A 120 -5.781 -24.792 7.480 1.00 0.00 C ATOM 1878 O PRO A 120 -6.913 -24.732 6.997 1.00 0.00 O ATOM 1879 CB PRO A 120 -5.973 -23.373 9.567 1.00 0.00 C ATOM 1880 CG PRO A 120 -5.913 -21.861 9.753 1.00 0.00 C ATOM 1881 CD PRO A 120 -5.978 -21.359 8.313 1.00 0.00 C ATOM 0 HA PRO A 120 -4.163 -23.884 8.448 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -7.001 -23.727 9.494 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.514 -23.898 10.404 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -6.745 -21.491 10.352 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -4.996 -21.548 10.253 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -7.010 -21.266 7.976 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.522 -20.373 8.220 1.00 0.00 H new ATOM 1889 N THR A 121 -5.027 -25.890 7.411 1.00 0.00 N ATOM 1890 CA THR A 121 -5.497 -27.183 6.909 1.00 0.00 C ATOM 1891 C THR A 121 -6.119 -28.012 8.040 1.00 0.00 C ATOM 1892 O THR A 121 -6.978 -28.859 7.789 1.00 0.00 O ATOM 1893 CB THR A 121 -4.317 -27.935 6.283 1.00 0.00 C ATOM 1894 OG1 THR A 121 -3.179 -27.810 7.107 1.00 0.00 O ATOM 1895 CG2 THR A 121 -3.947 -27.366 4.918 1.00 0.00 C ATOM 0 H THR A 121 -4.052 -25.906 7.709 1.00 0.00 H new ATOM 0 HA THR A 121 -6.266 -27.017 6.155 1.00 0.00 H new ATOM 0 HB THR A 121 -4.623 -28.976 6.177 1.00 0.00 H new ATOM 0 HG1 THR A 121 -2.507 -28.471 6.839 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.107 -27.925 4.506 1.00 0.00 H new ATOM 0 HG22 THR A 121 -4.801 -27.448 4.246 1.00 0.00 H new ATOM 0 HG23 THR A 121 -3.668 -26.318 5.024 1.00 0.00 H new ATOM 1903 N GLU A 122 -5.699 -27.782 9.288 1.00 0.00 N ATOM 1904 CA GLU A 122 -6.183 -28.505 10.449 1.00 0.00 C ATOM 1905 C GLU A 122 -7.663 -28.179 10.639 1.00 0.00 C ATOM 1906 O GLU A 122 -8.069 -27.012 10.620 1.00 0.00 O ATOM 1907 CB GLU A 122 -5.356 -28.153 11.695 1.00 0.00 C ATOM 1908 CG GLU A 122 -3.948 -28.766 11.671 1.00 0.00 C ATOM 1909 CD GLU A 122 -3.972 -30.287 11.930 1.00 0.00 C ATOM 1910 OE1 GLU A 122 -3.918 -30.702 13.114 1.00 0.00 O1- ATOM 1911 OE2 GLU A 122 -4.042 -31.079 10.958 1.00 0.00 O ATOM 0 H GLU A 122 -5.001 -27.074 9.515 1.00 0.00 H new ATOM 0 HA GLU A 122 -6.072 -29.578 10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -5.273 -27.069 11.776 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -5.883 -28.500 12.584 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -3.485 -28.571 10.704 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -3.329 -28.280 12.425 1.00 0.00 H new ATOM 1918 N GLY A 123 -8.467 -29.226 10.803 1.00 0.00 N ATOM 1919 CA GLY A 123 -9.917 -29.133 10.916 1.00 0.00 C ATOM 1920 C GLY A 123 -10.622 -28.921 9.569 1.00 0.00 C ATOM 1921 O GLY A 123 -11.855 -28.952 9.527 1.00 0.00 O ATOM 0 H GLY A 123 -8.119 -30.183 10.862 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.297 -30.045 11.377 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.170 -28.309 11.583 1.00 0.00 H new ATOM 1925 N TYR A 124 -9.877 -28.737 8.474 1.00 0.00 N ATOM 1926 CA TYR A 124 -10.402 -28.718 7.113 1.00 0.00 C ATOM 1927 C TYR A 124 -10.443 -30.152 6.571 1.00 0.00 C ATOM 1928 O TYR A 124 -9.780 -31.048 7.104 1.00 0.00 O ATOM 1929 CB TYR A 124 -9.555 -27.783 6.231 1.00 0.00 C ATOM 1930 CG TYR A 124 -10.385 -26.929 5.293 1.00 0.00 C ATOM 1931 CD1 TYR A 124 -10.850 -25.673 5.729 1.00 0.00 C ATOM 1932 CD2 TYR A 124 -10.722 -27.391 4.006 1.00 0.00 C ATOM 1933 CE1 TYR A 124 -11.656 -24.883 4.891 1.00 0.00 C ATOM 1934 CE2 TYR A 124 -11.537 -26.611 3.168 1.00 0.00 C ATOM 1935 CZ TYR A 124 -12.015 -25.355 3.606 1.00 0.00 C ATOM 1936 OH TYR A 124 -12.828 -24.615 2.800 1.00 0.00 O ATOM 0 H TYR A 124 -8.868 -28.594 8.515 1.00 0.00 H new ATOM 0 HA TYR A 124 -11.419 -28.326 7.106 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -8.958 -27.133 6.871 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -8.857 -28.381 5.645 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -10.586 -25.315 6.713 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -10.353 -28.346 3.662 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -12.001 -23.917 5.228 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -11.799 -26.973 2.185 1.00 0.00 H new ATOM 0 HH TYR A 124 -12.970 -25.089 1.954 1.00 0.00 H new ATOM 1946 N GLU A 125 -11.197 -30.379 5.493 1.00 0.00 N ATOM 1947 CA GLU A 125 -11.271 -31.666 4.804 1.00 0.00 C ATOM 1948 C GLU A 125 -10.932 -31.429 3.333 1.00 0.00 C ATOM 1949 O GLU A 125 -11.531 -30.562 2.700 1.00 0.00 O ATOM 1950 CB GLU A 125 -12.665 -32.297 4.968 1.00 0.00 C ATOM 1951 CG GLU A 125 -12.955 -32.711 6.418 1.00 0.00 C ATOM 1952 CD GLU A 125 -14.312 -33.432 6.535 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -15.348 -32.755 6.744 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -14.350 -34.684 6.440 1.00 0.00 O ATOM 0 H GLU A 125 -11.783 -29.660 5.068 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.559 -32.369 5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -13.423 -31.587 4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -12.743 -33.171 4.321 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -12.161 -33.366 6.777 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -12.954 -31.828 7.057 1.00 0.00 H new ATOM 1961 N PHE A 126 -9.940 -32.156 2.817 1.00 0.00 N ATOM 1962 CA PHE A 126 -9.421 -32.133 1.449 1.00 0.00 C ATOM 1963 C PHE A 126 -8.405 -33.288 1.352 1.00 0.00 C ATOM 1964 O PHE A 126 -8.039 -33.866 2.384 1.00 0.00 O ATOM 1965 CB PHE A 126 -8.704 -30.791 1.156 1.00 0.00 C ATOM 1966 CG PHE A 126 -7.421 -30.593 1.947 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -7.473 -30.267 3.317 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -6.172 -30.819 1.336 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -6.296 -30.211 4.080 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -4.993 -30.763 2.099 1.00 0.00 C ATOM 1971 CZ PHE A 126 -5.055 -30.469 3.473 1.00 0.00 C ATOM 0 H PHE A 126 -9.438 -32.832 3.393 1.00 0.00 H new ATOM 0 HA PHE A 126 -10.231 -32.240 0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -8.475 -30.737 0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -9.386 -29.970 1.377 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -8.425 -30.059 3.783 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -6.120 -31.036 0.279 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -6.344 -29.970 5.132 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -4.038 -30.946 1.629 1.00 0.00 H new ATOM 0 HZ PHE A 126 -4.150 -30.442 4.061 1.00 0.00 H new ATOM 1981 N THR A 127 -7.911 -33.613 0.151 1.00 0.00 N ATOM 1982 CA THR A 127 -6.759 -34.520 0.020 1.00 0.00 C ATOM 1983 C THR A 127 -5.729 -34.031 -1.013 1.00 0.00 C ATOM 1984 O THR A 127 -4.612 -34.550 -1.047 1.00 0.00 O ATOM 1985 CB THR A 127 -7.280 -35.955 -0.191 1.00 0.00 C ATOM 1986 OG1 THR A 127 -6.305 -36.952 0.076 1.00 0.00 O ATOM 1987 CG2 THR A 127 -7.875 -36.198 -1.580 1.00 0.00 C ATOM 0 H THR A 127 -8.283 -33.268 -0.734 1.00 0.00 H new ATOM 0 HA THR A 127 -6.180 -34.524 0.943 1.00 0.00 H new ATOM 0 HB THR A 127 -8.081 -36.043 0.543 1.00 0.00 H new ATOM 0 HG1 THR A 127 -5.412 -36.596 -0.116 1.00 0.00 H new ATOM 0 HG21 THR A 127 -8.220 -37.229 -1.653 1.00 0.00 H new ATOM 0 HG22 THR A 127 -8.715 -35.522 -1.739 1.00 0.00 H new ATOM 0 HG23 THR A 127 -7.114 -36.016 -2.339 1.00 0.00 H new ATOM 1995 N SER A 128 -6.054 -33.011 -1.818 1.00 0.00 N ATOM 1996 CA SER A 128 -5.156 -32.452 -2.822 1.00 0.00 C ATOM 1997 C SER A 128 -3.852 -31.920 -2.192 1.00 0.00 C ATOM 1998 O SER A 128 -3.929 -31.064 -1.310 1.00 0.00 O ATOM 1999 CB SER A 128 -5.912 -31.325 -3.530 1.00 0.00 C ATOM 2000 OG SER A 128 -7.168 -31.821 -3.949 1.00 0.00 O ATOM 0 H SER A 128 -6.962 -32.548 -1.785 1.00 0.00 H new ATOM 0 HA SER A 128 -4.862 -33.229 -3.528 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.045 -30.477 -2.858 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.342 -30.966 -4.387 1.00 0.00 H new ATOM 0 HG SER A 128 -7.274 -31.672 -4.912 1.00 0.00 H new ATOM 2006 N PRO A 129 -2.659 -32.340 -2.664 1.00 0.00 N ATOM 2007 CA PRO A 129 -1.390 -31.817 -2.156 1.00 0.00 C ATOM 2008 C PRO A 129 -0.975 -30.490 -2.823 1.00 0.00 C ATOM 2009 O PRO A 129 -0.227 -29.720 -2.227 1.00 0.00 O ATOM 2010 CB PRO A 129 -0.371 -32.938 -2.389 1.00 0.00 C ATOM 2011 CG PRO A 129 -0.906 -33.642 -3.635 1.00 0.00 C ATOM 2012 CD PRO A 129 -2.425 -33.520 -3.489 1.00 0.00 C ATOM 0 HA PRO A 129 -1.466 -31.558 -1.100 1.00 0.00 H new ATOM 0 HB2 PRO A 129 0.632 -32.543 -2.549 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -0.315 -33.615 -1.537 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.551 -33.166 -4.549 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.589 -34.684 -3.675 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -2.903 -33.415 -4.463 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -2.844 -34.411 -3.022 1.00 0.00 H new ATOM 2020 N LYS A 130 -1.462 -30.174 -4.034 1.00 0.00 N ATOM 2021 CA LYS A 130 -1.038 -28.962 -4.754 1.00 0.00 C ATOM 2022 C LYS A 130 -1.334 -27.648 -4.000 1.00 0.00 C ATOM 2023 O LYS A 130 -0.463 -26.778 -4.005 1.00 0.00 O ATOM 2024 CB LYS A 130 -1.584 -28.974 -6.196 1.00 0.00 C ATOM 2025 CG LYS A 130 -0.673 -28.177 -7.153 1.00 0.00 C ATOM 2026 CD LYS A 130 -1.192 -28.146 -8.603 1.00 0.00 C ATOM 2027 CE LYS A 130 -1.104 -29.536 -9.264 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.845 -29.611 -10.553 1.00 0.00 N1+ ATOM 0 H LYS A 130 -2.148 -30.739 -4.534 1.00 0.00 H new ATOM 0 HA LYS A 130 0.050 -28.988 -4.809 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -1.669 -30.003 -6.545 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -2.588 -28.549 -6.210 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -0.578 -27.155 -6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 130 0.326 -28.614 -7.141 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.226 -27.802 -8.613 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -0.612 -27.429 -9.183 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -0.057 -29.785 -9.437 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.501 -30.285 -8.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -1.564 -30.471 -11.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -2.867 -29.639 -10.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.622 -28.776 -11.131 1.00 0.00 H new ATOM 2042 N PRO A 131 -2.500 -27.442 -3.348 1.00 0.00 N ATOM 2043 CA PRO A 131 -2.784 -26.192 -2.640 1.00 0.00 C ATOM 2044 C PRO A 131 -2.148 -26.104 -1.245 1.00 0.00 C ATOM 2045 O PRO A 131 -2.455 -25.149 -0.529 1.00 0.00 O ATOM 2046 CB PRO A 131 -4.310 -26.124 -2.559 1.00 0.00 C ATOM 2047 CG PRO A 131 -4.677 -27.593 -2.389 1.00 0.00 C ATOM 2048 CD PRO A 131 -3.712 -28.258 -3.370 1.00 0.00 C ATOM 0 HA PRO A 131 -2.347 -25.349 -3.176 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -4.649 -25.518 -1.719 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -4.749 -25.694 -3.459 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -4.527 -27.939 -1.366 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -5.719 -27.788 -2.641 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.498 -29.285 -3.073 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -4.139 -28.298 -4.372 1.00 0.00 H new ATOM 2056 N VAL A 132 -1.313 -27.052 -0.811 1.00 0.00 N ATOM 2057 CA VAL A 132 -0.720 -27.045 0.525 1.00 0.00 C ATOM 2058 C VAL A 132 0.806 -27.102 0.447 1.00 0.00 C ATOM 2059 O VAL A 132 1.375 -27.682 -0.482 1.00 0.00 O ATOM 2060 CB VAL A 132 -1.302 -28.173 1.399 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -2.775 -27.924 1.725 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -1.222 -29.565 0.760 1.00 0.00 C ATOM 0 H VAL A 132 -1.029 -27.849 -1.381 1.00 0.00 H new ATOM 0 HA VAL A 132 -0.981 -26.104 1.009 1.00 0.00 H new ATOM 0 HB VAL A 132 -0.682 -28.158 2.295 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.154 -28.738 2.343 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -2.874 -26.983 2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -3.349 -27.873 0.800 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -1.652 -30.302 1.438 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -1.777 -29.567 -0.178 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -0.179 -29.816 0.565 1.00 0.00 H new ATOM 2072 N ILE A 133 1.477 -26.469 1.415 1.00 0.00 N ATOM 2073 CA ILE A 133 2.897 -26.653 1.636 1.00 0.00 C ATOM 2074 C ILE A 133 3.085 -27.910 2.467 1.00 0.00 C ATOM 2075 O ILE A 133 2.147 -28.391 3.117 1.00 0.00 O ATOM 2076 CB ILE A 133 3.560 -25.453 2.351 1.00 0.00 C ATOM 2077 CG1 ILE A 133 2.990 -25.225 3.773 1.00 0.00 C ATOM 2078 CG2 ILE A 133 3.604 -24.215 1.442 1.00 0.00 C ATOM 2079 CD1 ILE A 133 3.227 -23.815 4.312 1.00 0.00 C ATOM 0 H ILE A 133 1.040 -25.815 2.064 1.00 0.00 H new ATOM 0 HA ILE A 133 3.382 -26.738 0.664 1.00 0.00 H new ATOM 0 HB ILE A 133 4.607 -25.694 2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.918 -25.424 3.761 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.441 -25.946 4.455 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.076 -23.389 1.974 1.00 0.00 H new ATOM 0 HG22 ILE A 133 4.178 -24.443 0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 133 2.589 -23.933 1.162 1.00 0.00 H new ATOM 0 HD11 ILE A 133 2.800 -23.731 5.311 1.00 0.00 H new ATOM 0 HD12 ILE A 133 4.298 -23.618 4.357 1.00 0.00 H new ATOM 0 HD13 ILE A 133 2.752 -23.089 3.652 1.00 0.00 H new ATOM 2091 N ALA A 134 4.348 -28.326 2.545 1.00 0.00 N ATOM 2092 CA ALA A 134 4.818 -29.344 3.454 1.00 0.00 C ATOM 2093 C ALA A 134 4.017 -30.638 3.260 1.00 0.00 C ATOM 2094 O ALA A 134 3.415 -30.886 2.212 1.00 0.00 O ATOM 2095 CB ALA A 134 4.763 -28.727 4.868 1.00 0.00 C ATOM 0 H ALA A 134 5.088 -27.945 1.954 1.00 0.00 H new ATOM 0 HA ALA A 134 5.848 -29.649 3.268 1.00 0.00 H new ATOM 0 HB1 ALA A 134 5.110 -29.459 5.598 1.00 0.00 H new ATOM 0 HB2 ALA A 134 5.403 -27.846 4.905 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.737 -28.441 5.100 1.00 0.00 H new ATOM 2101 N ASP A 135 3.986 -31.457 4.303 1.00 0.00 N ATOM 2102 CA ASP A 135 3.123 -32.624 4.427 1.00 0.00 C ATOM 2103 C ASP A 135 1.728 -32.166 4.863 1.00 0.00 C ATOM 2104 O ASP A 135 1.265 -32.454 5.970 1.00 0.00 O ATOM 2105 CB ASP A 135 3.747 -33.673 5.357 1.00 0.00 C ATOM 2106 CG ASP A 135 2.864 -34.930 5.483 1.00 0.00 C ATOM 2107 OD1 ASP A 135 2.305 -35.393 4.458 1.00 0.00 O ATOM 2108 OD2 ASP A 135 2.766 -35.497 6.599 1.00 0.00 O1- ATOM 0 H ASP A 135 4.585 -31.321 5.118 1.00 0.00 H new ATOM 0 HA ASP A 135 3.017 -33.122 3.463 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.729 -33.956 4.977 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.900 -33.237 6.344 1.00 0.00 H new ATOM 2113 N GLY A 136 1.097 -31.339 4.025 1.00 0.00 N ATOM 2114 CA GLY A 136 -0.264 -30.844 4.225 1.00 0.00 C ATOM 2115 C GLY A 136 -0.406 -29.944 5.455 1.00 0.00 C ATOM 2116 O GLY A 136 -1.475 -29.909 6.065 1.00 0.00 O ATOM 0 H GLY A 136 1.529 -30.988 3.170 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -0.575 -30.290 3.340 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -0.941 -31.693 4.324 1.00 0.00 H new ATOM 2120 N GLN A 137 0.663 -29.244 5.851 1.00 0.00 N ATOM 2121 CA GLN A 137 0.702 -28.542 7.137 1.00 0.00 C ATOM 2122 C GLN A 137 -0.072 -27.226 7.091 1.00 0.00 C ATOM 2123 O GLN A 137 -0.520 -26.750 8.135 1.00 0.00 O ATOM 2124 CB GLN A 137 2.141 -28.267 7.586 1.00 0.00 C ATOM 2125 CG GLN A 137 2.962 -29.551 7.731 1.00 0.00 C ATOM 2126 CD GLN A 137 2.515 -30.417 8.918 1.00 0.00 C ATOM 2127 OE1 GLN A 137 2.785 -30.097 10.073 1.00 0.00 O ATOM 2128 NE2 GLN A 137 1.814 -31.514 8.672 1.00 0.00 N ATOM 0 H GLN A 137 1.514 -29.149 5.297 1.00 0.00 H new ATOM 0 HA GLN A 137 0.225 -29.203 7.860 1.00 0.00 H new ATOM 0 HB2 GLN A 137 2.625 -27.609 6.864 1.00 0.00 H new ATOM 0 HB3 GLN A 137 2.127 -27.738 8.539 1.00 0.00 H new ATOM 0 HG2 GLN A 137 2.882 -30.133 6.813 1.00 0.00 H new ATOM 0 HG3 GLN A 137 4.014 -29.292 7.853 1.00 0.00 H new ATOM 0 HE21 GLN A 137 1.594 -31.773 7.710 1.00 0.00 H new ATOM 0 HE22 GLN A 137 1.495 -32.099 9.444 1.00 0.00 H new ATOM 2137 N LEU A 138 -0.173 -26.612 5.903 1.00 0.00 N ATOM 2138 CA LEU A 138 -0.836 -25.323 5.733 1.00 0.00 C ATOM 2139 C LEU A 138 -1.237 -25.149 4.268 1.00 0.00 C ATOM 2140 O LEU A 138 -0.518 -25.615 3.382 1.00 0.00 O ATOM 2141 CB LEU A 138 0.161 -24.232 6.181 1.00 0.00 C ATOM 2142 CG LEU A 138 -0.414 -22.889 6.641 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -1.406 -23.010 7.803 1.00 0.00 C ATOM 2144 CD2 LEU A 138 0.733 -21.993 7.129 1.00 0.00 C ATOM 0 H LEU A 138 0.204 -26.999 5.038 1.00 0.00 H new ATOM 0 HA LEU A 138 -1.744 -25.255 6.331 1.00 0.00 H new ATOM 0 HB2 LEU A 138 0.759 -24.638 6.997 1.00 0.00 H new ATOM 0 HB3 LEU A 138 0.842 -24.039 5.352 1.00 0.00 H new ATOM 0 HG LEU A 138 -0.941 -22.476 5.781 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -1.771 -22.019 8.074 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -2.246 -23.636 7.501 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -0.908 -23.461 8.661 1.00 0.00 H new ATOM 0 HD21 LEU A 138 0.331 -21.035 7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 138 1.244 -22.477 7.961 1.00 0.00 H new ATOM 0 HD23 LEU A 138 1.439 -21.830 6.315 1.00 0.00 H new ATOM 2156 N PHE A 139 -2.351 -24.472 3.984 1.00 0.00 N ATOM 2157 CA PHE A 139 -2.715 -24.108 2.619 1.00 0.00 C ATOM 2158 C PHE A 139 -1.839 -22.943 2.200 1.00 0.00 C ATOM 2159 O PHE A 139 -1.609 -22.027 2.991 1.00 0.00 O ATOM 2160 CB PHE A 139 -4.183 -23.695 2.475 1.00 0.00 C ATOM 2161 CG PHE A 139 -5.217 -24.791 2.603 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -5.334 -25.763 1.591 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -6.115 -24.803 3.685 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -6.322 -26.758 1.677 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -7.124 -25.778 3.756 1.00 0.00 C ATOM 2166 CZ PHE A 139 -7.223 -26.761 2.755 1.00 0.00 C ATOM 0 H PHE A 139 -3.020 -24.164 4.690 1.00 0.00 H new ATOM 0 HA PHE A 139 -2.569 -24.986 1.989 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.398 -22.936 3.228 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.309 -23.222 1.501 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.662 -25.744 0.746 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -6.029 -24.060 4.464 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -6.389 -27.520 0.915 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -7.823 -25.773 4.579 1.00 0.00 H new ATOM 0 HZ PHE A 139 -7.991 -27.518 2.815 1.00 0.00 H new ATOM 2176 N VAL A 140 -1.432 -22.925 0.936 1.00 0.00 N ATOM 2177 CA VAL A 140 -0.562 -21.900 0.380 1.00 0.00 C ATOM 2178 C VAL A 140 -1.331 -20.585 0.104 1.00 0.00 C ATOM 2179 O VAL A 140 -0.830 -19.696 -0.584 1.00 0.00 O ATOM 2180 CB VAL A 140 0.150 -22.458 -0.875 1.00 0.00 C ATOM 2181 CG1 VAL A 140 0.759 -23.848 -0.644 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -0.761 -22.567 -2.109 1.00 0.00 C ATOM 0 H VAL A 140 -1.704 -23.637 0.258 1.00 0.00 H new ATOM 0 HA VAL A 140 0.203 -21.640 1.112 1.00 0.00 H new ATOM 0 HB VAL A 140 0.933 -21.723 -1.065 1.00 0.00 H new ATOM 0 HG11 VAL A 140 1.245 -24.189 -1.558 1.00 0.00 H new ATOM 0 HG12 VAL A 140 1.494 -23.794 0.159 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -0.029 -24.549 -0.369 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -0.191 -22.966 -2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -1.595 -23.233 -1.888 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -1.144 -21.580 -2.367 1.00 0.00 H new ATOM 2192 N GLY A 141 -2.576 -20.459 0.575 1.00 0.00 N ATOM 2193 CA GLY A 141 -3.469 -19.338 0.331 1.00 0.00 C ATOM 2194 C GLY A 141 -4.806 -19.586 1.030 1.00 0.00 C ATOM 2195 O GLY A 141 -5.010 -20.674 1.571 1.00 0.00 O ATOM 0 H GLY A 141 -3.002 -21.174 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -3.020 -18.416 0.699 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.625 -19.211 -0.740 1.00 0.00 H new ATOM 2199 N LEU A 142 -5.721 -18.610 1.025 1.00 0.00 N ATOM 2200 CA LEU A 142 -7.050 -18.760 1.631 1.00 0.00 C ATOM 2201 C LEU A 142 -7.897 -19.755 0.853 1.00 0.00 C ATOM 2202 O LEU A 142 -8.000 -19.683 -0.372 1.00 0.00 O ATOM 2203 CB LEU A 142 -7.745 -17.402 1.831 1.00 0.00 C ATOM 2204 CG LEU A 142 -9.290 -17.367 1.858 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -9.844 -17.917 3.180 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -9.790 -15.931 1.673 1.00 0.00 C ATOM 0 H LEU A 142 -5.562 -17.696 0.602 1.00 0.00 H new ATOM 0 HA LEU A 142 -6.920 -19.176 2.630 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -7.386 -16.980 2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.411 -16.737 1.034 1.00 0.00 H new ATOM 0 HG LEU A 142 -9.643 -17.996 1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.933 -17.877 3.163 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -9.521 -18.950 3.308 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -9.472 -17.315 4.009 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -10.880 -15.920 1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -9.405 -15.305 2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -9.441 -15.545 0.715 1.00 0.00 H new ATOM 2218 N ALA A 143 -8.552 -20.630 1.608 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.534 -21.573 1.132 1.00 0.00 C ATOM 2220 C ALA A 143 -10.934 -20.982 1.338 1.00 0.00 C ATOM 2221 O ALA A 143 -11.402 -20.887 2.472 1.00 0.00 O ATOM 2222 CB ALA A 143 -9.338 -22.859 1.942 1.00 0.00 C ATOM 0 H ALA A 143 -8.399 -20.697 2.614 1.00 0.00 H new ATOM 0 HA ALA A 143 -9.423 -21.787 0.069 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.061 -23.607 1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.328 -23.238 1.784 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -9.485 -22.648 3.001 1.00 0.00 H new ATOM 2228 N LEU A 144 -11.599 -20.570 0.255 1.00 0.00 N ATOM 2229 CA LEU A 144 -13.014 -20.214 0.277 1.00 0.00 C ATOM 2230 C LEU A 144 -13.823 -21.465 -0.057 1.00 0.00 C ATOM 2231 O LEU A 144 -13.392 -22.312 -0.843 1.00 0.00 O ATOM 2232 CB LEU A 144 -13.378 -19.110 -0.735 1.00 0.00 C ATOM 2233 CG LEU A 144 -12.794 -17.715 -0.513 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -13.258 -16.808 -1.660 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -13.271 -17.128 0.819 1.00 0.00 C ATOM 0 H LEU A 144 -11.166 -20.475 -0.664 1.00 0.00 H new ATOM 0 HA LEU A 144 -13.241 -19.827 1.270 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -13.069 -19.448 -1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -14.464 -19.019 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 144 -11.706 -17.782 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -12.851 -15.807 -1.519 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -12.906 -17.213 -2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -14.347 -16.759 -1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.842 -16.135 0.954 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -14.359 -17.056 0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -12.953 -17.775 1.636 1.00 0.00 H new ATOM 2247 N ASP A 145 -15.039 -21.510 0.475 1.00 0.00 N ATOM 2248 CA ASP A 145 -16.072 -22.491 0.190 1.00 0.00 C ATOM 2249 C ASP A 145 -17.400 -21.734 0.031 1.00 0.00 C ATOM 2250 O ASP A 145 -17.533 -20.620 0.551 1.00 0.00 O ATOM 2251 CB ASP A 145 -16.136 -23.539 1.307 1.00 0.00 C ATOM 2252 CG ASP A 145 -17.486 -24.250 1.275 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -17.705 -25.171 0.461 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -18.385 -23.848 2.041 1.00 0.00 O ATOM 0 H ASP A 145 -15.346 -20.818 1.159 1.00 0.00 H new ATOM 0 HA ASP A 145 -15.854 -23.033 -0.730 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -15.331 -24.263 1.185 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -15.990 -23.061 2.275 1.00 0.00 H new ATOM 2259 N GLU A 146 -18.361 -22.308 -0.698 1.00 0.00 N ATOM 2260 CA GLU A 146 -19.730 -21.799 -0.790 1.00 0.00 C ATOM 2261 C GLU A 146 -20.722 -22.980 -0.875 1.00 0.00 C ATOM 2262 O GLU A 146 -21.695 -22.947 -1.636 1.00 0.00 O ATOM 2263 CB GLU A 146 -19.839 -20.809 -1.970 1.00 0.00 C ATOM 2264 CG GLU A 146 -21.020 -19.834 -1.856 1.00 0.00 C ATOM 2265 CD GLU A 146 -20.775 -18.760 -0.780 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -20.195 -17.696 -1.109 1.00 0.00 O ATOM 2267 OE2 GLU A 146 -21.191 -18.955 0.388 1.00 0.00 O ATOM 0 H GLU A 146 -18.206 -23.152 -1.249 1.00 0.00 H new ATOM 0 HA GLU A 146 -19.994 -21.240 0.108 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -18.914 -20.237 -2.039 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -19.934 -21.373 -2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -21.187 -19.352 -2.819 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -21.927 -20.389 -1.616 1.00 0.00 H new ATOM 2274 N THR A 147 -20.442 -24.071 -0.158 1.00 0.00 N ATOM 2275 CA THR A 147 -21.224 -25.299 -0.172 1.00 0.00 C ATOM 2276 C THR A 147 -21.305 -25.886 1.236 1.00 0.00 C ATOM 2277 O THR A 147 -22.386 -26.268 1.697 1.00 0.00 O ATOM 2278 CB THR A 147 -20.577 -26.319 -1.134 1.00 0.00 C ATOM 2279 OG1 THR A 147 -20.415 -25.786 -2.445 1.00 0.00 O ATOM 2280 CG2 THR A 147 -21.380 -27.626 -1.214 1.00 0.00 C ATOM 0 H THR A 147 -19.637 -24.120 0.467 1.00 0.00 H new ATOM 0 HA THR A 147 -22.233 -25.074 -0.517 1.00 0.00 H new ATOM 0 HB THR A 147 -19.593 -26.537 -0.719 1.00 0.00 H new ATOM 0 HG1 THR A 147 -20.001 -26.460 -3.023 1.00 0.00 H new ATOM 0 HG21 THR A 147 -20.888 -28.314 -1.902 1.00 0.00 H new ATOM 0 HG22 THR A 147 -21.435 -28.080 -0.225 1.00 0.00 H new ATOM 0 HG23 THR A 147 -22.387 -27.413 -1.572 1.00 0.00 H new ATOM 2288 N ASN A 148 -20.170 -25.980 1.917 1.00 0.00 N ATOM 2289 CA ASN A 148 -20.058 -26.527 3.257 1.00 0.00 C ATOM 2290 C ASN A 148 -20.579 -25.496 4.259 1.00 0.00 C ATOM 2291 O ASN A 148 -21.203 -25.865 5.256 1.00 0.00 O ATOM 2292 CB ASN A 148 -18.598 -26.892 3.587 1.00 0.00 C ATOM 2293 CG ASN A 148 -18.074 -28.024 2.709 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -17.928 -29.154 3.169 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -17.815 -27.755 1.443 1.00 0.00 N ATOM 0 H ASN A 148 -19.276 -25.667 1.538 1.00 0.00 H new ATOM 0 HA ASN A 148 -20.652 -27.439 3.317 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -17.967 -26.012 3.458 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -18.526 -27.184 4.635 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -17.485 -28.494 0.822 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -17.945 -26.808 1.086 1.00 0.00 H new ATOM 2302 N GLN A 149 -20.333 -24.215 3.980 1.00 0.00 N ATOM 2303 CA GLN A 149 -20.811 -23.053 4.707 1.00 0.00 C ATOM 2304 C GLN A 149 -21.608 -22.155 3.752 1.00 0.00 C ATOM 2305 O GLN A 149 -21.463 -22.241 2.529 1.00 0.00 O ATOM 2306 CB GLN A 149 -19.647 -22.219 5.302 1.00 0.00 C ATOM 2307 CG GLN A 149 -18.340 -22.946 5.658 1.00 0.00 C ATOM 2308 CD GLN A 149 -18.455 -24.051 6.708 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -19.387 -24.103 7.505 1.00 0.00 O ATOM 2310 NE2 GLN A 149 -17.474 -24.945 6.741 1.00 0.00 N ATOM 0 H GLN A 149 -19.753 -23.951 3.183 1.00 0.00 H new ATOM 0 HA GLN A 149 -21.433 -23.411 5.528 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -19.406 -21.429 4.590 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -20.014 -21.732 6.206 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -17.928 -23.379 4.747 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -17.621 -22.207 6.013 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -16.708 -24.886 6.071 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -17.487 -25.691 7.437 1.00 0.00 H new ATOM 2319 N TYR A 150 -22.398 -21.260 4.349 1.00 0.00 N ATOM 2320 CA TYR A 150 -23.051 -20.143 3.672 1.00 0.00 C ATOM 2321 C TYR A 150 -22.960 -18.893 4.558 1.00 0.00 C ATOM 2322 O TYR A 150 -22.758 -17.784 4.061 1.00 0.00 O ATOM 2323 CB TYR A 150 -24.509 -20.496 3.344 1.00 0.00 C ATOM 2324 CG TYR A 150 -24.657 -21.608 2.317 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -24.501 -21.319 0.945 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -24.912 -22.932 2.726 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -24.595 -22.345 -0.014 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -25.001 -23.963 1.775 1.00 0.00 C ATOM 2329 CZ TYR A 150 -24.839 -23.677 0.399 1.00 0.00 C ATOM 2330 OH TYR A 150 -24.930 -24.689 -0.515 1.00 0.00 O ATOM 0 H TYR A 150 -22.606 -21.296 5.347 1.00 0.00 H new ATOM 0 HA TYR A 150 -22.546 -19.937 2.728 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -25.016 -20.793 4.262 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -25.014 -19.604 2.975 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -24.308 -20.305 0.629 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -25.040 -23.156 3.775 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -24.481 -22.116 -1.063 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -25.194 -24.976 2.095 1.00 0.00 H new ATOM 0 HH TYR A 150 -25.099 -25.535 -0.050 1.00 0.00 H new ATOM 2340 N ASP A 151 -23.057 -19.068 5.886 1.00 0.00 N ATOM 2341 CA ASP A 151 -22.936 -17.972 6.853 1.00 0.00 C ATOM 2342 C ASP A 151 -21.497 -17.458 6.957 1.00 0.00 C ATOM 2343 O ASP A 151 -21.260 -16.250 7.010 1.00 0.00 O ATOM 2344 CB ASP A 151 -23.386 -18.464 8.229 1.00 0.00 C ATOM 2345 CG ASP A 151 -23.317 -17.330 9.270 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -24.147 -16.392 9.199 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -22.459 -17.394 10.182 1.00 0.00 O ATOM 0 H ASP A 151 -23.222 -19.977 6.317 1.00 0.00 H new ATOM 0 HA ASP A 151 -23.565 -17.152 6.508 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -24.405 -18.845 8.168 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -22.755 -19.294 8.547 1.00 0.00 H new ATOM 2352 N LEU A 152 -20.525 -18.384 6.972 1.00 0.00 N ATOM 2353 CA LEU A 152 -19.123 -18.060 7.260 1.00 0.00 C ATOM 2354 C LEU A 152 -18.379 -17.521 6.049 1.00 0.00 C ATOM 2355 O LEU A 152 -17.224 -17.132 6.191 1.00 0.00 O ATOM 2356 CB LEU A 152 -18.359 -19.277 7.815 1.00 0.00 C ATOM 2357 CG LEU A 152 -18.871 -19.837 9.150 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -17.984 -21.023 9.551 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -18.847 -18.764 10.239 1.00 0.00 C ATOM 0 H LEU A 152 -20.690 -19.373 6.785 1.00 0.00 H new ATOM 0 HA LEU A 152 -19.159 -17.276 8.016 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -18.394 -20.073 7.072 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -17.312 -19.000 7.937 1.00 0.00 H new ATOM 0 HG LEU A 152 -19.904 -20.164 9.034 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -18.333 -21.434 10.498 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -18.035 -21.792 8.781 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -16.953 -20.686 9.660 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -19.214 -19.186 11.174 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -17.826 -18.409 10.378 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -19.484 -17.930 9.943 1.00 0.00 H new ATOM 2371 N SER A 153 -18.979 -17.514 4.865 1.00 0.00 N ATOM 2372 CA SER A 153 -18.287 -17.166 3.634 1.00 0.00 C ATOM 2373 C SER A 153 -17.779 -15.717 3.687 1.00 0.00 C ATOM 2374 O SER A 153 -16.665 -15.434 3.245 1.00 0.00 O ATOM 2375 CB SER A 153 -19.257 -17.414 2.475 1.00 0.00 C ATOM 2376 OG SER A 153 -19.847 -18.695 2.567 1.00 0.00 O ATOM 0 H SER A 153 -19.962 -17.751 4.733 1.00 0.00 H new ATOM 0 HA SER A 153 -17.400 -17.783 3.493 1.00 0.00 H new ATOM 0 HB2 SER A 153 -20.036 -16.651 2.479 1.00 0.00 H new ATOM 0 HB3 SER A 153 -18.726 -17.322 1.527 1.00 0.00 H new ATOM 0 HG SER A 153 -20.560 -18.776 1.899 1.00 0.00 H new ATOM 2382 N ASP A 154 -18.541 -14.814 4.315 1.00 0.00 N ATOM 2383 CA ASP A 154 -18.109 -13.437 4.562 1.00 0.00 C ATOM 2384 C ASP A 154 -16.955 -13.400 5.566 1.00 0.00 C ATOM 2385 O ASP A 154 -15.985 -12.669 5.375 1.00 0.00 O ATOM 2386 CB ASP A 154 -19.281 -12.610 5.094 1.00 0.00 C ATOM 2387 CG ASP A 154 -18.832 -11.177 5.422 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -18.680 -10.378 4.466 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -18.683 -10.843 6.621 1.00 0.00 O ATOM 0 H ASP A 154 -19.476 -15.020 4.666 1.00 0.00 H new ATOM 0 HA ASP A 154 -17.763 -13.013 3.619 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -20.080 -12.585 4.353 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -19.689 -13.082 5.988 1.00 0.00 H new ATOM 2394 N GLU A 155 -17.023 -14.242 6.601 1.00 0.00 N ATOM 2395 CA GLU A 155 -16.031 -14.316 7.668 1.00 0.00 C ATOM 2396 C GLU A 155 -14.686 -14.811 7.133 1.00 0.00 C ATOM 2397 O GLU A 155 -13.642 -14.245 7.460 1.00 0.00 O ATOM 2398 CB GLU A 155 -16.564 -15.180 8.830 1.00 0.00 C ATOM 2399 CG GLU A 155 -15.485 -15.465 9.881 1.00 0.00 C ATOM 2400 CD GLU A 155 -16.003 -16.270 11.079 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -16.778 -15.731 11.906 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -15.588 -17.448 11.201 1.00 0.00 O ATOM 0 H GLU A 155 -17.789 -14.905 6.720 1.00 0.00 H new ATOM 0 HA GLU A 155 -15.855 -13.315 8.062 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -17.404 -14.672 9.303 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -16.943 -16.123 8.436 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -14.666 -16.011 9.412 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -15.076 -14.520 10.237 1.00 0.00 H new ATOM 2409 N ARG A 156 -14.708 -15.841 6.277 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.506 -16.383 5.643 1.00 0.00 C ATOM 2411 C ARG A 156 -12.781 -15.266 4.883 1.00 0.00 C ATOM 2412 O ARG A 156 -11.558 -15.199 4.936 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.870 -17.534 4.680 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.760 -18.965 5.243 1.00 0.00 C ATOM 2415 CD ARG A 156 -14.839 -19.398 6.249 1.00 0.00 C ATOM 2416 NE ARG A 156 -14.585 -18.937 7.632 1.00 0.00 N ATOM 2417 CZ ARG A 156 -13.891 -19.596 8.578 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -13.193 -20.689 8.269 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -13.895 -19.178 9.838 1.00 0.00 N ATOM 0 H ARG A 156 -15.566 -16.322 6.006 1.00 0.00 H new ATOM 0 HA ARG A 156 -12.848 -16.781 6.415 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.893 -17.381 4.337 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -13.226 -17.462 3.804 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -13.777 -19.662 4.405 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.787 -19.067 5.723 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -15.805 -19.014 5.920 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -14.910 -20.486 6.246 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.974 -18.031 7.894 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -13.182 -21.032 7.309 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -12.670 -21.182 8.993 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -14.428 -18.348 10.098 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -13.365 -19.686 10.546 1.00 0.00 H new ATOM 2433 N ILE A 157 -13.520 -14.380 4.206 1.00 0.00 N ATOM 2434 CA ILE A 157 -12.928 -13.243 3.509 1.00 0.00 C ATOM 2435 C ILE A 157 -12.426 -12.242 4.560 1.00 0.00 C ATOM 2436 O ILE A 157 -11.252 -11.893 4.530 1.00 0.00 O ATOM 2437 CB ILE A 157 -13.922 -12.622 2.490 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -14.415 -13.644 1.439 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -13.238 -11.461 1.742 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -15.692 -13.205 0.713 1.00 0.00 C ATOM 0 H ILE A 157 -14.536 -14.433 4.129 1.00 0.00 H new ATOM 0 HA ILE A 157 -12.077 -13.566 2.910 1.00 0.00 H new ATOM 0 HB ILE A 157 -14.783 -12.276 3.062 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -13.626 -13.807 0.704 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -14.596 -14.600 1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -13.937 -11.027 1.027 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -12.930 -10.699 2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -12.363 -11.836 1.211 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -15.981 -13.969 -0.009 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -16.494 -13.069 1.438 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -15.510 -12.264 0.193 1.00 0.00 H new ATOM 2452 N GLN A 158 -13.278 -11.803 5.489 1.00 0.00 N ATOM 2453 CA GLN A 158 -12.985 -10.767 6.479 1.00 0.00 C ATOM 2454 C GLN A 158 -11.684 -11.038 7.218 1.00 0.00 C ATOM 2455 O GLN A 158 -10.752 -10.238 7.124 1.00 0.00 O ATOM 2456 CB GLN A 158 -14.187 -10.595 7.420 1.00 0.00 C ATOM 2457 CG GLN A 158 -13.932 -9.528 8.492 1.00 0.00 C ATOM 2458 CD GLN A 158 -13.840 -8.100 7.961 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -14.662 -7.651 7.171 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -12.838 -7.351 8.396 1.00 0.00 N ATOM 0 H GLN A 158 -14.225 -12.173 5.575 1.00 0.00 H new ATOM 0 HA GLN A 158 -12.829 -9.819 5.963 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -15.066 -10.320 6.838 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -14.409 -11.547 7.902 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -14.732 -9.576 9.230 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.004 -9.769 9.011 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -12.161 -7.737 9.054 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -12.744 -6.388 8.073 1.00 0.00 H new ATOM 2469 N SER A 159 -11.613 -12.143 7.943 1.00 0.00 N ATOM 2470 CA SER A 159 -10.504 -12.378 8.855 1.00 0.00 C ATOM 2471 C SER A 159 -9.203 -12.596 8.084 1.00 0.00 C ATOM 2472 O SER A 159 -8.141 -12.164 8.535 1.00 0.00 O ATOM 2473 CB SER A 159 -10.845 -13.551 9.784 1.00 0.00 C ATOM 2474 OG SER A 159 -12.087 -13.314 10.437 1.00 0.00 O ATOM 0 H SER A 159 -12.308 -12.889 7.918 1.00 0.00 H new ATOM 0 HA SER A 159 -10.347 -11.497 9.477 1.00 0.00 H new ATOM 0 HB2 SER A 159 -10.898 -14.476 9.210 1.00 0.00 H new ATOM 0 HB3 SER A 159 -10.055 -13.680 10.524 1.00 0.00 H new ATOM 0 HG SER A 159 -12.296 -14.069 11.026 1.00 0.00 H new ATOM 2480 N TRP A 160 -9.281 -13.182 6.884 1.00 0.00 N ATOM 2481 CA TRP A 160 -8.129 -13.311 6.006 1.00 0.00 C ATOM 2482 C TRP A 160 -7.659 -11.947 5.533 1.00 0.00 C ATOM 2483 O TRP A 160 -6.475 -11.652 5.619 1.00 0.00 O ATOM 2484 CB TRP A 160 -8.488 -14.176 4.805 1.00 0.00 C ATOM 2485 CG TRP A 160 -7.340 -14.426 3.885 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -6.281 -15.210 4.172 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -7.110 -13.917 2.539 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -5.470 -15.300 3.064 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -5.897 -14.476 2.050 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -7.816 -13.062 1.668 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -5.386 -14.181 0.783 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -7.322 -12.762 0.387 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -6.093 -13.294 -0.044 1.00 0.00 C ATOM 0 H TRP A 160 -10.141 -13.575 6.503 1.00 0.00 H new ATOM 0 HA TRP A 160 -7.321 -13.783 6.565 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -8.874 -15.132 5.159 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.291 -13.694 4.248 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -6.098 -15.691 5.121 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.651 -15.905 3.003 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -8.752 -12.630 1.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -4.463 -14.628 0.446 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -7.889 -12.119 -0.270 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -5.694 -13.020 -1.010 1.00 0.00 H new ATOM 2504 N CYS A 161 -8.574 -11.094 5.076 1.00 0.00 N ATOM 2505 CA CYS A 161 -8.240 -9.772 4.568 1.00 0.00 C ATOM 2506 C CYS A 161 -7.555 -8.944 5.650 1.00 0.00 C ATOM 2507 O CYS A 161 -6.542 -8.305 5.372 1.00 0.00 O ATOM 2508 CB CYS A 161 -9.525 -9.083 4.105 1.00 0.00 C ATOM 2509 SG CYS A 161 -10.072 -9.857 2.569 1.00 0.00 S ATOM 0 H CYS A 161 -9.572 -11.305 5.049 1.00 0.00 H new ATOM 0 HA CYS A 161 -7.551 -9.866 3.729 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -10.298 -9.171 4.869 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -9.349 -8.018 3.950 1.00 0.00 H new ATOM 0 HG CYS A 161 -10.750 -10.932 2.842 1.00 0.00 H new ATOM 2515 N GLU A 162 -8.063 -8.994 6.882 1.00 0.00 N ATOM 2516 CA GLU A 162 -7.440 -8.290 7.992 1.00 0.00 C ATOM 2517 C GLU A 162 -6.042 -8.843 8.249 1.00 0.00 C ATOM 2518 O GLU A 162 -5.102 -8.087 8.475 1.00 0.00 O ATOM 2519 CB GLU A 162 -8.298 -8.366 9.255 1.00 0.00 C ATOM 2520 CG GLU A 162 -9.567 -7.536 9.074 1.00 0.00 C ATOM 2521 CD GLU A 162 -10.308 -7.379 10.412 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -9.912 -6.523 11.239 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -11.320 -8.092 10.610 1.00 0.00 O ATOM 0 H GLU A 162 -8.903 -9.515 7.131 1.00 0.00 H new ATOM 0 HA GLU A 162 -7.354 -7.238 7.720 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -8.559 -9.403 9.466 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -7.733 -7.999 10.112 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -9.312 -6.554 8.676 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.220 -8.015 8.345 1.00 0.00 H new ATOM 2530 N GLN A 163 -5.881 -10.159 8.162 1.00 0.00 N ATOM 2531 CA GLN A 163 -4.610 -10.807 8.399 1.00 0.00 C ATOM 2532 C GLN A 163 -3.611 -10.403 7.331 1.00 0.00 C ATOM 2533 O GLN A 163 -2.526 -9.955 7.678 1.00 0.00 O ATOM 2534 CB GLN A 163 -4.787 -12.326 8.488 1.00 0.00 C ATOM 2535 CG GLN A 163 -3.438 -13.018 8.752 1.00 0.00 C ATOM 2536 CD GLN A 163 -3.557 -14.538 8.638 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -3.400 -15.271 9.610 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -3.837 -15.039 7.438 1.00 0.00 N ATOM 0 H GLN A 163 -6.635 -10.803 7.924 1.00 0.00 H new ATOM 0 HA GLN A 163 -4.212 -10.478 9.359 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -5.488 -12.569 9.287 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -5.218 -12.702 7.560 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -2.696 -12.656 8.040 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -3.081 -12.753 9.747 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -3.964 -14.414 6.642 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -3.925 -16.048 7.314 1.00 0.00 H new ATOM 2547 N ILE A 164 -3.950 -10.521 6.048 1.00 0.00 N ATOM 2548 CA ILE A 164 -2.986 -10.243 4.990 1.00 0.00 C ATOM 2549 C ILE A 164 -2.577 -8.785 5.043 1.00 0.00 C ATOM 2550 O ILE A 164 -1.399 -8.514 4.859 1.00 0.00 O ATOM 2551 CB ILE A 164 -3.476 -10.679 3.587 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -4.689 -9.901 3.038 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -3.790 -12.179 3.590 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.029 -10.219 1.574 1.00 0.00 C ATOM 0 H ILE A 164 -4.874 -10.804 5.721 1.00 0.00 H new ATOM 0 HA ILE A 164 -2.102 -10.855 5.171 1.00 0.00 H new ATOM 0 HB ILE A 164 -2.652 -10.444 2.913 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -5.558 -10.121 3.658 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -4.494 -8.833 3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -4.134 -12.481 2.601 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -2.891 -12.738 3.847 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -4.569 -12.386 4.324 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.893 -9.631 1.265 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.177 -9.972 0.941 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -5.258 -11.280 1.476 1.00 0.00 H new ATOM 2566 N LEU A 165 -3.495 -7.856 5.340 1.00 0.00 N ATOM 2567 CA LEU A 165 -3.158 -6.435 5.416 1.00 0.00 C ATOM 2568 C LEU A 165 -2.161 -6.198 6.552 1.00 0.00 C ATOM 2569 O LEU A 165 -1.234 -5.415 6.386 1.00 0.00 O ATOM 2570 CB LEU A 165 -4.444 -5.583 5.452 1.00 0.00 C ATOM 2571 CG LEU A 165 -4.922 -5.049 6.816 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -4.198 -3.749 7.184 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -6.429 -4.783 6.755 1.00 0.00 C ATOM 0 H LEU A 165 -4.475 -8.066 5.531 1.00 0.00 H new ATOM 0 HA LEU A 165 -2.639 -6.102 4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -4.296 -4.728 4.792 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -5.251 -6.179 5.026 1.00 0.00 H new ATOM 0 HG LEU A 165 -4.699 -5.798 7.576 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -4.555 -3.395 8.151 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -3.125 -3.933 7.238 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -4.398 -2.993 6.424 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -6.771 -4.405 7.718 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -6.637 -4.044 5.981 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -6.953 -5.710 6.522 1.00 0.00 H new ATOM 2585 N ASN A 166 -2.293 -6.932 7.656 1.00 0.00 N ATOM 2586 CA ASN A 166 -1.342 -6.853 8.769 1.00 0.00 C ATOM 2587 C ASN A 166 -0.014 -7.428 8.322 1.00 0.00 C ATOM 2588 O ASN A 166 1.018 -6.786 8.447 1.00 0.00 O ATOM 2589 CB ASN A 166 -1.790 -7.645 10.008 1.00 0.00 C ATOM 2590 CG ASN A 166 -2.721 -6.860 10.921 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -2.281 -6.028 11.710 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -4.016 -7.108 10.837 1.00 0.00 N ATOM 0 H ASN A 166 -3.055 -7.594 7.806 1.00 0.00 H new ATOM 0 HA ASN A 166 -1.272 -5.801 9.044 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -2.293 -8.557 9.685 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -0.910 -7.950 10.574 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -4.672 -6.604 11.434 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -4.360 -7.803 10.175 1.00 0.00 H new ATOM 2599 N GLU A 167 -0.028 -8.644 7.785 1.00 0.00 N ATOM 2600 CA GLU A 167 1.152 -9.432 7.521 1.00 0.00 C ATOM 2601 C GLU A 167 1.973 -8.847 6.354 1.00 0.00 C ATOM 2602 O GLU A 167 3.196 -8.970 6.328 1.00 0.00 O ATOM 2603 CB GLU A 167 0.631 -10.874 7.355 1.00 0.00 C ATOM 2604 CG GLU A 167 1.570 -11.769 6.580 1.00 0.00 C ATOM 2605 CD GLU A 167 1.126 -13.240 6.637 1.00 0.00 C ATOM 2606 OE1 GLU A 167 0.182 -13.613 5.900 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 1.732 -14.028 7.404 1.00 0.00 O ATOM 0 H GLU A 167 -0.892 -9.115 7.516 1.00 0.00 H new ATOM 0 HA GLU A 167 1.887 -9.421 8.325 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.461 -11.306 8.341 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -0.334 -10.847 6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 167 1.612 -11.441 5.541 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.578 -11.677 6.984 1.00 0.00 H new ATOM 2614 N MET A 168 1.338 -8.130 5.424 1.00 0.00 N ATOM 2615 CA MET A 168 2.039 -7.388 4.381 1.00 0.00 C ATOM 2616 C MET A 168 2.589 -6.059 4.889 1.00 0.00 C ATOM 2617 O MET A 168 3.612 -5.589 4.401 1.00 0.00 O ATOM 2618 CB MET A 168 1.148 -7.205 3.156 1.00 0.00 C ATOM 2619 CG MET A 168 -0.031 -6.242 3.228 1.00 0.00 C ATOM 2620 SD MET A 168 -0.969 -6.359 1.682 1.00 0.00 S ATOM 2621 CE MET A 168 -2.104 -7.751 1.943 1.00 0.00 C ATOM 0 H MET A 168 0.322 -8.049 5.375 1.00 0.00 H new ATOM 0 HA MET A 168 2.903 -7.981 4.080 1.00 0.00 H new ATOM 0 HB2 MET A 168 1.785 -6.882 2.333 1.00 0.00 H new ATOM 0 HB3 MET A 168 0.754 -8.185 2.888 1.00 0.00 H new ATOM 0 HG2 MET A 168 -0.669 -6.488 4.077 1.00 0.00 H new ATOM 0 HG3 MET A 168 0.322 -5.222 3.380 1.00 0.00 H new ATOM 0 HE1 MET A 168 -2.560 -8.032 0.994 1.00 0.00 H new ATOM 0 HE2 MET A 168 -1.552 -8.600 2.346 1.00 0.00 H new ATOM 0 HE3 MET A 168 -2.883 -7.458 2.647 1.00 0.00 H new ATOM 2631 N ALA A 169 1.919 -5.451 5.865 1.00 0.00 N ATOM 2632 CA ALA A 169 2.314 -4.166 6.411 1.00 0.00 C ATOM 2633 C ALA A 169 3.457 -4.320 7.410 1.00 0.00 C ATOM 2634 O ALA A 169 4.404 -3.538 7.406 1.00 0.00 O ATOM 2635 CB ALA A 169 1.107 -3.474 7.041 1.00 0.00 C ATOM 0 H ALA A 169 1.083 -5.843 6.298 1.00 0.00 H new ATOM 0 HA ALA A 169 2.682 -3.539 5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 169 1.412 -2.510 7.449 1.00 0.00 H new ATOM 0 HB2 ALA A 169 0.339 -3.321 6.283 1.00 0.00 H new ATOM 0 HB3 ALA A 169 0.708 -4.096 7.842 1.00 0.00 H new ATOM 2641 N GLU A 170 3.390 -5.359 8.237 1.00 0.00 N ATOM 2642 CA GLU A 170 4.372 -5.649 9.274 1.00 0.00 C ATOM 2643 C GLU A 170 5.700 -6.095 8.648 1.00 0.00 C ATOM 2644 O GLU A 170 6.770 -5.869 9.214 1.00 0.00 O ATOM 2645 CB GLU A 170 3.792 -6.680 10.259 1.00 0.00 C ATOM 2646 CG GLU A 170 3.807 -8.141 9.789 1.00 0.00 C ATOM 2647 CD GLU A 170 5.096 -8.899 10.179 1.00 0.00 C ATOM 2648 OE1 GLU A 170 5.354 -9.076 11.394 1.00 0.00 O1- ATOM 2649 OE2 GLU A 170 5.831 -9.370 9.280 1.00 0.00 O ATOM 0 H GLU A 170 2.631 -6.040 8.203 1.00 0.00 H new ATOM 0 HA GLU A 170 4.592 -4.746 9.843 1.00 0.00 H new ATOM 0 HB2 GLU A 170 4.349 -6.614 11.193 1.00 0.00 H new ATOM 0 HB3 GLU A 170 2.762 -6.401 10.482 1.00 0.00 H new ATOM 0 HG2 GLU A 170 2.947 -8.660 10.213 1.00 0.00 H new ATOM 0 HG3 GLU A 170 3.693 -8.167 8.705 1.00 0.00 H new ATOM 2656 N HIS A 171 5.633 -6.659 7.438 1.00 0.00 N ATOM 2657 CA HIS A 171 6.796 -6.963 6.613 1.00 0.00 C ATOM 2658 C HIS A 171 7.583 -5.683 6.277 1.00 0.00 C ATOM 2659 O HIS A 171 8.808 -5.736 6.123 1.00 0.00 O ATOM 2660 CB HIS A 171 6.313 -7.722 5.368 1.00 0.00 C ATOM 2661 CG HIS A 171 7.348 -7.870 4.289 1.00 0.00 C ATOM 2662 ND1 HIS A 171 8.263 -8.918 4.157 1.00 0.00 N ATOM 2663 CD2 HIS A 171 7.526 -6.983 3.271 1.00 0.00 C ATOM 2664 CE1 HIS A 171 8.997 -8.613 3.069 1.00 0.00 C ATOM 2665 NE2 HIS A 171 8.564 -7.467 2.511 1.00 0.00 N ATOM 0 H HIS A 171 4.750 -6.920 7.000 1.00 0.00 H new ATOM 0 HA HIS A 171 7.497 -7.600 7.153 1.00 0.00 H new ATOM 0 HB2 HIS A 171 5.977 -8.714 5.670 1.00 0.00 H new ATOM 0 HB3 HIS A 171 5.447 -7.204 4.955 1.00 0.00 H new ATOM 0 HD2 HIS A 171 6.963 -6.078 3.096 1.00 0.00 H new ATOM 0 HE1 HIS A 171 9.819 -9.206 2.696 1.00 0.00 H new ATOM 0 HE2 HIS A 171 8.941 -7.032 1.669 1.00 0.00 H new ATOM 2673 N TYR A 172 6.906 -4.529 6.225 1.00 0.00 N ATOM 2674 CA TYR A 172 7.480 -3.208 6.024 1.00 0.00 C ATOM 2675 C TYR A 172 7.608 -2.393 7.328 1.00 0.00 C ATOM 2676 O TYR A 172 7.896 -1.193 7.260 1.00 0.00 O ATOM 2677 CB TYR A 172 6.685 -2.458 4.940 1.00 0.00 C ATOM 2678 CG TYR A 172 6.787 -3.030 3.539 1.00 0.00 C ATOM 2679 CD1 TYR A 172 8.046 -3.304 2.967 1.00 0.00 C ATOM 2680 CD2 TYR A 172 5.617 -3.222 2.780 1.00 0.00 C ATOM 2681 CE1 TYR A 172 8.140 -3.776 1.647 1.00 0.00 C ATOM 2682 CE2 TYR A 172 5.705 -3.656 1.447 1.00 0.00 C ATOM 2683 CZ TYR A 172 6.967 -3.942 0.875 1.00 0.00 C ATOM 2684 OH TYR A 172 7.061 -4.371 -0.410 1.00 0.00 O ATOM 0 H TYR A 172 5.892 -4.498 6.328 1.00 0.00 H new ATOM 0 HA TYR A 172 8.505 -3.341 5.678 1.00 0.00 H new ATOM 0 HB2 TYR A 172 5.635 -2.442 5.231 1.00 0.00 H new ATOM 0 HB3 TYR A 172 7.025 -1.423 4.916 1.00 0.00 H new ATOM 0 HD1 TYR A 172 8.944 -3.150 3.547 1.00 0.00 H new ATOM 0 HD2 TYR A 172 4.650 -3.035 3.223 1.00 0.00 H new ATOM 0 HE1 TYR A 172 9.105 -4.011 1.223 1.00 0.00 H new ATOM 0 HE2 TYR A 172 4.807 -3.772 0.858 1.00 0.00 H new ATOM 0 HH TYR A 172 6.169 -4.598 -0.745 1.00 0.00 H new ATOM 2694 N ALA A 173 7.403 -2.998 8.507 1.00 0.00 N ATOM 2695 CA ALA A 173 7.640 -2.326 9.781 1.00 0.00 C ATOM 2696 C ALA A 173 9.125 -1.973 9.913 1.00 0.00 C ATOM 2697 O ALA A 173 9.989 -2.801 9.535 1.00 0.00 O ATOM 2698 CB ALA A 173 7.190 -3.188 10.963 1.00 0.00 C ATOM 2699 OXT ALA A 173 9.433 -0.877 10.433 1.00 0.00 O1- ATOM 0 H ALA A 173 7.071 -3.958 8.598 1.00 0.00 H new ATOM 0 HA ALA A 173 7.048 -1.411 9.798 1.00 0.00 H new ATOM 0 HB1 ALA A 173 7.382 -2.656 11.895 1.00 0.00 H new ATOM 0 HB2 ALA A 173 6.124 -3.396 10.876 1.00 0.00 H new ATOM 0 HB3 ALA A 173 7.744 -4.127 10.961 1.00 0.00 H new TER 2705 ALA A 173